#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x90 h LEU 18 N 0.00 0.13 -0.26 0.00 3.38 -2.00 -2.55 115.31 114.02 2x90 h LEU 18 Ca 0.00 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 2x90 h LEU 18 Cb 0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2x90 h LEU 18 CO 0.00 0.81 0.07 0.58 0.09 0.00 0.00 178.44 179.98 2x90 h VAL 19 N 0.07 1.21 -0.51 1.22 2.07 -2.00 -0.76 116.25 117.56 2x90 h VAL 19 Ca -0.02 -0.69 -0.09 0.00 0.82 0.00 0.00 66.70 66.73 2x90 h VAL 19 Cb 1.27 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 32.19 2x90 h VAL 19 CO 0.10 0.22 -0.04 0.11 0.02 0.00 0.00 177.57 177.98 2x90 h LYS 20 N 0.24 0.89 -0.43 1.57 6.56 -2.01 -3.09 116.57 120.31 2x90 h LYS 20 Ca 0.08 -0.27 -0.11 0.00 -1.06 0.00 0.00 60.65 59.29 2x90 h LYS 20 Cb 0.27 -0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 31.84 2x90 h LYS 20 CO 0.00 0.91 -0.16 1.49 -2.06 0.00 0.00 179.45 179.63 2x90 h GLU 21 N 0.81 0.87 -0.58 3.15 4.81 -1.29 -2.66 114.58 119.69 2x90 h GLU 21 Ca 0.15 -0.36 -0.03 0.00 -0.13 0.00 0.00 59.36 58.99 2x90 h GLU 21 Cb 0.54 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.86 2x90 h GLU 21 CO 0.03 1.00 0.26 1.49 -0.73 0.00 0.00 179.01 181.06 2x90 h GLU 22 N 0.69 0.83 -0.39 1.92 4.81 -1.12 0.31 114.58 121.63 2x90 h GLU 22 Ca 0.10 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 2x90 h GLU 22 Cb 0.72 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.93 2x90 h GLU 22 CO 0.05 0.66 0.16 0.82 -0.73 0.00 0.00 179.01 179.97 2x90 h ILE 23 N 0.83 1.19 -0.68 2.32 2.04 -1.47 -1.70 117.51 120.04 2x90 h ILE 23 Ca 0.20 -0.58 -0.05 0.00 1.00 0.00 0.00 64.86 65.43 2x90 h ILE 23 Cb 0.12 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 2x90 h ILE 23 CO -0.02 0.21 0.21 1.56 0.00 0.00 0.00 178.15 180.11 2x90 h GLN 24 N 0.49 1.04 -0.85 2.37 4.20 -1.01 -2.94 115.11 118.39 2x90 h GLN 24 Ca 0.13 -0.21 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 2x90 h GLN 24 Cb 0.18 -0.16 -0.04 0.00 0.30 0.00 0.00 27.48 27.76 2x90 h GLN 24 CO -0.01 0.89 0.44 0.00 -0.67 0.00 0.00 178.83 179.47 2x90 h ALA 25 N 1.23 1.10 -0.75 3.87 0.00 -0.21 -0.10 119.26 124.39 2x90 h ALA 25 Ca 0.22 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2x90 h ALA 25 Cb 0.28 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2x90 h ALA 25 CO -0.01 0.63 0.45 -0.22 0.00 0.00 0.00 179.25 180.10 2x90 h LYS 26 N 1.20 1.03 -0.31 0.00 3.64 -1.15 -0.46 116.57 120.53 2x90 h LYS 26 Ca 0.30 -0.10 -0.15 0.00 -1.27 0.00 0.00 60.65 59.43 2x90 h LYS 26 Cb 0.07 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 2x90 h LYS 26 CO -0.04 0.74 -0.42 0.93 -2.27 0.00 0.00 179.45 178.39 2x90 h GLU 27 N 1.03 0.76 -0.30 1.90 5.08 -1.33 -2.37 114.58 119.36 2x90 h GLU 27 Ca 0.27 -0.41 0.01 0.00 -1.00 0.00 0.00 59.36 58.24 2x90 h GLU 27 Cb -0.02 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 2x90 h GLU 27 CO -0.05 1.03 0.17 -0.92 -1.00 0.00 0.00 179.01 178.24 2x90 h TYR 28 N 0.62 0.32 -0.54 4.33 3.20 -0.67 -2.73 116.97 121.50 2x90 h TYR 28 Ca 0.05 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.85 2x90 h TYR 28 Cb 0.97 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.12 2x90 h TYR 28 CO 0.05 0.19 0.03 -0.07 -1.64 0.00 0.00 178.16 176.72 2x90 h LEU 29 N 0.35 0.90 -0.26 2.82 3.38 -1.03 -1.29 115.31 120.18 2x90 h LEU 29 Ca 0.12 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 57.82 2x90 h LEU 29 Cb 0.01 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.49 2x90 h LEU 29 CO -0.06 0.97 0.10 -0.08 0.09 0.00 0.00 178.44 179.46 2x90 h GLU 30 N 0.80 0.22 -0.32 1.13 4.81 -1.35 0.45 114.58 120.32 2x90 h GLU 30 Ca 0.16 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.29 2x90 h GLU 30 Cb 0.49 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 2x90 h GLU 30 CO 0.02 0.14 -0.12 -0.97 -0.73 0.00 0.00 179.01 177.36 2x90 h ASN 31 N 0.22 0.66 -0.70 1.04 -1.24 -1.42 -3.09 115.58 111.05 2x90 h ASN 31 Ca 0.11 -0.39 -0.03 0.00 0.71 0.00 0.00 56.30 56.70 2x90 h ASN 31 Cb 0.07 -0.18 -0.03 0.00 0.73 0.00 0.00 38.32 38.91 2x90 h ASN 31 CO -0.10 0.90 0.31 0.25 -1.29 0.00 0.00 177.43 177.49 2x90 h LEU 32 N 0.41 0.94 -0.37 0.34 5.85 -0.96 -1.22 115.31 120.31 2x90 h LEU 32 Ca 0.08 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.67 2x90 h LEU 32 Cb 0.63 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 2x90 h LEU 32 CO 0.04 0.83 0.19 0.78 -0.34 0.00 0.00 178.44 179.94 2x90 h ASN 33 N 0.99 0.27 -0.70 1.25 2.35 -0.96 0.21 115.58 118.98 2x90 h ASN 33 Ca 0.24 0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.96 2x90 h ASN 33 Cb 0.17 -0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.47 2x90 h ASN 33 CO -0.02 0.20 0.27 0.11 -1.65 0.00 0.00 177.43 176.33 2x90 h LYS 34 N 0.38 1.08 -0.66 0.81 1.57 -1.41 -0.56 116.57 117.79 2x90 h LYS 34 Ca 0.16 -0.20 -0.08 0.00 -1.87 0.00 0.00 60.65 58.66 2x90 h LYS 34 Cb 0.07 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.18 2x90 h LYS 34 CO -0.11 0.89 0.12 1.49 -0.57 0.00 0.00 179.45 181.27 2x90 h GLU 35 N 1.05 1.08 -0.58 3.15 4.81 -0.83 -2.43 114.58 120.83 2x90 h GLU 35 Ca 0.24 -0.28 -0.11 0.00 -0.13 0.00 0.00 59.36 59.08 2x90 h GLU 35 Cb 0.23 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 2x90 h GLU 35 CO -0.02 0.99 -0.05 -0.07 -0.73 0.00 0.00 179.01 179.13 2x90 h LEU 36 N 1.00 1.05 -0.57 1.64 3.38 -0.03 -1.30 115.31 120.48 2x90 h LEU 36 Ca 0.20 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2x90 h LEU 36 Cb 0.43 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2x90 h LEU 36 CO 0.01 1.12 0.36 0.00 0.09 0.00 0.00 178.44 180.03 2x90 h ALA 37 N 0.97 0.73 -0.43 1.53 0.00 -1.07 -0.52 119.26 120.47 2x90 h ALA 37 Ca 0.16 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 2x90 h ALA 37 Cb 0.62 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2x90 h ALA 37 CO 0.04 0.19 -0.05 -0.22 0.00 0.00 0.00 179.25 179.20 2x90 h LYS 38 N 0.77 0.79 -0.22 0.00 1.63 -1.26 -0.69 116.57 117.59 2x90 h LYS 38 Ca 0.21 -0.28 -0.12 0.00 -0.85 0.00 0.00 60.65 59.61 2x90 h LYS 38 Cb -0.05 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.51 2x90 h LYS 38 CO -0.04 0.89 -0.35 0.00 -3.45 0.00 0.00 179.45 176.49 2x90 h ARG 39 N 0.62 0.48 -0.02 1.90 3.08 -1.15 -3.08 114.38 116.21 2x90 h ARG 39 Ca 0.11 -0.22 -0.18 0.00 0.07 0.00 0.00 59.98 59.76 2x90 h ARG 39 Cb 0.56 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 2x90 h ARG 39 CO 0.03 0.77 -0.80 1.15 -1.07 0.00 0.00 179.97 180.05 2x90 h THR 40 N 0.41 1.46 -0.57 2.04 2.02 -0.95 -2.90 112.91 114.40 2x90 h THR 40 Ca 0.04 -2.42 0.11 0.00 0.77 0.00 0.00 66.41 64.91 2x90 h THR 40 Cb 0.81 2.32 -0.08 0.00 -1.74 0.00 0.00 68.15 69.46 2x90 h THR 40 CO 0.07 0.71 0.11 -1.13 0.37 0.00 0.00 175.52 175.64 2x90 h ASN 41 N 0.14 -0.03 -0.53 4.18 -0.73 -1.04 0.17 115.58 117.74 2x90 h ASN 41 Ca -0.03 0.11 -0.02 0.00 1.87 0.00 0.00 56.30 58.22 2x90 h ASN 41 Cb 1.39 0.16 -0.02 0.00 0.27 0.00 0.00 38.32 40.12 2x90 h ASN 41 CO 0.12 -0.00 0.24 0.58 -0.37 0.00 0.00 177.43 178.00 2x90 h VAL 42 N 0.24 1.21 -0.58 2.57 2.07 -1.46 -0.74 116.25 119.55 2x90 h VAL 42 Ca 0.30 -0.61 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 2x90 h VAL 42 Cb 0.44 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 2x90 h VAL 42 CO -0.40 0.24 0.20 -0.08 0.02 0.00 0.00 177.57 177.55 2x90 h GLU 43 N 0.72 0.89 -0.66 1.57 4.81 -1.24 -2.74 114.58 117.94 2x90 h GLU 43 Ca 0.18 -0.18 -0.09 0.00 -0.13 0.00 0.00 59.36 59.14 2x90 h GLU 43 Cb 0.15 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 2x90 h GLU 43 CO -0.02 0.79 0.08 1.15 -0.73 0.00 0.00 179.01 180.28 2x90 h THR 44 N 0.82 1.27 -0.69 0.32 2.02 -0.38 -1.41 112.91 114.84 2x90 h THR 44 Ca 0.19 -1.08 0.00 0.00 0.77 0.00 0.00 66.41 66.30 2x90 h THR 44 Cb 0.25 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.30 2x90 h THR 44 CO -0.01 0.40 0.45 -0.33 0.37 0.00 0.00 175.52 176.40 2x90 h GLU 45 N 1.03 0.92 -0.57 6.66 4.39 -1.07 0.11 114.58 126.04 2x90 h GLU 45 Ca 0.20 -0.06 -0.09 0.00 0.34 0.00 0.00 59.36 59.75 2x90 h GLU 45 Cb 0.48 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 2x90 h GLU 45 CO 0.02 0.62 0.01 0.00 -1.16 0.00 0.00 179.01 178.49 2x90 h ALA 46 N 1.25 0.93 -0.50 3.43 0.00 -1.22 -1.26 119.26 121.89 2x90 h ALA 46 Ca 0.25 -0.30 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 2x90 h ALA 46 Cb -0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2x90 h ALA 46 CO -0.05 0.64 -0.19 0.00 0.00 0.00 0.00 179.25 179.65 2x90 h ALA 47 N 1.09 0.71 -0.43 0.00 0.00 -0.92 -2.22 119.26 117.48 2x90 h ALA 47 Ca 0.17 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2x90 h ALA 47 Cb 0.52 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2x90 h ALA 47 CO 0.03 0.68 0.27 2.35 0.00 0.00 0.00 179.25 182.57 2x90 h TRP 48 N 0.88 0.57 -0.85 0.00 2.91 -0.67 -1.06 115.95 117.73 2x90 h TRP 48 Ca 0.12 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 60.12 2x90 h TRP 48 Cb 0.77 -0.19 -0.04 0.00 -0.51 0.00 0.00 29.16 29.19 2x90 h TRP 48 CO 0.05 0.39 0.46 0.00 -1.03 0.00 0.00 178.44 178.31 2x90 h ALA 49 N 1.13 1.09 -0.16 2.65 0.00 -1.12 -0.42 119.26 122.43 2x90 h ALA 49 Ca 0.16 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2x90 h ALA 49 Cb -0.01 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.43 2x90 h ALA 49 CO -0.03 0.60 -0.10 -0.92 0.00 0.00 0.00 179.25 178.80 2x90 h TYR 50 N 1.18 0.41 -0.11 0.00 3.20 -1.28 -2.01 116.97 118.36 2x90 h TYR 50 Ca 0.30 -0.11 -0.05 0.00 3.14 0.00 0.00 58.73 62.01 2x90 h TYR 50 Cb 0.04 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.21 2x90 h TYR 50 CO 0.01 0.69 -0.14 0.78 -1.64 0.00 0.00 178.16 177.86 2x90 h GLY 51 N 0.01 0.18 1.69 1.82 0.00 -1.01 -2.29 103.07 103.47 2x90 h GLY 51 Ca 0.03 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2x90 h GLY 51 CO 0.03 0.10 -0.25 1.76 0.00 0.00 0.00 176.54 178.18 2x90 h SER 52 N 0.16 0.00 -0.82 0.19 0.02 -1.05 -0.92 113.55 111.13 2x90 h SER 52 Ca 0.03 -0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 60.89 2x90 h SER 52 Cb 0.35 0.00 -0.18 0.00 0.14 0.00 0.00 62.40 62.71 2x90 h SER 52 CO 0.02 0.03 -0.38 0.21 -1.14 0.00 0.00 176.83 175.58 2x90 s ASN 53 N -4.80 -1.25 -0.41 3.07 2.47 -0.76 -4.76 114.94 108.50 2x90 s ASN 53 Ca 0.08 -0.74 -0.29 0.00 0.42 0.00 0.00 52.86 52.33 2x90 s ASN 53 Cb 0.11 1.60 0.02 0.00 -1.45 0.00 0.00 41.25 41.53 2x90 s ASN 53 CO 0.66 -0.13 1.23 -0.63 -3.72 0.00 0.00 177.10 174.51 2x90 s ILE 54 N 1.75 4.15 0.05 -5.21 1.01 0.52 -4.33 121.20 119.15 2x90 s ILE 54 Ca 0.17 1.22 -0.03 0.00 0.00 0.00 0.00 60.65 62.02 2x90 s ILE 54 Cb -0.02 -4.41 -0.03 0.00 0.01 0.00 0.00 42.46 38.01 2x90 s ILE 54 CO -0.09 -0.79 0.02 0.42 0.00 0.00 0.00 174.94 174.50 2x90 s THR 55 N 4.60 0.20 0.41 2.92 -4.23 -1.26 -4.56 115.64 113.71 2x90 s THR 55 Ca 0.52 -1.61 0.10 0.00 -1.18 0.00 0.00 61.69 59.52 2x90 s THR 55 Cb -0.11 -1.38 0.30 0.00 1.34 0.00 0.00 72.50 72.65 2x90 s THR 55 CO 0.29 -0.89 2.00 0.44 -0.54 0.00 0.00 174.62 175.92 2x90 h ASP 56 N 3.19 0.48 -0.18 3.99 5.19 -1.99 -1.14 116.42 125.95 2x90 h ASP 56 Ca -0.34 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.00 2x90 h ASP 56 Cb 1.16 -0.10 -0.00 0.00 0.18 0.00 0.00 39.33 40.56 2x90 h ASP 56 CO 0.62 0.31 -0.18 -0.08 -3.12 0.00 0.00 179.24 176.80 2x90 h GLU 57 N 0.54 0.43 -0.16 3.56 4.81 -1.97 -2.29 114.58 119.50 2x90 h GLU 57 Ca 0.24 -0.23 -0.10 0.00 -0.13 0.00 0.00 59.36 59.14 2x90 h GLU 57 Cb 0.27 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 2x90 h GLU 57 CO -0.07 0.79 -0.35 -0.91 -0.73 0.00 0.00 179.01 177.75 2x90 h ASN 58 N 0.09 0.34 0.15 1.04 2.35 -1.82 -1.84 115.58 115.90 2x90 h ASN 58 Ca 0.03 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.64 2x90 h ASN 58 Cb 0.72 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.99 2x90 h ASN 58 CO 0.04 0.67 -0.07 -0.08 -1.65 0.00 0.00 177.43 176.34 2x90 h GLU 59 N 0.29 -0.20 -0.54 0.81 4.81 -1.21 0.11 114.58 118.65 2x90 h GLU 59 Ca 0.03 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.33 2x90 h GLU 59 Cb 0.76 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.13 2x90 h GLU 59 CO 0.06 -0.10 0.26 -0.22 -0.73 0.00 0.00 179.01 178.27 2x90 h LYS 60 N -0.25 0.47 -0.22 1.92 3.64 -1.31 -0.61 116.57 120.22 2x90 h LYS 60 Ca -0.02 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 2x90 h LYS 60 Cb 0.19 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 2x90 h LYS 60 CO 0.03 0.31 0.09 0.87 -2.27 0.00 0.00 179.45 178.49 2x90 h LYS 61 N 0.49 0.33 -0.02 1.90 1.57 -1.22 -1.04 116.57 118.59 2x90 h LYS 61 Ca 0.25 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.98 2x90 h LYS 61 Cb 0.20 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 2x90 h LYS 61 CO -0.19 0.39 -0.09 -0.22 -0.57 0.00 0.00 179.45 178.77 2x90 h LYS 62 N 0.21 -0.14 -0.19 3.15 3.64 -0.65 -2.31 116.57 120.27 2x90 h LYS 62 Ca 0.07 0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.34 2x90 h LYS 62 Cb 0.18 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 2x90 h LYS 62 CO -0.01 -0.09 -0.42 -0.91 -2.27 0.00 0.00 179.45 175.75 2x90 h ASN 63 N -0.14 0.49 -0.17 4.20 2.35 -1.08 -2.42 115.58 118.81 2x90 h ASN 63 Ca 0.04 -0.22 -0.17 0.00 -0.55 0.00 0.00 56.30 55.41 2x90 h ASN 63 Cb 0.20 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 2x90 h ASN 63 CO -0.11 0.85 -0.50 -0.33 -1.65 0.00 0.00 177.43 175.69 2x90 h GLU 64 N 0.38 0.75 -0.60 0.81 5.08 -1.13 -1.79 114.58 118.08 2x90 h GLU 64 Ca 0.03 -0.45 -0.09 0.00 -1.00 0.00 0.00 59.36 57.85 2x90 h GLU 64 Cb 0.90 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.17 2x90 h GLU 64 CO 0.08 1.07 0.01 0.82 -1.00 0.00 0.00 179.01 179.99 2x90 h ILE 65 N 0.59 1.26 -0.70 3.13 1.08 -1.36 -2.21 117.51 119.31 2x90 h ILE 65 Ca 0.02 -1.13 -0.07 0.00 -0.39 0.00 0.00 64.86 63.29 2x90 h ILE 65 Cb 1.08 0.79 -0.03 0.00 -3.07 0.00 0.00 36.82 35.59 2x90 h ILE 65 CO 0.11 0.41 0.17 0.28 -0.69 0.00 0.00 178.15 178.43 2x90 h SER 66 N 0.96 1.07 -0.82 1.72 0.02 -1.35 -1.02 113.55 114.12 2x90 h SER 66 Ca 0.17 -0.23 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 2x90 h SER 66 Cb 0.54 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.76 2x90 h SER 66 CO 0.03 1.02 0.45 0.00 -1.14 0.00 0.00 176.83 177.19 2x90 h ALA 67 N 1.08 1.23 -0.35 3.77 0.00 -1.20 0.40 119.26 124.19 2x90 h ALA 67 Ca 0.22 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2x90 h ALA 67 Cb 0.37 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2x90 h ALA 67 CO 0.00 0.62 0.06 1.49 0.00 0.00 0.00 179.25 181.42 2x90 h GLU 68 N 1.16 0.58 -0.55 0.00 4.81 -1.00 -2.17 114.58 117.42 2x90 h GLU 68 Ca 0.29 -0.15 -0.09 0.00 -0.13 0.00 0.00 59.36 59.28 2x90 h GLU 68 Cb 0.03 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 2x90 h GLU 68 CO -0.05 0.65 -0.02 1.25 -0.73 0.00 0.00 179.01 180.12 2x90 h LEU 69 N 0.42 0.94 -0.69 1.64 5.85 -0.92 -2.70 115.31 119.85 2x90 h LEU 69 Ca 0.11 -0.26 0.03 0.00 0.84 0.00 0.00 57.88 58.60 2x90 h LEU 69 Cb 0.35 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 2x90 h LEU 69 CO 0.01 1.00 0.43 0.00 -0.34 0.00 0.00 178.44 179.54 2x90 h ALA 70 N 1.09 0.90 -0.77 1.25 0.00 -0.82 -0.95 119.26 119.96 2x90 h ALA 70 Ca 0.16 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2x90 h ALA 70 Cb 0.54 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 2x90 h ALA 70 CO 0.03 0.20 0.51 -0.22 0.00 0.00 0.00 179.25 179.77 2x90 h LYS 71 N 0.85 1.00 -0.68 0.00 3.64 -1.22 -1.86 116.57 118.30 2x90 h LYS 71 Ca 0.28 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.52 2x90 h LYS 71 Cb 0.01 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 31.58 2x90 h LYS 71 CO -0.10 0.66 0.11 0.35 -2.27 0.00 0.00 179.45 178.20 2x90 h PHE 72 N 1.03 1.18 -0.85 1.91 3.57 -1.10 -2.92 116.94 119.77 2x90 h PHE 72 Ca 0.29 -0.16 -0.02 0.00 3.53 0.00 0.00 57.97 61.61 2x90 h PHE 72 Cb -0.09 -0.33 -0.04 0.00 2.79 0.00 0.00 35.95 38.28 2x90 h PHE 72 CO -0.02 0.99 0.46 0.52 -2.23 0.00 0.00 178.31 178.02 2x90 h MET 73 N 1.04 1.19 -0.58 1.11 2.86 -0.74 -0.82 114.93 119.00 2x90 h MET 73 Ca 0.21 -0.15 0.07 0.00 -2.06 0.00 0.00 59.70 57.77 2x90 h MET 73 Cb 0.44 -0.23 -0.06 0.00 0.06 0.00 0.00 31.60 31.81 2x90 h MET 73 CO 0.01 0.88 0.25 0.87 1.06 0.00 0.00 176.91 179.98 2x90 h LYS 74 N 1.19 0.45 -0.61 1.72 1.57 -1.22 0.94 116.57 120.60 2x90 h LYS 74 Ca 0.30 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 59.01 2x90 h LYS 74 Cb 0.04 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 2x90 h LYS 74 CO -0.05 0.30 0.21 1.49 -0.57 0.00 0.00 179.45 180.83 2x90 h GLU 75 N 0.46 0.93 0.21 3.15 4.81 -1.25 -1.47 114.58 121.42 2x90 h GLU 75 Ca 0.28 -0.19 -0.01 0.00 -0.13 0.00 0.00 59.36 59.31 2x90 h GLU 75 Cb 0.28 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.51 2x90 h GLU 75 CO -0.24 0.82 -0.12 0.28 -0.73 0.00 0.00 179.01 179.01 2x90 h VAL 76 N 0.86 0.75 -0.99 0.32 2.07 -0.51 0.01 116.25 118.77 2x90 h VAL 76 Ca 0.20 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.76 2x90 h VAL 76 Cb 0.25 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 2x90 h VAL 76 CO -0.01 0.00 0.64 0.00 0.02 0.00 0.00 177.57 178.22 2x90 h ALA 77 N 0.48 1.32 -0.69 1.67 0.00 -0.75 -1.01 119.26 120.28 2x90 h ALA 77 Ca -0.02 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2x90 h ALA 77 Cb 0.25 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2x90 h ALA 77 CO 0.03 0.51 0.33 1.03 0.00 0.00 0.00 179.25 181.16 2x90 h SER 78 N 1.23 0.90 0.85 0.00 0.87 -1.07 -3.03 113.55 113.31 2x90 h SER 78 Ca 0.40 -0.13 -0.02 0.00 -1.23 0.00 0.00 61.79 60.80 2x90 h SER 78 Cb 0.04 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 61.76 2x90 h SER 78 CO -0.13 0.79 -0.10 0.44 -0.53 0.00 0.00 176.83 177.29 2x90 h ASP 79 N 0.96 0.00 0.38 6.23 3.45 0.27 -2.95 116.42 124.76 2x90 h ASP 79 Ca 0.24 0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.67 2x90 h ASP 79 Cb 0.12 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 38.89 2x90 h ASP 79 CO -0.03 0.10 -0.14 0.71 -1.57 0.00 0.00 179.24 178.31 2x90 h THR 80 N 0.00 0.65 0.00 0.35 1.35 -1.19 -2.60 112.91 111.47 2x90 h THR 80 Ca -0.00 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 65.25 2x90 h THR 80 Cb 0.56 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 68.36 2x90 h THR 80 CO 0.01 0.14 0.00 0.71 -0.25 0.00 0.00 175.52 176.13 2x90 h THR 81 N 0.00 0.00 0.00 6.82 1.35 -1.65 -2.28 112.91 117.15 2x90 h THR 81 Ca -0.00 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 2x90 h THR 81 Cb 0.37 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 2x90 h THR 81 CO 0.02 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.58 2x90 n LYS 82 N -2.55 0.19 -4.30 4.72 5.02 -0.98 -4.72 118.16 115.54 2x90 n LYS 82 Ca 0.02 0.26 -0.34 0.00 -2.02 0.00 0.00 58.31 56.22 2x90 n LYS 82 Cb 0.29 -1.77 -0.10 0.00 -0.02 0.00 0.00 35.03 33.43 2x90 n LYS 82 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2x90 s PHE 83 N -3.15 3.13 -0.43 2.13 0.08 -0.86 -5.00 117.98 113.88 2x90 s PHE 83 Ca 0.09 -0.01 -0.07 0.00 0.12 0.00 0.00 56.93 57.06 2x90 s PHE 83 Cb 0.12 -1.92 -0.22 0.00 -0.57 0.00 0.00 43.02 40.44 2x90 s PHE 83 CO 0.50 0.21 3.37 1.04 -0.10 0.00 0.00 175.22 180.25 2x90 n GLN 84 N 2.97 2.40 0.02 0.44 1.13 -1.26 -4.71 117.38 118.37 2x90 n GLN 84 Ca -0.18 -1.29 0.02 0.00 -1.94 0.00 0.00 57.00 53.61 2x90 n GLN 84 Cb 0.53 -2.20 0.36 0.00 0.11 0.00 0.00 30.24 29.03 2x90 n GLN 84 CO 0.00 0.00 0.00 0.11 -1.44 0.00 0.00 177.06 175.73 2x90 h TRP 85 N 3.63 0.48 0.00 1.08 5.08 -1.95 -0.52 115.95 123.75 2x90 h TRP 85 Ca 0.37 -0.03 0.00 0.00 1.08 0.00 0.00 58.89 60.31 2x90 h TRP 85 Cb 1.15 -0.15 0.00 0.00 -3.00 0.00 0.00 29.16 27.16 2x90 h TRP 85 CO 1.80 0.44 0.00 0.00 -1.28 0.00 0.00 178.44 179.40 2x90 h ARG 86 N 0.47 0.00 -0.00 0.12 3.08 -1.95 -2.29 114.38 113.80 2x90 h ARG 86 Ca 0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.16 2x90 h ARG 86 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 2x90 h ARG 86 CO -0.00 0.00 -0.36 0.43 -1.07 0.00 0.00 179.97 178.97 2x90 n SER 87 N -2.64 0.85 -4.78 7.04 7.64 -0.20 -4.99 113.62 116.54 2x90 n SER 87 Ca -0.01 -0.67 -0.32 0.00 1.01 0.00 0.00 58.87 58.88 2x90 n SER 87 Cb 0.14 0.20 0.04 0.00 -1.01 0.00 0.00 64.21 63.58 2x90 n SER 87 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2x90 s TYR 88 N -2.69 2.76 0.09 1.43 2.02 -0.86 -4.98 117.35 115.12 2x90 s TYR 88 Ca 0.19 1.53 -0.07 0.00 -0.37 0.00 0.00 57.07 58.35 2x90 s TYR 88 Cb 0.19 -3.08 -0.23 0.00 -0.40 0.00 0.00 41.96 38.43 2x90 s TYR 88 CO 0.59 -1.50 1.17 1.96 -1.57 0.00 0.00 175.55 176.20 2x90 h GLN 89 N -0.08 0.38 -6.36 -0.62 1.08 -1.94 -3.45 115.11 104.12 2x90 h GLN 89 Ca -0.46 -0.55 -0.57 0.00 -1.45 0.00 0.00 58.65 55.62 2x90 h GLN 89 Cb 1.23 0.19 -0.06 0.00 -0.05 0.00 0.00 27.48 28.79 2x90 h GLN 89 CO 0.55 1.23 0.90 0.45 -0.95 0.00 0.00 178.83 181.01 2x90 s SER 90 N -7.21 6.80 0.38 1.46 0.15 -1.26 -4.90 113.70 109.13 2x90 s SER 90 Ca -0.06 1.08 0.05 0.00 0.70 0.00 0.00 55.95 57.73 2x90 s SER 90 Cb 0.07 -2.54 0.76 0.00 -1.71 0.00 0.00 66.02 62.60 2x90 s SER 90 CO 0.89 -0.99 2.04 -0.33 1.20 0.00 0.00 173.24 176.05 2x90 h GLU 91 N 8.67 0.67 -0.14 5.44 4.39 -1.99 -2.16 114.58 129.46 2x90 h GLU 91 Ca -0.23 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.42 2x90 h GLU 91 Cb 1.08 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.57 2x90 h GLU 91 CO 1.04 0.44 0.04 0.22 -1.16 0.00 0.00 179.01 179.59 2x90 h ASP 92 N 0.69 0.21 -0.49 1.42 3.58 -1.94 -0.95 116.42 118.94 2x90 h ASP 92 Ca 0.19 -0.22 -0.03 0.00 0.42 0.00 0.00 57.03 57.39 2x90 h ASP 92 Cb -0.07 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 40.91 2x90 h ASP 92 CO -0.04 0.37 0.20 -0.07 -2.88 0.00 0.00 179.24 176.82 2x90 h LEU 93 N 0.04 0.67 -0.98 2.28 3.38 -1.92 -2.01 115.31 116.77 2x90 h LEU 93 Ca 0.04 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.86 2x90 h LEU 93 Cb 0.24 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 2x90 h LEU 93 CO -0.00 0.66 0.65 0.11 0.09 0.00 0.00 178.44 179.94 2x90 h LYS 94 N 0.65 1.29 -0.62 1.13 1.57 -1.34 -1.56 116.57 117.70 2x90 h LYS 94 Ca 0.16 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.81 2x90 h LYS 94 Cb 0.19 -0.29 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 2x90 h LYS 94 CO -0.01 0.86 0.18 -0.09 -0.57 0.00 0.00 179.45 179.81 2x90 h ARG 95 N 1.33 0.98 -0.29 3.15 2.43 -0.91 -1.14 114.38 119.93 2x90 h ARG 95 Ca 0.36 -0.22 -0.03 0.00 -0.81 0.00 0.00 59.98 59.28 2x90 h ARG 95 Cb -0.15 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.25 2x90 h ARG 95 CO -0.08 0.88 0.08 1.96 -1.51 0.00 0.00 179.97 181.29 2x90 h GLN 96 N 0.90 0.46 -0.73 0.20 4.20 -1.04 -1.92 115.11 117.16 2x90 h GLN 96 Ca 0.20 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 2x90 h GLN 96 Cb 0.32 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.00 2x90 h GLN 96 CO -0.00 0.53 0.42 0.74 -0.67 0.00 0.00 178.83 179.85 2x90 h PHE 97 N 0.30 0.99 -0.59 2.96 0.04 -1.20 -2.30 116.94 117.14 2x90 h PHE 97 Ca 0.09 -0.01 0.02 0.00 2.80 0.00 0.00 57.97 60.87 2x90 h PHE 97 Cb 0.27 -0.32 -0.03 0.00 2.20 0.00 0.00 35.95 38.07 2x90 h PHE 97 CO 0.01 0.68 0.37 -0.22 -0.60 0.00 0.00 178.31 178.55 2x90 h LYS 98 N 1.01 0.72 -0.94 1.51 3.64 -1.10 -2.03 116.57 119.38 2x90 h LYS 98 Ca 0.26 -0.04 0.08 0.00 -1.27 0.00 0.00 60.65 59.68 2x90 h LYS 98 Cb -0.00 -0.16 -0.07 0.00 -0.41 0.00 0.00 32.23 31.59 2x90 h LYS 98 CO -0.05 0.48 0.61 0.00 -2.27 0.00 0.00 179.45 178.22 2x90 h ALA 99 N 1.24 1.52 0.00 5.00 0.00 -0.97 -2.36 119.26 123.69 2x90 h ALA 99 Ca 0.23 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.04 2x90 h ALA 99 Cb -0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2x90 h ALA 99 CO -0.08 0.31 -0.40 -0.07 0.00 0.00 0.00 179.25 179.02 2x90 h LEU 100 N 1.02 0.00 -1.17 0.00 3.38 -0.84 -3.00 115.31 114.71 2x90 h LEU 100 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 2x90 h LEU 100 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2x90 h LEU 100 CO -0.18 0.40 0.00 0.71 0.09 0.00 0.00 178.44 179.46 2x90 h THR 101 N 0.00 0.00 -1.93 0.22 1.35 -0.86 -3.40 112.91 108.30 2x90 h THR 101 Ca -0.00 -0.58 -0.62 0.00 -0.55 0.00 0.00 66.41 64.66 2x90 h THR 101 Cb 0.86 1.57 -0.12 0.00 -1.73 0.00 0.00 68.15 68.72 2x90 h THR 101 CO 0.05 0.00 1.09 -0.54 -0.25 0.00 0.00 175.52 175.87 2x90 s LYS 102 N -3.57 3.44 0.15 4.72 1.02 -1.13 -4.86 119.74 119.50 2x90 s LYS 102 Ca 0.02 -1.08 0.07 0.00 0.02 0.00 0.00 55.97 55.00 2x90 s LYS 102 Cb 0.08 -4.84 -0.11 0.00 -0.52 0.00 0.00 37.83 32.44 2x90 s LYS 102 CO 0.56 -2.02 1.33 -0.07 -0.92 0.00 0.00 175.35 174.23 2x90 h LEU 103 N 11.99 0.04 0.00 3.17 3.38 -1.87 -3.49 115.31 128.52 2x90 h LEU 103 Ca 0.02 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2x90 h LEU 103 Cb 1.03 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2x90 h LEU 103 CO 1.28 0.96 0.00 0.61 0.09 0.00 0.00 178.44 181.37 2x90 n GLY 104 N 1.15 3.33 0.27 0.83 0.00 -1.26 -2.42 105.19 107.09 2x90 n GLY 104 Ca -0.01 -0.21 0.11 0.00 0.00 0.00 0.00 46.02 45.91 2x90 n GLY 104 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2x90 h TYR 105 N 0.00 0.00 0.00 1.61 0.05 -1.95 -2.38 116.97 114.30 2x90 h TYR 105 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2x90 h TYR 105 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 2x90 h TYR 105 CO 0.00 0.03 0.00 0.00 -1.05 0.00 0.00 178.16 177.14 2x90 n ALA 106 N -2.42 1.39 0.28 3.88 0.00 -1.01 -1.51 120.51 121.12 2x90 n ALA 106 Ca -0.03 -0.03 0.14 0.00 0.00 0.00 0.00 53.44 53.52 2x90 n ALA 106 Cb 0.12 -1.11 0.37 0.00 0.00 0.00 0.00 19.45 18.83 2x90 n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2x90 h ALA 107 N 2.27 1.00 -2.84 0.00 0.00 -1.59 -3.42 119.26 114.67 2x90 h ALA 107 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 2x90 h ALA 107 Cb 0.09 0.00 0.11 0.00 0.00 0.00 0.00 17.79 17.99 2x90 h ALA 107 CO 0.00 0.00 0.49 -0.51 0.00 0.00 0.00 179.25 179.23 2x90 s LEU 108 N -5.96 3.74 0.63 0.00 1.43 -0.57 -4.98 118.68 112.97 2x90 s LEU 108 Ca 0.05 2.43 -0.18 0.00 -1.03 0.00 0.00 54.13 55.41 2x90 s LEU 108 Cb 0.07 -4.50 -0.04 0.00 0.03 0.00 0.00 46.19 41.75 2x90 s LEU 108 CO 0.61 -1.49 0.90 -2.65 0.23 0.00 0.00 176.35 173.95 2x90 n PRO 109 N -1.34 0.74 -0.28 1.29 -0.02 -1.26 -4.62 135.00 129.50 2x90 n PRO 109 Ca 0.12 0.30 0.01 0.00 -2.02 0.00 0.00 63.50 61.90 2x90 n PRO 109 Cb 0.49 -2.12 0.07 0.00 -0.02 0.00 0.00 33.50 31.93 2x90 n PRO 109 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2x90 h GLU 110 N 0.25 -0.03 -0.59 -0.52 4.81 -1.96 -0.29 114.58 116.25 2x90 h GLU 110 Ca -0.48 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 58.67 2x90 h GLU 110 Cb 1.36 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.73 2x90 h GLU 110 CO 0.49 -0.02 0.05 -0.44 -0.73 0.00 0.00 179.01 178.36 2x90 h ASP 111 N -0.03 0.97 -0.48 1.04 3.32 -2.00 -2.28 116.42 116.95 2x90 h ASP 111 Ca 0.35 -0.28 -0.09 0.00 0.02 0.00 0.00 57.03 57.03 2x90 h ASP 111 Cb 0.59 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 2x90 h ASP 111 CO -0.83 1.01 -0.04 0.44 -1.72 0.00 0.00 179.24 178.10 2x90 h ASP 112 N 0.89 0.90 -0.57 6.45 3.32 -1.60 -1.92 116.42 123.89 2x90 h ASP 112 Ca 0.17 -0.25 -0.05 0.00 0.02 0.00 0.00 57.03 56.92 2x90 h ASP 112 Cb 0.48 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 2x90 h ASP 112 CO 0.02 0.98 0.16 0.22 -1.72 0.00 0.00 179.24 178.90 2x90 h TYR 113 N 0.84 0.95 -0.74 4.55 3.20 -1.00 -1.35 116.97 123.43 2x90 h TYR 113 Ca 0.15 -0.11 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 2x90 h TYR 113 Cb 0.55 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.51 2x90 h TYR 113 CO 0.03 0.80 0.34 0.00 -1.64 0.00 0.00 178.16 177.70 2x90 h ALA 114 N 1.03 0.95 -0.67 1.82 0.00 -1.24 -1.51 119.26 119.64 2x90 h ALA 114 Ca 0.18 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2x90 h ALA 114 Cb 0.32 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2x90 h ALA 114 CO -0.00 0.53 0.09 1.49 0.00 0.00 0.00 179.25 181.36 2x90 h GLU 115 N 1.04 1.12 -0.37 0.00 4.81 -1.20 -1.88 114.58 118.10 2x90 h GLU 115 Ca 0.25 -0.31 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 2x90 h GLU 115 Cb 0.14 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 2x90 h GLU 115 CO -0.03 1.03 0.15 1.25 -0.73 0.00 0.00 179.01 180.68 2x90 h LEU 116 N 1.04 0.52 -0.64 1.64 5.85 -0.95 -0.41 115.31 122.37 2x90 h LEU 116 Ca 0.20 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 58.77 2x90 h LEU 116 Cb 0.47 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 2x90 h LEU 116 CO 0.02 0.55 0.40 -0.07 -0.34 0.00 0.00 178.44 178.99 2x90 h LEU 117 N 0.46 0.66 -1.14 2.25 3.38 -1.15 0.10 115.31 119.87 2x90 h LEU 117 Ca 0.12 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 2x90 h LEU 117 Cb 0.20 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2x90 h LEU 117 CO -0.01 0.46 0.03 0.44 0.09 0.00 0.00 178.44 179.45 2x90 h ASP 118 N 0.79 0.59 -0.27 -0.43 3.45 -1.16 -0.96 116.42 118.43 2x90 h ASP 118 Ca 0.25 -0.12 -0.07 0.00 0.43 0.00 0.00 57.03 57.52 2x90 h ASP 118 Cb -0.00 -0.16 -0.01 0.00 -0.56 0.00 0.00 39.33 38.61 2x90 h ASP 118 CO -0.09 0.65 -0.12 0.74 -1.57 0.00 0.00 179.24 178.84 2x90 h THR 119 N 0.61 1.30 -0.37 0.35 2.02 -0.39 -2.00 112.91 114.41 2x90 h THR 119 Ca 0.13 -1.19 -0.03 0.00 0.77 0.00 0.00 66.41 66.08 2x90 h THR 119 Cb 0.34 1.51 -0.02 0.00 -1.74 0.00 0.00 68.15 68.24 2x90 h THR 119 CO 0.01 0.38 0.10 -0.07 0.37 0.00 0.00 175.52 176.31 2x90 h LEU 120 N 0.29 0.55 -0.88 2.58 3.38 -0.57 -2.21 115.31 118.45 2x90 h LEU 120 Ca 0.06 -0.22 -0.10 0.00 0.09 0.00 0.00 57.88 57.71 2x90 h LEU 120 Cb 0.62 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2x90 h LEU 120 CO 0.04 0.63 -0.31 0.77 0.09 0.00 0.00 178.44 179.66 2x90 h SER 121 N 0.45 0.47 -0.58 -0.43 4.64 -1.24 -1.37 113.55 115.50 2x90 h SER 121 Ca 0.12 -0.18 0.03 0.00 -0.47 0.00 0.00 61.79 61.29 2x90 h SER 121 Cb 0.28 -0.13 -0.04 0.00 -0.31 0.00 0.00 62.40 62.21 2x90 h SER 121 CO -0.00 0.76 0.35 0.00 -0.87 0.00 0.00 176.83 177.07 2x90 h ALA 122 N 1.27 0.75 -0.11 5.18 0.00 -1.19 -0.37 119.26 124.79 2x90 h ALA 122 Ca 0.05 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 2x90 h ALA 122 Cb 0.74 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 2x90 h ALA 122 CO 0.06 0.09 -0.12 0.52 0.00 0.00 0.00 179.25 179.80 2x90 h MET 123 N 0.70 0.28 -0.61 0.00 2.07 -1.18 -2.01 114.93 114.18 2x90 h MET 123 Ca 0.23 -0.15 -0.10 0.00 -2.07 0.00 0.00 59.70 57.62 2x90 h MET 123 Cb 0.02 0.01 -0.02 0.00 -1.87 0.00 0.00 31.60 29.73 2x90 h MET 123 CO -0.10 0.69 0.01 1.49 1.07 0.00 0.00 176.91 180.07 2x90 h GLU 124 N -0.12 1.07 -0.25 1.72 4.81 -1.21 -2.06 114.58 118.54 2x90 h GLU 124 Ca 0.02 -0.33 -0.13 0.00 -0.13 0.00 0.00 59.36 58.79 2x90 h GLU 124 Cb 0.64 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 2x90 h GLU 124 CO 0.03 1.04 -0.38 0.66 -0.73 0.00 0.00 179.01 179.63 2x90 h SER 125 N 0.98 0.61 -0.01 1.04 4.64 -1.12 -1.43 113.55 118.25 2x90 h SER 125 Ca 0.17 -0.26 0.01 0.00 -0.47 0.00 0.00 61.79 61.25 2x90 h SER 125 Cb 0.55 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 2x90 h SER 125 CO 0.03 0.92 -0.04 -1.13 -0.87 0.00 0.00 176.83 175.74 2x90 h ASN 126 N 0.48 -0.12 -0.38 4.97 -0.73 -1.21 -0.82 115.58 117.77 2x90 h ASN 126 Ca 0.05 0.02 0.05 0.00 1.87 0.00 0.00 56.30 58.29 2x90 h ASN 126 Cb 0.87 0.06 -0.05 0.00 0.27 0.00 0.00 38.32 39.47 2x90 h ASN 126 CO 0.07 -0.06 0.10 0.15 -0.37 0.00 0.00 177.43 177.32 2x90 h PHE 127 N -0.07 0.18 0.00 0.67 3.57 -1.23 -2.52 116.94 117.54 2x90 h PHE 127 Ca 0.02 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.50 2x90 h PHE 127 Cb 0.10 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 2x90 h PHE 127 CO -0.12 0.05 -0.19 0.00 -2.23 0.00 0.00 178.31 175.82 2x90 h ALA 128 N 1.27 1.13 -0.22 2.41 0.00 -1.06 -3.06 119.26 119.72 2x90 h ALA 128 Ca 0.18 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2x90 h ALA 128 Cb 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2x90 h ALA 128 CO -0.21 0.23 0.00 1.63 0.00 0.00 0.00 179.25 180.90 2x90 n LYS 129 N -3.50 2.34 -1.71 0.00 5.02 -0.33 -4.70 118.16 115.28 2x90 n LYS 129 Ca -0.01 -1.99 -0.42 0.00 -2.02 0.00 0.00 58.31 53.87 2x90 n LYS 129 Cb 0.35 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.84 2x90 n LYS 129 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2x90 n VAL 130 N 1.28 0.12 -4.19 -0.18 0.31 -1.04 -5.00 118.33 109.62 2x90 n VAL 130 Ca 0.17 -0.02 -0.18 0.00 -0.01 0.00 0.00 64.34 64.30 2x90 n VAL 130 Cb 0.57 -2.05 -0.15 0.00 -0.91 0.00 0.00 33.84 31.30 2x90 n VAL 130 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2x90 s LYS 131 N 1.69 0.59 0.29 5.55 -0.14 -1.26 -4.29 119.74 122.17 2x90 s LYS 131 Ca 0.77 -0.18 0.09 0.00 -1.36 0.00 0.00 55.97 55.30 2x90 s LYS 131 Cb -0.49 -0.59 -0.06 0.00 -1.68 0.00 0.00 37.83 35.01 2x90 s LYS 131 CO 0.34 0.06 -0.13 0.14 -0.76 0.00 0.00 175.35 175.00 2x90 s VAL 132 N 0.20 2.13 0.24 3.17 -7.23 0.06 -4.90 120.40 114.07 2x90 s VAL 132 Ca -0.02 -2.26 -0.20 0.00 -1.81 0.00 0.00 61.98 57.69 2x90 s VAL 132 Cb -0.06 -2.41 -0.08 0.00 0.56 0.00 0.00 36.38 34.38 2x90 s VAL 132 CO -0.00 -0.34 0.74 0.00 -0.31 0.00 0.00 175.10 175.19 2x90 n ASP 134 N 0.61 3.51 -0.13 0.00 4.64 0.60 -4.90 116.55 120.88 2x90 n ASP 134 Ca -0.01 1.17 0.07 0.00 -1.38 0.00 0.00 54.79 54.63 2x90 n ASP 134 Cb 0.51 -1.55 0.39 0.00 -1.04 0.00 0.00 41.12 39.43 2x90 n ASP 134 CO 0.00 0.00 0.00 0.22 -0.82 0.00 0.00 177.20 176.60 2x90 h TYR 135 N 4.08 0.66 -0.00 -0.67 3.20 -1.96 -2.82 116.97 119.46 2x90 h TYR 135 Ca -0.47 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.42 2x90 h TYR 135 Cb 1.24 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.30 2x90 h TYR 135 CO 0.56 0.36 -0.89 1.63 -1.64 0.00 0.00 178.16 178.18 2x90 n LYS 136 N -4.47 0.58 -3.45 1.82 5.02 -1.26 -4.82 118.16 111.57 2x90 n LYS 136 Ca 0.09 -0.08 -0.25 0.00 -2.02 0.00 0.00 58.31 56.05 2x90 n LYS 136 Cb 0.21 -1.43 -0.11 0.00 -0.02 0.00 0.00 35.03 33.68 2x90 n LYS 136 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2x90 s ASP 137 N -2.81 2.56 0.00 4.39 -1.08 -1.06 -5.00 116.67 113.66 2x90 s ASP 137 Ca 0.08 -1.68 0.12 0.00 -0.52 0.00 0.00 52.55 50.56 2x90 s ASP 137 Cb 0.15 -0.07 0.60 0.00 -1.46 0.00 0.00 42.92 42.14 2x90 s ASP 137 CO 0.78 -0.34 1.29 -1.54 0.52 0.00 0.00 175.17 175.89 2x90 n SER 138 N 4.52 0.00 0.07 -0.34 3.41 -1.25 -1.96 113.62 118.07 2x90 n SER 138 Ca 0.06 0.13 -0.18 0.00 -0.26 0.00 0.00 58.87 58.62 2x90 n SER 138 Cb 0.41 -0.29 -0.14 0.00 -0.26 0.00 0.00 64.21 63.92 2x90 n SER 138 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2x90 h THR 139 N 0.00 1.17 -3.01 6.66 2.02 -1.94 -3.44 112.91 114.38 2x90 h THR 139 Ca 0.00 -2.79 -0.59 0.00 0.77 0.00 0.00 66.41 63.80 2x90 h THR 139 Cb 0.12 2.79 -0.11 0.00 -1.74 0.00 0.00 68.15 69.21 2x90 h THR 139 CO 0.00 0.83 0.74 -0.75 0.37 0.00 0.00 175.52 176.71 2x90 s LYS 140 N -2.62 3.33 -0.29 6.66 2.20 -0.83 -4.90 119.74 123.31 2x90 s LYS 140 Ca -0.09 -0.20 0.11 0.00 -0.36 0.00 0.00 55.97 55.43 2x90 s LYS 140 Cb 0.07 -4.08 0.47 0.00 -1.51 0.00 0.00 37.83 32.77 2x90 s LYS 140 CO 0.86 -1.68 1.17 0.00 -0.36 0.00 0.00 175.35 175.34 2x90 n ASP 142 N -0.67 1.67 -4.61 0.00 5.75 -1.23 -4.39 116.55 113.06 2x90 n ASP 142 Ca 0.34 -3.76 -0.42 0.00 -0.01 0.00 0.00 54.79 50.94 2x90 n ASP 142 Cb 0.92 -0.51 -0.04 0.00 -1.03 0.00 0.00 41.12 40.46 2x90 n ASP 142 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2x90 s LEU 143 N -3.00 4.05 0.32 -2.12 1.02 -1.01 -4.90 118.68 113.04 2x90 s LEU 143 Ca 0.38 0.68 0.02 0.00 0.02 0.00 0.00 54.13 55.23 2x90 s LEU 143 Cb 0.37 -3.19 -0.03 0.00 0.02 0.00 0.00 46.19 43.36 2x90 s LEU 143 CO -0.07 -0.71 0.49 0.00 0.02 0.00 0.00 176.35 176.07 2x90 s ALA 144 N 3.18 3.78 0.14 4.21 0.00 -1.26 -0.76 121.76 131.04 2x90 s ALA 144 Ca 0.36 -1.02 -0.21 0.00 0.00 0.00 0.00 51.96 51.08 2x90 s ALA 144 Cb -0.13 -1.99 0.01 0.00 0.00 0.00 0.00 23.12 21.01 2x90 s ALA 144 CO 0.14 0.05 1.67 1.25 0.00 0.00 0.00 175.76 178.87 2x90 h LEU 145 N 0.87 -0.47 -8.29 0.00 5.85 -1.95 -0.09 115.31 111.23 2x90 h LEU 145 Ca -0.50 0.10 -0.68 0.00 0.84 0.00 0.00 57.88 57.63 2x90 h LEU 145 Cb 1.22 0.24 -0.28 0.00 0.37 0.00 0.00 40.66 42.22 2x90 h LEU 145 CO 0.61 -0.18 -0.63 -0.62 -0.34 0.00 0.00 178.44 177.27 2x90 s ASP 146 N -5.10 5.08 -0.00 1.25 -1.08 -1.26 -1.13 116.67 114.43 2x90 s ASP 146 Ca -0.14 -0.88 0.18 0.00 -0.52 0.00 0.00 52.55 51.20 2x90 s ASP 146 Cb 0.11 -1.85 -0.20 0.00 -1.46 0.00 0.00 42.92 39.52 2x90 s ASP 146 CO 0.68 -0.23 0.78 -0.81 0.52 0.00 0.00 175.17 176.11 2x90 n PRO 147 N 4.82 0.87 0.23 4.34 -0.04 -1.26 -4.99 135.00 138.97 2x90 n PRO 147 Ca -0.14 -0.01 -0.15 0.00 -0.04 0.00 0.00 63.50 63.16 2x90 n PRO 147 Cb 0.47 -1.38 -0.08 0.00 -0.04 0.00 0.00 33.50 32.47 2x90 n PRO 147 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2x90 h GLU 148 N 0.00 -0.54 -0.29 0.54 3.07 -1.43 -1.46 114.58 114.46 2x90 h GLU 148 Ca 0.00 0.04 -0.10 0.00 -0.50 0.00 0.00 59.36 58.80 2x90 h GLU 148 Cb 0.45 0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.48 2x90 h GLU 148 CO 0.00 -0.30 -0.21 0.82 -1.40 0.00 0.00 179.01 177.92 2x90 h ILE 149 N -0.67 1.30 -0.17 3.13 2.04 -0.88 -2.97 117.51 119.28 2x90 h ILE 149 Ca -0.06 -1.34 -0.01 0.00 1.00 0.00 0.00 64.86 64.45 2x90 h ILE 149 Cb 0.49 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.09 2x90 h ILE 149 CO 0.09 0.43 0.04 -0.33 0.00 0.00 0.00 178.15 178.38 2x90 h GLU 150 N 0.40 0.23 -0.36 2.37 5.08 -1.13 -1.07 114.58 120.10 2x90 h GLU 150 Ca 0.06 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2x90 h GLU 150 Cb 0.75 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 2x90 h GLU 150 CO 0.06 0.22 0.19 1.49 -1.00 0.00 0.00 179.01 179.97 2x90 h GLU 151 N 0.23 0.50 -0.04 2.33 4.81 -1.11 -1.65 114.58 119.65 2x90 h GLU 151 Ca 0.06 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2x90 h GLU 151 Cb 0.09 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 2x90 h GLU 151 CO -0.00 0.42 0.01 0.28 -0.73 0.00 0.00 179.01 178.98 2x90 h VAL 152 N 0.45 1.21 -0.99 0.32 2.07 -1.22 -1.49 116.25 116.61 2x90 h VAL 152 Ca 0.12 -0.63 0.09 0.00 0.82 0.00 0.00 66.70 67.11 2x90 h VAL 152 Cb 0.07 1.57 -0.08 0.00 -1.52 0.00 0.00 31.29 31.33 2x90 h VAL 152 CO -0.02 0.17 0.62 0.40 0.02 0.00 0.00 177.57 178.76 2x90 h ILE 153 N -0.19 0.99 0.00 4.57 1.08 -1.20 0.16 117.51 122.92 2x90 h ILE 153 Ca 0.01 -0.36 -0.17 0.00 -0.39 0.00 0.00 64.86 63.95 2x90 h ILE 153 Cb 0.27 -0.15 -0.02 0.00 -3.07 0.00 0.00 36.82 33.84 2x90 h ILE 153 CO 0.00 0.19 -0.81 0.77 -0.69 0.00 0.00 178.15 177.61 2x90 h SER 154 N 1.05 0.00 0.00 1.72 4.64 -1.23 -3.37 113.55 116.36 2x90 h SER 154 Ca 0.46 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.56 2x90 h SER 154 Cb 0.34 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.39 2x90 h SER 154 CO -0.22 0.81 -1.84 0.29 -0.87 0.00 0.00 176.83 175.00 2x90 n LYS 155 N -3.32 0.74 -2.14 4.77 5.02 -0.57 -4.80 118.16 117.86 2x90 n LYS 155 Ca 0.01 0.07 -0.41 0.00 -2.02 0.00 0.00 58.31 55.96 2x90 n LYS 155 Cb 0.86 -1.30 -0.02 0.00 -0.02 0.00 0.00 35.03 34.54 2x90 n LYS 155 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2x90 s SER 156 N -5.23 6.81 -0.19 4.39 0.15 0.51 -4.93 113.70 115.21 2x90 s SER 156 Ca -0.17 2.65 0.13 0.00 0.70 0.00 0.00 55.95 59.27 2x90 s SER 156 Cb 0.05 -2.65 0.39 0.00 -1.71 0.00 0.00 66.02 62.11 2x90 s SER 156 CO 0.37 -0.51 1.23 0.54 1.20 0.00 0.00 173.24 176.08 2x90 n ARG 157 N 0.89 1.57 -3.24 5.44 5.12 -1.26 -4.91 116.66 120.27 2x90 n ARG 157 Ca 0.00 -3.06 -0.44 0.00 -1.93 0.00 0.00 57.85 52.41 2x90 n ARG 157 Cb 0.42 -1.61 -0.06 0.00 -1.16 0.00 0.00 32.46 30.05 2x90 n ARG 157 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2x90 s ASP 158 N -3.02 6.19 0.50 0.55 -1.08 -1.26 -4.96 116.67 113.59 2x90 s ASP 158 Ca 0.37 -1.27 0.15 0.00 -0.52 0.00 0.00 52.55 51.27 2x90 s ASP 158 Cb 0.35 -2.25 1.20 0.00 -1.46 0.00 0.00 42.92 40.76 2x90 s ASP 158 CO -0.03 -0.86 2.13 1.12 0.52 0.00 0.00 175.17 178.05 2x90 h HIS 159 N 8.95 0.08 0.01 -5.34 2.07 -1.97 -0.77 115.15 118.18 2x90 h HIS 159 Ca -0.29 0.00 -0.24 0.00 -2.85 0.00 0.00 60.37 57.00 2x90 h HIS 159 Cb 1.10 -0.03 0.01 0.00 2.57 0.00 0.00 27.41 31.06 2x90 h HIS 159 CO 0.73 0.05 -0.99 0.93 -3.07 0.00 0.00 177.93 175.58 2x90 h GLU 160 N 0.08 0.47 -0.06 5.12 5.08 -1.99 -1.51 114.58 121.78 2x90 h GLU 160 Ca 0.02 -0.52 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 2x90 h GLU 160 Cb -0.00 0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 2x90 h GLU 160 CO -0.00 1.17 0.04 1.49 -1.00 0.00 0.00 179.01 180.70 2x90 h GLU 161 N 0.26 0.08 -0.62 2.33 4.81 -1.77 -1.16 114.58 118.51 2x90 h GLU 161 Ca -0.10 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.19 2x90 h GLU 161 Cb 1.64 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.94 2x90 h GLU 161 CO 0.18 0.07 0.31 -0.07 -0.73 0.00 0.00 179.01 178.77 2x90 h LEU 162 N 0.07 0.43 -0.95 1.64 3.38 -1.17 -2.21 115.31 116.49 2x90 h LEU 162 Ca 0.02 0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 2x90 h LEU 162 Cb 0.01 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2x90 h LEU 162 CO -0.00 0.28 0.05 0.00 0.09 0.00 0.00 178.44 178.85 2x90 h ALA 163 N 1.35 1.14 0.26 1.53 0.00 -1.09 -1.41 119.26 121.05 2x90 h ALA 163 Ca 0.29 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2x90 h ALA 163 Cb 0.24 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2x90 h ALA 163 CO -0.21 0.56 -0.13 -0.92 0.00 0.00 0.00 179.25 178.55 2x90 h TYR 164 N 0.77 -0.35 -0.33 0.00 3.20 -0.67 -2.03 116.97 117.57 2x90 h TYR 164 Ca 0.16 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.93 2x90 h TYR 164 Cb 0.39 0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.76 2x90 h TYR 164 CO 0.02 -0.21 -0.17 1.88 -1.64 0.00 0.00 178.16 178.04 2x90 h TYR 165 N -0.36 0.65 0.27 -3.82 0.05 -1.23 -1.48 116.97 111.05 2x90 h TYR 165 Ca -0.03 -0.12 0.00 0.00 0.05 0.00 0.00 58.73 58.63 2x90 h TYR 165 Cb 0.28 -0.17 -0.02 0.00 1.01 0.00 0.00 36.73 37.84 2x90 h TYR 165 CO -0.07 0.73 -0.25 2.35 -1.05 0.00 0.00 178.16 179.87 2x90 h TRP 166 N 0.53 -0.67 -0.31 4.88 7.01 -1.20 -1.59 115.95 124.60 2x90 h TRP 166 Ca 0.09 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.09 2x90 h TRP 166 Cb 0.60 0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 27.91 2x90 h TRP 166 CO 0.02 -0.37 0.19 -0.09 -2.79 0.00 0.00 178.44 175.40 2x90 h ARG 167 N -0.55 0.42 -0.57 2.65 2.43 -1.14 -1.41 114.38 116.21 2x90 h ARG 167 Ca -0.01 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.13 2x90 h ARG 167 Cb 0.50 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 2x90 h ARG 167 CO -0.05 0.32 0.37 0.93 -1.51 0.00 0.00 179.97 180.03 2x90 h GLU 168 N 0.39 0.74 -0.00 0.20 4.39 -1.24 -1.69 114.58 117.38 2x90 h GLU 168 Ca 0.11 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.76 2x90 h GLU 168 Cb 0.01 -0.17 -0.00 0.00 -0.10 0.00 0.00 28.75 28.49 2x90 h GLU 168 CO -0.02 0.49 -0.00 0.35 -1.16 0.00 0.00 179.01 178.67 2x90 h PHE 169 N 0.76 0.01 -0.91 4.33 3.57 -1.13 -2.84 116.94 120.73 2x90 h PHE 169 Ca 0.21 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.71 2x90 h PHE 169 Cb -0.08 -0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.62 2x90 h PHE 169 CO -0.04 0.46 0.57 1.88 -2.23 0.00 0.00 178.31 178.95 2x90 h TYR 170 N -0.45 1.19 -0.88 0.41 -1.99 -1.23 0.27 116.97 114.29 2x90 h TYR 170 Ca 0.00 0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.73 2x90 h TYR 170 Cb 0.46 -0.39 -0.04 0.00 2.00 0.00 0.00 36.73 38.76 2x90 h TYR 170 CO 0.08 0.78 0.52 -0.44 -0.00 0.00 0.00 178.16 179.10 2x90 h ASP 171 N 1.25 1.06 0.28 3.88 3.32 -1.35 0.78 116.42 125.65 2x90 h ASP 171 Ca 0.33 -0.07 -0.34 0.00 0.02 0.00 0.00 57.03 56.98 2x90 h ASP 171 Cb -0.08 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.19 2x90 h ASP 171 CO -0.06 0.82 -1.75 0.11 -1.72 0.00 0.00 179.24 176.64 2x90 h LYS 172 N 1.21 0.27 0.00 3.56 1.57 -1.15 -3.05 116.57 118.99 2x90 h LYS 172 Ca 0.31 -0.47 -0.22 0.00 -1.87 0.00 0.00 60.65 58.41 2x90 h LYS 172 Cb -0.03 0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.41 2x90 h LYS 172 CO -0.06 1.14 -1.45 0.00 -0.57 0.00 0.00 179.45 178.51 2x90 h ALA 173 N 0.31 0.69 -1.16 3.86 0.00 -0.53 -3.39 119.26 119.03 2x90 h ALA 173 Ca -0.33 -1.07 0.00 0.00 0.00 0.00 0.00 54.91 53.51 2x90 h ALA 173 Cb 2.05 0.32 0.00 0.00 0.00 0.00 0.00 17.79 20.15 2x90 h ALA 173 CO 0.14 1.19 0.00 0.41 0.00 0.00 0.00 179.25 180.98 2x90 n GLY 174 N 1.45 -0.42 0.37 0.00 0.00 0.24 -3.61 105.19 103.20 2x90 n GLY 174 Ca -0.11 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.00 2x90 n GLY 174 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2x90 h THR 175 N 0.00 0.87 -0.03 2.61 2.02 -0.63 -2.44 112.91 115.30 2x90 h THR 175 Ca 0.00 -0.29 0.01 0.00 0.77 0.00 0.00 66.41 66.90 2x90 h THR 175 Cb 0.00 -0.06 -0.00 0.00 -1.74 0.00 0.00 68.15 66.35 2x90 h THR 175 CO 0.00 0.16 0.07 0.00 0.37 0.00 0.00 175.52 176.12 2x90 h ALA 176 N 1.57 1.32 -0.25 6.16 0.00 -1.73 -2.66 119.26 123.68 2x90 h ALA 176 Ca 0.48 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.33 2x90 h ALA 176 Cb 0.62 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 2x90 h ALA 176 CO -0.25 -0.09 -0.04 1.33 0.00 0.00 0.00 179.25 180.20 2x90 n VAL 177 N -3.39 2.33 -0.06 0.00 0.24 -0.92 -4.76 118.33 111.77 2x90 n VAL 177 Ca -0.02 -2.29 -0.08 0.00 -2.04 0.00 0.00 64.34 59.91 2x90 n VAL 177 Cb 0.15 -0.28 -0.01 0.00 -1.47 0.00 0.00 33.84 32.23 2x90 n VAL 177 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 2x90 h ARG 178 N 1.22 0.14 -0.65 7.34 2.43 -1.60 0.16 114.38 123.42 2x90 h ARG 178 Ca 0.08 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.16 2x90 h ARG 178 Cb 1.45 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.94 2x90 h ARG 178 CO 0.24 0.10 0.08 0.66 -1.51 0.00 0.00 179.97 179.54 2x90 h SER 179 N 0.15 1.04 -0.54 -3.80 4.64 -1.86 -0.08 113.55 113.09 2x90 h SER 179 Ca 0.12 -0.25 -0.05 0.00 -0.47 0.00 0.00 61.79 61.13 2x90 h SER 179 Cb 0.11 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 61.91 2x90 h SER 179 CO -0.15 1.04 0.13 1.56 -0.87 0.00 0.00 176.83 178.54 2x90 h GLN 180 N 1.01 0.87 -0.71 4.77 7.50 -1.86 -2.44 115.11 124.24 2x90 h GLN 180 Ca 0.20 -0.21 -0.03 0.00 0.50 0.00 0.00 58.65 59.11 2x90 h GLN 180 Cb 0.46 -0.11 -0.03 0.00 0.05 0.00 0.00 27.48 27.84 2x90 h GLN 180 CO 0.02 0.82 0.34 0.35 -1.50 0.00 0.00 178.83 178.85 2x90 h PHE 181 N 0.77 1.04 -0.55 2.96 3.57 -0.56 -0.72 116.94 123.44 2x90 h PHE 181 Ca 0.17 -0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.66 2x90 h PHE 181 Cb 0.34 -0.32 -0.04 0.00 2.79 0.00 0.00 35.95 38.72 2x90 h PHE 181 CO 0.02 0.77 0.30 0.93 -2.23 0.00 0.00 178.31 178.11 2x90 h GLU 182 N 1.00 0.57 -0.43 1.11 5.08 -0.91 -0.97 114.58 120.04 2x90 h GLU 182 Ca 0.24 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.46 2x90 h GLU 182 Cb 0.13 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2x90 h GLU 182 CO -0.03 0.38 -0.18 -0.09 -1.00 0.00 0.00 179.01 178.09 2x90 h ARG 183 N 0.59 0.83 -0.48 2.33 9.65 -1.15 -2.43 114.38 123.72 2x90 h ARG 183 Ca 0.23 -0.31 0.01 0.00 -1.10 0.00 0.00 59.98 58.81 2x90 h ARG 183 Cb 0.10 -0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 28.60 2x90 h ARG 183 CO -0.14 0.94 0.30 -0.92 2.80 0.00 0.00 179.97 182.96 2x90 h TYR 184 N 0.73 0.57 -0.51 2.20 3.20 -0.76 -1.12 116.97 121.27 2x90 h TYR 184 Ca 0.11 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.02 2x90 h TYR 184 Cb 0.69 -0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.74 2x90 h TYR 184 CO 0.04 0.35 0.30 0.28 -1.64 0.00 0.00 178.16 177.49 2x90 h VAL 185 N 0.62 1.04 -0.44 1.81 2.07 -1.01 0.16 116.25 120.50 2x90 h VAL 185 Ca 0.18 -0.20 0.03 0.00 0.82 0.00 0.00 66.70 67.53 2x90 h VAL 185 Cb -0.04 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 2x90 h VAL 185 CO -0.06 0.11 0.23 -0.33 0.02 0.00 0.00 177.57 177.54 2x90 h GLU 186 N 0.60 0.45 0.02 1.57 5.08 -1.15 -1.34 114.58 119.81 2x90 h GLU 186 Ca 0.21 -0.03 -0.23 0.00 -1.00 0.00 0.00 59.36 58.31 2x90 h GLU 186 Cb 0.04 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.19 2x90 h GLU 186 CO -0.10 0.30 -0.97 -0.07 -1.00 0.00 0.00 179.01 177.16 2x90 h LEU 187 N 0.46 0.48 -0.66 1.33 3.38 -0.90 -1.40 115.31 118.01 2x90 h LEU 187 Ca 0.19 -0.40 0.01 0.00 0.09 0.00 0.00 57.88 57.76 2x90 h LEU 187 Cb 0.08 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 2x90 h LEU 187 CO -0.12 1.22 0.43 -1.13 0.09 0.00 0.00 178.44 178.93 2x90 h ASN 188 N 0.19 0.75 -0.43 -0.43 -0.73 -0.62 -0.51 115.58 113.79 2x90 h ASN 188 Ca -0.08 -0.02 -0.03 0.00 1.87 0.00 0.00 56.30 58.04 2x90 h ASN 188 Cb 1.62 -0.18 -0.02 0.00 0.27 0.00 0.00 38.32 40.01 2x90 h ASN 188 CO 0.17 0.54 0.14 0.74 -0.37 0.00 0.00 177.43 178.64 2x90 h THR 189 N 0.88 1.22 -0.59 -3.57 2.02 -1.17 -1.41 112.91 110.30 2x90 h THR 189 Ca 0.24 -0.72 0.00 0.00 0.77 0.00 0.00 66.41 66.71 2x90 h THR 189 Cb -0.09 0.87 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 2x90 h THR 189 CO -0.06 0.26 0.38 0.50 0.37 0.00 0.00 175.52 176.97 2x90 h LYS 190 N 0.56 0.78 -0.30 6.66 3.64 -1.00 -1.89 116.57 125.02 2x90 h LYS 190 Ca 0.14 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.46 2x90 h LYS 190 Cb 0.25 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 2x90 h LYS 190 CO -0.01 0.53 0.17 0.00 -2.27 0.00 0.00 179.45 177.87 2x90 h ALA 191 N 1.21 0.38 -0.57 5.00 0.00 -0.96 -2.09 119.26 122.23 2x90 h ALA 191 Ca 0.22 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.09 2x90 h ALA 191 Cb -0.07 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 2x90 h ALA 191 CO -0.04 -0.09 0.32 0.00 0.00 0.00 0.00 179.25 179.44 2x90 h ALA 192 N 1.04 0.74 -0.02 0.00 0.00 -1.03 -2.25 119.26 117.74 2x90 h ALA 192 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 2x90 h ALA 192 Cb 0.06 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2x90 h ALA 192 CO -0.02 0.02 -0.45 0.87 0.00 0.00 0.00 179.25 179.67 2x90 h LYS 193 N 0.63 0.04 0.00 0.00 1.57 -1.24 -0.12 116.57 117.44 2x90 h LYS 193 Ca 0.24 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.98 2x90 h LYS 193 Cb 0.09 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 2x90 h LYS 193 CO -0.13 0.48 -0.11 -0.07 -0.57 0.00 0.00 179.45 179.05 2x90 h LEU 194 N 0.03 0.00 -1.90 2.94 3.38 -0.94 -0.88 115.31 117.94 2x90 h LEU 194 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2x90 h LEU 194 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2x90 h LEU 194 CO 0.06 0.11 0.00 0.59 0.09 0.00 0.00 178.44 179.29 2x90 n ASN 195 N -3.33 2.79 -1.91 -0.43 3.02 -0.69 -4.95 115.26 109.76 2x90 n ASN 195 Ca -0.00 -1.96 -0.19 0.00 -0.03 0.00 0.00 54.58 52.39 2x90 n ASN 195 Cb 0.32 -0.31 -0.04 0.00 -0.61 0.00 0.00 39.78 39.14 2x90 n ASN 195 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2x90 n ASN 196 N 1.03 -5.49 -4.88 6.41 3.02 -0.34 -5.02 115.26 109.99 2x90 n ASN 196 Ca 0.18 0.19 -0.30 0.00 -0.03 0.00 0.00 54.58 54.62 2x90 n ASN 196 Cb 0.46 -4.60 -0.03 0.00 -0.61 0.00 0.00 39.78 34.99 2x90 n ASN 196 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2x90 s PHE 197 N -2.87 3.46 0.19 3.10 0.08 -0.14 -4.98 117.98 116.82 2x90 s PHE 197 Ca 0.00 0.92 -0.11 0.00 0.12 0.00 0.00 56.93 57.86 2x90 s PHE 197 Cb 0.00 -2.33 0.10 0.00 -0.57 0.00 0.00 43.02 40.22 2x90 s PHE 197 CO 0.00 0.02 1.75 1.15 -0.10 0.00 0.00 175.22 178.04 2x90 h THR 198 N 1.29 1.24 -2.91 0.64 2.02 -1.95 -3.24 112.91 109.99 2x90 h THR 198 Ca -0.47 -0.74 -0.02 0.00 0.77 0.00 0.00 66.41 65.95 2x90 h THR 198 Cb 1.19 0.48 0.01 0.00 -1.74 0.00 0.00 68.15 68.09 2x90 h THR 198 CO 0.65 0.29 0.26 -1.54 0.37 0.00 0.00 175.52 175.56 2x90 n SER 199 N -4.41 -2.14 0.31 4.18 3.41 -1.26 -4.73 113.62 108.98 2x90 n SER 199 Ca 0.05 -2.47 0.19 0.00 -0.26 0.00 0.00 58.87 56.38 2x90 n SER 199 Cb 0.17 3.55 0.99 0.00 -0.26 0.00 0.00 64.21 68.66 2x90 n SER 199 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2x90 h GLY 200 N 1.84 0.00 0.83 5.00 0.00 -1.81 -2.50 103.07 106.44 2x90 h GLY 200 Ca -0.31 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 2x90 h GLY 200 CO 0.40 0.00 0.03 0.00 0.00 0.00 0.00 176.54 176.97 2x90 h ALA 201 N 1.98 0.15 -0.25 3.60 0.00 -1.90 -1.52 119.26 121.32 2x90 h ALA 201 Ca -0.00 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 2x90 h ALA 201 Cb 0.16 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2x90 h ALA 201 CO 0.00 -0.23 -0.31 0.93 0.00 0.00 0.00 179.25 179.64 2x90 h GLU 202 N -0.00 0.51 -0.53 0.00 3.07 -1.87 -0.67 114.58 115.09 2x90 h GLU 202 Ca 0.04 -0.22 0.00 0.00 -0.50 0.00 0.00 59.36 58.68 2x90 h GLU 202 Cb 0.23 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.10 2x90 h GLU 202 CO -0.00 0.77 0.34 0.00 -1.40 0.00 0.00 179.01 178.72 2x90 h ALA 203 N 1.22 0.68 -0.18 3.43 0.00 -1.37 -0.94 119.26 122.10 2x90 h ALA 203 Ca 0.05 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2x90 h ALA 203 Cb 0.77 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2x90 h ALA 203 CO 0.06 0.14 0.00 -1.49 0.00 0.00 0.00 179.25 177.96 2x90 h TRP 204 N 0.72 0.34 0.00 0.00 6.55 -1.05 -3.13 115.95 119.39 2x90 h TRP 204 Ca 0.19 -0.06 -0.01 0.00 0.95 0.00 0.00 58.89 59.97 2x90 h TRP 204 Cb -0.06 -0.09 -0.00 0.00 -0.86 0.00 0.00 29.16 28.15 2x90 h TRP 204 CO -0.03 0.51 -0.05 -0.07 -1.05 0.00 0.00 178.44 177.75 2x90 h LEU 205 N 0.06 0.00 -2.01 -4.49 3.38 -0.93 -2.28 115.31 109.04 2x90 h LEU 205 Ca 0.05 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.12 2x90 h LEU 205 Cb 0.38 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 2x90 h LEU 205 CO 0.01 0.05 0.24 -0.78 0.09 0.00 0.00 178.44 178.05 2x90 h ASP 206 N 0.00 0.00 0.10 -0.43 3.58 -1.11 -1.61 116.42 116.95 2x90 h ASP 206 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2x90 h ASP 206 Cb 0.11 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.16 2x90 h ASP 206 CO 0.01 0.00 0.00 -0.33 -2.88 0.00 0.00 179.24 176.04 2x90 h GLU 207 N 0.00 0.00 -0.02 0.28 4.39 -1.56 -2.19 114.58 115.48 2x90 h GLU 207 Ca 0.16 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.86 2x90 h GLU 207 Cb 0.64 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.29 2x90 h GLU 207 CO -0.00 0.00 -0.18 0.66 -1.16 0.00 0.00 179.01 178.33 2x90 n TYR 208 N -2.82 0.00 -4.13 4.33 4.01 -0.61 -4.62 117.16 113.34 2x90 n TYR 208 Ca -0.02 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.42 2x90 n TYR 208 Cb 0.08 -0.01 -0.05 0.00 -0.31 0.00 0.00 39.34 39.05 2x90 n TYR 208 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 2x90 n GLU 209 N 0.56 -1.88 -3.17 -0.72 1.02 -0.83 -4.92 120.64 110.71 2x90 n GLU 209 Ca 0.13 0.23 0.04 0.00 -0.02 0.00 0.00 57.16 57.54 2x90 n GLU 209 Cb 0.50 -3.92 -0.01 0.00 -0.02 0.00 0.00 31.44 27.99 2x90 n GLU 209 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2x90 s ASP 210 N -4.29 -1.36 0.00 1.62 3.68 -1.26 -5.01 116.67 110.05 2x90 s ASP 210 Ca 0.05 0.89 0.16 0.00 2.13 0.00 0.00 52.55 55.78 2x90 s ASP 210 Cb -0.03 2.16 0.79 0.00 -1.45 0.00 0.00 42.92 44.39 2x90 s ASP 210 CO 0.95 -0.26 1.45 -0.90 0.13 0.00 0.00 175.17 176.54 2x90 n ASP 211 N 5.43 0.00 -0.84 -0.34 5.75 -1.26 -1.90 116.55 123.39 2x90 n ASP 211 Ca -0.01 0.08 0.08 0.00 -0.01 0.00 0.00 54.79 54.92 2x90 n ASP 211 Cb 0.51 -0.29 0.23 0.00 -1.03 0.00 0.00 41.12 40.53 2x90 n ASP 211 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2x90 n THR 212 N -1.29 1.84 -0.22 2.12 -2.24 -1.26 -4.79 114.28 108.43 2x90 n THR 212 Ca 0.07 -1.55 -0.07 0.00 -2.27 0.00 0.00 64.05 60.24 2x90 n THR 212 Cb 0.13 0.02 0.04 0.00 -2.10 0.00 0.00 70.33 68.41 2x90 n THR 212 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 2x90 h PHE 213 N 1.97 0.86 -0.40 4.78 3.57 -1.79 -1.54 116.94 124.38 2x90 h PHE 213 Ca 0.00 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.49 2x90 h PHE 213 Cb 1.21 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 39.65 2x90 h PHE 213 CO 0.42 0.62 0.24 0.93 -2.23 0.00 0.00 178.31 178.29 2x90 h GLU 214 N 0.84 0.47 -0.72 1.11 5.08 -1.86 -2.16 114.58 117.34 2x90 h GLU 214 Ca 0.22 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.50 2x90 h GLU 214 Cb 0.06 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 2x90 h GLU 214 CO -0.03 0.31 0.25 0.37 -1.00 0.00 0.00 179.01 178.91 2x90 h GLN 215 N 0.49 1.11 -0.54 2.33 5.75 -1.83 -1.20 115.11 121.21 2x90 h GLN 215 Ca 0.16 -0.23 0.06 0.00 -0.15 0.00 0.00 58.65 58.49 2x90 h GLN 215 Cb -0.00 -0.17 -0.05 0.00 1.07 0.00 0.00 27.48 28.33 2x90 h GLN 215 CO -0.07 0.94 0.25 1.96 -2.65 0.00 0.00 178.83 179.26 2x90 h GLN 216 N 1.06 0.47 -0.44 1.69 4.20 -1.05 -0.05 115.11 120.98 2x90 h GLN 216 Ca 0.24 -0.03 -0.13 0.00 0.06 0.00 0.00 58.65 58.79 2x90 h GLN 216 Cb 0.27 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 2x90 h GLN 216 CO -0.01 0.31 -0.23 -0.07 -0.67 0.00 0.00 178.83 178.16 2x90 h LEU 217 N 0.48 0.94 -0.69 1.46 3.38 -1.16 -1.63 115.31 118.09 2x90 h LEU 217 Ca 0.25 -0.35 0.03 0.00 0.09 0.00 0.00 57.88 57.90 2x90 h LEU 217 Cb 0.21 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 2x90 h LEU 217 CO -0.20 1.12 0.43 -0.33 0.09 0.00 0.00 178.44 179.55 2x90 h GLU 218 N 0.79 0.81 -0.42 1.13 4.39 -0.71 0.12 114.58 120.70 2x90 h GLU 218 Ca 0.10 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.71 2x90 h GLU 218 Cb 0.79 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 29.23 2x90 h GLU 218 CO 0.07 0.54 0.11 -0.44 -1.16 0.00 0.00 179.01 178.12 2x90 h ASP 219 N 0.84 0.63 -0.13 1.42 3.32 -0.83 -0.96 116.42 120.70 2x90 h ASP 219 Ca 0.28 -0.23 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 2x90 h ASP 219 Cb 0.02 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.40 2x90 h ASP 219 CO -0.11 0.69 -0.02 0.40 -1.72 0.00 0.00 179.24 178.48 2x90 h ILE 220 N 0.53 1.27 -0.76 0.35 2.04 -1.09 -2.78 117.51 117.07 2x90 h ILE 220 Ca 0.13 -0.90 0.08 0.00 1.00 0.00 0.00 64.86 65.17 2x90 h ILE 220 Cb 0.30 1.61 -0.06 0.00 -0.74 0.00 0.00 36.82 37.93 2x90 h ILE 220 CO 0.00 0.26 0.43 0.15 0.00 0.00 0.00 178.15 178.99 2x90 h PHE 221 N -0.05 0.79 -0.46 1.37 3.57 -0.72 -1.98 116.94 119.46 2x90 h PHE 221 Ca 0.04 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 2x90 h PHE 221 Cb 0.41 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 38.88 2x90 h PHE 221 CO 0.04 0.35 0.27 0.00 -2.23 0.00 0.00 178.31 176.74 2x90 h ALA 222 N 1.41 1.61 -0.29 2.41 0.00 -1.09 0.15 119.26 123.45 2x90 h ALA 222 Ca 0.36 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 55.08 2x90 h ALA 222 Cb 0.27 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2x90 h ALA 222 CO -0.22 0.34 -0.31 -0.44 0.00 0.00 0.00 179.25 178.62 2x90 h ASP 223 N 0.64 0.64 0.91 0.00 3.32 -1.09 -3.26 116.42 117.58 2x90 h ASP 223 Ca 0.17 -0.25 -0.08 0.00 0.02 0.00 0.00 57.03 56.88 2x90 h ASP 223 Cb -0.01 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 2x90 h ASP 223 CO -0.03 0.92 -1.15 0.40 -1.72 0.00 0.00 179.24 177.66 2x90 h ILE 224 N 0.53 0.26 -0.78 0.35 1.08 -0.98 -3.40 117.51 114.57 2x90 h ILE 224 Ca 0.06 -1.49 0.15 0.00 -0.39 0.00 0.00 64.86 63.19 2x90 h ILE 224 Cb 0.80 1.79 -0.10 0.00 -3.07 0.00 0.00 36.82 36.24 2x90 h ILE 224 CO 0.07 0.15 0.31 -0.09 -0.69 0.00 0.00 178.15 177.89 2x90 h ARG 225 N 0.00 0.42 -0.83 2.37 2.43 -0.76 -1.51 114.38 116.51 2x90 h ARG 225 Ca -0.07 -0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.12 2x90 h ARG 225 Cb 1.28 -0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 30.69 2x90 h ARG 225 CO 0.02 0.28 0.54 -1.35 -1.51 0.00 0.00 179.97 177.95 2x90 h PRO 226 N 0.43 0.95 -0.65 0.20 0.11 -1.77 -1.27 132.00 130.01 2x90 h PRO 226 Ca 0.43 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.46 2x90 h PRO 226 Cb 0.69 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 31.55 2x90 h PRO 226 CO -0.43 0.63 0.30 1.25 -0.21 0.00 0.00 178.00 179.54 2x90 h LEU 227 N 0.98 0.86 -0.70 2.35 5.85 -1.56 -2.60 115.31 120.49 2x90 h LEU 227 Ca 0.34 -0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.95 2x90 h LEU 227 Cb 0.11 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 40.87 2x90 h LEU 227 CO -0.11 0.76 0.43 0.22 -0.34 0.00 0.00 178.44 179.41 2x90 h TYR 228 N 0.90 0.81 -0.57 1.25 3.20 -0.98 -2.09 116.97 119.49 2x90 h TYR 228 Ca 0.22 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.12 2x90 h TYR 228 Cb 0.14 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.12 2x90 h TYR 228 CO 0.01 0.45 0.37 1.96 -1.64 0.00 0.00 178.16 179.30 2x90 h GLN 229 N 0.84 0.75 -0.32 1.82 1.08 -0.98 0.14 115.11 118.43 2x90 h GLN 229 Ca 0.29 -0.05 -0.15 0.00 -1.45 0.00 0.00 58.65 57.29 2x90 h GLN 229 Cb 0.06 -0.17 -0.00 0.00 -0.05 0.00 0.00 27.48 27.32 2x90 h GLN 229 CO -0.12 0.50 -0.38 1.96 -0.95 0.00 0.00 178.83 179.84 2x90 h GLN 230 N 0.77 0.83 -0.13 1.46 1.08 -1.08 -1.16 115.11 116.88 2x90 h GLN 230 Ca 0.21 -0.46 -0.02 0.00 -1.45 0.00 0.00 58.65 56.93 2x90 h GLN 230 Cb -0.08 0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 27.38 2x90 h GLN 230 CO -0.04 1.09 0.00 0.82 -0.95 0.00 0.00 178.83 179.75 2x90 h ILE 231 N 0.60 1.25 -0.33 2.54 2.04 -0.81 -1.64 117.51 121.17 2x90 h ILE 231 Ca 0.04 -0.82 0.07 0.00 1.00 0.00 0.00 64.86 65.15 2x90 h ILE 231 Cb 0.97 1.54 -0.06 0.00 -0.74 0.00 0.00 36.82 38.53 2x90 h ILE 231 CO 0.09 0.24 -0.07 -0.74 0.00 0.00 0.00 178.15 177.67 2x90 h HIS 232 N -0.04 -0.15 -0.44 1.37 2.76 -0.75 -0.38 115.15 117.53 2x90 h HIS 232 Ca 0.04 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.25 2x90 h HIS 232 Cb 0.36 0.12 -0.03 0.00 1.55 0.00 0.00 27.41 29.41 2x90 h HIS 232 CO 0.03 -0.13 0.27 0.78 -1.30 0.00 0.00 177.93 177.59 2x90 h GLY 233 N 0.02 0.61 1.00 5.26 0.00 -1.12 -1.21 103.07 107.62 2x90 h GLY 233 Ca 0.16 -0.21 -0.08 0.00 0.00 0.00 0.00 47.33 47.20 2x90 h GLY 233 CO -0.33 0.19 -0.04 -1.82 0.00 0.00 0.00 176.54 174.54 2x90 h TYR 234 N 0.55 0.91 -0.40 5.60 5.03 -1.05 -1.93 116.97 125.68 2x90 h TYR 234 Ca 0.17 -0.17 -0.01 0.00 2.58 0.00 0.00 58.73 61.30 2x90 h TYR 234 Cb -0.01 -0.23 -0.02 0.00 1.55 0.00 0.00 36.73 38.02 2x90 h TYR 234 CO -0.06 0.89 0.21 0.28 -1.32 0.00 0.00 178.16 178.16 2x90 h VAL 235 N 0.67 1.15 -0.71 1.81 2.07 -0.89 -1.34 116.25 119.01 2x90 h VAL 235 Ca 0.12 -0.40 0.01 0.00 0.82 0.00 0.00 66.70 67.25 2x90 h VAL 235 Cb 0.55 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 30.98 2x90 h VAL 235 CO 0.03 0.16 0.47 -0.09 0.02 0.00 0.00 177.57 178.16 2x90 h ARG 236 N 0.51 0.93 -0.28 1.57 2.43 -1.16 0.11 114.38 118.50 2x90 h ARG 236 Ca 0.14 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 59.28 2x90 h ARG 236 Cb 0.07 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 29.38 2x90 h ARG 236 CO -0.02 0.62 0.11 0.35 -1.51 0.00 0.00 179.97 179.51 2x90 h PHE 237 N 0.96 0.20 -0.28 2.20 3.57 -1.14 -1.51 116.94 120.94 2x90 h PHE 237 Ca 0.26 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.66 2x90 h PHE 237 Cb -0.11 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.57 2x90 h PHE 237 CO -0.02 0.10 -0.31 0.00 -2.23 0.00 0.00 178.31 175.85 2x90 h ARG 238 N 0.24 0.59 -0.20 1.11 2.47 -0.73 -2.82 114.38 115.05 2x90 h ARG 238 Ca 0.12 -0.26 -0.08 0.00 -1.26 0.00 0.00 59.98 58.50 2x90 h ARG 238 Cb 0.07 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.36 2x90 h ARG 238 CO -0.11 0.83 -0.22 -0.07 0.56 0.00 0.00 179.97 180.96 2x90 h LEU 239 N 0.51 0.34 -0.93 3.04 3.38 -0.61 -2.72 115.31 118.33 2x90 h LEU 239 Ca 0.06 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 2x90 h LEU 239 Cb 0.78 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 2x90 h LEU 239 CO 0.06 0.57 0.40 0.03 0.09 0.00 0.00 178.44 179.60 2x90 h ARG 240 N 0.32 1.17 0.00 1.13 3.08 -1.03 0.10 114.38 119.15 2x90 h ARG 240 Ca 0.05 -0.16 -0.06 0.00 0.07 0.00 0.00 59.98 59.88 2x90 h ARG 240 Cb 0.56 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 2x90 h ARG 240 CO 0.04 0.89 -0.29 0.87 -1.07 0.00 0.00 179.97 180.41 2x90 h LYS 241 N 1.17 0.00 0.00 0.04 1.57 -1.32 0.73 116.57 118.76 2x90 h LYS 241 Ca 0.28 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.96 2x90 h LYS 241 Cb 0.10 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2x90 h LYS 241 CO -0.04 0.29 -0.64 1.25 -0.57 0.00 0.00 179.45 179.74 2x90 h HIS 242 N 0.00 0.00 0.00 -1.35 2.76 -1.16 -3.41 115.15 111.99 2x90 h HIS 242 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2x90 h HIS 242 Cb 0.66 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.62 2x90 h HIS 242 CO 0.00 1.02 -1.38 0.66 -1.30 0.00 0.00 177.93 176.92 2x90 n TYR 243 N -4.54 0.44 0.00 5.26 4.01 0.32 -5.09 117.16 117.55 2x90 n TYR 243 Ca -0.19 0.13 0.00 0.00 -0.16 0.00 0.00 57.90 57.68 2x90 n TYR 243 Cb 0.50 -0.66 0.00 0.00 -0.31 0.00 0.00 39.34 38.87 2x90 n TYR 243 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2x90 n GLY 244 N 1.25 -0.49 0.05 2.72 0.00 0.25 -4.49 105.19 104.48 2x90 n GLY 244 Ca -0.01 -1.69 0.12 0.00 0.00 0.00 0.00 46.02 44.44 2x90 n GLY 244 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2x90 n ASP 245 N -1.27 0.31 0.19 1.61 9.92 -1.26 -2.29 116.55 123.76 2x90 n ASP 245 Ca 0.00 0.54 0.06 0.00 -0.53 0.00 0.00 54.79 54.86 2x90 n ASP 245 Cb 0.00 -0.62 0.35 0.00 -0.64 0.00 0.00 41.12 40.21 2x90 n ASP 245 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2x90 h ALA 246 N 2.67 1.02 0.03 2.24 0.00 -1.96 -3.33 119.26 119.94 2x90 h ALA 246 Ca 0.00 -0.33 -0.38 0.00 0.00 0.00 0.00 54.91 54.20 2x90 h ALA 246 Cb 0.49 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 2x90 h ALA 246 CO 0.00 0.45 -2.35 0.28 0.00 0.00 0.00 179.25 177.63 2x90 n VAL 247 N -3.55 1.57 -4.25 0.00 0.31 -1.07 -4.93 118.33 106.40 2x90 n VAL 247 Ca -0.00 -0.59 -0.28 0.00 -0.01 0.00 0.00 64.34 63.46 2x90 n VAL 247 Cb 0.49 -1.51 -0.17 0.00 -0.91 0.00 0.00 33.84 31.75 2x90 n VAL 247 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2x90 s VAL 248 N -2.53 1.36 0.38 2.52 1.01 -0.97 -4.81 120.40 117.36 2x90 s VAL 248 Ca -0.32 -0.54 -0.06 0.00 0.00 0.00 0.00 61.98 61.07 2x90 s VAL 248 Cb 0.08 -1.28 -0.05 0.00 0.00 0.00 0.00 36.38 35.14 2x90 s VAL 248 CO 0.64 0.42 0.67 -0.94 0.00 0.00 0.00 175.10 175.89 2x90 s SER 249 N 1.22 6.41 0.22 3.32 1.04 -1.26 -4.18 113.70 120.47 2x90 s SER 249 Ca -0.02 0.86 -0.00 0.00 0.48 0.00 0.00 55.95 57.26 2x90 s SER 249 Cb -0.14 -2.21 0.22 0.00 0.10 0.00 0.00 66.02 63.99 2x90 s SER 249 CO -0.04 -0.36 1.58 -0.08 0.98 0.00 0.00 173.24 175.32 2x90 h GLU 250 N 1.10 0.49 -0.00 4.02 4.81 -1.94 -3.35 114.58 119.71 2x90 h GLU 250 Ca -0.48 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 58.49 2x90 h GLU 250 Cb 1.20 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.59 2x90 h GLU 250 CO 0.64 0.85 -0.50 0.25 -0.73 0.00 0.00 179.01 179.52 2x90 n THR 251 N -4.00 0.00 -2.65 0.32 -2.24 -1.26 -4.85 114.28 99.60 2x90 n THR 251 Ca -0.02 -0.25 -0.21 0.00 -2.27 0.00 0.00 64.05 61.29 2x90 n THR 251 Cb 0.54 1.01 0.04 0.00 -2.10 0.00 0.00 70.33 69.82 2x90 n THR 251 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2x90 s GLY 252 N -2.00 1.80 0.63 3.38 0.00 -1.26 -0.98 107.32 108.89 2x90 s GLY 252 Ca 0.05 -1.29 -0.19 0.00 0.00 0.00 0.00 44.72 43.29 2x90 s GLY 252 CO 0.44 -1.01 1.30 -4.14 0.00 0.00 0.00 173.10 169.69 2x90 s PRO 253 N -4.76 2.65 0.06 2.90 0.02 -1.26 -4.77 135.00 129.84 2x90 s PRO 253 Ca 0.57 2.08 -0.31 0.00 0.02 0.00 0.00 61.00 63.36 2x90 s PRO 253 Cb -0.10 -1.90 -0.06 0.00 0.02 0.00 0.00 34.50 32.45 2x90 s PRO 253 CO 0.39 -1.53 1.28 0.42 -0.33 0.00 0.00 177.00 177.23 2x90 s ILE 254 N -1.39 3.78 0.01 2.83 1.01 -0.29 -4.74 121.20 122.41 2x90 s ILE 254 Ca 0.81 1.26 -0.30 0.00 0.00 0.00 0.00 60.65 62.42 2x90 s ILE 254 Cb -0.38 -3.81 -0.08 0.00 0.01 0.00 0.00 42.46 38.21 2x90 s ILE 254 CO 0.40 0.08 1.91 -2.84 0.00 0.00 0.00 174.94 174.49 2x90 s PRO 255 N 1.32 4.13 0.48 2.79 0.02 -1.26 -1.66 135.00 140.82 2x90 s PRO 255 Ca 0.61 2.51 0.27 0.00 0.02 0.00 0.00 61.00 64.41 2x90 s PRO 255 Cb -0.32 -4.13 0.99 0.00 0.02 0.00 0.00 34.50 31.07 2x90 s PRO 255 CO 0.29 -0.96 1.85 0.00 -0.33 0.00 0.00 177.00 177.85 2x90 h MET 256 N 10.46 0.00 0.00 5.54 -0.00 -1.39 -2.89 114.93 126.65 2x90 h MET 256 Ca -0.47 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.23 2x90 h MET 256 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.82 2x90 h MET 256 CO 0.94 0.13 0.00 -2.39 -0.00 0.00 0.00 176.91 175.59 2x90 n HIS 257 N -3.25 0.00 0.89 -0.10 1.44 -1.26 -2.31 115.22 110.64 2x90 n HIS 257 Ca 0.01 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.83 2x90 n HIS 257 Cb 0.41 -0.48 0.29 0.00 0.12 0.00 0.00 29.99 30.32 2x90 n HIS 257 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2x90 n LEU 258 N -1.48 2.52 -1.23 2.39 4.77 -1.09 -4.40 117.00 118.48 2x90 n LEU 258 Ca 0.04 -1.01 0.12 0.00 -0.03 0.00 0.00 56.01 55.13 2x90 n LEU 258 Cb 0.16 -0.13 0.26 0.00 -2.33 0.00 0.00 43.42 41.38 2x90 n LEU 258 CO 0.13 0.50 0.73 0.18 -1.33 0.00 0.00 177.39 177.60 2x90 n LEU 259 N 0.90 3.64 0.00 2.23 4.77 -0.98 -4.95 117.00 122.62 2x90 n LEU 259 Ca 0.17 -1.67 0.00 0.00 -0.03 0.00 0.00 56.01 54.49 2x90 n LEU 259 Cb 0.48 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2x90 n LEU 259 CO 0.15 0.83 0.00 0.61 -1.33 0.00 0.00 177.39 177.65 2x90 n GLY 260 N 1.57 0.66 3.19 -0.72 0.00 -1.26 -4.35 105.19 104.28 2x90 n GLY 260 Ca 0.21 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.11 2x90 n GLY 260 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2x90 s ASN 261 N -2.28 -0.34 0.53 1.61 3.84 -1.26 -3.96 114.94 113.07 2x90 s ASN 261 Ca 0.00 0.65 0.24 0.00 0.21 0.00 0.00 52.86 53.96 2x90 s ASN 261 Cb 0.00 0.63 1.38 0.00 -0.55 0.00 0.00 41.25 42.70 2x90 s ASN 261 CO 0.00 -0.13 2.02 -0.03 -2.79 0.00 0.00 177.10 176.17 2x90 h MET 262 N 6.09 0.00 -0.13 0.43 1.85 -1.92 -1.61 114.93 119.64 2x90 h MET 262 Ca -0.30 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.79 2x90 h MET 262 Cb 1.18 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.21 2x90 h MET 262 CO 0.32 0.00 0.00 0.91 -0.40 0.00 0.00 176.91 177.74 2x90 n TRP 263 N -4.40 0.16 -2.88 1.39 8.01 -1.26 -4.98 117.44 113.49 2x90 n TRP 263 Ca 0.08 -0.27 -0.18 0.00 -1.31 0.00 0.00 57.50 55.81 2x90 n TRP 263 Cb 0.52 -0.02 0.00 0.00 -2.01 0.00 0.00 31.31 29.80 2x90 n TRP 263 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2x90 n ALA 264 N 0.26 -0.91 0.10 6.99 0.00 -0.61 -4.88 120.51 121.46 2x90 n ALA 264 Ca 0.06 0.12 -0.02 0.00 0.00 0.00 0.00 53.44 53.60 2x90 n ALA 264 Cb 0.28 -2.31 -0.04 0.00 0.00 0.00 0.00 19.45 17.37 2x90 n ALA 264 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 2x90 h GLN 265 N -0.56 0.00 -3.29 0.00 3.07 -1.93 -3.45 115.11 108.94 2x90 h GLN 265 Ca -0.38 0.00 -0.19 0.00 0.09 0.00 0.00 58.65 58.17 2x90 h GLN 265 Cb 1.26 0.00 -0.27 0.00 0.08 0.00 0.00 27.48 28.56 2x90 h GLN 265 CO 0.45 0.70 -0.52 -0.65 0.09 0.00 0.00 178.83 178.91 2x90 s GLN 266 N -2.85 0.20 -0.06 0.06 -0.21 -1.26 -3.29 119.66 112.25 2x90 s GLN 266 Ca 0.02 0.26 0.13 0.00 0.02 0.00 0.00 55.36 55.80 2x90 s GLN 266 Cb 0.09 0.07 0.41 0.00 1.00 0.00 0.00 33.01 34.58 2x90 s GLN 266 CO 0.78 -0.04 1.34 0.91 -2.12 0.00 0.00 175.29 176.16 2x90 n TRP 267 N 3.12 0.69 0.31 0.91 8.01 -0.05 -4.42 117.44 125.99 2x90 n TRP 267 Ca -0.14 -0.62 0.18 0.00 -1.31 0.00 0.00 57.50 55.61 2x90 n TRP 267 Cb 0.58 -0.13 0.99 0.00 -2.01 0.00 0.00 31.31 30.75 2x90 n TRP 267 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 2x90 h SER 268 N 2.14 0.00 0.71 -0.99 4.64 -1.83 -1.99 113.55 116.22 2x90 h SER 268 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2x90 h SER 268 Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 2x90 h SER 268 CO 0.08 0.02 0.00 -0.33 -0.87 0.00 0.00 176.83 175.73 2x90 h GLU 269 N 0.00 0.00 -0.46 4.77 4.39 -1.84 -2.53 114.58 118.91 2x90 h GLU 269 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2x90 h GLU 269 Cb 0.09 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 2x90 h GLU 269 CO 0.00 0.00 0.00 0.44 -1.16 0.00 0.00 179.01 178.29 2x90 n ILE 270 N -2.48 1.70 -0.15 3.13 -5.35 -0.75 -4.62 119.36 110.85 2x90 n ILE 270 Ca 0.01 -1.32 0.12 0.00 -0.27 0.00 0.00 62.75 61.29 2x90 n ILE 270 Cb 0.22 0.14 0.46 0.00 -1.74 0.00 0.00 39.64 38.72 2x90 n ILE 270 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2x90 h ALA 271 N 2.88 1.95 0.00 -1.28 0.00 -1.57 -1.62 119.26 119.62 2x90 h ALA 271 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2x90 h ALA 271 Cb 1.23 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2x90 h ALA 271 CO 0.16 -0.11 0.00 0.38 0.00 0.00 0.00 179.25 179.68 2x90 h ASP 272 N 0.52 0.00 0.00 0.00 2.03 -1.84 -0.58 116.42 116.55 2x90 h ASP 272 Ca 0.33 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.63 2x90 h ASP 272 Cb 0.58 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.08 2x90 h ASP 272 CO -0.11 0.00 -0.63 2.30 -1.03 0.00 0.00 179.24 179.78 2x90 n ILE 273 N -3.06 0.00 0.00 4.15 -5.35 -0.65 -4.64 119.36 109.82 2x90 n ILE 273 Ca -0.01 -0.21 0.00 0.00 -0.27 0.00 0.00 62.75 62.26 2x90 n ILE 273 Cb 0.18 0.97 0.00 0.00 -1.74 0.00 0.00 39.64 39.06 2x90 n ILE 273 CO 0.00 0.00 0.00 1.33 -1.76 0.00 0.00 176.55 176.12 2x90 n VAL 274 N -1.32 0.36 -2.09 7.28 0.24 -0.98 -4.81 118.33 117.02 2x90 n VAL 274 Ca 0.02 -0.68 -0.41 0.00 -2.04 0.00 0.00 64.34 61.23 2x90 n VAL 274 Cb 0.20 0.82 -0.02 0.00 -1.47 0.00 0.00 33.84 33.37 2x90 n VAL 274 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2x90 s SER 275 N -0.36 6.74 0.26 -1.34 1.04 -0.25 -4.92 113.70 114.88 2x90 s SER 275 Ca 0.00 2.63 -0.01 0.00 0.48 0.00 0.00 55.95 59.05 2x90 s SER 275 Cb 0.00 -2.63 0.57 0.00 0.10 0.00 0.00 66.02 64.06 2x90 s SER 275 CO 0.00 -0.60 1.71 -0.65 0.98 0.00 0.00 173.24 174.68 2x90 h PRO 276 N 4.40 0.40 -3.08 4.02 0.11 -1.91 -3.32 132.00 132.62 2x90 h PRO 276 Ca -0.47 -0.02 -0.62 0.00 0.11 0.00 0.00 66.00 65.00 2x90 h PRO 276 Cb 1.22 -0.09 -0.41 0.00 0.11 0.00 0.00 31.00 31.84 2x90 h PRO 276 CO 0.72 0.26 -0.69 -0.06 -0.21 0.00 0.00 178.00 178.02 2x90 s PHE 277 N -5.97 2.58 0.05 0.65 0.08 -1.26 -4.98 117.98 109.13 2x90 s PHE 277 Ca -0.12 -2.82 0.31 0.00 0.12 0.00 0.00 56.93 54.42 2x90 s PHE 277 Cb 0.23 -2.25 1.53 0.00 -0.57 0.00 0.00 43.02 41.96 2x90 s PHE 277 CO 0.77 -0.73 1.94 -1.35 -0.10 0.00 0.00 175.22 175.76 2x90 h PRO 278 N 6.32 0.00 -0.00 0.24 0.11 -1.97 -1.75 132.00 134.95 2x90 h PRO 278 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 2x90 h PRO 278 Cb 0.88 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.99 2x90 h PRO 278 CO 0.58 0.00 -0.53 0.39 -0.21 0.00 0.00 178.00 178.23 2x90 n GLU 279 N -2.66 0.00 -4.07 1.05 1.02 -1.26 -4.89 120.64 109.82 2x90 n GLU 279 Ca -0.01 -0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.91 2x90 n GLU 279 Cb 0.14 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.02 2x90 n GLU 279 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2x90 s LYS 280 N -3.00 3.05 0.42 3.49 -0.14 -0.66 -5.07 119.74 117.84 2x90 s LYS 280 Ca 0.11 -0.94 -0.26 0.00 -1.36 0.00 0.00 55.97 53.51 2x90 s LYS 280 Cb 0.17 -2.66 -0.09 0.00 -1.68 0.00 0.00 37.83 33.57 2x90 s LYS 280 CO 0.71 0.43 1.43 -0.35 -0.76 0.00 0.00 175.35 176.80 2x90 n PRO 281 N -1.06 2.34 -4.29 -1.68 -0.04 -1.26 -4.93 135.00 124.07 2x90 n PRO 281 Ca -0.08 0.83 -0.28 0.00 -0.04 0.00 0.00 63.50 63.93 2x90 n PRO 281 Cb 0.57 -2.61 -0.17 0.00 -0.04 0.00 0.00 33.50 31.26 2x90 n PRO 281 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2x90 s LEU 282 N -2.34 1.60 -0.17 1.53 2.96 -1.26 -4.79 118.68 116.22 2x90 s LEU 282 Ca 0.59 -0.40 -0.29 0.00 -0.22 0.00 0.00 54.13 53.81 2x90 s LEU 282 Cb -0.47 -1.02 -0.02 0.00 0.50 0.00 0.00 46.19 45.18 2x90 s LEU 282 CO 0.60 -0.02 1.44 -0.69 -1.32 0.00 0.00 176.35 176.36 2x90 s VAL 283 N 1.17 3.96 -0.33 1.68 1.01 -1.26 -4.94 120.40 121.68 2x90 s VAL 283 Ca -0.03 1.14 0.02 0.00 0.00 0.00 0.00 61.98 63.11 2x90 s VAL 283 Cb -0.14 -3.82 0.15 0.00 0.00 0.00 0.00 36.38 32.57 2x90 s VAL 283 CO -0.04 -0.20 0.37 -0.62 0.00 0.00 0.00 175.10 174.62 2x90 s ASP 284 N 2.90 1.01 0.00 3.32 3.68 -1.26 -5.05 116.67 121.27 2x90 s ASP 284 Ca 0.63 -1.07 0.23 0.00 2.13 0.00 0.00 52.55 54.47 2x90 s ASP 284 Cb -0.25 0.73 0.79 0.00 -1.45 0.00 0.00 42.92 42.75 2x90 s ASP 284 CO 0.22 -0.31 1.58 1.33 0.13 0.00 0.00 175.17 178.13 2x90 n VAL 285 N 4.77 0.17 -0.14 1.11 0.24 -1.26 -4.37 118.33 118.86 2x90 n VAL 285 Ca 0.05 -0.35 -0.04 0.00 -2.04 0.00 0.00 64.34 61.97 2x90 n VAL 285 Cb 0.47 0.47 0.05 0.00 -1.47 0.00 0.00 33.84 33.36 2x90 n VAL 285 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2x90 h SER 286 N 2.45 -0.03 -0.54 -1.34 0.02 -1.91 -0.88 113.55 111.32 2x90 h SER 286 Ca 0.00 0.08 0.01 0.00 -0.84 0.00 0.00 61.79 61.05 2x90 h SER 286 Cb 0.53 0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.16 2x90 h SER 286 CO 0.00 0.02 0.34 0.00 -1.14 0.00 0.00 176.83 176.05 2x90 h ALA 287 N 1.35 0.69 -0.51 3.77 0.00 -1.91 -1.96 119.26 120.69 2x90 h ALA 287 Ca 0.22 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 2x90 h ALA 287 Cb 0.29 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2x90 h ALA 287 CO -0.30 0.08 -0.08 0.93 0.00 0.00 0.00 179.25 179.88 2x90 h GLU 288 N 0.69 0.93 -0.43 0.00 4.39 -1.75 -0.04 114.58 118.36 2x90 h GLU 288 Ca 0.21 -0.32 0.05 0.00 0.34 0.00 0.00 59.36 59.64 2x90 h GLU 288 Cb -0.03 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 28.50 2x90 h GLU 288 CO -0.07 0.97 0.17 0.52 -1.16 0.00 0.00 179.01 179.45 2x90 h MET 289 N 0.84 0.34 -0.52 2.33 2.86 -0.89 0.49 114.93 120.38 2x90 h MET 289 Ca 0.14 -0.02 -0.12 0.00 -2.06 0.00 0.00 59.70 57.64 2x90 h MET 289 Cb 0.61 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.18 2x90 h MET 289 CO 0.04 0.22 -0.13 0.93 1.06 0.00 0.00 176.91 179.04 2x90 h GLU 290 N 0.35 1.00 -0.73 1.72 5.08 -1.16 -1.09 114.58 119.75 2x90 h GLU 290 Ca 0.20 -0.38 -0.01 0.00 -1.00 0.00 0.00 59.36 58.16 2x90 h GLU 290 Cb 0.17 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 2x90 h GLU 290 CO -0.19 1.07 0.41 -0.22 -1.00 0.00 0.00 179.01 179.08 2x90 h LYS 291 N 0.87 1.01 -0.06 2.33 3.64 -0.66 -2.48 116.57 121.23 2x90 h LYS 291 Ca 0.13 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2x90 h LYS 291 Cb 0.70 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 2x90 h LYS 291 CO 0.05 0.75 0.00 1.04 -2.27 0.00 0.00 179.45 179.02 2x90 n GLN 292 N -4.48 1.21 -2.19 1.90 6.02 0.13 -4.91 117.38 115.06 2x90 n GLN 292 Ca 0.06 -0.31 -0.09 0.00 -0.01 0.00 0.00 57.00 56.65 2x90 n GLN 292 Cb 0.08 -1.26 -0.00 0.00 1.02 0.00 0.00 30.24 30.08 2x90 n GLN 292 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2x90 n GLY 293 N 0.83 -0.00 3.70 1.08 0.00 -0.93 -4.99 105.19 104.87 2x90 n GLY 293 Ca 0.12 -0.50 -0.41 0.00 0.00 0.00 0.00 46.02 45.23 2x90 n GLY 293 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2x90 n TYR 294 N -4.00 2.13 -4.43 1.61 0.53 -0.44 -5.04 117.16 107.52 2x90 n TYR 294 Ca -0.11 0.50 -0.21 0.00 -1.02 0.00 0.00 57.90 57.06 2x90 n TYR 294 Cb 0.58 -2.37 -0.10 0.00 -1.03 0.00 0.00 39.34 36.41 2x90 n TYR 294 CO 0.00 0.00 0.00 0.95 -1.02 0.00 0.00 176.86 176.79 2x90 s THR 295 N -1.21 1.81 0.26 -0.72 -4.23 -1.26 -4.86 115.64 105.43 2x90 s THR 295 Ca 0.62 -2.18 -0.02 0.00 -1.18 0.00 0.00 61.69 58.93 2x90 s THR 295 Cb -0.50 -2.36 0.24 0.00 1.34 0.00 0.00 72.50 71.21 2x90 s THR 295 CO 0.58 -0.37 1.73 -0.65 -0.54 0.00 0.00 174.62 175.37 2x90 h PRO 296 N 2.31 0.47 -0.44 3.99 0.11 -1.89 -1.71 132.00 134.85 2x90 h PRO 296 Ca -0.40 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.73 2x90 h PRO 296 Cb 1.24 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 2x90 h PRO 296 CO 0.66 0.31 0.19 1.25 -0.21 0.00 0.00 178.00 180.20 2x90 h LEU 297 N 0.49 0.24 -0.93 2.35 5.85 -1.96 -1.88 115.31 119.46 2x90 h LEU 297 Ca 0.46 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 59.21 2x90 h LEU 297 Cb 0.71 -0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.70 2x90 h LEU 297 CO -0.42 0.18 0.58 0.50 -0.34 0.00 0.00 178.44 178.94 2x90 h LYS 298 N 0.38 1.25 -0.73 1.25 1.63 -1.81 -0.45 116.57 118.10 2x90 h LYS 298 Ca 0.20 -0.10 -0.03 0.00 -0.85 0.00 0.00 60.65 59.86 2x90 h LYS 298 Cb 0.15 -0.27 -0.03 0.00 -0.60 0.00 0.00 32.23 31.48 2x90 h LYS 298 CO -0.17 0.86 0.32 0.52 -3.45 0.00 0.00 179.45 177.53 2x90 h MET 299 N 1.28 1.07 -0.23 1.90 2.86 -0.81 0.03 114.93 121.02 2x90 h MET 299 Ca 0.34 -0.18 -0.16 0.00 -2.06 0.00 0.00 59.70 57.64 2x90 h MET 299 Cb -0.08 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.39 2x90 h MET 299 CO -0.07 0.86 -0.53 0.74 1.06 0.00 0.00 176.91 178.98 2x90 h PHE 300 N 1.03 0.82 -0.48 -0.22 0.04 -1.05 -2.16 116.94 114.92 2x90 h PHE 300 Ca 0.25 -0.29 -0.06 0.00 2.80 0.00 0.00 57.97 60.67 2x90 h PHE 300 Cb 0.17 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.13 2x90 h PHE 300 CO 0.01 1.04 0.06 1.96 -0.60 0.00 0.00 178.31 180.79 2x90 h GLN 301 N 0.51 0.76 -0.33 1.51 4.20 -0.83 -0.66 115.11 120.27 2x90 h GLN 301 Ca 0.02 -0.17 -0.13 0.00 0.06 0.00 0.00 58.65 58.42 2x90 h GLN 301 Cb 1.09 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.75 2x90 h GLN 301 CO 0.11 0.73 -0.33 0.52 -0.67 0.00 0.00 178.83 179.18 2x90 h MET 302 N 0.72 0.72 -0.23 1.46 2.86 -0.90 -1.02 114.93 118.54 2x90 h MET 302 Ca 0.15 -0.34 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 2x90 h MET 302 Cb 0.35 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 2x90 h MET 302 CO 0.01 0.95 0.09 0.78 1.06 0.00 0.00 176.91 179.80 2x90 h GLY 303 N 0.96 0.38 0.36 8.32 0.00 -1.08 -1.91 103.07 110.09 2x90 h GLY 303 Ca 0.07 -0.21 0.08 0.00 0.00 0.00 0.00 47.33 47.26 2x90 h GLY 303 CO 0.07 0.20 0.02 -1.80 0.00 0.00 0.00 176.54 175.03 2x90 h ASP 304 N 0.22 -0.13 -0.92 0.19 3.58 -1.00 -1.88 116.42 116.48 2x90 h ASP 304 Ca 0.08 0.09 0.10 0.00 0.42 0.00 0.00 57.03 57.72 2x90 h ASP 304 Cb 0.19 0.16 -0.08 0.00 1.72 0.00 0.00 39.33 41.31 2x90 h ASP 304 CO -0.01 -0.03 0.56 -0.78 -2.88 0.00 0.00 179.24 176.11 2x90 h ASP 305 N 0.13 0.83 -0.07 2.28 3.58 -1.03 -1.24 116.42 120.91 2x90 h ASP 305 Ca 0.21 0.04 -0.00 0.00 0.42 0.00 0.00 57.03 57.70 2x90 h ASP 305 Cb 0.29 -0.13 -0.00 0.00 1.72 0.00 0.00 39.33 41.21 2x90 h ASP 305 CO -0.33 0.48 0.04 0.15 -2.88 0.00 0.00 179.24 176.70 2x90 h PHE 306 N 0.94 0.10 -0.17 0.28 3.57 -0.54 0.14 116.94 121.26 2x90 h PHE 306 Ca 0.44 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.93 2x90 h PHE 306 Cb 0.37 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 2x90 h PHE 306 CO -0.03 0.14 0.09 0.74 -2.23 0.00 0.00 178.31 177.02 2x90 h PHE 307 N 0.03 0.23 -0.00 0.41 0.04 -1.07 -2.76 116.94 113.81 2x90 h PHE 307 Ca 0.02 -0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.73 2x90 h PHE 307 Cb 0.07 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.14 2x90 h PHE 307 CO -0.05 0.22 -0.29 1.79 -0.60 0.00 0.00 178.31 179.38 2x90 h THR 308 N 0.17 1.21 0.00 -1.55 1.35 -1.17 -1.66 112.91 111.26 2x90 h THR 308 Ca 0.06 -1.00 -0.02 0.00 -0.55 0.00 0.00 66.41 64.89 2x90 h THR 308 Cb 0.07 1.54 -0.00 0.00 -1.73 0.00 0.00 68.15 68.02 2x90 h THR 308 CO -0.01 0.29 -0.10 0.77 -0.25 0.00 0.00 175.52 176.22 2x90 h SER 309 N 0.01 0.00 -0.54 5.36 4.64 -0.68 -1.02 113.55 121.32 2x90 h SER 309 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2x90 h SER 309 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2x90 h SER 309 CO 0.04 0.10 0.00 0.23 -0.87 0.00 0.00 176.83 176.32 2x90 n MET 310 N -3.56 2.58 -2.21 4.77 2.00 -0.74 -3.64 117.12 116.32 2x90 n MET 310 Ca -0.02 -2.07 -0.13 0.00 0.00 0.00 0.00 57.70 55.49 2x90 n MET 310 Cb 0.22 -1.54 -0.01 0.00 0.00 0.00 0.00 33.22 31.89 2x90 n MET 310 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 2x90 n ASN 311 N 1.02 -3.99 -4.95 7.83 5.15 -0.39 -3.79 115.26 116.13 2x90 n ASN 311 Ca 0.19 0.00 -0.20 0.00 -0.60 0.00 0.00 54.58 53.97 2x90 n ASN 311 Cb 0.56 -3.17 0.06 0.00 -0.53 0.00 0.00 39.78 36.70 2x90 n ASN 311 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2x90 n LEU 312 N -1.79 0.00 -4.71 1.20 4.77 -0.70 -4.92 117.00 110.85 2x90 n LEU 312 Ca -0.15 -2.56 -0.42 0.00 -0.03 0.00 0.00 56.01 52.85 2x90 n LEU 312 Cb 0.61 -0.39 -0.03 0.00 -2.33 0.00 0.00 43.42 41.28 2x90 n LEU 312 CO 0.17 -0.70 0.69 -0.89 -1.33 0.00 0.00 177.39 175.34 2x90 s THR 313 N -2.64 4.82 0.46 -5.08 2.01 -1.26 -4.12 115.64 109.83 2x90 s THR 313 Ca 0.58 2.03 -0.24 0.00 0.31 0.00 0.00 61.69 64.37 2x90 s THR 313 Cb -0.05 -4.30 -0.07 0.00 0.01 0.00 0.00 72.50 68.09 2x90 s THR 313 CO 0.37 0.15 1.24 -0.75 -0.69 0.00 0.00 174.62 174.95 2x90 s LYS 314 N 1.03 3.71 0.21 4.92 2.20 -1.26 -4.69 119.74 125.86 2x90 s LYS 314 Ca 0.52 1.97 -0.31 0.00 -0.36 0.00 0.00 55.97 57.79 2x90 s LYS 314 Cb -0.21 -2.49 -0.11 0.00 -1.51 0.00 0.00 37.83 33.51 2x90 s LYS 314 CO 0.28 -0.65 1.59 -0.51 -0.36 0.00 0.00 175.35 175.70 2x90 s LEU 315 N -2.93 4.37 0.77 5.43 1.43 -1.26 -5.00 118.68 121.49 2x90 s LEU 315 Ca 0.63 2.74 -0.11 0.00 -1.03 0.00 0.00 54.13 56.35 2x90 s LEU 315 Cb -0.34 -3.61 0.05 0.00 0.03 0.00 0.00 46.19 42.33 2x90 s LEU 315 CO 0.41 -0.86 1.09 -2.16 0.23 0.00 0.00 176.35 175.07 2x90 s PRO 316 N 0.65 2.34 0.35 1.29 0.04 -1.26 -4.95 135.00 133.46 2x90 s PRO 316 Ca 0.68 0.62 0.03 0.00 0.04 0.00 0.00 61.00 62.37 2x90 s PRO 316 Cb -0.46 -1.95 0.65 0.00 0.04 0.00 0.00 34.50 32.79 2x90 s PRO 316 CO 0.36 -1.44 2.01 0.37 0.04 0.00 0.00 177.00 178.34 2x90 h GLN 317 N -0.95 0.82 -0.97 4.56 5.75 -1.94 -1.86 115.11 120.51 2x90 h GLN 317 Ca -0.46 -0.05 0.11 0.00 -0.15 0.00 0.00 58.65 58.09 2x90 h GLN 317 Cb 1.26 -0.18 -0.08 0.00 1.07 0.00 0.00 27.48 29.55 2x90 h GLN 317 CO 0.60 0.54 0.62 -0.44 -2.65 0.00 0.00 178.83 177.50 2x90 h ASP 318 N 0.84 0.90 0.03 -0.69 3.32 -1.92 -0.60 116.42 118.30 2x90 h ASP 318 Ca 0.24 0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.34 2x90 h ASP 318 Cb -0.06 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.31 2x90 h ASP 318 CO -0.06 0.51 -0.16 0.15 -1.72 0.00 0.00 179.24 177.96 2x90 h PHE 319 N 0.98 -0.42 -0.64 4.55 3.57 -1.38 0.01 116.94 123.60 2x90 h PHE 319 Ca 0.46 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.89 2x90 h PHE 319 Cb 0.43 0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.33 2x90 h PHE 319 CO -0.00 -0.24 0.07 -1.49 -2.23 0.00 0.00 178.31 174.42 2x90 h TRP 320 N -0.28 1.17 -0.33 0.41 4.06 -1.46 -1.09 115.95 118.43 2x90 h TRP 320 Ca 0.04 -0.18 -0.10 0.00 2.06 0.00 0.00 58.89 60.72 2x90 h TRP 320 Cb 0.33 -0.31 -0.02 0.00 -1.00 0.00 0.00 29.16 28.17 2x90 h TRP 320 CO -0.20 1.00 -0.20 -0.44 -3.56 0.00 0.00 178.44 175.03 2x90 h ASP 321 N 1.00 0.61 0.00 -3.49 3.32 -0.94 -3.37 116.42 113.55 2x90 h ASP 321 Ca 0.19 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2x90 h ASP 321 Cb 0.48 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.87 2x90 h ASP 321 CO 0.02 0.82 -1.15 0.29 -1.72 0.00 0.00 179.24 177.50 2x90 n LYS 322 N -4.14 1.21 -1.61 3.56 5.02 -0.03 -5.02 118.16 117.16 2x90 n LYS 322 Ca 0.00 -0.06 -0.33 0.00 -2.02 0.00 0.00 58.31 55.90 2x90 n LYS 322 Cb 0.39 -1.12 0.07 0.00 -0.02 0.00 0.00 35.03 34.35 2x90 n LYS 322 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2x90 s SER 323 N -2.68 4.72 -0.29 4.39 0.01 -0.42 -4.93 113.70 114.50 2x90 s SER 323 Ca -0.02 2.13 -0.02 0.00 1.31 0.00 0.00 55.95 59.36 2x90 s SER 323 Cb 0.06 -2.57 0.04 0.00 0.21 0.00 0.00 66.02 63.76 2x90 s SER 323 CO 0.34 -1.90 -0.01 -0.63 0.41 0.00 0.00 173.24 171.46 2x90 s ILE 324 N -2.22 3.01 -0.65 1.44 1.01 -0.20 -4.98 121.20 118.60 2x90 s ILE 324 Ca 0.70 -1.29 0.06 0.00 0.00 0.00 0.00 60.65 60.12 2x90 s ILE 324 Cb -0.24 -2.69 0.12 0.00 0.01 0.00 0.00 42.46 39.67 2x90 s ILE 324 CO 0.43 -0.04 0.96 2.30 0.00 0.00 0.00 174.94 178.59 2x90 n ILE 325 N 4.64 0.58 -3.93 2.92 -5.35 -1.25 -0.28 119.36 116.68 2x90 n ILE 325 Ca -0.14 -0.79 -0.10 0.00 -0.27 0.00 0.00 62.75 61.45 2x90 n ILE 325 Cb 0.44 0.77 -0.11 0.00 -1.74 0.00 0.00 39.64 39.00 2x90 n ILE 325 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2x90 s GLU 326 N -0.81 0.32 0.10 6.28 2.02 -1.09 -3.10 118.70 122.43 2x90 s GLU 326 Ca 0.11 -0.45 -0.31 0.00 0.02 0.00 0.00 54.97 54.34 2x90 s GLU 326 Cb 0.06 0.12 -0.09 0.00 0.10 0.00 0.00 34.13 34.32 2x90 s GLU 326 CO 0.09 -0.06 1.72 0.21 0.02 0.00 0.00 175.26 177.24 2x90 s LYS 327 N -1.22 4.17 0.48 1.61 2.20 -1.26 -4.80 119.74 120.92 2x90 s LYS 327 Ca -0.13 2.45 -0.23 0.00 -0.36 0.00 0.00 55.97 57.70 2x90 s LYS 327 Cb -0.08 -3.54 -0.08 0.00 -1.51 0.00 0.00 37.83 32.62 2x90 s LYS 327 CO -0.00 -0.77 1.12 -2.30 -0.36 0.00 0.00 175.35 173.04 2x90 n PRO 328 N 5.44 1.47 0.00 4.03 -0.02 -1.26 -4.94 135.00 139.72 2x90 n PRO 328 Ca 0.16 0.53 0.12 0.00 -2.02 0.00 0.00 63.50 62.29 2x90 n PRO 328 Cb 0.39 -2.25 0.12 0.00 -0.02 0.00 0.00 33.50 31.75 2x90 n PRO 328 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2x90 n THR 329 N -0.77 0.00 -1.31 3.45 -2.24 -1.26 -4.92 114.28 107.22 2x90 n THR 329 Ca 0.10 -0.15 -0.22 0.00 -2.27 0.00 0.00 64.05 61.51 2x90 n THR 329 Cb 0.42 0.83 0.16 0.00 -2.10 0.00 0.00 70.33 69.65 2x90 n THR 329 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2x90 n ASP 330 N -0.63 -0.79 -0.00 3.42 5.68 -1.26 -4.95 116.55 118.01 2x90 n ASP 330 Ca 0.09 -1.18 0.16 0.00 -0.50 0.00 0.00 54.79 53.36 2x90 n ASP 330 Cb 0.39 -0.74 0.91 0.00 -1.14 0.00 0.00 41.12 40.54 2x90 n ASP 330 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2x90 n GLY 331 N -2.00 -1.05 3.76 6.12 0.00 -1.26 -4.96 105.19 105.79 2x90 n GLY 331 Ca 0.12 -0.19 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 2x90 n GLY 331 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2x90 s ARG 332 N -2.12 2.83 0.08 1.61 1.70 -1.26 -5.03 118.95 116.76 2x90 s ARG 332 Ca 0.44 1.63 -0.17 0.00 -0.47 0.00 0.00 55.73 57.16 2x90 s ARG 332 Cb 0.22 -1.93 -0.07 0.00 -0.57 0.00 0.00 34.95 32.60 2x90 s ARG 332 CO 0.39 -1.27 0.54 -0.51 -1.08 0.00 0.00 175.30 173.37 2x90 s ASP 333 N -2.03 6.96 0.25 -2.89 -0.00 -1.26 -5.01 116.67 112.68 2x90 s ASP 333 Ca 0.72 1.16 -0.15 0.00 -0.00 0.00 0.00 52.55 54.28 2x90 s ASP 333 Cb -0.26 -2.32 0.01 0.00 -0.00 0.00 0.00 42.92 40.35 2x90 s ASP 333 CO 0.37 0.24 0.54 -1.48 -0.00 0.00 0.00 175.17 174.84 2x90 s LEU 334 N -1.34 0.15 -0.50 1.23 2.34 -1.26 -0.35 118.68 118.95 2x90 s LEU 334 Ca 0.30 -0.79 -0.22 0.00 0.06 0.00 0.00 54.13 53.49 2x90 s LEU 334 Cb -0.18 2.06 0.04 0.00 -0.56 0.00 0.00 46.19 47.55 2x90 s LEU 334 CO 0.18 -1.18 0.78 -0.69 -1.06 0.00 0.00 176.35 174.38 2x90 s VAL 335 N -3.97 4.64 -0.67 1.48 1.01 -0.35 -4.79 120.40 117.75 2x90 s VAL 335 Ca 0.18 0.10 0.25 0.00 0.00 0.00 0.00 61.98 62.51 2x90 s VAL 335 Cb -0.02 -4.37 0.19 0.00 0.00 0.00 0.00 36.38 32.18 2x90 s VAL 335 CO 0.07 -0.85 1.57 0.00 0.00 0.00 0.00 175.10 175.88 2x90 n HIS 337 N -2.26 2.44 -1.77 0.00 -0.00 -1.26 -3.98 115.22 108.39 2x90 n HIS 337 Ca 0.04 -0.19 -0.41 0.00 -0.00 0.00 0.00 57.72 57.16 2x90 n HIS 337 Cb 0.44 -2.74 -0.00 0.00 -0.00 0.00 0.00 29.99 27.69 2x90 n HIS 337 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2x90 n ALA 338 N 6.93 2.35 -3.21 1.57 0.00 -1.26 -4.92 120.51 121.96 2x90 n ALA 338 Ca 0.21 0.35 -0.13 0.00 0.00 0.00 0.00 53.44 53.86 2x90 n ALA 338 Cb 0.35 -2.42 -0.06 0.00 0.00 0.00 0.00 19.45 17.33 2x90 n ALA 338 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2x90 s SER 339 N -0.07 -0.34 -0.00 0.00 1.04 -0.78 -5.03 113.70 108.51 2x90 s SER 339 Ca 0.54 0.06 0.08 0.00 0.48 0.00 0.00 55.95 57.11 2x90 s SER 339 Cb -0.48 0.45 -0.02 0.00 0.10 0.00 0.00 66.02 66.07 2x90 s SER 339 CO 0.62 -0.69 -0.25 0.00 0.98 0.00 0.00 173.24 173.90 2x90 s ALA 340 N -2.50 2.05 -0.05 5.32 0.00 -1.26 -1.42 121.76 123.90 2x90 s ALA 340 Ca -0.05 -1.09 0.03 0.00 0.00 0.00 0.00 51.96 50.85 2x90 s ALA 340 Cb -0.01 -0.50 0.01 0.00 0.00 0.00 0.00 23.12 22.62 2x90 s ALA 340 CO -0.02 0.50 -0.13 -1.58 0.00 0.00 0.00 175.76 174.53 2x90 s TRP 341 N -0.62 1.39 -0.16 0.00 0.52 0.13 -5.00 118.94 115.18 2x90 s TRP 341 Ca 0.10 -0.44 -0.05 0.00 0.02 0.00 0.00 56.10 55.73 2x90 s TRP 341 Cb -0.09 -0.99 -0.03 0.00 -1.15 0.00 0.00 33.47 31.21 2x90 s TRP 341 CO -0.00 -0.20 -0.01 0.34 0.02 0.00 0.00 176.95 177.09 2x90 s ASP 342 N 0.39 4.99 0.00 2.95 3.68 -1.26 -1.56 116.67 125.85 2x90 s ASP 342 Ca -0.09 -0.09 0.19 0.00 2.13 0.00 0.00 52.55 54.69 2x90 s ASP 342 Cb -0.13 -1.83 0.27 0.00 -1.45 0.00 0.00 42.92 39.78 2x90 s ASP 342 CO 0.02 0.17 1.20 0.49 0.13 0.00 0.00 175.17 177.18 2x90 n PHE 343 N 3.57 0.25 -1.91 -5.34 3.72 -0.89 -4.99 117.46 111.87 2x90 n PHE 343 Ca -0.17 -0.16 -0.16 0.00 -0.05 0.00 0.00 57.45 56.91 2x90 n PHE 343 Cb 0.52 -0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 39.02 2x90 n PHE 343 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2x90 n TYR 344 N 1.11 -0.40 0.00 1.38 4.02 -1.26 -4.28 117.16 117.73 2x90 n TYR 344 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.03 2x90 n TYR 344 Cb 0.50 -3.05 0.00 0.00 -0.02 0.00 0.00 39.34 36.77 2x90 n TYR 344 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 2x90 n LEU 345 N -2.07 0.00 -4.11 7.72 4.77 -1.26 -4.70 117.00 117.34 2x90 n LEU 345 Ca -0.18 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.49 2x90 n LEU 345 Cb 0.59 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.52 2x90 n LEU 345 CO 0.23 0.00 -0.52 -0.89 -1.33 0.00 0.00 177.39 174.88 2x90 s THR 346 N 3.92 1.91 0.00 -5.08 2.01 -1.26 -4.81 115.64 112.33 2x90 s THR 346 Ca 0.00 -0.87 0.00 0.00 0.31 0.00 0.00 61.69 61.13 2x90 s THR 346 Cb 0.00 -1.72 0.00 0.00 0.01 0.00 0.00 72.50 70.79 2x90 s THR 346 CO 0.00 0.52 0.00 0.47 -0.69 0.00 0.00 174.62 174.92 2x90 n ASP 347 N 4.39 -4.97 -4.38 3.53 10.43 -1.26 -4.92 116.55 119.37 2x90 n ASP 347 Ca -0.20 0.00 -0.46 0.00 2.57 0.00 0.00 54.79 56.71 2x90 n ASP 347 Cb 0.51 -2.63 -0.02 0.00 1.84 0.00 0.00 41.12 40.81 2x90 n ASP 347 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2x90 s ASP 348 N -2.01 6.66 0.05 -2.24 -1.08 -1.26 -4.45 116.67 112.34 2x90 s ASP 348 Ca 0.00 -2.33 0.04 0.00 -0.52 0.00 0.00 52.55 49.74 2x90 s ASP 348 Cb 0.00 -2.29 -0.02 0.00 -1.46 0.00 0.00 42.92 39.14 2x90 s ASP 348 CO 0.00 -0.82 -0.13 0.68 0.52 0.00 0.00 175.17 175.43 2x90 s VAL 349 N 1.40 1.00 0.00 1.11 -7.23 -1.26 -2.09 120.40 113.33 2x90 s VAL 349 Ca 0.23 -1.05 -0.12 0.00 -1.81 0.00 0.00 61.98 59.24 2x90 s VAL 349 Cb -0.09 -0.94 0.01 0.00 0.56 0.00 0.00 36.38 35.93 2x90 s VAL 349 CO -0.08 -0.10 0.24 -0.13 -0.31 0.00 0.00 175.10 174.72 2x90 s ARG 350 N -1.30 0.62 0.01 4.82 0.52 -0.60 -3.57 118.95 119.45 2x90 s ARG 350 Ca -0.01 -0.32 0.06 0.00 -0.52 0.00 0.00 55.73 54.94 2x90 s ARG 350 Cb -0.08 0.27 -0.03 0.00 0.52 0.00 0.00 34.95 35.62 2x90 s ARG 350 CO 0.01 -0.17 -0.18 0.42 0.02 0.00 0.00 175.30 175.41 2x90 s ILE 351 N -1.53 2.79 -0.27 1.52 1.01 -1.26 0.17 121.20 123.62 2x90 s ILE 351 Ca -0.13 -1.04 0.03 0.00 0.00 0.00 0.00 60.65 59.51 2x90 s ILE 351 Cb -0.05 -2.13 0.07 0.00 0.01 0.00 0.00 42.46 40.35 2x90 s ILE 351 CO 0.02 0.44 -0.09 -0.75 0.00 0.00 0.00 174.94 174.56 2x90 s LYS 352 N -1.14 2.14 -0.02 2.79 2.20 -0.51 -1.04 119.74 124.16 2x90 s LYS 352 Ca 0.13 -1.42 -0.01 0.00 -0.36 0.00 0.00 55.97 54.31 2x90 s LYS 352 Cb -0.10 -2.94 0.02 0.00 -1.51 0.00 0.00 37.83 33.30 2x90 s LYS 352 CO 0.03 -0.62 0.04 -1.14 -0.36 0.00 0.00 175.35 173.30 2x90 s GLN 353 N 1.07 -0.00 -1.34 4.03 0.74 0.61 -1.87 119.66 122.91 2x90 s GLN 353 Ca -0.06 0.18 -0.10 0.00 0.05 0.00 0.00 55.36 55.42 2x90 s GLN 353 Cb -0.20 -0.17 0.13 0.00 1.10 0.00 0.00 33.01 33.86 2x90 s GLN 353 CO -0.05 -0.13 2.03 0.00 -0.55 0.00 0.00 175.29 176.59 2x90 s THR 355 N 0.99 2.83 0.21 0.00 2.01 -1.18 -4.70 115.64 115.81 2x90 s THR 355 Ca 0.43 0.62 0.10 0.00 0.31 0.00 0.00 61.69 63.15 2x90 s THR 355 Cb 0.12 -3.40 -0.04 0.00 0.01 0.00 0.00 72.50 69.18 2x90 s THR 355 CO -0.03 0.06 -0.12 -0.13 -0.69 0.00 0.00 174.62 173.72 2x90 s ARG 356 N 0.70 1.94 -1.23 4.92 0.52 -1.26 -4.73 118.95 119.81 2x90 s ARG 356 Ca 0.65 -1.42 -0.14 0.00 -0.52 0.00 0.00 55.73 54.30 2x90 s ARG 356 Cb -0.41 -2.04 0.16 0.00 0.52 0.00 0.00 34.95 33.17 2x90 s ARG 356 CO 0.34 0.40 1.50 0.28 0.02 0.00 0.00 175.30 177.84 2x90 n VAL 357 N -0.19 4.21 -4.20 3.52 0.31 -1.26 -4.71 118.33 116.00 2x90 n VAL 357 Ca -0.09 -4.62 -0.12 0.00 -0.01 0.00 0.00 64.34 59.50 2x90 n VAL 357 Cb 0.57 -2.45 -0.10 0.00 -0.91 0.00 0.00 33.84 30.95 2x90 n VAL 357 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2x90 s THR 358 N 1.91 0.51 0.12 2.52 -4.23 -1.26 -4.74 115.64 110.48 2x90 s THR 358 Ca 0.44 -1.95 -0.20 0.00 -1.18 0.00 0.00 61.69 58.81 2x90 s THR 358 Cb -0.01 -2.02 -0.06 0.00 1.34 0.00 0.00 72.50 71.74 2x90 s THR 358 CO 0.01 -0.54 1.77 -0.61 -0.54 0.00 0.00 174.62 174.71 2x90 h GLN 359 N 2.79 0.24 -0.85 3.99 4.15 -1.90 -1.53 115.11 122.01 2x90 h GLN 359 Ca -0.36 -0.01 0.07 0.00 0.77 0.00 0.00 58.65 59.11 2x90 h GLN 359 Cb 1.20 -0.05 -0.06 0.00 0.21 0.00 0.00 27.48 28.77 2x90 h GLN 359 CO 0.62 0.16 0.52 0.22 -1.93 0.00 0.00 178.83 178.42 2x90 h ASP 360 N 0.25 0.80 0.20 -0.69 3.58 -1.97 -1.59 116.42 117.01 2x90 h ASP 360 Ca 0.08 0.02 -0.09 0.00 0.42 0.00 0.00 57.03 57.46 2x90 h ASP 360 Cb -0.01 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 40.88 2x90 h ASP 360 CO -0.03 0.51 -0.35 1.56 -2.88 0.00 0.00 179.24 178.04 2x90 h GLN 361 N 0.93 0.22 -0.60 0.28 1.08 -1.79 -1.93 115.11 113.30 2x90 h GLN 361 Ca 0.38 -0.09 -0.00 0.00 -1.45 0.00 0.00 58.65 57.48 2x90 h GLN 361 Cb 0.20 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.59 2x90 h GLN 361 CO -0.18 0.55 0.35 1.25 -0.95 0.00 0.00 178.83 179.85 2x90 h LEU 362 N 0.19 0.72 -0.34 1.46 5.85 -0.29 0.42 115.31 123.33 2x90 h LEU 362 Ca 0.02 -0.04 -0.16 0.00 0.84 0.00 0.00 57.88 58.55 2x90 h LEU 362 Cb 0.72 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.56 2x90 h LEU 362 CO 0.05 0.56 -0.40 -0.26 -0.34 0.00 0.00 178.44 178.05 2x90 h PHE 363 N 0.83 1.05 -0.77 1.25 0.04 -1.06 -2.73 116.94 115.56 2x90 h PHE 363 Ca 0.22 -0.33 -0.01 0.00 2.80 0.00 0.00 57.97 60.65 2x90 h PHE 363 Cb -0.02 -0.22 -0.04 0.00 2.20 0.00 0.00 35.95 37.88 2x90 h PHE 363 CO 0.00 1.14 0.46 1.15 -0.60 0.00 0.00 178.31 180.46 2x90 h THR 364 N 0.66 1.22 -0.39 -1.55 2.02 -0.82 0.34 112.91 114.38 2x90 h THR 364 Ca 0.05 -0.49 0.05 0.00 0.77 0.00 0.00 66.41 66.78 2x90 h THR 364 Cb 0.99 0.16 -0.05 0.00 -1.74 0.00 0.00 68.15 67.52 2x90 h THR 364 CO 0.10 0.23 0.11 0.58 0.37 0.00 0.00 175.52 176.91 2x90 h VAL 365 N 1.05 0.84 -0.40 3.16 2.07 -0.91 -1.06 116.25 121.01 2x90 h VAL 365 Ca 0.27 -0.09 -0.10 0.00 0.82 0.00 0.00 66.70 67.61 2x90 h VAL 365 Cb -0.02 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 2x90 h VAL 365 CO -0.05 0.05 -0.15 0.45 0.02 0.00 0.00 177.57 177.89 2x90 h HIS 366 N 0.25 0.81 0.00 1.57 -0.00 -1.14 -0.86 115.15 115.79 2x90 h HIS 366 Ca 0.19 -0.15 0.02 0.00 -0.00 0.00 0.00 60.37 60.42 2x90 h HIS 366 Cb 0.19 -0.20 -0.03 0.00 -0.00 0.00 0.00 27.41 27.37 2x90 h HIS 366 CO -0.17 0.83 -0.12 1.25 -0.00 0.00 0.00 177.93 179.72 2x90 h HIS 367 N 0.66 -0.31 -0.44 2.45 6.17 -0.52 -1.31 115.15 121.85 2x90 h HIS 367 Ca 0.11 0.01 -0.09 0.00 0.71 0.00 0.00 60.37 61.10 2x90 h HIS 367 Cb 0.62 0.14 -0.02 0.00 2.52 0.00 0.00 27.41 30.67 2x90 h HIS 367 CO 0.03 -0.18 -0.11 0.93 0.71 0.00 0.00 177.93 179.31 2x90 h GLU 368 N -0.21 0.79 0.00 5.26 4.39 -1.04 -2.41 114.58 121.36 2x90 h GLU 368 Ca 0.04 -0.26 -0.04 0.00 0.34 0.00 0.00 59.36 59.45 2x90 h GLU 368 Cb 0.26 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 2x90 h GLU 368 CO -0.12 0.86 -0.18 -0.07 -1.16 0.00 0.00 179.01 178.35 2x90 h LEU 369 N 0.71 0.00 -0.57 1.33 3.38 -1.03 -2.26 115.31 116.88 2x90 h LEU 369 Ca 0.12 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2x90 h LEU 369 Cb 0.59 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 2x90 h LEU 369 CO 0.04 0.18 0.24 1.23 0.09 0.00 0.00 178.44 180.22 2x90 h GLY 370 N 1.61 0.90 0.95 0.83 0.00 -0.72 -0.57 103.07 106.07 2x90 h GLY 370 Ca -0.00 -0.48 0.01 0.00 0.00 0.00 0.00 47.33 46.86 2x90 h GLY 370 CO 0.02 0.45 0.10 0.45 0.00 0.00 0.00 176.54 177.57 2x90 h HIS 371 N 0.78 0.19 -0.43 5.60 3.86 -1.32 -2.19 115.15 121.64 2x90 h HIS 371 Ca 0.19 0.01 0.04 0.00 -1.16 0.00 0.00 60.37 59.44 2x90 h HIS 371 Cb 0.17 -0.06 -0.04 0.00 1.06 0.00 0.00 27.41 28.55 2x90 h HIS 371 CO 0.01 0.11 0.21 0.82 0.86 0.00 0.00 177.93 179.94 2x90 h ILE 372 N 0.22 0.96 -0.80 2.45 1.08 -1.22 -1.47 117.51 118.72 2x90 h ILE 372 Ca 0.07 -0.15 0.02 0.00 -0.39 0.00 0.00 64.86 64.42 2x90 h ILE 372 Cb -0.00 0.50 -0.04 0.00 -3.07 0.00 0.00 36.82 34.21 2x90 h ILE 372 CO -0.04 0.08 0.52 -0.61 -0.69 0.00 0.00 178.15 177.41 2x90 h GLN 373 N 0.42 1.00 -0.40 2.37 5.75 -1.01 -1.52 115.11 121.72 2x90 h GLN 373 Ca 0.19 -0.06 0.01 0.00 -0.15 0.00 0.00 58.65 58.64 2x90 h GLN 373 Cb 0.10 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.40 2x90 h GLN 373 CO -0.14 0.66 0.25 -0.92 -2.65 0.00 0.00 178.83 176.03 2x90 h TYR 374 N 1.03 0.46 -0.57 3.99 -0.00 -0.88 -0.12 116.97 120.87 2x90 h TYR 374 Ca 0.31 0.01 0.08 0.00 -0.00 0.00 0.00 58.73 59.13 2x90 h TYR 374 Cb -0.04 -0.15 -0.06 0.00 -0.00 0.00 0.00 36.73 36.48 2x90 h TYR 374 CO -0.02 0.28 0.23 0.74 -0.00 0.00 0.00 178.16 179.39 2x90 h PHE 375 N 0.50 0.41 -0.39 -3.82 0.04 -0.63 -2.30 116.94 110.75 2x90 h PHE 375 Ca 0.15 0.03 -0.12 0.00 2.80 0.00 0.00 57.97 60.83 2x90 h PHE 375 Cb -0.02 -0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.02 2x90 h PHE 375 CO -0.06 0.14 -0.25 -0.07 -0.60 0.00 0.00 178.31 177.46 2x90 h LEU 376 N 0.43 0.81 -1.03 1.54 3.38 -0.91 -2.35 115.31 117.18 2x90 h LEU 376 Ca 0.28 -0.31 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 2x90 h LEU 376 Cb 0.30 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2x90 h LEU 376 CO -0.26 1.03 -0.20 1.56 0.09 0.00 0.00 178.44 180.66 2x90 h GLN 377 N 0.68 0.46 -0.36 1.13 1.08 -0.59 -3.24 115.11 114.27 2x90 h GLN 377 Ca 0.09 -0.15 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 2x90 h GLN 377 Cb 0.78 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.17 2x90 h GLN 377 CO 0.06 0.64 0.00 2.48 -0.95 0.00 0.00 178.83 181.07 2x90 n TYR 378 N -4.16 0.48 0.28 2.96 0.18 -0.91 -4.19 117.16 111.81 2x90 n TYR 378 Ca -0.00 -0.45 0.13 0.00 1.88 0.00 0.00 57.90 59.46 2x90 n TYR 378 Cb 0.37 -0.02 0.62 0.00 -0.38 0.00 0.00 39.34 39.92 2x90 n TYR 378 CO 0.00 0.00 0.00 -0.56 -2.08 0.00 0.00 176.86 174.22 2x90 h GLN 379 N 2.37 0.00 0.00 -3.48 3.07 -1.45 -0.72 115.11 114.90 2x90 h GLN 379 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2x90 h GLN 379 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.31 2x90 h GLN 379 CO 0.00 0.00 -0.21 -2.39 0.09 0.00 0.00 178.83 176.32 2x90 n HIS 380 N -2.39 0.24 -1.86 0.06 1.44 -1.26 -4.90 115.22 106.54 2x90 n HIS 380 Ca -0.00 0.07 -0.32 0.00 -2.01 0.00 0.00 57.72 55.45 2x90 n HIS 380 Cb 0.13 -0.53 0.03 0.00 0.12 0.00 0.00 29.99 29.74 2x90 n HIS 380 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 2x90 s GLN 381 N -3.04 3.07 0.68 -1.40 -1.52 -0.28 -5.01 119.66 112.16 2x90 s GLN 381 Ca 0.12 1.22 -0.17 0.00 -1.95 0.00 0.00 55.36 54.58 2x90 s GLN 381 Cb 0.17 -2.00 0.00 0.00 -0.22 0.00 0.00 33.01 30.96 2x90 s GLN 381 CO 0.61 -1.02 1.16 -0.35 -0.25 0.00 0.00 175.29 175.45 2x90 n PRO 382 N -2.36 0.82 -0.29 2.91 -0.04 -1.26 -4.75 135.00 130.03 2x90 n PRO 382 Ca 0.09 0.34 0.07 0.00 -0.04 0.00 0.00 63.50 63.96 2x90 n PRO 382 Cb 0.53 -2.40 0.18 0.00 -0.04 0.00 0.00 33.50 31.76 2x90 n PRO 382 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2x90 h PHE 383 N 0.15 -0.13 0.00 0.54 3.57 -1.95 0.65 116.94 119.77 2x90 h PHE 383 Ca -0.49 0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.07 2x90 h PHE 383 Cb 1.34 0.19 -0.00 0.00 2.79 0.00 0.00 35.95 40.26 2x90 h PHE 383 CO 0.41 -0.31 -0.02 -0.39 -2.23 0.00 0.00 178.31 175.77 2x90 h VAL 384 N 0.06 0.13 -0.08 1.41 -1.51 -1.89 -0.94 116.25 113.42 2x90 h VAL 384 Ca 0.45 -0.19 0.00 0.00 -1.23 0.00 0.00 66.70 65.73 2x90 h VAL 384 Cb 0.82 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 31.14 2x90 h VAL 384 CO -0.76 0.02 0.00 -1.22 -1.23 0.00 0.00 177.57 174.37 2x90 n TYR 385 N -3.23 0.08 -1.98 5.19 4.01 0.21 -4.67 117.16 116.77 2x90 n TYR 385 Ca -0.02 -0.04 -0.41 0.00 -0.16 0.00 0.00 57.90 57.27 2x90 n TYR 385 Cb 0.15 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.17 2x90 n TYR 385 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2x90 n ARG 386 N 0.98 3.83 -3.83 -0.72 1.74 -0.36 -1.31 116.66 116.99 2x90 n ARG 386 Ca 0.16 -3.17 -0.08 0.00 -0.77 0.00 0.00 57.85 54.00 2x90 n ARG 386 Cb 0.52 -2.87 0.01 0.00 -1.02 0.00 0.00 32.46 29.10 2x90 n ARG 386 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 2x90 s THR 387 N 0.58 0.00 0.69 0.55 -1.32 -1.26 -5.01 115.64 109.87 2x90 s THR 387 Ca 0.50 -0.98 -0.14 0.00 -1.21 0.00 0.00 61.69 59.86 2x90 s THR 387 Cb 0.14 -2.57 0.02 0.00 -1.51 0.00 0.00 72.50 68.58 2x90 s THR 387 CO -0.05 0.00 1.11 -0.83 -2.21 0.00 0.00 174.62 172.64 2x90 s GLY 388 N -3.03 2.05 0.26 6.08 0.00 -1.26 -2.26 107.32 109.16 2x90 s GLY 388 Ca 0.14 0.50 -0.02 0.00 0.00 0.00 0.00 44.72 45.34 2x90 s GLY 388 CO 0.10 0.85 1.79 0.00 0.00 0.00 0.00 173.10 175.84 2x90 h ALA 389 N -0.27 1.26 -2.69 3.20 0.00 -1.91 -3.39 119.26 115.47 2x90 h ALA 389 Ca -0.46 0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.39 2x90 h ALA 389 Cb 1.25 -0.09 -0.12 0.00 0.00 0.00 0.00 17.79 18.82 2x90 h ALA 389 CO 0.53 0.03 -0.31 0.54 0.00 0.00 0.00 179.25 180.05 2x90 s ASN 390 N -5.54 0.02 0.51 0.00 2.20 -1.26 -4.15 114.94 106.72 2x90 s ASN 390 Ca -0.12 -0.97 0.22 0.00 -0.94 0.00 0.00 52.86 51.04 2x90 s ASN 390 Cb 0.21 0.47 1.30 0.00 -2.00 0.00 0.00 41.25 41.23 2x90 s ASN 390 CO 0.78 -0.96 2.01 -0.65 -2.94 0.00 0.00 177.10 175.35 2x90 h PRO 391 N 2.47 0.08 -0.41 3.55 0.11 -1.82 -1.22 132.00 134.76 2x90 h PRO 391 Ca -0.31 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.73 2x90 h PRO 391 Cb 1.24 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 2x90 h PRO 391 CO 0.45 0.06 -0.03 0.78 -0.21 0.00 0.00 178.00 179.05 2x90 h GLY 392 N 0.09 0.72 0.94 -0.55 0.00 -1.91 -3.00 103.07 99.35 2x90 h GLY 392 Ca 0.23 -0.47 0.02 0.00 0.00 0.00 0.00 47.33 47.10 2x90 h GLY 392 CO -0.02 0.43 0.36 0.74 0.00 0.00 0.00 176.54 178.06 2x90 h PHE 393 N 0.62 0.68 -0.83 5.60 0.05 -1.53 -2.02 116.94 119.51 2x90 h PHE 393 Ca 0.12 0.02 -0.01 0.00 3.82 0.00 0.00 57.97 61.92 2x90 h PHE 393 Cb 0.43 -0.23 -0.04 0.00 2.00 0.00 0.00 35.95 38.11 2x90 h PHE 393 CO 0.02 0.41 0.49 1.25 -0.18 0.00 0.00 178.31 180.30 2x90 h HIS 394 N 0.73 1.11 0.00 -0.55 2.76 -1.52 -2.37 115.15 115.31 2x90 h HIS 394 Ca 0.22 -0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.33 2x90 h HIS 394 Cb -0.03 -0.36 -0.01 0.00 1.55 0.00 0.00 27.41 28.56 2x90 h HIS 394 CO -0.05 0.75 -0.26 0.93 -1.30 0.00 0.00 177.93 178.01 2x90 h GLU 395 N 1.15 0.00 0.03 5.26 4.39 -1.39 -3.31 114.58 120.70 2x90 h GLU 395 Ca 0.30 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.78 2x90 h GLU 395 Cb -0.02 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 2x90 h GLU 395 CO -0.05 0.26 -1.04 0.00 -1.16 0.00 0.00 179.01 177.02 2x90 h ALA 396 N 1.74 0.32 0.26 3.43 0.00 -0.82 -3.39 119.26 120.80 2x90 h ALA 396 Ca -0.00 -0.89 0.01 0.00 0.00 0.00 0.00 54.91 54.02 2x90 h ALA 396 Cb 0.82 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.45 2x90 h ALA 396 CO 0.03 1.17 -0.43 0.28 0.00 0.00 0.00 179.25 180.31 2x90 h VAL 397 N 0.02 0.15 -0.18 0.00 2.07 -1.63 -1.90 116.25 114.77 2x90 h VAL 397 Ca -0.04 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.43 2x90 h VAL 397 Cb 1.79 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 2x90 h VAL 397 CO 0.14 0.00 -0.11 1.23 0.02 0.00 0.00 177.57 178.85 2x90 h GLY 398 N -0.75 0.31 1.97 2.17 0.00 -1.74 -2.76 103.07 102.27 2x90 h GLY 398 Ca -0.01 -0.19 -0.10 0.00 0.00 0.00 0.00 47.33 47.03 2x90 h GLY 398 CO -0.16 0.18 -0.48 -0.55 0.00 0.00 0.00 176.54 175.52 2x90 h ASP 399 N 0.28 0.03 -0.60 0.19 5.19 -1.61 -1.03 116.42 118.87 2x90 h ASP 399 Ca 0.06 -0.02 0.01 0.00 -0.62 0.00 0.00 57.03 56.46 2x90 h ASP 399 Cb 0.37 -0.01 -0.03 0.00 0.18 0.00 0.00 39.33 39.84 2x90 h ASP 399 CO 0.02 0.51 0.39 0.58 -3.12 0.00 0.00 179.24 177.62 2x90 h VAL 400 N 0.03 1.14 -0.28 -1.35 2.07 -1.05 0.34 116.25 117.14 2x90 h VAL 400 Ca -0.00 -0.27 -0.15 0.00 0.82 0.00 0.00 66.70 67.09 2x90 h VAL 400 Cb 0.86 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 2x90 h VAL 400 CO 0.06 0.15 -0.45 -0.07 0.02 0.00 0.00 177.57 177.28 2x90 h LEU 401 N 0.80 0.77 -1.30 2.57 3.38 -1.51 -3.06 115.31 116.96 2x90 h LEU 401 Ca 0.23 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.83 2x90 h LEU 401 Cb -0.07 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.43 2x90 h LEU 401 CO -0.06 1.10 0.43 0.28 0.09 0.00 0.00 178.44 180.29 2x90 h SER 402 N 0.57 0.79 -0.80 -0.43 0.02 -0.79 0.15 113.55 113.07 2x90 h SER 402 Ca 0.04 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2x90 h SER 402 Cb 1.00 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 63.30 2x90 h SER 402 CO 0.09 0.59 0.51 -0.07 -1.14 0.00 0.00 176.83 176.82 2x90 h LEU 403 N 0.93 0.93 -0.05 5.07 3.38 -0.84 -1.01 115.31 123.72 2x90 h LEU 403 Ca 0.25 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.13 2x90 h LEU 403 Cb -0.08 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.44 2x90 h LEU 403 CO -0.05 0.69 -0.19 0.28 0.09 0.00 0.00 178.44 179.26 2x90 h SER 404 N 1.09 0.26 -0.55 -0.43 0.02 -1.20 -3.21 113.55 109.53 2x90 h SER 404 Ca 0.29 -0.63 0.06 0.00 -0.84 0.00 0.00 61.79 60.67 2x90 h SER 404 Cb -0.10 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.33 2x90 h SER 404 CO -0.06 0.84 0.37 0.58 -1.14 0.00 0.00 176.83 177.42 2x90 h VAL 405 N -0.31 0.99 0.00 2.27 2.07 -0.60 -2.57 116.25 118.10 2x90 h VAL 405 Ca -0.01 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.33 2x90 h VAL 405 Cb 0.83 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 2x90 h VAL 405 CO 0.04 0.09 0.00 0.77 0.02 0.00 0.00 177.57 178.49 2x90 h SER 406 N 0.51 0.00 -3.93 0.57 4.64 -1.19 -3.37 113.55 110.79 2x90 h SER 406 Ca 0.24 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 61.05 2x90 h SER 406 Cb 0.29 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.43 2x90 h SER 406 CO -0.07 0.00 0.53 0.42 -0.87 0.00 0.00 176.83 176.84 2x90 s THR 407 N -3.26 3.06 0.39 2.95 -4.23 -0.97 -4.90 115.64 108.68 2x90 s THR 407 Ca 0.07 0.93 0.14 0.00 -1.18 0.00 0.00 61.69 61.65 2x90 s THR 407 Cb 0.10 -3.54 0.36 0.00 1.34 0.00 0.00 72.50 70.76 2x90 s THR 407 CO 0.50 0.12 1.84 -0.65 -0.54 0.00 0.00 174.62 175.89 2x90 h PRO 408 N 2.79 0.50 0.04 3.99 0.11 -1.88 -1.38 132.00 136.16 2x90 h PRO 408 Ca -0.49 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 65.62 2x90 h PRO 408 Cb 1.23 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 32.19 2x90 h PRO 408 CO 0.63 0.33 -0.28 -0.22 -0.21 0.00 0.00 178.00 178.25 2x90 h LYS 409 N 0.51 -0.43 -0.25 1.05 3.64 -1.91 -1.31 116.57 117.86 2x90 h LYS 409 Ca 0.50 0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.84 2x90 h LYS 409 Cb 1.09 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.00 2x90 h LYS 409 CO -0.23 -0.29 -0.11 1.25 -2.27 0.00 0.00 179.45 177.80 2x90 h HIS 410 N -0.45 0.61 -0.07 1.91 2.76 -1.67 -2.95 115.15 115.29 2x90 h HIS 410 Ca 0.05 -0.15 -0.05 0.00 -2.20 0.00 0.00 60.37 58.03 2x90 h HIS 410 Cb 0.51 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.32 2x90 h HIS 410 CO -0.29 0.78 -0.18 -0.07 -1.30 0.00 0.00 177.93 176.87 2x90 h LEU 411 N 0.26 0.10 -0.46 0.26 3.38 -1.16 -1.40 115.31 116.29 2x90 h LEU 411 Ca 0.06 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.86 2x90 h LEU 411 Cb 0.62 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2x90 h LEU 411 CO 0.04 0.29 -0.34 -0.33 0.09 0.00 0.00 178.44 178.18 2x90 h GLU 412 N 0.10 0.91 -0.86 1.13 5.08 -1.26 -0.81 114.58 118.87 2x90 h GLU 412 Ca 0.02 -0.45 0.08 0.00 -1.00 0.00 0.00 59.36 58.00 2x90 h GLU 412 Cb 0.38 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.56 2x90 h GLU 412 CO 0.03 1.11 0.52 0.87 -1.00 0.00 0.00 179.01 180.53 2x90 h LYS 413 N 0.76 0.89 -0.45 2.33 1.57 -1.09 -2.52 116.57 118.06 2x90 h LYS 413 Ca 0.07 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2x90 h LYS 413 Cb 0.92 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.03 2x90 h LYS 413 CO 0.09 0.59 0.00 0.44 -0.57 0.00 0.00 179.45 180.00 2x90 n ILE 414 N -4.66 0.59 -1.24 1.86 -5.35 -0.93 -4.93 119.36 104.71 2x90 n ILE 414 Ca 0.13 -0.60 -0.08 0.00 -0.27 0.00 0.00 62.75 61.92 2x90 n ILE 414 Cb 0.22 0.32 -0.04 0.00 -1.74 0.00 0.00 39.64 38.40 2x90 n ILE 414 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2x90 n GLY 415 N 1.23 1.02 0.08 3.28 0.00 -0.95 -4.90 105.19 104.95 2x90 n GLY 415 Ca 0.15 -0.58 0.09 0.00 0.00 0.00 0.00 46.02 45.68 2x90 n GLY 415 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2x90 n LEU 416 N -0.95 0.59 -4.14 0.99 4.77 -0.36 -4.80 117.00 113.11 2x90 n LEU 416 Ca -0.08 0.24 -0.33 0.00 -0.03 0.00 0.00 56.01 55.80 2x90 n LEU 416 Cb 0.29 -0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.23 2x90 n LEU 416 CO 0.13 -0.06 -0.48 -0.22 -1.33 0.00 0.00 177.39 175.43 2x90 s LEU 417 N -5.21 2.70 0.09 2.23 2.96 -0.91 -4.78 118.68 115.75 2x90 s LEU 417 Ca -0.03 -0.85 0.09 0.00 -0.22 0.00 0.00 54.13 53.11 2x90 s LEU 417 Cb 0.10 -1.55 -0.04 0.00 0.50 0.00 0.00 46.19 45.21 2x90 s LEU 417 CO 0.83 -0.07 -0.21 -0.54 -1.32 0.00 0.00 176.35 175.04 2x90 s LYS 418 N 1.26 1.77 -1.51 1.98 1.02 -1.26 -4.33 119.74 118.68 2x90 s LYS 418 Ca 0.01 -1.16 -0.13 0.00 0.02 0.00 0.00 55.97 54.71 2x90 s LYS 418 Cb -0.15 -2.07 0.08 0.00 -0.52 0.00 0.00 37.83 35.16 2x90 s LYS 418 CO -0.09 0.49 0.98 -0.25 -0.92 0.00 0.00 175.35 175.57 2x90 n ASP 419 N 1.13 -4.68 -4.67 2.83 10.43 -1.26 -4.95 116.55 115.37 2x90 n ASP 419 Ca -0.16 -0.77 -0.38 0.00 2.57 0.00 0.00 54.79 56.05 2x90 n ASP 419 Cb 0.53 -3.97 -0.07 0.00 1.84 0.00 0.00 41.12 39.45 2x90 n ASP 419 CO 0.00 0.00 0.00 -0.47 -1.07 0.00 0.00 177.20 175.66 2x90 s TYR 420 N -3.33 3.38 -0.25 1.24 5.04 -1.26 -5.06 117.35 117.11 2x90 s TYR 420 Ca 0.62 0.64 -0.06 0.00 -2.44 0.00 0.00 57.07 55.83 2x90 s TYR 420 Cb -0.31 -2.53 -0.01 0.00 0.35 0.00 0.00 41.96 39.47 2x90 s TYR 420 CO 0.82 0.00 0.03 0.08 -1.34 0.00 0.00 175.55 175.14 2x90 s VAL 421 N 1.26 3.82 -1.24 3.14 1.01 -1.26 -5.04 120.40 122.09 2x90 s VAL 421 Ca 0.20 -0.47 -0.08 0.00 0.00 0.00 0.00 61.98 61.62 2x90 s VAL 421 Cb -0.15 -2.83 0.19 0.00 0.00 0.00 0.00 36.38 33.60 2x90 s VAL 421 CO 0.08 0.29 1.82 -1.14 0.00 0.00 0.00 175.10 176.15 2x90 n ARG 422 N 4.85 3.83 -1.82 2.72 0.63 -1.26 -4.74 116.66 120.86 2x90 n ARG 422 Ca -0.16 -3.72 -0.22 0.00 -0.92 0.00 0.00 57.85 52.82 2x90 n ARG 422 Cb 0.50 -2.83 0.14 0.00 0.45 0.00 0.00 32.46 30.72 2x90 n ARG 422 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 2x90 n ASP 423 N 3.28 0.48 -0.29 6.15 3.85 -1.26 -4.85 116.55 123.90 2x90 n ASP 423 Ca 0.38 -1.61 0.06 0.00 -0.71 0.00 0.00 54.79 52.91 2x90 n ASP 423 Cb 0.35 -0.73 0.27 0.00 -1.35 0.00 0.00 41.12 39.67 2x90 n ASP 423 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.20 176.63 2x90 h ASP 424 N -1.08 0.84 0.09 -1.12 3.45 -1.99 -1.56 116.42 115.04 2x90 h ASP 424 Ca -0.32 0.02 -0.27 0.00 0.43 0.00 0.00 57.03 56.89 2x90 h ASP 424 Cb 0.99 -0.16 0.02 0.00 -0.56 0.00 0.00 39.33 39.62 2x90 h ASP 424 CO 0.27 0.51 -1.07 -0.33 -1.57 0.00 0.00 179.24 177.04 2x90 h GLU 425 N 0.94 0.64 -0.51 3.56 5.08 -1.96 -2.36 114.58 119.97 2x90 h GLU 425 Ca 0.41 -0.72 -0.04 0.00 -1.00 0.00 0.00 59.36 58.01 2x90 h GLU 425 Cb 0.34 0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 2x90 h GLU 425 CO -0.17 1.30 0.15 0.00 -1.00 0.00 0.00 179.01 179.30 2x90 h ALA 426 N 0.44 1.31 -0.45 3.43 0.00 -1.81 -1.89 119.26 120.29 2x90 h ALA 426 Ca -0.13 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 2x90 h ALA 426 Cb 1.73 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.29 2x90 h ALA 426 CO 0.21 0.50 0.10 -0.09 0.00 0.00 0.00 179.25 179.96 2x90 h ARG 427 N 0.75 0.72 -0.50 0.00 2.43 -1.20 -1.71 114.38 114.88 2x90 h ARG 427 Ca 0.17 -0.18 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2x90 h ARG 427 Cb 0.23 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 2x90 h ARG 427 CO -0.01 0.73 0.30 0.82 -1.51 0.00 0.00 179.97 180.30 2x90 h ILE 428 N 0.60 1.16 -0.64 1.20 1.08 -1.26 -0.09 117.51 119.55 2x90 h ILE 428 Ca 0.14 -0.36 0.10 0.00 -0.39 0.00 0.00 64.86 64.35 2x90 h ILE 428 Cb 0.34 0.49 -0.08 0.00 -3.07 0.00 0.00 36.82 34.51 2x90 h ILE 428 CO 0.00 0.16 0.25 0.78 -0.69 0.00 0.00 178.15 178.65 2x90 h ASN 429 N 0.67 0.26 -0.26 1.72 2.35 -1.18 0.51 115.58 119.65 2x90 h ASN 429 Ca 0.18 0.08 -0.12 0.00 -0.55 0.00 0.00 56.30 55.89 2x90 h ASN 429 Cb -0.00 0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.42 2x90 h ASN 429 CO -0.03 0.14 -0.31 -0.61 -1.65 0.00 0.00 177.43 174.97 2x90 h GLN 430 N 0.43 0.66 -0.59 0.81 5.75 -0.93 -0.77 115.11 120.47 2x90 h GLN 430 Ca 0.33 -0.37 -0.00 0.00 -0.15 0.00 0.00 58.65 58.45 2x90 h GLN 430 Cb 0.41 0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.95 2x90 h GLN 430 CO -0.32 0.98 0.35 -0.07 -2.65 0.00 0.00 178.83 177.12 2x90 h LEU 431 N 0.38 0.72 -0.53 -2.39 3.38 -0.81 -1.00 115.31 115.06 2x90 h LEU 431 Ca 0.03 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 2x90 h LEU 431 Cb 0.88 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 2x90 h LEU 431 CO 0.07 0.57 0.18 0.15 0.09 0.00 0.00 178.44 179.51 2x90 h PHE 432 N 0.80 0.83 -0.38 1.13 3.04 -0.81 -0.37 116.94 121.17 2x90 h PHE 432 Ca 0.21 -0.07 0.04 0.00 3.98 0.00 0.00 57.97 62.12 2x90 h PHE 432 Cb -0.01 -0.24 -0.04 0.00 2.56 0.00 0.00 35.95 38.22 2x90 h PHE 432 CO -0.02 0.70 0.17 1.25 -2.02 0.00 0.00 178.31 178.39 2x90 h LEU 433 N 0.72 0.23 -0.69 0.59 5.85 -0.93 -0.44 115.31 120.63 2x90 h LEU 433 Ca 0.17 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.91 2x90 h LEU 433 Cb 0.24 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 2x90 h LEU 433 CO -0.01 0.17 0.41 0.74 -0.34 0.00 0.00 178.44 179.41 2x90 h THR 434 N 0.35 1.20 -0.18 1.05 2.02 -0.87 -2.69 112.91 113.79 2x90 h THR 434 Ca 0.17 -0.46 -0.06 0.00 0.77 0.00 0.00 66.41 66.84 2x90 h THR 434 Cb 0.11 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 66.77 2x90 h THR 434 CO -0.14 0.21 -0.14 0.00 0.37 0.00 0.00 175.52 175.82 2x90 h ALA 435 N 1.21 1.43 0.00 6.16 0.00 -0.57 0.16 119.26 127.66 2x90 h ALA 435 Ca 0.25 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2x90 h ALA 435 Cb -0.02 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2x90 h ALA 435 CO -0.04 0.40 -0.02 -0.07 0.00 0.00 0.00 179.25 179.51 2x90 h LEU 436 N 0.27 0.00 0.03 0.00 3.38 -0.75 -1.02 115.31 117.23 2x90 h LEU 436 Ca 0.05 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.64 2x90 h LEU 436 Cb 0.42 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 2x90 h LEU 436 CO 0.03 0.02 -2.24 0.47 0.09 0.00 0.00 178.44 176.80 2x90 n ASP 437 N -3.46 2.00 -0.03 -0.43 10.43 -0.61 -0.87 116.55 123.57 2x90 n ASP 437 Ca -0.03 0.11 -0.19 0.00 2.57 0.00 0.00 54.79 57.25 2x90 n ASP 437 Cb 0.12 -0.67 -0.13 0.00 1.84 0.00 0.00 41.12 42.27 2x90 n ASP 437 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 2x90 n LYS 438 N -3.67 0.72 -0.02 -1.24 4.76 0.47 -3.67 118.16 115.52 2x90 n LYS 438 Ca -0.43 0.23 -0.20 0.00 -2.87 0.00 0.00 58.31 55.04 2x90 n LYS 438 Cb 0.95 -1.66 -0.13 0.00 -1.84 0.00 0.00 35.03 32.34 2x90 n LYS 438 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 2x90 h ILE 439 N 0.05 1.27 -0.93 -0.18 1.08 -1.41 -3.35 117.51 114.04 2x90 h ILE 439 Ca -0.46 -2.39 0.18 0.00 -0.39 0.00 0.00 64.86 61.80 2x90 h ILE 439 Cb 2.00 2.88 -0.08 0.00 -3.07 0.00 0.00 36.82 38.56 2x90 h ILE 439 CO 0.04 0.63 0.60 0.58 -0.69 0.00 0.00 178.15 179.30 2x90 h VAL 440 N -0.57 0.75 0.00 1.67 2.07 -1.68 -1.73 116.25 116.76 2x90 h VAL 440 Ca -0.21 -0.21 -0.07 0.00 0.82 0.00 0.00 66.70 67.03 2x90 h VAL 440 Cb 1.51 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 2x90 h VAL 440 CO 0.03 0.11 -0.31 0.15 0.02 0.00 0.00 177.57 177.57 2x90 h PHE 441 N 0.62 0.00 0.27 1.57 3.57 -1.62 -3.34 116.94 118.01 2x90 h PHE 441 Ca 0.49 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.99 2x90 h PHE 441 Cb 0.92 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.65 2x90 h PHE 441 CO -0.00 0.31 -0.19 -0.07 -2.23 0.00 0.00 178.31 176.13 2x90 h LEU 442 N 0.00 -0.47 -1.07 0.59 3.38 -1.44 0.10 115.31 116.40 2x90 h LEU 442 Ca -0.00 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 2x90 h LEU 442 Cb 0.57 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 2x90 h LEU 442 CO 0.04 -0.29 0.01 1.55 0.09 0.00 0.00 178.44 179.84 2x90 h PRO 443 N -0.45 0.67 0.01 1.13 0.13 -1.74 -2.12 132.00 129.62 2x90 h PRO 443 Ca -0.02 -0.16 0.03 0.00 -0.87 0.00 0.00 66.00 64.98 2x90 h PRO 443 Cb 0.39 -0.09 -0.04 0.00 0.13 0.00 0.00 31.00 31.39 2x90 h PRO 443 CO 0.01 0.68 -0.21 0.35 -0.23 0.00 0.00 178.00 178.60 2x90 h PHE 444 N 0.64 -0.56 -0.81 1.56 3.57 -1.55 -1.98 116.94 117.81 2x90 h PHE 444 Ca 0.13 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.62 2x90 h PHE 444 Cb 0.38 0.25 -0.04 0.00 2.79 0.00 0.00 35.95 39.33 2x90 h PHE 444 CO 0.02 -0.30 0.40 0.00 -2.23 0.00 0.00 178.31 176.20 2x90 h ALA 445 N 0.53 1.04 -0.61 2.41 0.00 -0.61 -2.41 119.26 119.61 2x90 h ALA 445 Ca 0.06 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2x90 h ALA 445 Cb 0.42 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2x90 h ALA 445 CO -0.19 0.59 0.38 0.35 0.00 0.00 0.00 179.25 180.38 2x90 h PHE 446 N 1.14 0.80 -0.10 0.00 3.04 -1.22 -2.97 116.94 117.62 2x90 h PHE 446 Ca 0.28 0.00 -0.07 0.00 3.98 0.00 0.00 57.97 62.16 2x90 h PHE 446 Cb 0.10 -0.26 -0.01 0.00 2.56 0.00 0.00 35.95 38.33 2x90 h PHE 446 CO 0.01 0.53 -0.26 1.79 -2.02 0.00 0.00 178.31 178.37 2x90 h THR 447 N 0.83 1.23 -0.43 4.41 1.35 -0.88 -0.46 112.91 118.96 2x90 h THR 447 Ca 0.22 -1.07 0.05 0.00 -0.55 0.00 0.00 66.41 65.06 2x90 h THR 447 Cb -0.04 1.44 -0.04 0.00 -1.73 0.00 0.00 68.15 67.78 2x90 h THR 447 CO -0.04 0.32 0.18 0.24 -0.25 0.00 0.00 175.52 175.97 2x90 h MET 448 N 0.16 0.36 0.03 4.72 2.86 -1.30 -0.03 114.93 121.72 2x90 h MET 448 Ca 0.03 -0.02 -0.28 0.00 -2.06 0.00 0.00 59.70 57.36 2x90 h MET 448 Cb 0.54 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 32.09 2x90 h MET 448 CO 0.04 0.24 -1.54 -0.44 1.06 0.00 0.00 176.91 176.26 2x90 h ASP 449 N 0.37 0.10 -0.91 1.22 3.45 -1.58 -3.03 116.42 116.04 2x90 h ASP 449 Ca 0.19 -0.17 0.10 0.00 0.43 0.00 0.00 57.03 57.59 2x90 h ASP 449 Cb 0.15 -0.03 -0.08 0.00 -0.56 0.00 0.00 39.33 38.81 2x90 h ASP 449 CO -0.17 1.15 0.55 0.11 -1.57 0.00 0.00 179.24 179.30 2x90 h LYS 450 N 0.02 0.87 0.62 3.56 1.57 -1.00 0.35 116.57 122.56 2x90 h LYS 450 Ca -0.23 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.47 2x90 h LYS 450 Cb 1.96 -0.20 0.01 0.00 0.08 0.00 0.00 32.23 34.08 2x90 h LYS 450 CO 0.11 0.58 -0.30 -0.92 -0.57 0.00 0.00 179.45 178.34 2x90 h TYR 451 N 0.90 -0.78 -0.56 -1.35 3.20 -1.07 -2.05 116.97 115.26 2x90 h TYR 451 Ca 0.44 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.25 2x90 h TYR 451 Cb 0.41 0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.91 2x90 h TYR 451 CO -0.03 -0.44 0.14 0.00 -1.64 0.00 0.00 178.16 176.19 2x90 h ARG 452 N -0.98 0.85 -0.54 1.82 3.08 -1.38 -2.15 114.38 115.07 2x90 h ARG 452 Ca -0.09 -0.17 0.04 0.00 0.07 0.00 0.00 59.98 59.83 2x90 h ARG 452 Cb 0.68 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.56 2x90 h ARG 452 CO 0.14 0.76 0.30 -1.49 -1.07 0.00 0.00 179.97 178.61 2x90 h TRP 453 N 0.82 0.55 -0.34 3.04 6.55 -0.32 0.12 115.95 126.37 2x90 h TRP 453 Ca 0.18 0.02 -0.05 0.00 0.95 0.00 0.00 58.89 59.99 2x90 h TRP 453 Cb 0.28 -0.17 -0.02 0.00 -0.86 0.00 0.00 29.16 28.40 2x90 h TRP 453 CO 0.02 0.28 -0.01 0.66 -1.05 0.00 0.00 178.44 178.35 2x90 h SER 454 N 0.58 0.50 -0.06 -3.49 4.64 -0.79 0.12 113.55 115.05 2x90 h SER 454 Ca 0.23 -0.09 -0.04 0.00 -0.47 0.00 0.00 61.79 61.42 2x90 h SER 454 Cb 0.10 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 2x90 h SER 454 CO -0.14 0.57 -0.10 -0.07 -0.87 0.00 0.00 176.83 176.21 2x90 h LEU 455 N 0.51 0.19 -0.83 5.97 3.38 -0.92 0.22 115.31 123.84 2x90 h LEU 455 Ca 0.11 -0.55 0.09 0.00 0.09 0.00 0.00 57.88 57.61 2x90 h LEU 455 Cb 0.34 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 40.96 2x90 h LEU 455 CO 0.01 0.71 0.48 -0.26 0.09 0.00 0.00 178.44 179.47 2x90 h PHE 456 N -0.32 0.88 0.00 1.13 0.05 -0.55 -1.92 116.94 116.21 2x90 h PHE 456 Ca 0.00 0.03 0.00 0.00 3.82 0.00 0.00 57.97 61.82 2x90 h PHE 456 Cb 0.67 -0.27 0.00 0.00 2.00 0.00 0.00 35.95 38.35 2x90 h PHE 456 CO 0.11 0.38 0.00 0.54 -0.18 0.00 0.00 178.31 179.16 2x90 n ARG 457 N -4.72 0.40 -2.39 1.51 1.74 0.01 -4.58 116.66 108.63 2x90 n ARG 457 Ca 0.13 0.02 -0.10 0.00 -0.77 0.00 0.00 57.85 57.13 2x90 n ARG 457 Cb 0.25 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.20 2x90 n ARG 457 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2x90 n GLY 458 N 1.12 0.06 0.04 -0.13 0.00 -0.72 -4.94 105.19 100.63 2x90 n GLY 458 Ca 0.13 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.84 2x90 n GLY 458 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2x90 n GLU 459 N -2.07 0.22 -4.77 1.61 1.02 0.05 -4.80 120.64 111.90 2x90 n GLU 459 Ca -0.08 0.05 -0.30 0.00 -0.02 0.00 0.00 57.16 56.81 2x90 n GLU 459 Cb 0.57 -1.63 -0.17 0.00 -0.02 0.00 0.00 31.44 30.20 2x90 n GLU 459 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2x90 s VAL 460 N -3.13 1.77 0.43 2.62 1.01 -1.23 -5.03 120.40 116.85 2x90 s VAL 460 Ca 0.07 -0.83 -0.25 0.00 0.00 0.00 0.00 61.98 60.98 2x90 s VAL 460 Cb 0.15 -1.57 -0.08 0.00 0.00 0.00 0.00 36.38 34.88 2x90 s VAL 460 CO 0.72 0.49 1.27 -1.81 0.00 0.00 0.00 175.10 175.77 2x90 s ASP 461 N 0.70 6.16 0.41 3.32 1.01 -1.26 -4.92 116.67 122.10 2x90 s ASP 461 Ca -0.12 2.56 0.18 0.00 0.71 0.00 0.00 52.55 55.89 2x90 s ASP 461 Cb -0.16 -2.63 1.10 0.00 1.01 0.00 0.00 42.92 42.24 2x90 s ASP 461 CO 0.02 -0.94 1.83 0.11 0.21 0.00 0.00 175.17 176.40 2x90 h LYS 462 N 2.38 0.38 0.00 8.23 1.57 -2.00 0.18 116.57 127.31 2x90 h LYS 462 Ca -0.50 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 2x90 h LYS 462 Cb 1.25 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2x90 h LYS 462 CO 0.61 0.25 0.00 0.00 -0.57 0.00 0.00 179.45 179.75 2x90 h ALA 463 N 1.60 1.00 -0.07 3.86 0.00 -2.00 -3.04 119.26 120.61 2x90 h ALA 463 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.42 2x90 h ALA 463 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2x90 h ALA 463 CO -0.21 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.13 2x90 n ASN 464 N -2.67 2.27 -0.27 0.00 5.03 0.62 -4.83 115.26 115.41 2x90 n ASN 464 Ca -0.01 -2.19 -0.06 0.00 0.87 0.00 0.00 54.58 53.19 2x90 n ASN 464 Cb 0.10 -0.12 0.06 0.00 -1.02 0.00 0.00 39.78 38.79 2x90 n ASN 464 CO 0.00 0.00 0.00 -0.50 -1.83 0.00 0.00 177.26 174.93 2x90 h TRP 465 N 0.40 1.06 -0.06 3.10 4.06 -1.49 -1.32 115.95 121.70 2x90 h TRP 465 Ca 0.00 -0.04 -0.16 0.00 2.06 0.00 0.00 58.89 60.75 2x90 h TRP 465 Cb 0.65 -0.33 0.01 0.00 -1.00 0.00 0.00 29.16 28.48 2x90 h TRP 465 CO 0.06 0.77 -0.57 -0.97 -3.56 0.00 0.00 178.44 174.16 2x90 h ASN 466 N 1.04 0.61 0.74 -3.49 -1.24 -1.86 -2.97 115.58 108.42 2x90 h ASN 466 Ca 0.26 -0.69 -0.07 0.00 0.71 0.00 0.00 56.30 56.51 2x90 h ASN 466 Cb 0.09 -0.18 -0.01 0.00 0.73 0.00 0.00 38.32 38.95 2x90 h ASN 466 CO -0.04 1.21 -0.35 0.00 -1.29 0.00 0.00 177.43 176.97 2x90 h ALA 468 N 1.65 1.57 0.32 0.00 0.00 -1.24 0.12 119.26 121.68 2x90 h ALA 468 Ca -0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2x90 h ALA 468 Cb 0.81 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2x90 h ALA 468 CO 0.04 0.39 -0.16 0.35 0.00 0.00 0.00 179.25 179.88 2x90 h PHE 469 N 0.76 -0.40 0.00 0.00 3.57 -1.20 -3.03 116.94 116.64 2x90 h PHE 469 Ca 0.20 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.62 2x90 h PHE 469 Cb -0.05 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 2x90 h PHE 469 CO 0.00 -0.09 -0.34 -1.49 -2.23 0.00 0.00 178.31 174.16 2x90 h TRP 470 N -0.72 0.00 -0.65 0.41 4.06 -1.32 -2.27 115.95 115.47 2x90 h TRP 470 Ca -0.04 0.00 0.02 0.00 2.06 0.00 0.00 58.89 60.93 2x90 h TRP 470 Cb 0.49 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.61 2x90 h TRP 470 CO 0.01 0.34 0.40 0.87 -3.56 0.00 0.00 178.44 176.50 2x90 h LYS 471 N 0.00 0.78 -0.25 0.49 1.57 -0.80 -0.27 116.57 118.10 2x90 h LYS 471 Ca -0.00 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.67 2x90 h LYS 471 Cb 0.62 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 2x90 h LYS 471 CO 0.04 0.51 -0.09 -0.07 -0.57 0.00 0.00 179.45 179.27 2x90 h LEU 472 N 0.80 0.51 -1.14 2.94 3.38 -1.32 0.68 115.31 121.15 2x90 h LEU 472 Ca 0.26 -0.39 0.07 0.00 0.09 0.00 0.00 57.88 57.90 2x90 h LEU 472 Cb 0.00 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.55 2x90 h LEU 472 CO -0.10 0.78 0.59 0.03 0.09 0.00 0.00 178.44 179.84 2x90 h ARG 473 N 0.23 1.00 0.53 1.13 2.47 -1.25 -0.30 114.38 118.19 2x90 h ARG 473 Ca 0.06 -0.06 -0.03 0.00 -1.26 0.00 0.00 59.98 58.69 2x90 h ARG 473 Cb 0.58 -0.22 0.01 0.00 -1.65 0.00 0.00 29.97 28.68 2x90 h ARG 473 CO 0.03 0.66 -0.26 0.22 0.56 0.00 0.00 179.97 181.18 2x90 h ASP 474 N 1.03 -0.61 -0.62 7.04 -0.00 -0.91 -1.70 116.42 120.65 2x90 h ASP 474 Ca 0.39 -0.05 0.09 0.00 -0.00 0.00 0.00 57.03 57.47 2x90 h ASP 474 Cb 0.21 0.16 -0.07 0.00 -0.00 0.00 0.00 39.33 39.63 2x90 h ASP 474 CO -0.15 -0.22 0.26 -0.08 -0.00 0.00 0.00 179.24 179.04 2x90 h GLU 475 N -1.06 0.44 0.07 0.28 4.81 -0.50 -1.20 114.58 117.42 2x90 h GLU 475 Ca -0.07 -0.03 -0.35 0.00 -0.13 0.00 0.00 59.36 58.78 2x90 h GLU 475 Cb 0.62 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.87 2x90 h GLU 475 CO 0.12 0.29 -1.96 0.66 -0.73 0.00 0.00 179.01 177.39 2x90 n TYR 476 N -4.96 0.94 -0.01 0.92 4.01 -0.15 -4.62 117.16 113.28 2x90 n TYR 476 Ca 0.09 0.24 0.10 0.00 -0.16 0.00 0.00 57.90 58.17 2x90 n TYR 476 Cb 0.26 -1.12 -0.16 0.00 -0.31 0.00 0.00 39.34 38.02 2x90 n TYR 476 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2x90 n SER 477 N -3.69 0.25 -2.17 7.72 7.64 -0.68 -4.85 113.62 117.84 2x90 n SER 477 Ca -0.36 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.37 2x90 n SER 477 Cb 0.96 1.94 0.03 0.00 -1.01 0.00 0.00 64.21 66.12 2x90 n SER 477 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2x90 n GLY 478 N 1.33 -0.09 3.46 0.23 0.00 -0.45 -4.96 105.19 104.71 2x90 n GLY 478 Ca -0.04 -0.16 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 2x90 n GLY 478 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2x90 s ILE 479 N -3.02 2.13 0.09 -0.61 -5.25 -1.23 -1.13 121.20 112.18 2x90 s ILE 479 Ca 0.24 -2.27 -0.12 0.00 -0.99 0.00 0.00 60.65 57.51 2x90 s ILE 479 Cb -0.11 -2.37 0.02 0.00 2.95 0.00 0.00 42.46 42.95 2x90 s ILE 479 CO 0.30 -0.37 0.29 -1.83 -1.79 0.00 0.00 174.94 171.54 2x90 s GLU 480 N -3.60 0.91 0.75 0.37 -1.05 -0.67 -3.69 118.70 111.73 2x90 s GLU 480 Ca 0.29 -0.75 -0.15 0.00 -0.15 0.00 0.00 54.97 54.21 2x90 s GLU 480 Cb -0.01 0.39 0.04 0.00 -0.44 0.00 0.00 34.13 34.11 2x90 s GLU 480 CO 0.13 -0.31 1.13 -2.30 0.95 0.00 0.00 175.26 174.86 2x90 n PRO 481 N 0.06 0.45 0.24 -4.83 -0.02 -1.26 -1.10 135.00 128.54 2x90 n PRO 481 Ca -0.16 0.22 0.13 0.00 -2.02 0.00 0.00 63.50 61.67 2x90 n PRO 481 Cb 0.62 -2.37 0.48 0.00 -0.02 0.00 0.00 33.50 32.21 2x90 n PRO 481 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2x90 h PRO 482 N -0.44 0.00 -5.32 0.52 0.13 -1.95 -3.43 132.00 121.50 2x90 h PRO 482 Ca -0.47 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.26 2x90 h PRO 482 Cb 1.32 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.30 2x90 h PRO 482 CO 0.47 0.11 -0.72 0.14 -0.23 0.00 0.00 178.00 177.78 2x90 s VAL 483 N -3.55 1.46 0.05 1.56 -7.23 -1.26 -5.08 120.40 106.34 2x90 s VAL 483 Ca 0.02 -2.14 -0.31 0.00 -1.81 0.00 0.00 61.98 57.75 2x90 s VAL 483 Cb 0.09 -1.97 -0.07 0.00 0.56 0.00 0.00 36.38 34.98 2x90 s VAL 483 CO 0.61 -0.65 1.57 -0.69 -0.31 0.00 0.00 175.10 175.63 2x90 s VAL 484 N -3.15 3.24 0.39 1.32 1.01 -1.26 -4.91 120.40 117.05 2x90 s VAL 484 Ca 0.20 0.67 0.08 0.00 0.00 0.00 0.00 61.98 62.93 2x90 s VAL 484 Cb 0.01 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 2x90 s VAL 484 CO 0.04 -0.00 0.30 -0.13 0.00 0.00 0.00 175.10 175.31 2x90 s ARG 485 N 2.56 2.48 0.10 2.72 1.81 0.14 -5.00 118.95 123.77 2x90 s ARG 485 Ca 0.71 -1.56 -0.01 0.00 -1.72 0.00 0.00 55.73 53.15 2x90 s ARG 485 Cb -0.37 -2.29 0.01 0.00 -0.45 0.00 0.00 34.95 31.84 2x90 s ARG 485 CO 0.30 -0.10 0.16 -1.13 -0.68 0.00 0.00 175.30 173.85 2x90 n SER 486 N -1.41 -0.44 0.00 0.23 3.41 -1.26 -0.71 113.62 113.44 2x90 n SER 486 Ca 0.01 -1.52 0.11 0.00 -0.26 0.00 0.00 58.87 57.21 2x90 n SER 486 Cb 0.62 0.79 0.60 0.00 -0.26 0.00 0.00 64.21 65.96 2x90 n SER 486 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2x90 n GLU 487 N -0.16 0.48 0.21 4.33 -0.58 -1.25 -1.95 120.64 121.73 2x90 n GLU 487 Ca -0.00 0.05 0.11 0.00 -0.42 0.00 0.00 57.16 56.89 2x90 n GLU 487 Cb 0.17 -1.50 0.27 0.00 -0.57 0.00 0.00 31.44 29.81 2x90 n GLU 487 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2x90 h LYS 488 N 0.00 0.00 -6.41 3.49 1.57 -1.95 -3.45 116.57 109.82 2x90 h LYS 488 Ca 0.00 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.33 2x90 h LYS 488 Cb 0.11 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.43 2x90 h LYS 488 CO 0.00 0.14 -0.28 -0.51 -0.57 0.00 0.00 179.45 178.22 2x90 s ASP 489 N -6.17 6.04 -0.29 0.86 1.11 -0.82 -5.03 116.67 112.37 2x90 s ASP 489 Ca 0.04 0.05 -0.01 0.00 0.18 0.00 0.00 52.55 52.81 2x90 s ASP 489 Cb 0.07 -1.52 0.13 0.00 1.07 0.00 0.00 42.92 42.67 2x90 s ASP 489 CO 0.66 -0.41 0.27 0.12 1.18 0.00 0.00 175.17 176.99 2x90 s PHE 490 N -2.24 -0.35 -0.12 4.23 5.36 -1.26 -4.74 117.98 118.87 2x90 s PHE 490 Ca 0.43 -0.28 0.21 0.00 -0.96 0.00 0.00 56.93 56.33 2x90 s PHE 490 Cb -0.10 -0.53 -0.21 0.00 -0.34 0.00 0.00 43.02 41.84 2x90 s PHE 490 CO 0.33 -0.91 0.63 -0.25 -1.46 0.00 0.00 175.22 173.56 2x90 n ASP 491 N 5.30 0.34 -0.16 6.13 8.00 -1.26 -0.80 116.55 134.10 2x90 n ASP 491 Ca -0.03 0.14 -0.02 0.00 0.71 0.00 0.00 54.79 55.59 2x90 n ASP 491 Cb 0.46 1.23 0.06 0.00 -0.02 0.00 0.00 41.12 42.85 2x90 n ASP 491 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2x90 h ALA 492 N 1.81 0.54 0.00 2.24 0.00 -1.94 -1.96 119.26 119.95 2x90 h ALA 492 Ca -0.08 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2x90 h ALA 492 Cb 1.22 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2x90 h ALA 492 CO 0.01 -0.32 0.00 -2.30 0.00 0.00 0.00 179.25 176.64 2x90 n PRO 493 N -5.12 0.13 0.06 0.00 -0.02 -1.26 -2.02 135.00 126.76 2x90 n PRO 493 Ca 0.05 0.20 0.07 0.00 -2.02 0.00 0.00 63.50 61.80 2x90 n PRO 493 Cb 0.24 -1.50 0.31 0.00 -0.02 0.00 0.00 33.50 32.54 2x90 n PRO 493 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2x90 n ALA 494 N -1.30 1.38 -2.69 3.55 0.00 -0.74 -4.03 120.51 116.68 2x90 n ALA 494 Ca 0.04 0.03 -0.37 0.00 0.00 0.00 0.00 53.44 53.15 2x90 n ALA 494 Cb 0.08 -1.22 -0.08 0.00 0.00 0.00 0.00 19.45 18.24 2x90 n ALA 494 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2x90 s LYS 495 N -3.16 4.19 0.20 0.00 2.47 -0.85 -4.91 119.74 117.68 2x90 s LYS 495 Ca 0.03 0.06 -0.19 0.00 -1.56 0.00 0.00 55.97 54.32 2x90 s LYS 495 Cb 0.06 -3.49 0.18 0.00 -1.46 0.00 0.00 37.83 33.12 2x90 s LYS 495 CO 0.21 0.11 1.58 -0.92 0.16 0.00 0.00 175.35 176.49 2x90 h TYR 496 N 7.08 -0.88 -0.00 4.03 3.20 -1.89 -0.84 116.97 127.67 2x90 h TYR 496 Ca -0.39 0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.56 2x90 h TYR 496 Cb 1.16 0.49 -0.00 0.00 1.54 0.00 0.00 36.73 39.92 2x90 h TYR 496 CO 0.64 -0.38 0.00 0.45 -1.64 0.00 0.00 178.16 177.23 2x90 h HIS 497 N -0.11 0.00 -0.04 -3.82 3.86 -1.92 0.19 115.15 113.31 2x90 h HIS 497 Ca 0.28 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.35 2x90 h HIS 497 Cb 0.56 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.04 2x90 h HIS 497 CO -0.68 0.00 -0.50 0.82 0.86 0.00 0.00 177.93 178.43 2x90 h ILE 498 N 0.00 1.42 -0.53 2.45 2.04 -1.43 0.74 117.51 122.20 2x90 h ILE 498 Ca 0.00 -1.93 -0.05 0.00 1.00 0.00 0.00 64.86 63.88 2x90 h ILE 498 Cb 0.00 2.44 -0.02 0.00 -0.74 0.00 0.00 36.82 38.49 2x90 h ILE 498 CO -0.00 0.56 0.13 0.28 0.00 0.00 0.00 178.15 179.12 2x90 h SER 499 N -0.07 0.75 -0.23 1.72 0.02 -0.98 -3.17 113.55 111.59 2x90 h SER 499 Ca -0.05 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 2x90 h SER 499 Cb 1.18 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.53 2x90 h SER 499 CO 0.10 0.74 0.00 0.00 -1.14 0.00 0.00 176.83 176.53 2x90 n ALA 500 N -2.46 2.48 -3.57 3.77 0.00 0.61 -3.85 120.51 117.49 2x90 n ALA 500 Ca 0.04 -0.69 -0.23 0.00 0.00 0.00 0.00 53.44 52.56 2x90 n ALA 500 Cb 0.22 -1.00 0.05 0.00 0.00 0.00 0.00 19.45 18.72 2x90 n ALA 500 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2x90 n ASP 501 N 0.76 -4.11 -4.27 0.00 4.64 -0.59 -4.99 116.55 107.99 2x90 n ASP 501 Ca 0.17 -0.86 -0.34 0.00 -1.38 0.00 0.00 54.79 52.38 2x90 n ASP 501 Cb 0.44 -4.12 -0.14 0.00 -1.04 0.00 0.00 41.12 36.25 2x90 n ASP 501 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 2x90 s VAL 502 N -3.52 3.05 0.33 5.18 1.01 0.15 -5.05 120.40 121.55 2x90 s VAL 502 Ca 0.29 -0.61 -0.28 0.00 0.00 0.00 0.00 61.98 61.38 2x90 s VAL 502 Cb -0.08 -2.36 -0.12 0.00 0.00 0.00 0.00 36.38 33.82 2x90 s VAL 502 CO 0.81 0.46 1.32 1.21 0.00 0.00 0.00 175.10 178.90 2x90 n GLU 503 N 4.64 2.17 -0.01 2.72 0.00 -1.26 -4.65 120.64 124.25 2x90 n GLU 503 Ca -0.19 0.76 0.08 0.00 0.00 0.00 0.00 57.16 57.81 2x90 n GLU 503 Cb 0.51 -2.37 -0.11 0.00 0.00 0.00 0.00 31.44 29.47 2x90 n GLU 503 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.13 178.11 2x90 n TYR 504 N 0.53 0.00 0.04 4.31 9.36 -1.26 -4.53 117.16 125.61 2x90 n TYR 504 Ca 0.05 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.40 2x90 n TYR 504 Cb 0.36 -0.29 0.58 0.00 -0.63 0.00 0.00 39.34 39.36 2x90 n TYR 504 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 2x90 h LEU 505 N 0.00 0.18 -1.51 2.98 5.85 -1.92 0.08 115.31 120.96 2x90 h LEU 505 Ca 0.00 0.00 0.32 0.00 0.84 0.00 0.00 57.88 59.04 2x90 h LEU 505 Cb 0.64 -0.04 -0.09 0.00 0.37 0.00 0.00 40.66 41.54 2x90 h LEU 505 CO 0.00 0.11 0.75 0.08 -0.34 0.00 0.00 178.44 179.04 2x90 h ARG 506 N 0.20 0.24 0.09 1.25 0.11 -1.89 -0.29 114.38 114.09 2x90 h ARG 506 Ca 0.18 -0.01 -0.26 0.00 0.10 0.00 0.00 59.98 59.99 2x90 h ARG 506 Cb 0.47 -0.05 0.00 0.00 1.11 0.00 0.00 29.97 31.50 2x90 h ARG 506 CO -0.03 0.16 -1.15 1.88 0.10 0.00 0.00 179.97 180.93 2x90 h TYR 507 N 0.25 0.51 -0.17 4.08 0.05 -1.29 -0.54 116.97 119.86 2x90 h TYR 507 Ca 0.64 -0.34 -0.01 0.00 0.05 0.00 0.00 58.73 59.06 2x90 h TYR 507 Cb 1.90 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 39.60 2x90 h TYR 507 CO -0.00 1.23 0.06 1.25 -1.05 0.00 0.00 178.16 179.65 2x90 h LEU 508 N 0.11 0.24 -0.12 3.88 5.85 -1.23 -1.29 115.31 122.75 2x90 h LEU 508 Ca -0.12 -0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.45 2x90 h LEU 508 Cb 1.85 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.79 2x90 h LEU 508 CO 0.19 0.36 -0.04 0.58 -0.34 0.00 0.00 178.44 179.19 2x90 h VAL 509 N 0.11 0.86 -0.33 1.05 2.07 -1.14 -2.75 116.25 116.13 2x90 h VAL 509 Ca 0.06 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.65 2x90 h VAL 509 Cb 0.20 0.86 -0.07 0.00 -1.52 0.00 0.00 31.29 30.76 2x90 h VAL 509 CO -0.00 0.00 -0.13 -1.28 0.02 0.00 0.00 177.57 176.18 2x90 h SER 510 N -0.01 -0.45 0.32 0.57 0.87 -1.00 0.51 113.55 114.36 2x90 h SER 510 Ca 0.06 0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.72 2x90 h SER 510 Cb 0.10 0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.32 2x90 h SER 510 CO -0.13 -0.17 -0.10 -0.26 -0.53 0.00 0.00 176.83 175.64 2x90 h PHE 511 N -0.07 0.00 0.03 2.24 0.05 -1.05 0.24 116.94 118.37 2x90 h PHE 511 Ca 0.16 0.00 -0.00 0.00 3.82 0.00 0.00 57.97 61.95 2x90 h PHE 511 Cb 0.32 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.27 2x90 h PHE 511 CO -0.35 0.10 -0.01 0.82 -0.18 0.00 0.00 178.31 178.69 2x90 h ILE 512 N 0.00 0.72 0.00 -0.55 2.04 -1.14 -3.40 117.51 115.19 2x90 h ILE 512 Ca -0.00 -1.48 -0.04 0.00 1.00 0.00 0.00 64.86 64.34 2x90 h ILE 512 Cb 0.29 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 2x90 h ILE 512 CO 0.01 0.24 -0.18 0.16 0.00 0.00 0.00 178.15 178.38 2x90 h ILE 513 N -0.99 0.42 0.00 -0.67 3.07 -0.61 -2.91 117.51 115.81 2x90 h ILE 513 Ca -0.00 -1.08 -0.01 0.00 1.55 0.00 0.00 64.86 65.31 2x90 h ILE 513 Cb 0.42 1.80 -0.00 0.00 -0.27 0.00 0.00 36.82 38.77 2x90 h ILE 513 CO 0.01 0.18 -0.03 0.06 -1.05 0.00 0.00 178.15 177.31 2x90 h GLN 514 N 0.00 0.00 0.01 0.16 3.07 -0.74 -0.67 115.11 116.93 2x90 h GLN 514 Ca -0.00 0.00 -0.19 0.00 0.09 0.00 0.00 58.65 58.55 2x90 h GLN 514 Cb 0.78 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.32 2x90 h GLN 514 CO 0.02 0.03 -0.89 0.74 0.09 0.00 0.00 178.83 178.83 2x90 h PHE 515 N 0.00 0.08 -0.15 0.06 0.04 -1.72 0.84 116.94 116.08 2x90 h PHE 515 Ca -0.00 -0.05 -0.01 0.00 2.80 0.00 0.00 57.97 60.72 2x90 h PHE 515 Cb 0.06 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.20 2x90 h PHE 515 CO 0.00 0.91 0.07 1.96 -0.60 0.00 0.00 178.31 180.65 2x90 h GLN 516 N 0.02 0.22 -0.26 1.51 4.20 -1.36 -0.88 115.11 118.56 2x90 h GLN 516 Ca -0.02 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 2x90 h GLN 516 Cb 1.56 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 29.29 2x90 h GLN 516 CO 0.12 0.29 0.14 0.74 -0.67 0.00 0.00 178.83 179.45 2x90 h PHE 517 N 0.10 0.37 -0.23 2.96 0.05 -1.12 -2.52 116.94 116.55 2x90 h PHE 517 Ca 0.05 -0.01 -0.01 0.00 3.82 0.00 0.00 57.97 61.82 2x90 h PHE 517 Cb 0.15 -0.12 -0.01 0.00 2.00 0.00 0.00 35.95 37.97 2x90 h PHE 517 CO -0.02 0.32 0.10 -0.92 -0.18 0.00 0.00 178.31 177.61 2x90 h TYR 518 N 0.31 0.33 -0.49 -0.55 3.20 -0.80 0.48 116.97 119.45 2x90 h TYR 518 Ca 0.09 -0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.97 2x90 h TYR 518 Cb 0.08 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.21 2x90 h TYR 518 CO -0.03 0.34 0.28 -0.22 -1.64 0.00 0.00 178.16 176.89 2x90 h LYS 519 N 0.23 0.53 -0.27 1.82 3.64 -1.17 0.19 116.57 121.54 2x90 h LYS 519 Ca 0.08 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 2x90 h LYS 519 Cb 0.14 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2x90 h LYS 519 CO -0.01 0.35 -0.04 0.77 -2.27 0.00 0.00 179.45 178.26 2x90 h SER 520 N 0.55 0.51 -0.94 4.20 0.02 -1.27 -1.59 113.55 115.02 2x90 h SER 520 Ca 0.20 -0.34 0.00 0.00 -0.84 0.00 0.00 61.79 60.81 2x90 h SER 520 Cb 0.06 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.41 2x90 h SER 520 CO -0.11 0.73 0.60 0.00 -1.14 0.00 0.00 176.83 176.91 2x90 h ALA 521 N 0.79 1.20 -0.67 3.77 0.00 -0.74 -0.82 119.26 122.79 2x90 h ALA 521 Ca 0.07 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2x90 h ALA 521 Cb 0.49 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2x90 h ALA 521 CO 0.02 0.62 0.12 0.00 0.00 0.00 0.00 179.25 180.01 2x90 h ILE 523 N 1.03 1.22 -0.27 0.00 2.04 -0.96 0.28 117.51 120.86 2x90 h ILE 523 Ca 0.21 -0.74 -0.02 0.00 1.00 0.00 0.00 64.86 65.30 2x90 h ILE 523 Cb 0.43 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.67 2x90 h ILE 523 CO 0.01 0.24 0.06 0.11 0.00 0.00 0.00 178.15 178.58 2x90 h LYS 524 N 0.28 0.38 0.00 2.37 1.57 -1.03 -1.74 116.57 118.41 2x90 h LYS 524 Ca 0.09 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2x90 h LYS 524 Cb 0.31 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.55 2x90 h LYS 524 CO 0.00 0.36 0.00 0.00 -0.57 0.00 0.00 179.45 179.24 2x90 n ALA 525 N -2.49 2.39 -1.64 3.86 0.00 -0.09 -4.70 120.51 117.85 2x90 n ALA 525 Ca 0.01 -0.12 -0.09 0.00 0.00 0.00 0.00 53.44 53.24 2x90 n ALA 525 Cb 0.16 -1.47 -0.02 0.00 0.00 0.00 0.00 19.45 18.11 2x90 n ALA 525 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x90 n GLY 526 N 1.34 0.62 0.00 0.00 0.00 -0.66 -4.92 105.19 101.57 2x90 n GLY 526 Ca 0.11 -0.58 0.10 0.00 0.00 0.00 0.00 46.02 45.64 2x90 n GLY 526 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2x90 n GLN 527 N -2.37 0.39 -4.04 1.61 1.13 0.95 -4.90 117.38 110.16 2x90 n GLN 527 Ca -0.10 -0.05 -0.22 0.00 -1.94 0.00 0.00 57.00 54.69 2x90 n GLN 527 Cb 0.41 -1.47 -0.17 0.00 0.11 0.00 0.00 30.24 29.13 2x90 n GLN 527 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 2x90 s TYR 528 N -3.06 0.85 -0.09 1.08 5.04 -0.98 -4.52 117.35 115.67 2x90 s TYR 528 Ca 0.03 -0.27 -0.03 0.00 -2.44 0.00 0.00 57.07 54.36 2x90 s TYR 528 Cb 0.15 -0.79 0.04 0.00 0.35 0.00 0.00 41.96 41.71 2x90 s TYR 528 CO 0.84 -0.27 0.06 0.34 -1.34 0.00 0.00 175.55 175.18 2x90 s ASP 529 N 1.31 1.66 0.61 4.32 3.68 -1.09 -4.43 116.67 122.73 2x90 s ASP 529 Ca -0.05 -0.20 0.40 0.00 2.13 0.00 0.00 52.55 54.83 2x90 s ASP 529 Cb -0.14 -0.23 2.06 0.00 -1.45 0.00 0.00 42.92 43.16 2x90 s ASP 529 CO -0.02 -0.28 2.22 1.55 0.13 0.00 0.00 175.17 178.77 2x90 h PRO 530 N 8.41 0.00 -0.66 4.34 0.13 -1.99 -1.67 132.00 140.55 2x90 h PRO 530 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 2x90 h PRO 530 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2x90 h PRO 530 CO 0.22 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 177.74 2x90 n ASP 531 N -3.02 3.83 -4.01 1.44 8.00 -1.26 -4.84 116.55 116.69 2x90 n ASP 531 Ca -0.02 -2.00 -0.31 0.00 0.71 0.00 0.00 54.79 53.17 2x90 n ASP 531 Cb 0.13 -0.44 -0.16 0.00 -0.02 0.00 0.00 41.12 40.64 2x90 n ASP 531 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2x90 s ASN 532 N -1.10 3.87 0.60 -2.24 3.84 -0.63 -5.00 114.94 114.27 2x90 s ASN 532 Ca 0.47 -1.13 0.33 0.00 0.21 0.00 0.00 52.86 52.74 2x90 s ASN 532 Cb 0.25 -1.33 1.92 0.00 -0.55 0.00 0.00 41.25 41.54 2x90 s ASN 532 CO 0.33 -0.18 2.26 1.62 -2.79 0.00 0.00 177.10 178.34 2x90 h VAL 533 N 6.58 0.39 -0.00 -5.21 3.04 -1.88 -1.34 116.25 117.83 2x90 h VAL 533 Ca -0.23 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.38 2x90 h VAL 533 Cb 1.07 1.06 0.00 0.00 -2.01 0.00 0.00 31.29 31.41 2x90 h VAL 533 CO 0.46 0.02 -0.21 -0.62 -1.01 0.00 0.00 177.57 176.20 2x90 n GLU 534 N -3.62 0.47 -3.17 4.17 -0.58 -1.26 -4.30 120.64 112.35 2x90 n GLU 534 Ca -0.03 -0.20 -0.25 0.00 -0.42 0.00 0.00 57.16 56.26 2x90 n GLU 534 Cb 0.10 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.42 2x90 n GLU 534 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2x90 n LEU 535 N -1.09 3.27 -4.83 -4.62 4.77 -0.50 -5.09 117.00 108.91 2x90 n LEU 535 Ca 0.11 -5.40 -0.33 0.00 -0.03 0.00 0.00 56.01 50.36 2x90 n LEU 535 Cb 0.31 -0.29 -0.06 0.00 -2.33 0.00 0.00 43.42 41.05 2x90 n LEU 535 CO 0.27 2.21 0.64 -2.16 -1.33 0.00 0.00 177.39 177.02 2x90 s PRO 536 N -2.73 4.13 0.30 3.23 0.04 -1.26 -2.67 135.00 136.05 2x90 s PRO 536 Ca 0.43 1.04 -0.01 0.00 0.04 0.00 0.00 61.00 62.50 2x90 s PRO 536 Cb 0.23 -2.19 0.47 0.00 0.04 0.00 0.00 34.50 33.06 2x90 s PRO 536 CO -0.08 -0.08 1.93 1.25 0.04 0.00 0.00 177.00 180.05 2x90 h LEU 537 N 1.66 0.83 0.00 -3.56 5.85 -1.92 -2.45 115.31 115.72 2x90 h LEU 537 Ca -0.48 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.17 2x90 h LEU 537 Cb 1.18 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.00 2x90 h LEU 537 CO 0.61 0.68 0.00 -0.90 -0.34 0.00 0.00 178.44 178.49 2x90 n ASP 538 N -4.37 0.00 -0.36 1.25 5.75 -1.26 -2.56 116.55 115.01 2x90 n ASP 538 Ca 0.07 -0.87 0.06 0.00 -0.01 0.00 0.00 54.79 54.04 2x90 n ASP 538 Cb 0.10 0.00 0.10 0.00 -1.03 0.00 0.00 41.12 40.29 2x90 n ASP 538 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 2x90 n ASN 539 N -0.94 1.52 -4.72 -1.12 5.15 -0.93 -4.82 115.26 109.40 2x90 n ASN 539 Ca 0.17 -2.82 -0.42 0.00 -0.60 0.00 0.00 54.58 50.91 2x90 n ASN 539 Cb 0.08 -0.37 -0.03 0.00 -0.53 0.00 0.00 39.78 38.92 2x90 n ASN 539 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2x90 s ASP 541 N 0.70 3.73 0.00 0.00 3.68 -1.26 -4.50 116.67 119.01 2x90 s ASP 541 Ca 0.53 -0.95 0.15 0.00 2.13 0.00 0.00 52.55 54.41 2x90 s ASP 541 Cb -0.26 -1.52 0.45 0.00 -1.45 0.00 0.00 42.92 40.14 2x90 s ASP 541 CO 0.30 -0.08 1.36 2.30 0.13 0.00 0.00 175.17 179.18 2x90 n ILE 542 N 4.55 0.49 -1.69 4.11 -5.35 -1.26 -4.93 119.36 115.28 2x90 n ILE 542 Ca -0.18 -0.53 -0.44 0.00 -0.27 0.00 0.00 62.75 61.33 2x90 n ILE 542 Cb 0.47 0.33 -0.02 0.00 -1.74 0.00 0.00 39.64 38.68 2x90 n ILE 542 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2x90 n TYR 543 N 0.69 2.30 -0.96 4.28 9.36 -1.26 -2.13 117.16 129.44 2x90 n TYR 543 Ca 0.15 0.41 0.00 0.00 3.32 0.00 0.00 57.90 61.78 2x90 n TYR 543 Cb 0.36 -2.48 0.00 0.00 -0.63 0.00 0.00 39.34 36.59 2x90 n TYR 543 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2x90 n GLY 544 N 2.03 0.65 3.49 2.98 0.00 -1.24 -4.99 105.19 108.11 2x90 n GLY 544 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 2x90 n GLY 544 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2x90 s SER 545 N -2.46 6.29 0.33 1.61 0.15 -0.91 -4.73 113.70 113.99 2x90 s SER 545 Ca 0.00 -0.56 0.10 0.00 0.70 0.00 0.00 55.95 56.18 2x90 s SER 545 Cb 0.00 -2.34 0.58 0.00 -1.71 0.00 0.00 66.02 62.55 2x90 s SER 545 CO 0.00 -0.96 1.76 0.00 1.20 0.00 0.00 173.24 175.25 2x90 h ALA 546 N 9.05 1.25 -0.49 5.45 0.00 -1.78 -2.19 119.26 130.54 2x90 h ALA 546 Ca -0.26 -0.38 -0.12 0.00 0.00 0.00 0.00 54.91 54.15 2x90 h ALA 546 Cb 1.09 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2x90 h ALA 546 CO 0.98 0.53 -0.16 0.00 0.00 0.00 0.00 179.25 180.61 2x90 h ALA 547 N 1.50 0.69 -0.44 0.00 0.00 -1.88 0.68 119.26 119.80 2x90 h ALA 547 Ca 0.01 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 2x90 h ALA 547 Cb 0.74 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2x90 h ALA 547 CO 0.06 0.63 -0.05 0.00 0.00 0.00 0.00 179.25 179.88 2x90 h ALA 548 N 0.88 0.60 -0.64 0.00 0.00 -1.80 -3.03 119.26 115.28 2x90 h ALA 548 Ca 0.12 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2x90 h ALA 548 Cb 0.73 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 2x90 h ALA 548 CO 0.06 0.45 0.38 0.78 0.00 0.00 0.00 179.25 180.91 2x90 h GLY 549 N 0.65 0.93 1.01 0.00 0.00 -1.20 -2.48 103.07 101.98 2x90 h GLY 549 Ca 0.12 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.05 2x90 h GLY 549 CO 0.03 0.37 0.38 0.00 0.00 0.00 0.00 176.54 177.33 2x90 h ALA 550 N 1.53 0.93 -0.45 3.60 0.00 -0.77 0.14 119.26 124.24 2x90 h ALA 550 Ca 0.23 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2x90 h ALA 550 Cb -0.02 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 2x90 h ALA 550 CO -0.04 0.46 0.23 0.00 0.00 0.00 0.00 179.25 179.91 2x90 h ALA 551 N 1.19 0.58 -0.50 0.00 0.00 -1.37 -0.51 119.26 118.65 2x90 h ALA 551 Ca 0.25 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2x90 h ALA 551 Cb 0.07 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 2x90 h ALA 551 CO -0.04 0.12 0.31 0.74 0.00 0.00 0.00 179.25 180.38 2x90 h PHE 552 N 0.59 0.65 -0.26 0.00 0.04 -1.08 -2.13 116.94 114.75 2x90 h PHE 552 Ca 0.16 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.95 2x90 h PHE 552 Cb 0.08 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 37.99 2x90 h PHE 552 CO -0.02 0.45 0.10 1.25 -0.60 0.00 0.00 178.31 179.49 2x90 h HIS 553 N 0.67 0.18 -0.86 -0.55 2.76 -0.49 0.19 115.15 117.05 2x90 h HIS 553 Ca 0.18 0.01 0.07 0.00 -2.20 0.00 0.00 60.37 58.43 2x90 h HIS 553 Cb -0.02 -0.04 -0.06 0.00 1.55 0.00 0.00 27.41 28.83 2x90 h HIS 553 CO -0.03 0.09 0.53 -0.91 -1.30 0.00 0.00 177.93 176.31 2x90 h ASN 554 N 0.22 0.83 0.00 3.26 2.35 -0.90 -2.13 115.58 119.20 2x90 h ASN 554 Ca 0.11 0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.88 2x90 h ASN 554 Cb 0.07 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.29 2x90 h ASN 554 CO -0.11 0.52 -0.03 -0.03 -1.65 0.00 0.00 177.43 176.13 2x90 h MET 555 N 0.96 0.00 -0.19 0.81 4.05 -1.15 -3.38 114.93 116.03 2x90 h MET 555 Ca 0.38 0.00 -0.09 0.00 -0.28 0.00 0.00 59.70 59.71 2x90 h MET 555 Cb 0.20 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 30.99 2x90 h MET 555 CO -0.18 0.88 -0.27 -0.07 0.23 0.00 0.00 176.91 177.50 2x90 h LEU 556 N -1.00 0.35 -2.27 3.39 3.38 -0.62 -2.67 115.31 115.87 2x90 h LEU 556 Ca -0.01 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 2x90 h LEU 556 Cb 0.89 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.54 2x90 h LEU 556 CO -0.00 0.62 -0.01 0.77 0.09 0.00 0.00 178.44 179.90 2x90 h SER 557 N 0.31 0.00 0.55 -0.43 4.64 -1.55 -2.16 113.55 114.92 2x90 h SER 557 Ca 0.05 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.29 2x90 h SER 557 Cb 0.64 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.72 2x90 h SER 557 CO 0.05 0.01 -0.38 0.24 -0.87 0.00 0.00 176.83 175.88 2x90 h MET 558 N 0.00 0.00 0.00 4.77 2.86 -1.65 -3.41 114.93 117.50 2x90 h MET 558 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2x90 h MET 558 Cb 0.24 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.90 2x90 h MET 558 CO 0.00 0.38 0.00 0.41 1.06 0.00 0.00 176.91 178.76 2x90 n GLY 559 N -0.17 3.15 1.67 8.32 0.00 -0.81 -1.66 105.19 115.69 2x90 n GLY 559 Ca -0.01 -0.05 -0.05 0.00 0.00 0.00 0.00 46.02 45.91 2x90 n GLY 559 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x90 n ALA 560 N 9.81 4.36 0.29 4.61 0.00 -0.43 -3.35 120.51 135.80 2x90 n ALA 560 Ca 0.00 -2.55 0.18 0.00 0.00 0.00 0.00 53.44 51.07 2x90 n ALA 560 Cb 0.00 -1.08 0.84 0.00 0.00 0.00 0.00 19.45 19.21 2x90 n ALA 560 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2x90 h SER 561 N 2.03 0.00 -4.96 0.00 4.64 -1.53 -3.44 113.55 110.29 2x90 h SER 561 Ca 0.25 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.39 2x90 h SER 561 Cb 2.11 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 64.01 2x90 h SER 561 CO 0.62 0.02 -0.70 -0.54 -0.87 0.00 0.00 176.83 175.36 2x90 s LYS 562 N -3.85 0.48 0.53 4.77 -0.14 -1.26 -4.99 119.74 115.28 2x90 s LYS 562 Ca -0.01 -0.86 -0.21 0.00 -1.36 0.00 0.00 55.97 53.53 2x90 s LYS 562 Cb 0.10 0.02 -0.07 0.00 -1.68 0.00 0.00 37.83 36.20 2x90 s LYS 562 CO 0.51 -0.04 1.00 -2.30 -0.76 0.00 0.00 175.35 173.76 2x90 n PRO 563 N 1.04 1.13 0.10 -1.68 -0.02 -1.26 -4.75 135.00 129.56 2x90 n PRO 563 Ca -0.20 0.42 0.14 0.00 -2.02 0.00 0.00 63.50 61.84 2x90 n PRO 563 Cb 0.57 -2.15 0.64 0.00 -0.02 0.00 0.00 33.50 32.55 2x90 n PRO 563 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 2x90 h TRP 564 N 0.94 0.06 0.00 6.00 5.08 -1.92 -0.24 115.95 125.87 2x90 h TRP 564 Ca -0.47 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 59.48 2x90 h TRP 564 Cb 1.35 -0.02 -0.00 0.00 -3.00 0.00 0.00 29.16 27.49 2x90 h TRP 564 CO 0.40 0.03 -0.09 -1.35 -1.28 0.00 0.00 178.44 176.15 2x90 h PRO 565 N 0.05 0.00 -0.08 0.12 0.11 -1.90 -0.24 132.00 130.07 2x90 h PRO 565 Ca 0.14 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.12 2x90 h PRO 565 Cb 0.50 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.60 2x90 h PRO 565 CO -0.01 0.09 -0.56 -0.44 -0.21 0.00 0.00 178.00 176.87 2x90 h ASP 566 N 0.00 0.27 -0.22 -2.05 3.45 -1.37 -1.36 116.42 115.14 2x90 h ASP 566 Ca -0.00 -0.15 -0.10 0.00 0.43 0.00 0.00 57.03 57.21 2x90 h ASP 566 Cb 0.18 -0.08 -0.00 0.00 -0.56 0.00 0.00 39.33 38.87 2x90 h ASP 566 CO 0.01 0.78 -0.25 0.00 -1.57 0.00 0.00 179.24 178.20 2x90 h ALA 567 N 1.23 0.33 -0.70 3.45 0.00 -1.20 -2.04 119.26 120.34 2x90 h ALA 567 Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2x90 h ALA 567 Cb 1.04 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 2x90 h ALA 567 CO 0.09 0.31 0.45 1.25 0.00 0.00 0.00 179.25 181.35 2x90 h LEU 568 N 0.24 0.81 -1.21 0.00 5.85 -1.09 -2.57 115.31 117.34 2x90 h LEU 568 Ca 0.03 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.75 2x90 h LEU 568 Cb 0.82 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.60 2x90 h LEU 568 CO 0.06 0.59 0.54 -0.08 -0.34 0.00 0.00 178.44 179.22 2x90 h GLU 569 N 0.94 1.01 -0.06 1.25 4.81 0.08 -1.30 114.58 121.31 2x90 h GLU 569 Ca 0.25 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.38 2x90 h GLU 569 Cb -0.09 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.05 2x90 h GLU 569 CO -0.05 0.67 -0.15 0.00 -0.73 0.00 0.00 179.01 178.75 2x90 h ALA 570 N 1.51 1.63 0.13 2.92 0.00 -0.98 0.12 119.26 124.59 2x90 h ALA 570 Ca 0.32 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2x90 h ALA 570 Cb -0.01 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2x90 h ALA 570 CO -0.09 0.27 -0.06 0.35 0.00 0.00 0.00 179.25 179.72 2x90 h PHE 571 N 0.10 -0.16 0.00 0.00 3.57 -0.96 -3.41 116.94 116.07 2x90 h PHE 571 Ca 0.02 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2x90 h PHE 571 Cb 0.33 0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.12 2x90 h PHE 571 CO 0.00 0.20 -0.02 0.27 -2.23 0.00 0.00 178.31 176.53 2x90 n ASN 572 N -4.87 0.16 0.00 0.41 0.23 -0.72 -4.83 115.26 105.65 2x90 n ASN 572 Ca -0.06 -1.12 0.00 0.00 -0.53 0.00 0.00 54.58 52.87 2x90 n ASN 572 Cb 0.21 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 37.90 2x90 n ASN 572 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2x90 n GLY 573 N -0.04 0.99 3.94 4.83 0.00 0.41 -5.00 105.19 110.32 2x90 n GLY 573 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 2x90 n GLY 573 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2x90 s GLU 574 N -0.07 3.50 0.00 1.61 2.02 -1.26 -4.82 118.70 119.68 2x90 s GLU 574 Ca 0.00 -0.38 0.00 0.00 0.02 0.00 0.00 54.97 54.61 2x90 s GLU 574 Cb 0.00 -2.76 0.00 0.00 0.10 0.00 0.00 34.13 31.47 2x90 s GLU 574 CO 0.00 0.29 0.44 0.54 0.02 0.00 0.00 175.26 176.55 2x90 n ARG 575 N -1.28 0.07 -4.91 1.61 1.74 -1.26 -1.09 116.66 111.54 2x90 n ARG 575 Ca -0.05 -0.52 -0.30 0.00 -0.77 0.00 0.00 57.85 56.21 2x90 n ARG 575 Cb 0.55 -0.80 -0.17 0.00 -1.02 0.00 0.00 32.46 31.02 2x90 n ARG 575 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2x90 s ILE 576 N -0.17 1.75 0.05 0.55 1.01 -1.26 -4.69 121.20 118.44 2x90 s ILE 576 Ca 0.00 -0.83 -0.31 0.00 0.00 0.00 0.00 60.65 59.51 2x90 s ILE 576 Cb 0.00 -1.54 -0.07 0.00 0.01 0.00 0.00 42.46 40.85 2x90 s ILE 576 CO 0.00 0.49 1.55 -0.32 0.00 0.00 0.00 174.94 176.66 2x90 s MET 577 N 0.55 4.23 -0.03 2.79 -2.45 -1.26 -5.01 119.30 118.12 2x90 s MET 577 Ca -0.15 2.19 -0.03 0.00 -1.25 0.00 0.00 55.69 56.45 2x90 s MET 577 Cb -0.17 -3.55 0.01 0.00 1.25 0.00 0.00 34.83 32.37 2x90 s MET 577 CO 0.05 -0.66 0.08 0.45 1.05 0.00 0.00 175.02 176.00 2x90 s SER 578 N 2.11 -0.09 0.00 1.11 0.15 -1.26 -5.02 113.70 110.70 2x90 s SER 578 Ca 0.70 0.17 0.19 0.00 0.70 0.00 0.00 55.95 57.71 2x90 s SER 578 Cb -0.37 0.17 0.90 0.00 -1.71 0.00 0.00 66.02 65.01 2x90 s SER 578 CO 0.30 -0.03 1.61 0.61 1.20 0.00 0.00 173.24 176.93 2x90 n GLY 579 N 3.04 -0.38 0.12 9.45 0.00 -1.26 -4.26 105.19 111.90 2x90 n GLY 579 Ca -0.12 -0.26 -0.08 0.00 0.00 0.00 0.00 46.02 45.56 2x90 n GLY 579 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2x90 h LYS 580 N 1.05 0.16 -0.40 1.61 3.64 -1.96 -2.57 116.57 118.10 2x90 h LYS 580 Ca 0.00 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.32 2x90 h LYS 580 Cb 0.23 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 2x90 h LYS 580 CO 0.00 0.10 0.04 0.00 -2.27 0.00 0.00 179.45 177.32 2x90 h ALA 581 N 1.18 0.53 -0.59 5.00 0.00 -1.89 -0.96 119.26 122.53 2x90 h ALA 581 Ca 0.12 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 2x90 h ALA 581 Cb 0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2x90 h ALA 581 CO -0.15 0.27 0.06 0.97 0.00 0.00 0.00 179.25 180.41 2x90 h ILE 582 N 0.52 1.25 -0.19 0.00 2.10 -1.83 -1.52 117.51 117.84 2x90 h ILE 582 Ca 0.12 -1.02 -0.10 0.00 1.08 0.00 0.00 64.86 64.94 2x90 h ILE 582 Cb 0.41 0.73 -0.01 0.00 -1.09 0.00 0.00 36.82 36.86 2x90 h ILE 582 CO 0.01 0.37 -0.31 0.00 -1.08 0.00 0.00 178.15 177.14 2x90 h ALA 583 N 1.15 1.11 -0.32 0.18 0.00 -1.27 -2.66 119.26 117.46 2x90 h ALA 583 Ca 0.18 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 2x90 h ALA 583 Cb 0.44 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2x90 h ALA 583 CO 0.02 0.56 0.02 1.49 0.00 0.00 0.00 179.25 181.34 2x90 h GLU 584 N 0.33 0.55 -0.54 0.00 4.81 -0.85 -0.93 114.58 117.95 2x90 h GLU 584 Ca 0.04 -0.17 0.06 0.00 -0.13 0.00 0.00 59.36 59.17 2x90 h GLU 584 Cb 0.72 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.99 2x90 h GLU 584 CO 0.06 0.67 0.25 -0.92 -0.73 0.00 0.00 179.01 178.34 2x90 h TYR 585 N 0.36 0.45 -0.02 0.92 3.20 -1.13 -3.06 116.97 117.70 2x90 h TYR 585 Ca 0.09 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.99 2x90 h TYR 585 Cb 0.41 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.55 2x90 h TYR 585 CO 0.03 0.19 -0.03 1.19 -1.64 0.00 0.00 178.16 177.90 2x90 n PHE 586 N -4.92 0.00 -0.20 -3.82 3.72 -1.02 -4.52 117.46 106.70 2x90 n PHE 586 Ca 0.06 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.47 2x90 n PHE 586 Cb 0.18 -0.01 0.12 0.00 -0.94 0.00 0.00 39.48 38.83 2x90 n PHE 586 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 2x90 h GLU 587 N 3.28 0.23 -0.43 -1.08 4.57 -1.05 0.77 114.58 120.87 2x90 h GLU 587 Ca 0.00 -0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.18 2x90 h GLU 587 Cb 0.72 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.24 2x90 h GLU 587 CO 0.00 0.15 0.29 -1.00 -1.18 0.00 0.00 179.01 177.27 2x90 h PRO 588 N 0.24 0.53 -0.15 0.92 0.13 -1.82 -1.27 132.00 130.58 2x90 h PRO 588 Ca 0.33 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 65.39 2x90 h PRO 588 Cb 0.51 -0.12 -0.00 0.00 0.13 0.00 0.00 31.00 31.51 2x90 h PRO 588 CO -0.44 0.35 -0.05 1.25 -0.23 0.00 0.00 178.00 178.88 2x90 h LEU 589 N 0.54 0.30 -0.32 1.56 5.85 -1.26 -2.59 115.31 119.40 2x90 h LEU 589 Ca 0.16 -0.38 0.06 0.00 0.84 0.00 0.00 57.88 58.56 2x90 h LEU 589 Cb -0.00 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 40.88 2x90 h LEU 589 CO -0.04 0.62 -0.07 -0.09 -0.34 0.00 0.00 178.44 178.52 2x90 h ARG 590 N -0.02 0.00 -0.02 1.25 2.43 -0.42 0.29 114.38 117.90 2x90 h ARG 590 Ca 0.04 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.23 2x90 h ARG 590 Cb 0.49 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.01 2x90 h ARG 590 CO 0.02 0.00 -0.14 0.28 -1.51 0.00 0.00 179.97 178.62 2x90 h VAL 591 N 0.00 0.65 -0.45 0.20 2.07 -1.30 -1.36 116.25 116.06 2x90 h VAL 591 Ca 0.15 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.64 2x90 h VAL 591 Cb 0.23 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 2x90 h VAL 591 CO -0.32 0.00 0.17 -0.25 0.02 0.00 0.00 177.57 177.19 2x90 h TRP 592 N -0.22 0.69 -0.28 1.57 7.01 -1.04 -3.00 115.95 120.67 2x90 h TRP 592 Ca 0.06 -0.05 -0.11 0.00 2.11 0.00 0.00 58.89 60.89 2x90 h TRP 592 Cb 0.30 -0.21 -0.00 0.00 -2.10 0.00 0.00 29.16 27.15 2x90 h TRP 592 CO -0.21 0.60 -0.26 1.25 -2.79 0.00 0.00 178.44 177.03 2x90 h LEU 593 N 0.58 0.72 -0.39 0.65 5.85 -0.31 -0.19 115.31 122.23 2x90 h LEU 593 Ca 0.15 -0.46 0.07 0.00 0.84 0.00 0.00 57.88 58.47 2x90 h LEU 593 Cb 0.20 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 40.97 2x90 h LEU 593 CO -0.01 1.04 0.01 -0.33 -0.34 0.00 0.00 178.44 178.81 2x90 h GLU 594 N 0.42 0.11 -0.56 1.25 5.08 -1.30 0.24 114.58 119.82 2x90 h GLU 594 Ca 0.05 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2x90 h GLU 594 Cb 0.83 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.02 2x90 h GLU 594 CO 0.07 0.08 0.29 0.00 -1.00 0.00 0.00 179.01 178.44 2x90 h ALA 595 N 1.33 0.72 -0.50 3.43 0.00 -1.38 -2.33 119.26 120.54 2x90 h ALA 595 Ca 0.19 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 2x90 h ALA 595 Cb 0.26 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2x90 h ALA 595 CO -0.31 0.27 -0.04 1.49 0.00 0.00 0.00 179.25 180.66 2x90 h GLU 596 N 0.76 0.87 -0.40 0.00 4.57 -0.52 0.46 114.58 120.30 2x90 h GLU 596 Ca 0.19 -0.26 -0.10 0.00 -1.18 0.00 0.00 59.36 58.01 2x90 h GLU 596 Cb 0.09 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.58 2x90 h GLU 596 CO -0.03 0.89 -0.16 -0.91 -1.18 0.00 0.00 179.01 177.62 2x90 h ASN 597 N 0.79 0.76 -0.17 1.04 2.35 -0.86 -1.48 115.58 118.02 2x90 h ASN 597 Ca 0.14 -0.25 -0.03 0.00 -0.55 0.00 0.00 56.30 55.62 2x90 h ASN 597 Cb 0.53 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.69 2x90 h ASN 597 CO 0.03 0.92 -0.02 0.40 -1.65 0.00 0.00 177.43 177.11 2x90 h ILE 598 N 0.68 1.27 -0.93 2.81 2.04 -1.15 0.18 117.51 122.41 2x90 h ILE 598 Ca 0.11 -0.92 0.12 0.00 1.00 0.00 0.00 64.86 65.17 2x90 h ILE 598 Cb 0.65 1.54 -0.08 0.00 -0.74 0.00 0.00 36.82 38.18 2x90 h ILE 598 CO 0.05 0.27 0.56 0.50 0.00 0.00 0.00 178.15 179.53 2x90 h LYS 599 N 0.04 0.84 -0.67 2.37 3.64 -0.76 -1.95 116.57 120.09 2x90 h LYS 599 Ca 0.05 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2x90 h LYS 599 Cb 0.42 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 2x90 h LYS 599 CO 0.01 0.56 0.00 0.09 -2.27 0.00 0.00 179.45 177.84 2x90 n ASN 600 N -4.70 3.69 -3.89 4.20 3.02 -0.57 -4.96 115.26 112.05 2x90 n ASN 600 Ca 0.17 -2.05 -0.26 0.00 -0.03 0.00 0.00 54.58 52.42 2x90 n ASN 600 Cb 0.36 -0.46 0.00 0.00 -0.61 0.00 0.00 39.78 39.07 2x90 n ASN 600 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2x90 n ASN 601 N 1.41 -1.51 -4.69 6.41 5.15 -0.68 -4.88 115.26 116.47 2x90 n ASN 601 Ca 0.23 -0.92 -0.42 0.00 -0.60 0.00 0.00 54.58 52.87 2x90 n ASN 601 Cb 0.60 -3.46 -0.03 0.00 -0.53 0.00 0.00 39.78 36.36 2x90 n ASN 601 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2x90 s VAL 602 N -3.71 4.68 0.16 3.44 1.01 0.55 -5.00 120.40 121.54 2x90 s VAL 602 Ca 0.17 1.95 -0.31 0.00 0.00 0.00 0.00 61.98 63.79 2x90 s VAL 602 Cb -0.09 -4.25 -0.08 0.00 0.00 0.00 0.00 36.38 31.96 2x90 s VAL 602 CO 0.86 0.04 1.35 -2.28 0.00 0.00 0.00 175.10 175.07 2x90 s HIS 603 N 1.79 3.24 -0.06 5.22 2.46 -1.26 -4.89 115.29 121.79 2x90 s HIS 603 Ca 0.51 1.09 0.04 0.00 0.47 0.00 0.00 55.06 57.16 2x90 s HIS 603 Cb -0.20 -3.65 -0.02 0.00 -0.13 0.00 0.00 32.58 28.57 2x90 s HIS 603 CO 0.21 -2.16 -0.16 0.42 -2.47 0.00 0.00 174.74 170.58 2x90 s ILE 604 N 0.56 2.86 0.00 0.89 -1.09 -1.26 -4.63 121.20 118.54 2x90 s ILE 604 Ca 0.60 -0.79 0.00 0.00 -2.23 0.00 0.00 60.65 58.24 2x90 s ILE 604 Cb -0.37 -2.11 0.00 0.00 -1.58 0.00 0.00 42.46 38.40 2x90 s ILE 604 CO 0.35 0.58 0.00 0.61 -1.23 0.00 0.00 174.94 175.25 2x90 n GLY 605 N 2.50 0.12 3.26 6.18 0.00 -1.26 -5.08 105.19 110.91 2x90 n GLY 605 Ca -0.17 -1.89 -0.14 0.00 0.00 0.00 0.00 46.02 43.82 2x90 n GLY 605 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2x90 s TRP 606 N -1.53 -0.21 0.71 1.61 -2.14 -1.26 -4.81 118.94 111.32 2x90 s TRP 606 Ca 0.00 0.31 -0.11 0.00 2.66 0.00 0.00 56.10 58.96 2x90 s TRP 606 Cb 0.00 0.12 0.02 0.00 -3.10 0.00 0.00 33.47 30.50 2x90 s TRP 606 CO 0.00 -0.41 1.07 0.95 -2.66 0.00 0.00 176.95 175.90 2x90 s THR 607 N -1.35 3.86 0.26 0.66 -4.23 -0.16 -4.93 115.64 109.75 2x90 s THR 607 Ca -0.13 0.61 -0.30 0.00 -1.18 0.00 0.00 61.69 60.69 2x90 s THR 607 Cb -0.05 -3.28 -0.10 0.00 1.34 0.00 0.00 72.50 70.40 2x90 s THR 607 CO 0.04 -0.78 1.47 -0.89 -0.54 0.00 0.00 174.62 173.92 2x90 s THR 608 N -3.00 2.52 0.52 3.99 2.01 -1.26 -4.21 115.64 116.21 2x90 s THR 608 Ca 0.59 0.44 -0.22 0.00 0.31 0.00 0.00 61.69 62.81 2x90 s THR 608 Cb -0.15 -3.28 -0.06 0.00 0.01 0.00 0.00 72.50 69.02 2x90 s THR 608 CO 0.55 0.07 1.28 -0.55 -0.69 0.00 0.00 174.62 175.28 2x90 s SER 609 N 0.37 5.58 -0.11 3.53 0.15 -1.26 -4.95 113.70 117.00 2x90 s SER 609 Ca 0.60 2.57 0.15 0.00 0.70 0.00 0.00 55.95 59.97 2x90 s SER 609 Cb -0.43 -2.62 0.47 0.00 -1.71 0.00 0.00 66.02 61.73 2x90 s SER 609 CO 0.45 -1.34 1.39 0.59 1.20 0.00 0.00 173.24 175.52 2x90 n ASN 610 N -0.88 3.65 -0.35 5.45 3.02 -1.26 -4.69 115.26 120.20 2x90 n ASN 610 Ca 0.09 -2.61 0.14 0.00 -0.03 0.00 0.00 54.58 52.17 2x90 n ASN 610 Cb 0.46 -0.44 0.58 0.00 -0.61 0.00 0.00 39.78 39.77 2x90 n ASN 610 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2x90 n LYS 611 N -0.00 1.38 -3.95 3.52 4.76 -1.26 -4.65 118.16 117.95 2x90 n LYS 611 Ca 0.18 -0.70 -0.30 0.00 -2.87 0.00 0.00 58.31 54.62 2x90 n LYS 611 Cb 0.73 -1.49 -0.16 0.00 -1.84 0.00 0.00 35.03 32.28 2x90 n LYS 611 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2x90 s VAL 613 N 1.46 4.94 -2.00 0.00 1.01 0.12 -4.97 120.40 120.96 2x90 s VAL 613 Ca -0.02 1.42 0.28 0.00 0.00 0.00 0.00 61.98 63.66 2x90 s VAL 613 Cb -0.17 -4.05 0.81 0.00 0.00 0.00 0.00 36.38 32.97 2x90 s VAL 613 CO -0.07 0.06 2.04 -1.20 0.00 0.00 0.00 175.10 175.92