#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a70 h VAL 3 N 0.00 0.81 -0.60 1.61 3.04 -1.66 -1.91 116.25 117.53 3a70 h VAL 3 Ca 0.00 -0.14 0.00 0.00 -1.01 0.00 0.00 66.70 65.55 3a70 h VAL 3 Cb 0.00 0.38 0.00 0.00 -2.01 0.00 0.00 31.29 29.66 3a70 h VAL 3 CO 0.00 0.07 0.00 -1.22 -1.01 0.00 0.00 177.57 175.41 3a70 n TYR 4 N -4.47 1.67 -1.60 3.17 4.01 -1.26 -3.82 117.16 114.86 3a70 n TYR 4 Ca 0.13 -0.67 -0.50 0.00 -0.16 0.00 0.00 57.90 56.71 3a70 n TYR 4 Cb 0.51 -0.34 -0.05 0.00 -0.31 0.00 0.00 39.34 39.14 3a70 n TYR 4 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3a70 n ASP 5 N 0.86 1.82 -3.97 7.72 8.00 -0.72 -4.67 116.55 125.59 3a70 n ASP 5 Ca 0.26 1.12 -0.25 0.00 0.71 0.00 0.00 54.79 56.64 3a70 n ASP 5 Cb 1.00 -1.24 -0.17 0.00 -0.02 0.00 0.00 41.12 40.69 3a70 n ASP 5 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3a70 s TYR 6 N 0.34 1.36 0.00 1.24 5.04 -1.26 -5.01 117.35 119.06 3a70 s TYR 6 Ca 0.80 -0.55 0.00 0.00 -2.44 0.00 0.00 57.07 54.88 3a70 s TYR 6 Cb -0.88 -1.06 0.00 0.00 0.35 0.00 0.00 41.96 40.37 3a70 s TYR 6 CO 0.47 -0.34 0.00 1.63 -1.34 0.00 0.00 175.55 175.97 3a70 n LYS 7 N 4.22 0.00 -0.27 4.97 5.02 -1.26 -1.94 118.16 128.90 3a70 n LYS 7 Ca -0.20 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.16 3a70 n LYS 7 Cb 0.51 0.00 0.20 0.00 -0.02 0.00 0.00 35.03 35.72 3a70 n LYS 7 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3a70 n ASN 8 N 3.81 3.30 -4.75 4.39 5.03 -1.26 -5.00 115.26 120.78 3a70 n ASN 8 Ca 0.00 -2.22 -0.34 0.00 0.87 0.00 0.00 54.58 52.89 3a70 n ASN 8 Cb 0.00 -0.33 0.07 0.00 -1.02 0.00 0.00 39.78 38.50 3a70 n ASN 8 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 3a70 s PHE 9 N -1.40 2.32 0.44 3.10 0.08 -0.82 -5.01 117.98 116.70 3a70 s PHE 9 Ca 0.30 1.58 -0.07 0.00 0.12 0.00 0.00 56.93 58.86 3a70 s PHE 9 Cb 0.19 -3.33 0.11 0.00 -0.57 0.00 0.00 43.02 39.41 3a70 s PHE 9 CO 0.16 -2.16 0.37 0.41 -0.10 0.00 0.00 175.22 173.90 3a70 n GLY 10 N -0.00 -2.79 0.23 4.36 0.00 -1.26 -4.62 105.19 101.10 3a70 n GLY 10 Ca 0.12 -1.43 -0.15 0.00 0.00 0.00 0.00 46.02 44.56 3a70 n GLY 10 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3a70 h THR 11 N -2.05 0.64 -0.49 2.61 2.02 -1.98 -2.51 112.91 111.15 3a70 h THR 11 Ca -0.14 -0.10 0.04 0.00 0.77 0.00 0.00 66.41 66.98 3a70 h THR 11 Cb 0.44 0.69 -0.04 0.00 -1.74 0.00 0.00 68.15 67.50 3a70 h THR 11 CO 0.09 0.02 0.25 0.00 0.37 0.00 0.00 175.52 176.25 3a70 h ALA 12 N 0.05 0.63 -0.10 6.16 0.00 -2.00 -2.25 119.26 121.74 3a70 h ALA 12 Ca -0.05 0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.69 3a70 h ALA 12 Cb 0.42 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 3a70 h ALA 12 CO 0.09 -0.09 -0.71 -0.44 0.00 0.00 0.00 179.25 178.09 3a70 h ASP 13 N 0.49 0.57 -0.89 0.00 3.32 -1.91 -1.86 116.42 116.14 3a70 h ASP 13 Ca 0.21 -0.36 0.02 0.00 0.02 0.00 0.00 57.03 56.93 3a70 h ASP 13 Cb 0.12 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 39.45 3a70 h ASP 13 CO -0.15 1.11 0.58 0.28 -1.72 0.00 0.00 179.24 179.34 3a70 h SER 14 N 0.33 0.99 -0.58 6.45 0.02 -1.42 -2.21 113.55 117.13 3a70 h SER 14 Ca -0.03 -0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 60.81 3a70 h SER 14 Cb 1.29 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.58 3a70 h SER 14 CO 0.13 0.69 0.01 0.11 -1.14 0.00 0.00 176.83 176.63 3a70 h LYS 15 N 1.16 1.04 -0.40 3.45 1.57 -1.07 0.98 116.57 123.29 3a70 h LYS 15 Ca 0.35 -0.32 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 3a70 h LYS 15 Cb -0.05 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 3a70 h LYS 15 CO -0.10 1.01 -0.18 0.00 -0.57 0.00 0.00 179.45 179.60 3a70 h ALA 16 N 1.05 0.92 0.14 3.86 0.00 -1.23 -0.11 119.26 123.88 3a70 h ALA 16 Ca 0.17 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 3a70 h ALA 16 Cb 0.53 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3a70 h ALA 16 CO 0.03 0.62 -0.07 1.25 0.00 0.00 0.00 179.25 181.08 3a70 h LEU 17 N 0.69 -0.15 -0.39 0.00 5.85 -1.19 -2.63 115.31 117.49 3a70 h LEU 17 Ca 0.10 -0.16 0.07 0.00 0.84 0.00 0.00 57.88 58.73 3a70 h LEU 17 Cb 0.68 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.69 3a70 h LEU 17 CO 0.05 0.07 0.02 0.15 -0.34 0.00 0.00 178.44 178.39 3a70 h PHE 18 N -0.38 0.01 -0.63 1.25 3.57 -0.64 0.24 116.94 120.37 3a70 h PHE 18 Ca -0.02 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 3a70 h PHE 18 Cb 0.30 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.06 3a70 h PHE 18 CO -0.01 -0.05 0.28 0.77 -2.23 0.00 0.00 178.31 177.07 3a70 h SER 19 N 0.13 0.81 -0.20 0.41 0.02 -0.99 -1.40 113.55 112.33 3a70 h SER 19 Ca 0.19 -0.09 -0.06 0.00 -0.84 0.00 0.00 61.79 60.99 3a70 h SER 19 Cb 0.26 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 3a70 h SER 19 CO -0.30 0.71 -0.10 0.44 -1.14 0.00 0.00 176.83 176.43 3a70 h ASP 20 N 0.89 0.45 -0.66 3.07 3.32 -1.19 -1.16 116.42 121.14 3a70 h ASP 20 Ca 0.22 -0.42 0.06 0.00 0.02 0.00 0.00 57.03 56.91 3a70 h ASP 20 Cb 0.13 -0.12 -0.06 0.00 0.22 0.00 0.00 39.33 39.50 3a70 h ASP 20 CO -0.02 0.76 0.36 0.00 -1.72 0.00 0.00 179.24 178.62 3a70 h ALA 21 N 0.70 0.88 -0.33 3.45 0.00 -0.76 -1.20 119.26 122.00 3a70 h ALA 21 Ca 0.04 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3a70 h ALA 21 Cb 0.60 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 3a70 h ALA 21 CO 0.03 0.03 0.08 1.98 0.00 0.00 0.00 179.25 181.36 3a70 h MET 22 N 0.66 0.52 -0.13 0.00 1.85 -1.21 -0.82 114.93 115.80 3a70 h MET 22 Ca 0.30 -0.13 0.02 0.00 -0.61 0.00 0.00 59.70 59.28 3a70 h MET 22 Cb 0.20 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 32.14 3a70 h MET 22 CO -0.19 0.59 -0.01 0.00 -0.40 0.00 0.00 176.91 176.89 3a70 h ALA 23 N 0.91 0.10 -0.17 0.39 0.00 -0.86 -0.52 119.26 119.11 3a70 h ALA 23 Ca 0.10 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 3a70 h ALA 23 Cb 0.30 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3a70 h ALA 23 CO 0.00 -0.47 -0.36 -0.84 0.00 0.00 0.00 179.25 177.59 3a70 h ILE 24 N 0.03 1.29 -0.25 0.00 3.07 -1.18 -1.27 117.51 119.19 3a70 h ILE 24 Ca 0.06 -1.43 -0.00 0.00 1.55 0.00 0.00 64.86 65.04 3a70 h ILE 24 Cb 0.08 1.56 -0.01 0.00 -0.27 0.00 0.00 36.82 38.18 3a70 h ILE 24 CO -0.11 0.44 0.15 0.74 -1.05 0.00 0.00 178.15 178.31 3a70 h THR 25 N 0.30 1.11 -0.58 0.16 2.02 -0.94 -2.40 112.91 112.57 3a70 h THR 25 Ca 0.03 -0.28 -0.01 0.00 0.77 0.00 0.00 66.41 66.92 3a70 h THR 25 Cb 0.77 0.84 -0.03 0.00 -1.74 0.00 0.00 68.15 67.99 3a70 h THR 25 CO 0.06 0.11 0.32 -0.07 0.37 0.00 0.00 175.52 176.31 3a70 h LEU 26 N 0.31 0.73 -0.96 2.58 3.38 -0.94 -2.75 115.31 117.66 3a70 h LEU 26 Ca 0.09 -0.09 0.14 0.00 0.09 0.00 0.00 57.88 58.11 3a70 h LEU 26 Cb 0.05 -0.19 -0.09 0.00 0.09 0.00 0.00 40.66 40.52 3a70 h LEU 26 CO -0.02 0.61 0.58 0.22 0.09 0.00 0.00 178.44 179.92 3a70 h TYR 27 N 0.79 1.03 0.00 1.13 3.20 -1.04 -2.46 116.97 119.62 3a70 h TYR 27 Ca 0.21 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.10 3a70 h TYR 27 Cb 0.04 -0.32 -0.00 0.00 1.54 0.00 0.00 36.73 37.99 3a70 h TYR 27 CO -0.01 0.34 -0.04 0.66 -1.64 0.00 0.00 178.16 177.46 3a70 h SER 28 N 0.85 0.00 0.34 -2.11 4.64 -1.12 -1.20 113.55 114.95 3a70 h SER 28 Ca 0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 3a70 h SER 28 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 3a70 h SER 28 CO -0.31 0.04 -0.57 -1.22 -0.87 0.00 0.00 176.83 173.89 3a70 n TYR 29 N -3.51 0.00 -3.62 4.77 4.01 -0.93 -4.77 117.16 113.10 3a70 n TYR 29 Ca -0.02 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.45 3a70 n TYR 29 Cb 0.15 -0.17 0.02 0.00 -0.31 0.00 0.00 39.34 39.03 3a70 n TYR 29 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 3a70 n HIS 30 N -1.34 -2.15 -2.19 -0.72 8.25 -0.46 -1.91 115.22 114.70 3a70 n HIS 30 Ca 0.06 0.74 -0.19 0.00 -0.26 0.00 0.00 57.72 58.08 3a70 n HIS 30 Cb 0.34 -3.85 -0.02 0.00 1.12 0.00 0.00 29.99 27.58 3a70 n HIS 30 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3a70 n ASN 31 N -2.65 -5.38 -0.14 0.41 3.02 -1.26 -4.33 115.26 104.92 3a70 n ASN 31 Ca 0.00 0.08 0.04 0.00 -0.03 0.00 0.00 54.58 54.67 3a70 n ASN 31 Cb 0.54 -4.45 0.34 0.00 -0.61 0.00 0.00 39.78 35.60 3a70 n ASN 31 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3a70 h LEU 32 N 0.00 0.67 -0.61 3.41 5.85 -1.71 -1.77 115.31 121.15 3a70 h LEU 32 Ca -0.43 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.28 3a70 h LEU 32 Cb 1.31 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.18 3a70 h LEU 32 CO 0.53 0.47 0.00 -0.90 -0.34 0.00 0.00 178.44 178.20 3a70 n ASP 33 N -4.46 0.94 -0.06 1.25 5.75 -1.26 -4.37 116.55 114.34 3a70 n ASP 33 Ca 0.08 -1.42 -0.08 0.00 -0.01 0.00 0.00 54.79 53.36 3a70 n ASP 33 Cb 0.11 -0.03 -0.01 0.00 -1.03 0.00 0.00 41.12 40.16 3a70 n ASP 33 CO 0.00 0.00 0.00 -1.13 -0.11 0.00 0.00 177.20 175.96 3a70 h ASN 34 N 1.37 -0.73 -0.99 -1.12 -0.00 -1.48 0.14 115.58 112.77 3a70 h ASN 34 Ca 0.00 0.14 0.02 0.00 -0.00 0.00 0.00 56.30 56.45 3a70 h ASN 34 Cb 0.29 0.35 -0.05 0.00 -0.00 0.00 0.00 38.32 38.92 3a70 h ASN 34 CO 0.00 -0.26 0.65 1.23 -0.00 0.00 0.00 177.43 179.05 3a70 h GLY 35 N -0.22 1.40 0.95 1.57 0.00 -1.31 -0.56 103.07 104.90 3a70 h GLY 35 Ca 0.14 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 46.96 3a70 h GLY 35 CO -0.39 0.49 0.08 -2.75 0.00 0.00 0.00 176.54 173.97 3a70 h PHE 36 N 1.32 0.19 -0.52 5.60 -0.00 -1.39 0.81 116.94 122.95 3a70 h PHE 36 Ca 0.37 -0.00 -0.03 0.00 -0.00 0.00 0.00 57.97 58.31 3a70 h PHE 36 Cb -0.13 -0.06 -0.02 0.00 -0.00 0.00 0.00 35.95 35.74 3a70 h PHE 36 CO -0.00 0.18 0.22 0.00 -0.00 0.00 0.00 178.31 178.70 3a70 h ALA 37 N 1.00 0.68 -0.21 2.41 0.00 -0.45 0.18 119.26 122.86 3a70 h ALA 37 Ca 0.05 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 3a70 h ALA 37 Cb 0.05 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 3a70 h ALA 37 CO -0.01 0.28 -0.25 0.00 0.00 0.00 0.00 179.25 179.27 3a70 h ALA 38 N 1.06 0.32 -0.09 0.00 0.00 -1.03 -1.08 119.26 118.43 3a70 h ALA 38 Ca 0.17 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.74 3a70 h ALA 38 Cb 0.18 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 3a70 h ALA 38 CO -0.02 0.29 -0.21 0.78 0.00 0.00 0.00 179.25 180.09 3a70 h GLY 39 N 0.22 -0.24 0.73 0.00 0.00 -0.69 -2.14 103.07 100.96 3a70 h GLY 39 Ca 0.03 0.26 0.04 0.00 0.00 0.00 0.00 47.33 47.66 3a70 h GLY 39 CO 0.06 -0.19 0.27 -1.82 0.00 0.00 0.00 176.54 174.87 3a70 h TYR 40 N -0.30 0.50 -0.89 5.60 3.20 -0.92 0.76 116.97 124.93 3a70 h TYR 40 Ca 0.09 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 3a70 h TYR 40 Cb 0.42 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.50 3a70 h TYR 40 CO -0.30 0.25 0.55 0.37 -1.64 0.00 0.00 178.16 177.39 3a70 h GLN 41 N 0.53 1.21 0.16 1.82 5.75 -0.84 0.22 115.11 123.96 3a70 h GLN 41 Ca 0.23 -0.10 -0.29 0.00 -0.15 0.00 0.00 58.65 58.34 3a70 h GLN 41 Cb 0.13 -0.26 0.01 0.00 1.07 0.00 0.00 27.48 28.44 3a70 h GLN 41 CO -0.16 0.84 -1.29 1.25 -2.65 0.00 0.00 178.83 176.82 3a70 h HIS 42 N 1.23 0.65 0.00 3.99 2.76 -1.11 0.24 115.15 122.91 3a70 h HIS 42 Ca 0.32 -0.47 -0.10 0.00 -2.20 0.00 0.00 60.37 57.92 3a70 h HIS 42 Cb -0.07 -0.03 -0.02 0.00 1.55 0.00 0.00 27.41 28.84 3a70 h HIS 42 CO 0.00 1.36 -1.61 0.09 -1.30 0.00 0.00 177.93 176.48 3a70 n ASN 43 N -3.60 2.49 0.00 3.26 4.13 0.24 -4.55 115.26 117.23 3a70 n ASN 43 Ca -0.11 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.15 3a70 n ASN 43 Cb 1.04 1.09 0.00 0.00 -1.54 0.00 0.00 39.78 40.37 3a70 n ASN 43 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3a70 n GLY 44 N 2.15 -0.33 0.47 7.41 0.00 0.76 -4.00 105.19 111.64 3a70 n GLY 44 Ca -0.10 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.85 3a70 n GLY 44 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3a70 n PHE 45 N 0.00 0.00 0.00 1.61 7.35 -1.26 -4.08 117.46 121.08 3a70 n PHE 45 Ca 0.00 -0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 3a70 n PHE 45 Cb 0.00 -0.05 0.00 0.00 0.35 0.00 0.00 39.48 39.78 3a70 n PHE 45 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3a70 n GLY 46 N -0.00 1.08 0.12 7.13 0.00 -1.26 -4.60 105.19 107.66 3a70 n GLY 46 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 3a70 n GLY 46 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3a70 n LEU 47 N 0.00 -0.31 0.00 0.99 7.94 -1.26 -0.94 117.00 123.41 3a70 n LEU 47 Ca 0.00 1.03 0.01 0.00 -1.11 0.00 0.00 56.01 55.94 3a70 n LEU 47 Cb 0.00 -0.32 0.07 0.00 0.53 0.00 0.00 43.42 43.70 3a70 n LEU 47 CO 0.00 -0.68 0.25 0.61 -1.11 0.00 0.00 177.39 176.46 3a70 n GLY 48 N -1.07 -0.34 0.22 -3.96 0.00 -1.26 -3.68 105.19 95.10 3a70 n GLY 48 Ca 0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 46.02 46.00 3a70 n GLY 48 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3a70 h LEU 49 N 0.00 0.08 -1.12 0.99 5.85 -1.19 -1.33 115.31 118.59 3a70 h LEU 49 Ca 0.00 0.09 0.10 0.00 0.84 0.00 0.00 57.88 58.91 3a70 h LEU 49 Cb 0.00 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.07 3a70 h LEU 49 CO 0.00 0.06 0.61 -0.65 -0.34 0.00 0.00 178.44 178.11 3a70 h PRO 50 N 0.30 0.94 -0.37 5.25 0.11 -1.80 -1.17 132.00 135.25 3a70 h PRO 50 Ca 0.29 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 66.23 3a70 h PRO 50 Cb 0.39 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.28 3a70 h PRO 50 CO -0.34 0.62 -0.22 0.00 -0.21 0.00 0.00 178.00 177.84 3a70 h ALA 51 N 1.53 0.91 -0.69 -0.75 0.00 -1.63 -0.20 119.26 118.43 3a70 h ALA 51 Ca 0.44 -0.37 0.03 0.00 0.00 0.00 0.00 54.91 55.01 3a70 h ALA 51 Cb 0.39 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 3a70 h ALA 51 CO -0.20 0.62 0.43 1.15 0.00 0.00 0.00 179.25 181.25 3a70 h THR 52 N 0.64 1.10 -0.29 0.00 2.02 -0.79 -2.37 112.91 113.22 3a70 h THR 52 Ca 0.09 -0.29 -0.14 0.00 0.77 0.00 0.00 66.41 66.84 3a70 h THR 52 Cb 0.72 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 3a70 h THR 52 CO 0.06 0.16 -0.39 -0.07 0.37 0.00 0.00 175.52 175.64 3a70 h LEU 53 N 0.85 0.74 -0.35 2.58 3.38 -0.70 -0.43 115.31 121.37 3a70 h LEU 53 Ca 0.27 -0.33 0.07 0.00 0.09 0.00 0.00 57.88 57.98 3a70 h LEU 53 Cb 0.00 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.48 3a70 h LEU 53 CO -0.10 1.05 -0.10 0.58 0.09 0.00 0.00 178.44 179.96 3a70 h VAL 54 N 0.57 0.63 -0.15 1.22 2.07 -0.78 -2.22 116.25 117.59 3a70 h VAL 54 Ca 0.05 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.46 3a70 h VAL 54 Cb 0.92 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 3a70 h VAL 54 CO 0.08 0.00 -0.38 0.74 0.02 0.00 0.00 177.57 178.04 3a70 h THR 55 N -0.01 1.30 -0.59 2.57 2.02 -1.15 -0.09 112.91 116.96 3a70 h THR 55 Ca 0.17 -1.46 0.10 0.00 0.77 0.00 0.00 66.41 65.98 3a70 h THR 55 Cb 0.27 1.60 -0.04 0.00 -1.74 0.00 0.00 68.15 68.24 3a70 h THR 55 CO -0.37 0.45 0.40 0.00 0.37 0.00 0.00 175.52 176.36 3a70 h ALA 56 N 1.33 2.01 0.03 6.16 0.00 -0.48 0.20 119.26 128.51 3a70 h ALA 56 Ca 0.03 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.72 3a70 h ALA 56 Cb 0.79 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 3a70 h ALA 56 CO 0.06 -0.14 -1.09 -0.07 0.00 0.00 0.00 179.25 178.01 3a70 h LEU 57 N 0.41 0.11 -0.12 0.00 3.38 -1.01 -0.79 115.31 117.29 3a70 h LEU 57 Ca 0.27 -0.70 0.00 0.00 0.09 0.00 0.00 57.88 57.54 3a70 h LEU 57 Cb 0.53 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.24 3a70 h LEU 57 CO -0.07 1.45 -0.29 0.18 0.09 0.00 0.00 178.44 179.79 3a70 n LEU 58 N -4.30 0.43 0.00 1.67 4.77 -0.10 -1.01 117.00 118.47 3a70 n LEU 58 Ca -0.26 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.17 3a70 n LEU 58 Cb 0.71 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.80 3a70 n LEU 58 CO 0.28 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 3a70 n GLY 59 N 1.09 1.27 0.00 -0.72 0.00 0.71 -4.30 105.19 103.24 3a70 n GLY 59 Ca 0.02 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.39 3a70 n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a70 n GLY 60 N 0.00 3.16 0.18 -0.02 0.00 -0.54 -4.44 105.19 103.53 3a70 n GLY 60 Ca 0.00 -0.46 0.14 0.00 0.00 0.00 0.00 46.02 45.70 3a70 n GLY 60 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3a70 h THR 61 N 0.00 0.00 0.00 2.61 1.35 -1.94 -3.25 112.91 111.67 3a70 h THR 61 Ca 0.00 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 3a70 h THR 61 Cb 0.00 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 67.81 3a70 h THR 61 CO 0.00 0.00 -0.06 -0.90 -0.25 0.00 0.00 175.52 174.31 3a70 n ASP 62 N -2.60 1.29 -3.73 5.36 5.75 -1.26 -4.40 116.55 116.96 3a70 n ASP 62 Ca 0.03 -1.94 -0.10 0.00 -0.01 0.00 0.00 54.79 52.77 3a70 n ASP 62 Cb 0.34 -0.10 -0.06 0.00 -1.03 0.00 0.00 41.12 40.27 3a70 n ASP 62 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3a70 s SER 63 N -1.09 -0.11 -0.16 -1.12 1.04 -1.23 -4.83 113.70 106.21 3a70 s SER 63 Ca 0.06 -0.38 0.01 0.00 0.48 0.00 0.00 55.95 56.12 3a70 s SER 63 Cb 0.05 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.58 3a70 s SER 63 CO 0.01 -0.76 -0.17 -1.58 0.98 0.00 0.00 173.24 171.72 3a70 s GLN 64 N -3.51 3.15 0.00 4.02 0.74 -1.26 -1.46 119.66 121.33 3a70 s GLN 64 Ca 0.02 -0.78 0.00 0.00 0.05 0.00 0.00 55.36 54.65 3a70 s GLN 64 Cb 0.02 -2.61 0.00 0.00 1.10 0.00 0.00 33.01 31.53 3a70 s GLN 64 CO -0.10 -0.04 0.00 0.41 -0.55 0.00 0.00 175.29 175.01 3a70 n GLY 65 N 4.21 0.55 0.23 2.59 0.00 -1.25 -1.08 105.19 110.43 3a70 n GLY 65 Ca -0.19 -1.60 -0.07 0.00 0.00 0.00 0.00 46.02 44.16 3a70 n GLY 65 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3a70 h VAL 66 N 0.00 1.30 -3.16 1.61 2.07 -0.22 -3.44 116.25 114.41 3a70 h VAL 66 Ca 0.00 -1.55 -0.57 0.00 0.82 0.00 0.00 66.70 65.40 3a70 h VAL 66 Cb 0.00 1.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 3a70 h VAL 66 CO 0.00 0.49 0.70 -0.63 0.02 0.00 0.00 177.57 178.15 3a70 s ILE 67 N -4.27 4.72 0.76 4.57 1.01 -0.18 -4.83 121.20 122.99 3a70 s ILE 67 Ca -0.07 2.03 -0.10 0.00 0.00 0.00 0.00 60.65 62.51 3a70 s ILE 67 Cb 0.12 -4.31 0.07 0.00 0.01 0.00 0.00 42.46 38.35 3a70 s ILE 67 CO 0.82 -0.10 1.11 -2.16 0.00 0.00 0.00 174.94 174.61 3a70 s PRO 68 N 2.70 2.16 -0.23 2.79 0.04 -1.26 -4.45 135.00 136.74 3a70 s PRO 68 Ca 0.46 0.03 0.00 0.00 0.04 0.00 0.00 61.00 61.53 3a70 s PRO 68 Cb -0.16 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.34 3a70 s PRO 68 CO 0.11 -1.40 0.00 0.41 0.04 0.00 0.00 177.00 176.16 3a70 n GLY 69 N -3.14 0.52 3.64 0.56 0.00 -1.26 -5.00 105.19 100.50 3a70 n GLY 69 Ca 0.08 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 3a70 n GLY 69 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a70 s ILE 70 N -1.85 4.81 0.23 -0.61 1.01 -1.26 -4.95 121.20 118.58 3a70 s ILE 70 Ca 0.00 1.62 -0.08 0.00 0.00 0.00 0.00 60.65 62.19 3a70 s ILE 70 Cb 0.00 -4.14 0.21 0.00 0.01 0.00 0.00 42.46 38.53 3a70 s ILE 70 CO 0.00 -0.09 1.90 -0.65 0.00 0.00 0.00 174.94 176.10 3a70 h PRO 71 N 7.66 1.17 0.00 2.79 0.11 -1.99 -2.31 132.00 139.42 3a70 h PRO 71 Ca -0.22 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.81 3a70 h PRO 71 Cb 1.09 -0.26 0.00 0.00 0.11 0.00 0.00 31.00 31.94 3a70 h PRO 71 CO 0.89 0.78 0.00 -2.67 -0.21 0.00 0.00 178.00 176.79 3a70 n TRP 72 N -4.46 0.00 -2.61 0.65 2.14 -1.26 -4.81 117.44 107.09 3a70 n TRP 72 Ca 0.10 0.00 -0.35 0.00 2.07 0.00 0.00 57.50 59.32 3a70 n TRP 72 Cb 0.02 -0.50 -0.05 0.00 -0.81 0.00 0.00 31.31 29.98 3a70 n TRP 72 CO 0.00 0.00 0.00 -0.80 2.07 0.00 0.00 177.69 178.96 3a70 s ASN 73 N -2.99 6.68 0.71 -0.67 0.02 -0.87 -4.27 114.94 113.55 3a70 s ASN 73 Ca 0.12 1.92 -0.13 0.00 -1.02 0.00 0.00 52.86 53.75 3a70 s ASN 73 Cb 0.16 -2.57 0.03 0.00 0.02 0.00 0.00 41.25 38.89 3a70 s ASN 73 CO 0.43 -0.55 1.11 -2.16 0.02 0.00 0.00 177.10 175.96 3a70 s PRO 74 N -2.85 2.49 -1.23 -0.60 0.04 -1.26 -4.94 135.00 126.65 3a70 s PRO 74 Ca 0.61 1.35 -0.19 0.00 0.04 0.00 0.00 61.00 62.81 3a70 s PRO 74 Cb -0.17 -1.91 -0.01 0.00 0.04 0.00 0.00 34.50 32.44 3a70 s PRO 74 CO 0.22 -1.49 1.91 -3.47 0.04 0.00 0.00 177.00 174.21 3a70 n ASP 75 N -2.89 3.92 0.27 6.66 -0.08 -1.26 -4.52 116.55 118.64 3a70 n ASP 75 Ca 0.10 -2.81 0.11 0.00 -1.51 0.00 0.00 54.79 50.68 3a70 n ASP 75 Cb 0.52 -1.65 0.73 0.00 2.34 0.00 0.00 41.12 43.07 3a70 n ASP 75 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 3a70 h SER 76 N 7.89 0.00 -0.14 1.67 4.64 -1.92 -1.11 113.55 124.58 3a70 h SER 76 Ca 0.41 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.50 3a70 h SER 76 Cb 0.82 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.92 3a70 h SER 76 CO 1.54 0.07 -0.78 -0.33 -0.87 0.00 0.00 176.83 176.47 3a70 h GLU 77 N 0.00 0.79 -0.52 4.77 5.08 -1.87 0.93 114.58 123.77 3a70 h GLU 77 Ca -0.00 -0.65 -0.11 0.00 -1.00 0.00 0.00 59.36 57.60 3a70 h GLU 77 Cb 0.16 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 3a70 h GLU 77 CO 0.01 1.25 -0.13 -0.22 -1.00 0.00 0.00 179.01 178.93 3a70 h LYS 78 N 0.54 0.98 -0.98 2.33 3.64 -1.72 -2.14 116.57 119.22 3a70 h LYS 78 Ca -0.05 -0.36 0.06 0.00 -1.27 0.00 0.00 60.65 59.02 3a70 h LYS 78 Cb 1.41 -0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 33.10 3a70 h LYS 78 CO 0.16 1.04 0.64 -0.07 -2.27 0.00 0.00 179.45 178.95 3a70 h LEU 79 N 0.87 1.03 -0.62 5.20 3.38 -0.97 -1.06 115.31 123.14 3a70 h LEU 79 Ca 0.13 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 3a70 h LEU 79 Cb 0.68 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 3a70 h LEU 79 CO 0.05 0.67 0.31 0.00 0.09 0.00 0.00 178.44 179.56 3a70 h ALA 80 N 1.46 0.80 0.16 1.53 0.00 -0.52 -0.27 119.26 122.41 3a70 h ALA 80 Ca 0.42 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 3a70 h ALA 80 Cb 0.13 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3a70 h ALA 80 CO -0.16 0.35 -0.08 1.25 0.00 0.00 0.00 179.25 180.62 3a70 h LEU 81 N 0.85 -0.18 -0.76 0.00 5.85 -1.11 -1.92 115.31 118.04 3a70 h LEU 81 Ca 0.21 -0.12 0.15 0.00 0.84 0.00 0.00 57.88 58.96 3a70 h LEU 81 Cb 0.10 0.05 -0.10 0.00 0.37 0.00 0.00 40.66 41.07 3a70 h LEU 81 CO -0.03 0.01 0.29 0.44 -0.34 0.00 0.00 178.44 178.81 3a70 h ASP 82 N -0.37 0.25 -0.54 1.25 3.32 -1.13 -1.61 116.42 117.60 3a70 h ASP 82 Ca -0.02 0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 3a70 h ASP 82 Cb 0.29 0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.92 3a70 h ASP 82 CO 0.04 0.08 0.28 0.00 -1.72 0.00 0.00 179.24 177.92 3a70 h ALA 83 N 1.57 0.69 -0.11 3.45 0.00 -0.87 -0.07 119.26 123.92 3a70 h ALA 83 Ca 0.42 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 55.11 3a70 h ALA 83 Cb 0.67 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3a70 h ALA 83 CO -0.43 0.22 -0.47 -0.24 0.00 0.00 0.00 179.25 178.33 3a70 h VAL 84 N 0.72 1.33 -0.15 0.00 3.04 -0.79 -2.55 116.25 117.85 3a70 h VAL 84 Ca 0.19 -1.67 -0.04 0.00 -1.01 0.00 0.00 66.70 64.17 3a70 h VAL 84 Cb 0.07 1.77 -0.00 0.00 -2.01 0.00 0.00 31.29 31.12 3a70 h VAL 84 CO -0.03 0.50 -0.07 0.11 -1.01 0.00 0.00 177.57 177.07 3a70 h LYS 85 N 0.21 0.31 -0.82 4.17 1.57 -1.13 -0.18 116.57 120.71 3a70 h LYS 85 Ca 0.01 -0.13 0.21 0.00 -1.87 0.00 0.00 60.65 58.87 3a70 h LYS 85 Cb 0.91 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.17 3a70 h LYS 85 CO 0.07 0.63 0.57 -0.22 -0.57 0.00 0.00 179.45 179.93 3a70 h LYS 86 N -0.02 0.16 -0.00 3.15 3.64 -0.87 0.60 116.57 123.22 3a70 h LYS 86 Ca 0.03 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 3a70 h LYS 86 Cb 0.54 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 3a70 h LYS 86 CO 0.02 0.11 -0.03 0.00 -2.27 0.00 0.00 179.45 177.28 3a70 n ALA 87 N -2.62 2.59 0.00 5.00 0.00 -0.97 -4.91 120.51 119.60 3a70 n ALA 87 Ca 0.17 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3a70 n ALA 87 Cb 0.78 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.77 3a70 n ALA 87 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a70 n GLY 88 N 1.23 1.02 3.51 0.00 0.00 0.21 -5.00 105.19 106.17 3a70 n GLY 88 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 3a70 n GLY 88 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3a70 s TRP 89 N -2.00 2.87 -0.06 1.61 0.52 -0.10 -4.23 118.94 117.54 3a70 s TRP 89 Ca 0.00 -0.15 0.02 0.00 0.02 0.00 0.00 56.10 55.99 3a70 s TRP 89 Cb 0.00 -1.73 0.02 0.00 -1.15 0.00 0.00 33.47 30.60 3a70 s TRP 89 CO 0.00 0.18 -0.11 0.99 0.02 0.00 0.00 176.95 178.03 3a70 s THR 90 N -0.50 1.01 0.13 2.01 2.01 0.08 -3.16 115.64 117.22 3a70 s THR 90 Ca 0.07 -0.40 -0.34 0.00 0.31 0.00 0.00 61.69 61.32 3a70 s THR 90 Cb -0.12 -0.94 -0.14 0.00 0.01 0.00 0.00 72.50 71.31 3a70 s THR 90 CO 0.02 0.33 1.56 -2.65 -0.69 0.00 0.00 174.62 173.19 3a70 n PRO 91 N 3.89 1.98 -2.93 4.92 -0.02 -1.26 0.11 135.00 141.70 3a70 n PRO 91 Ca -0.23 0.72 -0.41 0.00 -2.02 0.00 0.00 63.50 61.56 3a70 n PRO 91 Cb 0.51 -2.47 -0.04 0.00 -0.02 0.00 0.00 33.50 31.48 3a70 n PRO 91 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3a70 s ILE 92 N 1.09 4.97 0.53 4.25 1.01 0.73 -4.82 121.20 128.97 3a70 s ILE 92 Ca 0.81 1.65 -0.13 0.00 0.00 0.00 0.00 60.65 62.98 3a70 s ILE 92 Cb -0.73 -4.14 -0.06 0.00 0.01 0.00 0.00 42.46 37.55 3a70 s ILE 92 CO 0.41 0.20 0.96 0.42 0.00 0.00 0.00 174.94 176.92 3a70 s THR 93 N 1.01 4.65 0.33 2.92 -4.23 -1.26 -4.76 115.64 114.31 3a70 s THR 93 Ca 0.42 0.95 0.09 0.00 -1.18 0.00 0.00 61.69 61.97 3a70 s THR 93 Cb -0.19 -3.78 0.32 0.00 1.34 0.00 0.00 72.50 70.19 3a70 s THR 93 CO 0.21 -0.84 1.78 0.00 -0.54 0.00 0.00 174.62 175.22 3a70 h ALA 94 N 0.48 1.83 -0.16 3.99 0.00 -1.90 -2.34 119.26 121.16 3a70 h ALA 94 Ca -0.46 0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.36 3a70 h ALA 94 Cb 1.19 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 3a70 h ALA 94 CO 0.62 -0.21 -0.60 1.03 0.00 0.00 0.00 179.25 180.09 3a70 h SER 95 N 0.65 0.62 -0.51 0.00 0.87 -1.92 0.43 113.55 113.68 3a70 h SER 95 Ca 0.58 -0.35 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 3a70 h SER 95 Cb 1.06 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 62.82 3a70 h SER 95 CO -0.36 1.07 0.34 1.56 -0.53 0.00 0.00 176.83 178.91 3a70 h GLN 96 N 0.41 0.67 -0.00 2.24 4.20 -1.80 -2.85 115.11 117.98 3a70 h GLN 96 Ca -0.00 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.66 3a70 h GLN 96 Cb 1.16 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.78 3a70 h GLN 96 CO 0.11 0.45 -0.38 1.28 -0.67 0.00 0.00 178.83 179.62 3a70 n LEU 97 N -4.46 0.69 -3.39 1.46 4.77 -1.02 -4.94 117.00 110.11 3a70 n LEU 97 Ca 0.05 -0.09 -0.22 0.00 -0.03 0.00 0.00 56.01 55.71 3a70 n LEU 97 Cb 0.05 -0.20 0.08 0.00 -2.33 0.00 0.00 43.42 41.01 3a70 n LEU 97 CO 0.36 0.15 0.23 0.61 -1.33 0.00 0.00 177.39 177.40 3a70 n GLY 98 N 1.43 -0.45 3.72 -0.72 0.00 -0.66 -4.84 105.19 103.67 3a70 n GLY 98 Ca 0.08 0.19 -0.36 0.00 0.00 0.00 0.00 46.02 45.93 3a70 n GLY 98 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3a70 s TYR 99 N -3.30 3.45 -1.26 1.61 5.04 0.05 -5.00 117.35 117.94 3a70 s TYR 99 Ca 0.53 0.56 0.16 0.00 -2.44 0.00 0.00 57.07 55.88 3a70 s TYR 99 Cb -0.23 -2.33 0.48 0.00 0.35 0.00 0.00 41.96 40.22 3a70 s TYR 99 CO 0.68 0.22 1.40 -0.40 -1.34 0.00 0.00 175.55 176.12 3a70 n ASP 100 N 3.64 3.53 -1.98 4.32 3.85 -1.26 -4.70 116.55 123.95 3a70 n ASP 100 Ca -0.12 -2.11 0.00 0.00 -0.71 0.00 0.00 54.79 51.85 3a70 n ASP 100 Cb 0.52 -0.37 0.00 0.00 -1.35 0.00 0.00 41.12 39.91 3a70 n ASP 100 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3a70 n GLY 101 N 0.91 0.04 3.74 6.12 0.00 -1.26 -5.05 105.19 109.69 3a70 n GLY 101 Ca 0.18 -1.81 -0.40 0.00 0.00 0.00 0.00 46.02 43.99 3a70 n GLY 101 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3a70 s LYS 102 N -1.04 4.55 0.35 1.61 2.20 -1.26 -5.04 119.74 121.11 3a70 s LYS 102 Ca 0.00 1.18 0.07 0.00 -0.36 0.00 0.00 55.97 56.86 3a70 s LYS 102 Cb 0.00 -3.38 -0.07 0.00 -1.51 0.00 0.00 37.83 32.87 3a70 s LYS 102 CO 0.00 0.23 -0.03 0.95 -0.36 0.00 0.00 175.35 176.15 3a70 s THR 103 N 0.07 1.88 0.45 3.43 -4.23 -1.26 -2.06 115.64 113.92 3a70 s THR 103 Ca 0.41 -2.08 0.05 0.00 -1.18 0.00 0.00 61.69 58.90 3a70 s THR 103 Cb -0.21 -2.76 0.05 0.00 1.34 0.00 0.00 72.50 70.92 3a70 s THR 103 CO 0.25 -0.11 0.45 -0.90 -0.54 0.00 0.00 174.62 173.76 3a70 n ASP 104 N -0.80 2.15 0.27 3.99 5.75 -1.02 -4.96 116.55 121.93 3a70 n ASP 104 Ca -0.05 -2.42 0.14 0.00 -0.01 0.00 0.00 54.79 52.45 3a70 n ASP 104 Cb 0.65 -0.15 0.73 0.00 -1.03 0.00 0.00 41.12 41.32 3a70 n ASP 104 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3a70 h ALA 105 N 0.51 1.21 -0.01 2.12 0.00 -2.03 -0.53 119.26 120.53 3a70 h ALA 105 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3a70 h ALA 105 Cb 1.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.81 3a70 h ALA 105 CO 0.39 -0.21 -0.37 0.54 0.00 0.00 0.00 179.25 179.61 3a70 n ARG 106 N -2.61 0.91 -0.62 0.00 1.74 -1.26 -4.93 116.66 109.89 3a70 n ARG 106 Ca -0.02 -0.64 0.00 0.00 -0.77 0.00 0.00 57.85 56.43 3a70 n ARG 106 Cb 0.27 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.23 3a70 n ARG 106 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3a70 n GLY 107 N 1.38 0.73 3.76 -0.13 0.00 -0.21 -5.05 105.19 105.67 3a70 n GLY 107 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 3a70 n GLY 107 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a70 s THR 108 N -2.43 2.67 -0.02 2.61 2.01 -1.26 -4.79 115.64 114.43 3a70 s THR 108 Ca 0.00 0.62 -0.13 0.00 0.31 0.00 0.00 61.69 62.50 3a70 s THR 108 Cb 0.00 -3.40 -0.05 0.00 0.01 0.00 0.00 72.50 69.06 3a70 s THR 108 CO 0.00 0.13 0.35 -0.36 -0.69 0.00 0.00 174.62 174.04 3a70 s PHE 109 N -0.62 3.69 0.10 4.92 0.08 -0.12 -2.43 117.98 123.59 3a70 s PHE 109 Ca 0.54 0.87 0.07 0.00 0.12 0.00 0.00 56.93 58.53 3a70 s PHE 109 Cb -0.41 -2.20 -0.04 0.00 -0.57 0.00 0.00 43.02 39.80 3a70 s PHE 109 CO 0.49 0.66 -0.11 -0.06 -0.10 0.00 0.00 175.22 176.10 3a70 s PHE 110 N -1.09 2.72 0.59 0.36 0.08 -0.87 -1.16 117.98 118.60 3a70 s PHE 110 Ca 0.22 -0.17 -0.20 0.00 0.12 0.00 0.00 56.93 56.91 3a70 s PHE 110 Cb -0.15 -1.43 -0.03 0.00 -0.57 0.00 0.00 43.02 40.83 3a70 s PHE 110 CO 0.12 0.41 1.33 0.20 -0.10 0.00 0.00 175.22 177.18 3a70 s GLY 111 N -2.14 2.87 0.10 4.36 0.00 -0.32 -4.62 107.32 107.57 3a70 s GLY 111 Ca 0.21 1.28 0.21 0.00 0.00 0.00 0.00 44.72 46.42 3a70 s GLY 111 CO 0.13 1.76 0.81 1.18 0.00 0.00 0.00 173.10 176.98 3a70 n GLU 112 N -1.39 0.63 -4.44 2.90 1.02 0.17 -4.26 120.64 115.27 3a70 n GLU 112 Ca 0.13 0.06 -0.24 0.00 -0.02 0.00 0.00 57.16 57.09 3a70 n GLU 112 Cb 0.46 -1.74 -0.11 0.00 -0.02 0.00 0.00 31.44 30.04 3a70 n GLU 112 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3a70 s LYS 113 N -3.26 1.58 0.24 3.49 1.02 -1.25 -4.99 119.74 116.57 3a70 s LYS 113 Ca -0.03 -1.66 -0.30 0.00 0.02 0.00 0.00 55.97 54.00 3a70 s LYS 113 Cb 0.10 -1.72 -0.15 0.00 -0.52 0.00 0.00 37.83 35.55 3a70 s LYS 113 CO 0.83 0.34 1.10 0.00 -0.92 0.00 0.00 175.35 176.69 3a70 n ALA 114 N -0.26 -0.32 -0.18 5.17 0.00 -1.26 -0.84 120.51 122.81 3a70 n ALA 114 Ca -0.08 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.78 3a70 n ALA 114 Cb 0.59 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 17.99 3a70 n ALA 114 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a70 n GLY 115 N 1.61 2.17 0.00 0.00 0.00 -1.26 -4.82 105.19 102.88 3a70 n GLY 115 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3a70 n GLY 115 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3a70 n TYR 116 N -2.00 0.00 0.51 1.61 4.01 -0.02 -4.85 117.16 116.41 3a70 n TYR 116 Ca 0.00 -0.22 0.07 0.00 -0.16 0.00 0.00 57.90 57.59 3a70 n TYR 116 Cb 0.00 -0.02 0.31 0.00 -0.31 0.00 0.00 39.34 39.32 3a70 n TYR 116 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3a70 n THR 117 N -0.22 0.98 0.14 -0.72 -2.24 -1.13 -1.76 114.28 109.33 3a70 n THR 117 Ca 0.00 0.24 0.09 0.00 -2.27 0.00 0.00 64.05 62.12 3a70 n THR 117 Cb 0.31 -1.00 0.18 0.00 -2.10 0.00 0.00 70.33 67.73 3a70 n THR 117 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3a70 n THR 118 N -1.48 0.60 -2.47 4.28 -2.24 -1.26 -4.15 114.28 107.56 3a70 n THR 118 Ca 0.04 -0.80 -0.40 0.00 -2.27 0.00 0.00 64.05 60.62 3a70 n THR 118 Cb 0.16 0.86 -0.04 0.00 -2.10 0.00 0.00 70.33 69.21 3a70 n THR 118 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3a70 s ALA 119 N -1.22 3.41 0.02 6.98 0.00 -0.72 -4.79 121.76 125.44 3a70 s ALA 119 Ca 0.32 0.90 0.05 0.00 0.00 0.00 0.00 51.96 53.23 3a70 s ALA 119 Cb 0.18 -3.33 -0.02 0.00 0.00 0.00 0.00 23.12 19.95 3a70 s ALA 119 CO 0.25 -0.17 -0.16 -0.65 0.00 0.00 0.00 175.76 175.03 3a70 s GLN 120 N -1.35 1.18 0.00 0.00 1.11 -1.26 -1.17 119.66 118.17 3a70 s GLN 120 Ca 0.45 -0.71 -0.02 0.00 0.01 0.00 0.00 55.36 55.08 3a70 s GLN 120 Cb -0.32 -1.20 -0.01 0.00 -1.01 0.00 0.00 33.01 30.48 3a70 s GLN 120 CO 0.41 0.31 0.04 0.54 0.01 0.00 0.00 175.29 176.60 3a70 s VAL 121 N -0.63 0.07 -0.15 1.09 0.11 -0.30 -1.45 120.40 119.13 3a70 s VAL 121 Ca 0.05 -0.55 -0.05 0.00 -2.93 0.00 0.00 61.98 58.50 3a70 s VAL 121 Cb -0.07 -0.24 -0.04 0.00 -1.53 0.00 0.00 36.38 34.50 3a70 s VAL 121 CO 0.01 -0.30 0.02 -1.61 -3.33 0.00 0.00 175.10 169.89 3a70 s GLU 122 N -0.93 3.67 -0.23 1.54 0.41 0.19 -0.95 118.70 122.41 3a70 s GLU 122 Ca -0.10 -0.40 -0.04 0.00 -0.41 0.00 0.00 54.97 54.02 3a70 s GLU 122 Cb -0.06 -3.04 -0.00 0.00 -1.78 0.00 0.00 34.13 29.25 3a70 s GLU 122 CO -0.00 0.37 -0.04 0.42 -0.49 0.00 0.00 175.26 175.52 3a70 s ILE 123 N 0.06 3.33 0.10 -1.63 -1.09 -1.26 -1.36 121.20 119.35 3a70 s ILE 123 Ca 0.03 -0.58 0.07 0.00 -2.23 0.00 0.00 60.65 57.95 3a70 s ILE 123 Cb -0.13 -2.55 -0.03 0.00 -1.58 0.00 0.00 42.46 38.17 3a70 s ILE 123 CO 0.02 0.37 -0.19 -0.76 -1.23 0.00 0.00 174.94 173.15 3a70 s LEU 124 N 1.46 2.31 -0.01 2.97 1.02 0.66 -0.20 118.68 126.90 3a70 s LEU 124 Ca 0.05 -0.69 0.07 0.00 0.02 0.00 0.00 54.13 53.57 3a70 s LEU 124 Cb -0.15 -0.78 -0.03 0.00 0.02 0.00 0.00 46.19 45.26 3a70 s LEU 124 CO -0.03 0.01 -0.21 -0.83 0.02 0.00 0.00 176.35 175.31 3a70 s GLY 125 N -1.96 1.43 -0.18 -3.19 0.00 0.12 0.23 107.32 103.77 3a70 s GLY 125 Ca 0.05 -1.11 -0.06 0.00 0.00 0.00 0.00 44.72 43.60 3a70 s GLY 125 CO 0.04 -0.94 0.04 1.25 0.00 0.00 0.00 173.10 173.48 3a70 s LYS 126 N -0.91 3.87 -0.04 2.90 2.20 -0.19 -0.74 119.74 126.83 3a70 s LYS 126 Ca 0.12 -0.40 0.05 0.00 -0.36 0.00 0.00 55.97 55.37 3a70 s LYS 126 Cb -0.10 -3.14 -0.00 0.00 -1.51 0.00 0.00 37.83 33.07 3a70 s LYS 126 CO 0.01 0.23 -0.18 0.71 -0.36 0.00 0.00 175.35 175.76 3a70 s TYR 127 N 0.47 1.79 0.84 4.03 2.02 -1.26 -0.25 117.35 124.99 3a70 s TYR 127 Ca 0.01 -0.51 -0.14 0.00 -0.37 0.00 0.00 57.07 56.06 3a70 s TYR 127 Cb -0.13 -1.20 0.19 0.00 -0.40 0.00 0.00 41.96 40.43 3a70 s TYR 127 CO 0.01 -0.16 1.08 -0.40 -1.57 0.00 0.00 175.55 174.51 3a70 n ASP 128 N 3.10 -0.16 -0.33 2.29 5.68 0.14 -4.84 116.55 122.43 3a70 n ASP 128 Ca -0.18 -1.36 0.08 0.00 -0.50 0.00 0.00 54.79 52.84 3a70 n ASP 128 Cb 0.53 -0.84 0.25 0.00 -1.14 0.00 0.00 41.12 39.92 3a70 n ASP 128 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3a70 h ALA 129 N -1.92 1.45 0.00 2.12 0.00 -2.01 0.32 119.26 119.21 3a70 h ALA 129 Ca -0.35 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3a70 h ALA 129 Cb 0.99 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3a70 h ALA 129 CO 0.25 0.04 0.00 1.04 0.00 0.00 0.00 179.25 180.58 3a70 n GLN 130 N -4.75 0.19 -0.90 0.00 3.00 -1.26 -4.91 117.38 108.76 3a70 n GLN 130 Ca 0.19 0.12 0.00 0.00 -0.01 0.00 0.00 57.00 57.30 3a70 n GLN 130 Cb 0.43 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.17 3a70 n GLN 130 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3a70 n GLY 131 N 0.43 0.51 3.82 1.08 0.00 0.11 -5.06 105.19 106.09 3a70 n GLY 131 Ca 0.08 -0.88 -0.37 0.00 0.00 0.00 0.00 46.02 44.85 3a70 n GLY 131 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3a70 s HIS 132 N -2.00 3.71 0.02 1.61 3.76 -1.26 -4.79 115.29 116.35 3a70 s HIS 132 Ca 0.00 1.22 -0.30 0.00 -0.15 0.00 0.00 55.06 55.83 3a70 s HIS 132 Cb 0.00 -2.48 -0.08 0.00 1.11 0.00 0.00 32.58 31.14 3a70 s HIS 132 CO 0.00 0.48 1.75 -1.17 -0.85 0.00 0.00 174.74 174.96 3a70 s LEU 133 N -1.58 4.37 -0.02 0.89 2.96 -1.26 -0.68 118.68 123.36 3a70 s LEU 133 Ca 0.35 2.48 0.11 0.00 -0.22 0.00 0.00 54.13 56.84 3a70 s LEU 133 Cb -0.17 -3.54 -0.17 0.00 0.50 0.00 0.00 46.19 42.80 3a70 s LEU 133 CO 0.20 -0.95 0.23 0.35 -1.32 0.00 0.00 176.35 174.85 3a70 n THR 134 N 5.20 0.05 -3.60 3.68 -2.24 0.66 -4.92 114.28 113.11 3a70 n THR 134 Ca 0.18 -0.27 -0.16 0.00 -2.27 0.00 0.00 64.05 61.53 3a70 n THR 134 Cb 0.41 0.18 -0.07 0.00 -2.10 0.00 0.00 70.33 68.75 3a70 n THR 134 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3a70 s GLU 135 N -2.75 0.90 -0.07 -0.78 2.12 -1.17 -4.90 118.70 112.05 3a70 s GLU 135 Ca -0.04 0.35 0.03 0.00 0.36 0.00 0.00 54.97 55.67 3a70 s GLU 135 Cb 0.07 0.43 -0.02 0.00 0.26 0.00 0.00 34.13 34.86 3a70 s GLU 135 CO 0.46 -0.24 -0.16 0.42 -0.54 0.00 0.00 175.26 175.20 3a70 s ILE 136 N -0.79 2.84 -0.14 -3.70 1.01 -0.28 -1.02 121.20 119.12 3a70 s ILE 136 Ca -0.08 -0.79 -0.00 0.00 0.00 0.00 0.00 60.65 59.78 3a70 s ILE 136 Cb -0.02 -2.11 -0.01 0.00 0.01 0.00 0.00 42.46 40.32 3a70 s ILE 136 CO 0.06 0.57 -0.13 -0.83 0.00 0.00 0.00 174.94 174.62 3a70 s GLY 137 N -0.38 1.54 -0.27 6.18 0.00 0.14 -0.43 107.32 114.09 3a70 s GLY 137 Ca 0.04 -0.92 0.01 0.00 0.00 0.00 0.00 44.72 43.85 3a70 s GLY 137 CO 0.02 -0.14 -0.07 -0.42 0.00 0.00 0.00 173.10 172.50 3a70 s ILE 138 N 0.45 2.54 -0.35 0.90 1.01 0.86 -0.24 121.20 126.36 3a70 s ILE 138 Ca -0.10 -1.47 0.01 0.00 0.00 0.00 0.00 60.65 59.09 3a70 s ILE 138 Cb -0.16 -2.45 0.10 0.00 0.01 0.00 0.00 42.46 39.95 3a70 s ILE 138 CO 0.05 -0.03 0.09 0.00 0.00 0.00 0.00 174.94 175.05 3a70 s ALA 139 N 1.18 2.95 0.09 9.38 0.00 -0.47 -0.21 121.76 134.69 3a70 s ALA 139 Ca -0.06 -2.40 -0.28 0.00 0.00 0.00 0.00 51.96 49.22 3a70 s ALA 139 Cb -0.19 -2.09 -0.06 0.00 0.00 0.00 0.00 23.12 20.78 3a70 s ALA 139 CO -0.04 -1.65 0.89 -0.06 0.00 0.00 0.00 175.76 174.91 3a70 s PHE 140 N 1.04 3.79 0.21 0.00 0.08 -0.40 -0.64 117.98 122.05 3a70 s PHE 140 Ca 0.07 1.68 -0.30 0.00 0.12 0.00 0.00 56.93 58.50 3a70 s PHE 140 Cb -0.20 -2.97 -0.08 0.00 -0.57 0.00 0.00 43.02 39.20 3a70 s PHE 140 CO -0.06 0.23 1.07 0.50 -0.10 0.00 0.00 175.22 176.86 3a70 s ARG 141 N -0.04 4.65 0.76 0.44 3.52 -0.53 -3.89 118.95 123.87 3a70 s ARG 141 Ca 0.44 1.69 -0.13 0.00 -0.13 0.00 0.00 55.73 57.60 3a70 s ARG 141 Cb -0.22 -3.26 0.19 0.00 -1.56 0.00 0.00 34.95 30.10 3a70 s ARG 141 CO 0.27 0.19 0.71 0.41 -0.81 0.00 0.00 175.30 176.08 3a70 n GLY 142 N 1.73 -2.49 3.52 8.12 0.00 -1.19 -3.03 105.19 111.85 3a70 n GLY 142 Ca 0.01 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.11 3a70 n GLY 142 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3a70 n THR 143 N -3.90 2.15 0.00 2.61 -1.04 -1.26 -4.76 114.28 108.08 3a70 n THR 143 Ca 0.10 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.61 3a70 n THR 143 Cb 0.37 -0.81 0.00 0.00 -1.82 0.00 0.00 70.33 68.07 3a70 n THR 143 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 3a70 n SER 144 N 0.88 0.00 -0.94 8.00 3.41 -1.26 -5.02 113.62 118.69 3a70 n SER 144 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 3a70 n SER 144 Cb 0.39 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 3a70 n SER 144 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3a70 n GLY 145 N 1.19 3.70 3.59 5.00 0.00 -1.26 -4.78 105.19 112.63 3a70 n GLY 145 Ca 0.00 -1.52 -0.45 0.00 0.00 0.00 0.00 46.02 44.05 3a70 n GLY 145 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3a70 n PRO 146 N 0.00 1.31 -0.35 1.61 -0.02 -1.26 -4.72 135.00 131.58 3a70 n PRO 146 Ca 0.00 0.46 0.23 0.00 -2.02 0.00 0.00 63.50 62.17 3a70 n PRO 146 Cb 0.00 -1.86 0.48 0.00 -0.02 0.00 0.00 33.50 32.10 3a70 n PRO 146 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3a70 h ARG 147 N 2.30 0.40 -1.05 -0.52 3.08 -1.97 -1.85 114.38 114.77 3a70 h ARG 147 Ca -0.40 -0.02 0.28 0.00 0.07 0.00 0.00 59.98 59.90 3a70 h ARG 147 Cb 1.34 -0.09 -0.11 0.00 0.08 0.00 0.00 29.97 31.19 3a70 h ARG 147 CO 0.63 0.26 0.66 0.93 -1.07 0.00 0.00 179.97 181.38 3a70 h GLU 148 N 0.41 0.40 -0.47 0.04 3.07 -1.91 -3.23 114.58 112.90 3a70 h GLU 148 Ca 0.67 -0.02 -0.28 0.00 -0.50 0.00 0.00 59.36 59.22 3a70 h GLU 148 Cb 1.57 -0.09 -0.40 0.00 -0.84 0.00 0.00 28.75 28.98 3a70 h GLU 148 CO -0.44 0.27 -1.08 -1.71 -1.40 0.00 0.00 179.01 174.65 3a70 n ASN 149 N -4.73 2.01 0.07 1.42 4.05 -0.71 -4.96 115.26 112.41 3a70 n ASN 149 Ca 0.27 -2.25 -0.13 0.00 0.45 0.00 0.00 54.58 52.92 3a70 n ASN 149 Cb 0.89 -0.46 -0.08 0.00 1.23 0.00 0.00 39.78 41.36 3a70 n ASN 149 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 3a70 h LEU 150 N 2.55 -0.12 0.46 1.20 5.85 -1.53 -0.93 115.31 122.79 3a70 h LEU 150 Ca -0.07 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.42 3a70 h LEU 150 Cb 1.31 0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.37 3a70 h LEU 150 CO 0.26 0.13 -0.22 0.40 -0.34 0.00 0.00 178.44 178.67 3a70 h ILE 151 N -0.39 0.55 -0.45 4.05 1.08 -1.90 0.43 117.51 120.88 3a70 h ILE 151 Ca -0.02 -0.09 0.01 0.00 -0.39 0.00 0.00 64.86 64.38 3a70 h ILE 151 Cb 0.32 0.59 -0.02 0.00 -3.07 0.00 0.00 36.82 34.64 3a70 h ILE 151 CO 0.02 0.02 0.29 0.25 -0.69 0.00 0.00 178.15 178.04 3a70 h LEU 152 N -0.66 0.50 -0.54 1.44 5.85 -1.97 -0.78 115.31 119.13 3a70 h LEU 152 Ca -0.06 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.62 3a70 h LEU 152 Cb 0.50 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 3a70 h LEU 152 CO 0.10 0.36 0.22 -0.78 -0.34 0.00 0.00 178.44 178.00 3a70 h ASP 153 N 0.60 0.75 -0.66 1.25 3.58 -1.15 -2.69 116.42 118.10 3a70 h ASP 153 Ca 0.17 -0.17 -0.04 0.00 0.42 0.00 0.00 57.03 57.41 3a70 h ASP 153 Cb -0.05 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 40.77 3a70 h ASP 153 CO -0.05 0.72 0.27 0.28 -2.88 0.00 0.00 179.24 177.58 3a70 h SER 154 N 0.74 0.92 -0.16 2.28 0.02 -0.36 -1.44 113.55 115.56 3a70 h SER 154 Ca 0.18 -0.13 0.02 0.00 -0.84 0.00 0.00 61.79 61.02 3a70 h SER 154 Cb 0.20 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 3a70 h SER 154 CO -0.01 0.82 0.05 0.40 -1.14 0.00 0.00 176.83 176.95 3a70 h ILE 155 N 0.99 0.96 -0.31 3.27 2.04 -0.91 0.72 117.51 124.26 3a70 h ILE 155 Ca 0.23 -0.04 0.07 0.00 1.00 0.00 0.00 64.86 66.12 3a70 h ILE 155 Cb 0.19 0.82 -0.07 0.00 -0.74 0.00 0.00 36.82 37.02 3a70 h ILE 155 CO -0.02 0.02 -0.16 1.23 0.00 0.00 0.00 178.15 179.22 3a70 h GLY 156 N 0.12 0.07 0.40 5.37 0.00 -1.15 -2.09 103.07 105.79 3a70 h GLY 156 Ca 0.07 0.20 0.09 0.00 0.00 0.00 0.00 47.33 47.69 3a70 h GLY 156 CO -0.07 -0.17 0.17 -0.55 0.00 0.00 0.00 176.54 175.91 3a70 h ASP 157 N -0.12 0.13 -0.82 0.19 3.45 -0.85 -2.49 116.42 115.89 3a70 h ASP 157 Ca 0.16 0.08 -0.03 0.00 0.43 0.00 0.00 57.03 57.67 3a70 h ASP 157 Cb 0.36 0.08 -0.04 0.00 -0.56 0.00 0.00 39.33 39.18 3a70 h ASP 157 CO -0.38 0.09 0.40 0.58 -1.57 0.00 0.00 179.24 178.36 3a70 h VAL 158 N 0.33 1.25 -0.71 -1.35 2.07 -0.37 0.12 116.25 117.60 3a70 h VAL 158 Ca 0.27 -0.70 0.07 0.00 0.82 0.00 0.00 66.70 67.16 3a70 h VAL 158 Cb 0.34 0.18 -0.06 0.00 -1.52 0.00 0.00 31.29 30.23 3a70 h VAL 158 CO -0.30 0.30 0.39 0.40 0.02 0.00 0.00 177.57 178.38 3a70 h ILE 159 N 1.18 0.95 -0.69 4.57 2.04 -1.20 0.24 117.51 124.59 3a70 h ILE 159 Ca 0.29 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.86 3a70 h ILE 159 Cb 0.10 0.18 -0.03 0.00 -0.74 0.00 0.00 36.82 36.33 3a70 h ILE 159 CO -0.04 0.13 0.27 0.78 0.00 0.00 0.00 178.15 179.29 3a70 h ASN 160 N 0.71 0.96 -0.20 1.72 -0.26 -0.79 -0.55 115.58 117.17 3a70 h ASN 160 Ca 0.32 -0.18 -0.00 0.00 -0.56 0.00 0.00 56.30 55.89 3a70 h ASN 160 Cb 0.23 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 37.23 3a70 h ASN 160 CO -0.20 0.88 0.12 0.44 -1.06 0.00 0.00 177.43 177.61 3a70 h ASP 161 N 0.99 0.23 -0.52 5.81 3.32 -0.10 -1.74 116.42 124.40 3a70 h ASP 161 Ca 0.23 -0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.19 3a70 h ASP 161 Cb 0.22 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 3a70 h ASP 161 CO -0.02 0.20 0.17 -0.07 -1.72 0.00 0.00 179.24 177.81 3a70 h LEU 162 N 0.24 0.80 -0.98 1.55 3.38 -0.31 -2.93 115.31 117.05 3a70 h LEU 162 Ca 0.07 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 3a70 h LEU 162 Cb 0.01 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3a70 h LEU 162 CO -0.01 0.76 -0.37 -0.07 0.09 0.00 0.00 178.44 178.84 3a70 h LEU 163 N 0.83 0.28 -1.52 1.67 4.07 -0.72 0.14 115.31 120.06 3a70 h LEU 163 Ca 0.19 -0.11 0.11 0.00 0.08 0.00 0.00 57.88 58.15 3a70 h LEU 163 Cb 0.26 -0.08 -0.05 0.00 1.08 0.00 0.00 40.66 41.87 3a70 h LEU 163 CO -0.01 0.63 0.47 0.00 -1.08 0.00 0.00 178.44 178.45 3a70 h ALA 164 N 1.39 1.95 0.04 1.53 0.00 -1.13 0.23 119.26 123.26 3a70 h ALA 164 Ca 0.03 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.58 3a70 h ALA 164 Cb 0.76 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 3a70 h ALA 164 CO 0.06 -0.11 -2.05 0.00 0.00 0.00 0.00 179.25 177.15 3a70 n ALA 165 N -2.49 1.27 -0.27 0.00 0.00 -0.93 -4.64 120.51 113.46 3a70 n ALA 165 Ca 0.12 -0.85 0.00 0.00 0.00 0.00 0.00 53.44 52.71 3a70 n ALA 165 Cb 0.39 -0.56 0.00 0.00 0.00 0.00 0.00 19.45 19.28 3a70 n ALA 165 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3a70 n PHE 166 N -3.19 0.00 -1.33 0.00 3.72 0.43 -4.42 117.46 112.66 3a70 n PHE 166 Ca -0.30 -0.11 0.00 0.00 -0.05 0.00 0.00 57.45 56.99 3a70 n PHE 166 Cb 1.06 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.59 3a70 n PHE 166 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3a70 n GLY 167 N -0.11 2.31 3.60 1.37 0.00 0.06 -4.96 105.19 107.45 3a70 n GLY 167 Ca 0.00 -1.92 -0.40 0.00 0.00 0.00 0.00 46.02 43.70 3a70 n GLY 167 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3a70 n PRO 168 N 0.00 1.11 -0.28 1.61 -0.02 -1.26 -4.88 135.00 131.28 3a70 n PRO 168 Ca 0.00 0.41 0.08 0.00 -2.02 0.00 0.00 63.50 61.97 3a70 n PRO 168 Cb 0.00 -2.06 0.23 0.00 -0.02 0.00 0.00 33.50 31.65 3a70 n PRO 168 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3a70 h LYS 169 N 1.03 0.47 -0.87 -0.52 3.64 -1.96 -1.83 116.57 116.53 3a70 h LYS 169 Ca -0.46 -0.03 -0.20 0.00 -1.27 0.00 0.00 60.65 58.69 3a70 h LYS 169 Cb 1.35 -0.11 -0.12 0.00 -0.41 0.00 0.00 32.23 32.95 3a70 h LYS 169 CO 0.54 0.31 0.25 -0.25 -2.27 0.00 0.00 179.45 178.03 3a70 n ASP 170 N -4.98 3.85 -0.01 4.20 8.00 -1.26 -4.61 116.55 121.74 3a70 n ASP 170 Ca 0.17 -2.90 -0.12 0.00 0.71 0.00 0.00 54.79 52.66 3a70 n ASP 170 Cb 0.49 -0.69 -0.07 0.00 -0.02 0.00 0.00 41.12 40.84 3a70 n ASP 170 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 3a70 h TYR 171 N 1.60 0.13 0.15 1.24 3.20 -1.63 -1.55 116.97 120.10 3a70 h TYR 171 Ca 0.24 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.10 3a70 h TYR 171 Cb 1.95 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 40.17 3a70 h TYR 171 CO 0.94 0.28 -0.13 0.00 -1.64 0.00 0.00 178.16 177.61 3a70 h ALA 172 N 0.83 -0.28 -0.92 1.82 0.00 -1.82 -1.81 119.26 117.08 3a70 h ALA 172 Ca 0.03 -0.04 0.26 0.00 0.00 0.00 0.00 54.91 55.15 3a70 h ALA 172 Cb 0.21 0.19 -0.15 0.00 0.00 0.00 0.00 17.79 18.04 3a70 h ALA 172 CO -0.00 -0.67 0.28 -0.22 0.00 0.00 0.00 179.25 178.63 3a70 h LYS 173 N -0.31 0.18 0.00 0.00 3.64 -1.86 -2.49 116.57 115.74 3a70 h LYS 173 Ca -0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3a70 h LYS 173 Cb 0.28 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 3a70 h LYS 173 CO -0.02 0.12 -0.53 0.09 -2.27 0.00 0.00 179.45 176.84 3a70 n ASN 174 N -5.23 0.69 -0.32 4.20 3.02 -0.59 -4.46 115.26 112.56 3a70 n ASN 174 Ca 0.24 0.16 0.03 0.00 -0.03 0.00 0.00 54.58 54.99 3a70 n ASN 174 Cb 0.77 0.04 0.11 0.00 -0.61 0.00 0.00 39.78 40.08 3a70 n ASN 174 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 3a70 h TYR 175 N 0.00 -0.54 -0.15 3.10 3.20 -0.85 -0.81 116.97 120.91 3a70 h TYR 175 Ca 0.00 0.08 -0.14 0.00 3.14 0.00 0.00 58.73 61.81 3a70 h TYR 175 Cb 0.72 0.38 -0.01 0.00 1.54 0.00 0.00 36.73 39.36 3a70 h TYR 175 CO 0.00 -0.39 -0.51 0.28 -1.64 0.00 0.00 178.16 175.90 3a70 h VAL 176 N -0.01 1.33 -0.14 1.81 2.07 -1.79 -0.46 116.25 119.07 3a70 h VAL 176 Ca 0.42 -1.75 0.03 0.00 0.82 0.00 0.00 66.70 66.21 3a70 h VAL 176 Cb 0.65 1.77 -0.03 0.00 -1.52 0.00 0.00 31.29 32.16 3a70 h VAL 176 CO -0.92 0.53 -0.04 1.23 0.02 0.00 0.00 177.57 178.39 3a70 h GLY 177 N 1.19 0.09 1.08 2.17 0.00 -1.57 0.55 103.07 106.59 3a70 h GLY 177 Ca 0.01 0.05 -0.14 0.00 0.00 0.00 0.00 47.33 47.26 3a70 h GLY 177 CO 0.09 -0.06 -0.30 0.83 0.00 0.00 0.00 176.54 177.10 3a70 h GLU 178 N -0.01 0.90 -0.04 4.80 4.39 -1.13 -2.74 114.58 120.74 3a70 h GLU 178 Ca 0.07 -0.44 -0.23 0.00 0.34 0.00 0.00 59.36 59.10 3a70 h GLU 178 Cb 0.11 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.78 3a70 h GLU 178 CO -0.15 1.09 -0.85 0.00 -1.16 0.00 0.00 179.01 177.94 3a70 h ALA 179 N 0.79 0.16 0.00 3.43 0.00 -1.04 -3.34 119.26 119.25 3a70 h ALA 179 Ca 0.07 -0.63 -0.16 0.00 0.00 0.00 0.00 54.91 54.18 3a70 h ALA 179 Cb 0.89 0.03 -0.34 0.00 0.00 0.00 0.00 17.79 18.37 3a70 h ALA 179 CO 0.08 0.59 -0.94 1.19 0.00 0.00 0.00 179.25 180.17 3a70 n PHE 180 N -3.98 0.00 -0.13 0.00 3.72 0.17 0.42 117.46 117.67 3a70 n PHE 180 Ca -0.10 -0.47 -0.04 0.00 -0.05 0.00 0.00 57.45 56.79 3a70 n PHE 180 Cb 0.79 -0.09 0.03 0.00 -0.94 0.00 0.00 39.48 39.27 3a70 n PHE 180 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3a70 h GLY 181 N 0.85 0.36 0.53 1.37 0.00 -1.38 -1.61 103.07 103.20 3a70 h GLY 181 Ca -0.24 0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.17 3a70 h GLY 181 CO 0.06 -0.14 -0.15 3.43 0.00 0.00 0.00 176.54 179.74 3a70 h ASN 182 N 0.05 -0.36 -0.90 0.19 2.35 -1.92 -2.81 115.58 112.18 3a70 h ASN 182 Ca 0.21 -0.18 0.23 0.00 -0.55 0.00 0.00 56.30 56.01 3a70 h ASN 182 Cb 0.31 0.09 -0.16 0.00 0.05 0.00 0.00 38.32 38.61 3a70 h ASN 182 CO -0.39 0.08 0.04 0.25 -1.65 0.00 0.00 177.43 175.76 3a70 h LEU 183 N -0.90 -0.38 -0.94 1.61 5.85 -1.92 0.22 115.31 118.86 3a70 h LEU 183 Ca -0.04 0.24 -0.11 0.00 0.84 0.00 0.00 57.88 58.81 3a70 h LEU 183 Cb 0.52 0.41 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 3a70 h LEU 183 CO 0.07 -0.27 -0.53 -0.07 -0.34 0.00 0.00 178.44 177.31 3a70 h LEU 184 N 0.07 0.00 -0.55 2.25 3.38 -1.34 -0.17 115.31 118.95 3a70 h LEU 184 Ca 0.53 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.48 3a70 h LEU 184 Cb 1.05 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.77 3a70 h LEU 184 CO -0.81 0.53 0.26 0.78 0.09 0.00 0.00 178.44 179.29 3a70 h ASN 185 N 0.00 0.73 -0.23 -0.43 2.35 -0.32 -1.88 115.58 115.79 3a70 h ASN 185 Ca -0.01 -0.14 -0.01 0.00 -0.55 0.00 0.00 56.30 55.59 3a70 h ASN 185 Cb 0.94 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 39.11 3a70 h ASN 185 CO 0.07 0.66 0.11 0.44 -1.65 0.00 0.00 177.43 177.06 3a70 h ASP 186 N 0.74 0.35 -0.32 5.81 3.32 -0.50 -2.17 116.42 123.65 3a70 h ASP 186 Ca 0.19 -0.03 -0.11 0.00 0.02 0.00 0.00 57.03 57.10 3a70 h ASP 186 Cb 0.13 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 3a70 h ASP 186 CO -0.02 0.32 -0.22 0.58 -1.72 0.00 0.00 179.24 178.18 3a70 h VAL 187 N 0.39 1.29 -0.34 -1.35 2.07 -0.79 -0.62 116.25 116.90 3a70 h VAL 187 Ca 0.10 -1.36 0.06 0.00 0.82 0.00 0.00 66.70 66.33 3a70 h VAL 187 Cb 0.08 1.47 -0.06 0.00 -1.52 0.00 0.00 31.29 31.26 3a70 h VAL 187 CO -0.01 0.44 -0.02 0.58 0.02 0.00 0.00 177.57 178.58 3a70 h VAL 188 N 0.48 0.73 -0.82 2.57 2.07 -1.06 0.14 116.25 120.36 3a70 h VAL 188 Ca 0.06 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 67.52 3a70 h VAL 188 Cb 0.77 0.64 -0.04 0.00 -1.52 0.00 0.00 31.29 31.15 3a70 h VAL 188 CO 0.06 0.01 0.34 0.00 0.02 0.00 0.00 177.57 178.01 3a70 h ALA 189 N 1.31 1.06 -0.49 1.67 0.00 -1.33 -1.43 119.26 120.05 3a70 h ALA 189 Ca 0.17 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3a70 h ALA 189 Cb 0.24 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3a70 h ALA 189 CO -0.29 0.67 0.15 0.35 0.00 0.00 0.00 179.25 180.13 3a70 h PHE 190 N 1.18 0.79 0.06 0.00 3.57 -0.62 -1.35 116.94 120.57 3a70 h PHE 190 Ca 0.27 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.69 3a70 h PHE 190 Cb 0.19 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.70 3a70 h PHE 190 CO 0.02 0.69 -0.03 0.00 -2.23 0.00 0.00 178.31 176.76 3a70 h ALA 191 N 1.01 -0.08 -0.27 2.41 0.00 -0.47 -2.45 119.26 119.41 3a70 h ALA 191 Ca 0.16 -0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.05 3a70 h ALA 191 Cb 0.27 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 3a70 h ALA 191 CO -0.01 -0.49 -0.15 0.87 0.00 0.00 0.00 179.25 179.47 3a70 h LYS 192 N -0.21 -0.12 -0.75 0.00 1.79 -1.23 -0.24 116.57 115.81 3a70 h LYS 192 Ca -0.01 0.01 0.22 0.00 -2.18 0.00 0.00 60.65 58.69 3a70 h LYS 192 Cb 0.18 0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.83 3a70 h LYS 192 CO 0.01 -0.08 0.54 0.00 -1.08 0.00 0.00 179.45 178.84 3a70 h ALA 193 N 1.06 2.69 -0.68 3.86 0.00 -1.14 -0.70 119.26 124.34 3a70 h ALA 193 Ca 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3a70 h ALA 193 Cb 0.35 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3a70 h ALA 193 CO -0.35 -0.90 0.00 0.09 0.00 0.00 0.00 179.25 178.09 3a70 n ASN 194 N -4.32 3.87 -0.05 0.00 3.02 -0.54 -4.95 115.26 112.30 3a70 n ASN 194 Ca 0.15 -2.00 -0.01 0.00 -0.03 0.00 0.00 54.58 52.70 3a70 n ASN 194 Cb 0.81 -0.45 -0.00 0.00 -0.61 0.00 0.00 39.78 39.52 3a70 n ASN 194 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3a70 n GLY 195 N 1.59 0.45 3.94 7.41 0.00 -0.27 -4.86 105.19 113.45 3a70 n GLY 195 Ca 0.24 -0.81 -0.26 0.00 0.00 0.00 0.00 46.02 45.18 3a70 n GLY 195 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3a70 s LEU 196 N -0.15 4.31 0.00 0.99 1.02 -0.21 -5.00 118.68 119.64 3a70 s LEU 196 Ca 0.00 0.22 0.00 0.00 0.02 0.00 0.00 54.13 54.37 3a70 s LEU 196 Cb 0.00 -2.97 0.00 0.00 0.02 0.00 0.00 46.19 43.24 3a70 s LEU 196 CO 0.00 0.03 0.00 -1.54 0.02 0.00 0.00 176.35 174.86 3a70 n SER 197 N -0.60 1.70 -0.27 2.29 3.41 -1.26 -3.84 113.62 115.05 3a70 n SER 197 Ca -0.07 -0.59 0.03 0.00 -0.26 0.00 0.00 58.87 57.99 3a70 n SER 197 Cb 0.54 0.00 0.25 0.00 -0.26 0.00 0.00 64.21 64.74 3a70 n SER 197 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3a70 h GLY 198 N 0.00 1.21 2.00 5.00 0.00 -1.91 -2.65 103.07 106.72 3a70 h GLY 198 Ca 0.00 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 46.93 3a70 h GLY 198 CO 0.00 0.31 -0.01 0.07 0.00 0.00 0.00 176.54 176.91 3a70 h LYS 199 N 1.00 0.00 -0.56 4.80 2.10 -1.86 -2.08 116.57 119.96 3a70 h LYS 199 Ca 0.35 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.00 3a70 h LYS 199 Cb 0.13 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.46 3a70 h LYS 199 CO -0.12 0.01 0.00 -0.25 -2.00 0.00 0.00 179.45 177.09 3a70 n ASP 200 N -3.17 2.89 -4.24 7.07 8.00 -1.00 -4.77 116.55 121.34 3a70 n ASP 200 Ca -0.02 -2.21 -0.33 0.00 0.71 0.00 0.00 54.79 52.94 3a70 n ASP 200 Cb 0.17 -0.42 -0.16 0.00 -0.02 0.00 0.00 41.12 40.70 3a70 n ASP 200 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3a70 s VAL 201 N -1.66 2.43 -0.17 2.53 1.01 -0.79 -1.12 120.40 122.63 3a70 s VAL 201 Ca 0.30 -0.86 -0.05 0.00 0.00 0.00 0.00 61.98 61.38 3a70 s VAL 201 Cb 0.19 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 3a70 s VAL 201 CO 0.16 0.53 -0.01 -0.22 0.00 0.00 0.00 175.10 175.56 3a70 s LEU 202 N 0.73 3.38 -0.17 3.92 2.96 0.43 -1.71 118.68 128.22 3a70 s LEU 202 Ca -0.08 -0.09 -0.01 0.00 -0.22 0.00 0.00 54.13 53.74 3a70 s LEU 202 Cb -0.16 -1.83 0.00 0.00 0.50 0.00 0.00 46.19 44.70 3a70 s LEU 202 CO 0.01 0.15 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.36 3a70 s VAL 203 N 0.47 2.70 0.30 1.68 1.01 0.26 -0.10 120.40 126.72 3a70 s VAL 203 Ca -0.02 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.26 3a70 s VAL 203 Cb -0.14 -2.16 -0.01 0.00 0.00 0.00 0.00 36.38 34.07 3a70 s VAL 203 CO 0.02 0.50 0.32 -0.24 0.00 0.00 0.00 175.10 175.70 3a70 n SER 204 N 4.34 -0.84 0.00 3.32 2.88 0.71 -1.53 113.62 122.50 3a70 n SER 204 Ca -0.19 -2.83 0.00 0.00 -1.33 0.00 0.00 58.87 54.52 3a70 n SER 204 Cb 0.51 1.76 0.00 0.00 -0.75 0.00 0.00 64.21 65.73 3a70 n SER 204 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3a70 n GLY 205 N -0.54 3.02 3.17 0.46 0.00 -1.25 -1.28 105.19 108.77 3a70 n GLY 205 Ca 0.04 -1.18 -0.26 0.00 0.00 0.00 0.00 46.02 44.63 3a70 n GLY 205 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3a70 s HIS 206 N -2.00 1.66 0.00 1.61 2.46 -1.25 -0.82 115.29 116.95 3a70 s HIS 206 Ca 0.00 -0.35 0.00 0.00 0.47 0.00 0.00 55.06 55.18 3a70 s HIS 206 Cb 0.00 -1.08 0.00 0.00 -0.13 0.00 0.00 32.58 31.37 3a70 s HIS 206 CO 0.00 -0.06 0.00 0.45 -2.47 0.00 0.00 174.74 172.66 3a70 n SER 207 N 2.75 0.00 -0.25 9.88 2.88 0.11 -0.90 113.62 128.08 3a70 n SER 207 Ca -0.16 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.51 3a70 n SER 207 Cb 0.53 0.00 0.40 0.00 -0.75 0.00 0.00 64.21 64.40 3a70 n SER 207 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 3a70 h LEU 208 N 0.00 0.61 -1.23 2.46 5.85 -1.85 0.30 115.31 121.44 3a70 h LEU 208 Ca 0.00 0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.69 3a70 h LEU 208 Cb 0.00 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 3a70 h LEU 208 CO 0.00 0.31 -0.17 1.23 -0.34 0.00 0.00 178.44 179.46 3a70 h GLY 209 N 0.64 0.34 1.53 3.75 0.00 -0.93 -0.88 103.07 107.53 3a70 h GLY 209 Ca 0.44 -0.23 -0.18 0.00 0.00 0.00 0.00 47.33 47.35 3a70 h GLY 209 CO -0.19 0.22 -0.67 -1.33 0.00 0.00 0.00 176.54 174.57 3a70 h GLY 210 N 0.88 0.52 0.47 4.60 0.00 -0.74 -0.73 103.07 108.07 3a70 h GLY 210 Ca 0.05 -0.68 0.07 0.00 0.00 0.00 0.00 47.33 46.77 3a70 h GLY 210 CO 0.03 0.61 0.09 -2.00 0.00 0.00 0.00 176.54 175.27 3a70 h LEU 211 N 0.34 0.02 -1.07 3.11 6.46 -0.23 -2.68 115.31 121.26 3a70 h LEU 211 Ca -0.02 0.07 0.02 0.00 -0.12 0.00 0.00 57.88 57.84 3a70 h LEU 211 Cb 1.23 0.10 -0.05 0.00 -0.73 0.00 0.00 40.66 41.20 3a70 h LEU 211 CO 0.12 0.04 0.63 0.00 -0.62 0.00 0.00 178.44 178.61 3a70 h ALA 212 N 1.33 1.35 -0.46 1.25 0.00 -0.92 -0.51 119.26 121.30 3a70 h ALA 212 Ca 0.21 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.14 3a70 h ALA 212 Cb 0.26 -0.36 -0.07 0.00 0.00 0.00 0.00 17.79 17.61 3a70 h ALA 212 CO -0.27 0.58 0.06 0.28 0.00 0.00 0.00 179.25 179.90 3a70 h VAL 213 N 1.25 0.70 -0.18 0.00 2.07 -0.82 -0.93 116.25 118.35 3a70 h VAL 213 Ca 0.36 -0.06 -0.15 0.00 0.82 0.00 0.00 66.70 67.67 3a70 h VAL 213 Cb -0.08 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 3a70 h VAL 213 CO -0.10 0.03 -0.53 0.78 0.02 0.00 0.00 177.57 177.77 3a70 h ASN 214 N 0.18 0.58 -0.03 0.57 2.35 -1.11 -1.91 115.58 116.20 3a70 h ASN 214 Ca 0.23 -0.30 0.01 0.00 -0.55 0.00 0.00 56.30 55.69 3a70 h ASN 214 Cb 0.32 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 3a70 h ASN 214 CO -0.33 1.00 -0.06 -1.28 -1.65 0.00 0.00 177.43 175.11 3a70 h SER 215 N 0.40 -0.17 -0.19 5.81 0.87 -0.84 -1.74 113.55 117.69 3a70 h SER 215 Ca 0.01 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.60 3a70 h SER 215 Cb 1.07 0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 63.10 3a70 h SER 215 CO 0.10 -0.08 0.12 -0.03 -0.53 0.00 0.00 176.83 176.41 3a70 h MET 216 N -0.09 0.26 -0.42 2.24 1.85 -0.98 -0.58 114.93 117.20 3a70 h MET 216 Ca 0.03 -0.02 0.07 0.00 -0.61 0.00 0.00 59.70 59.18 3a70 h MET 216 Cb 0.13 -0.06 -0.06 0.00 0.43 0.00 0.00 31.60 32.04 3a70 h MET 216 CO -0.08 0.19 0.04 0.00 -0.40 0.00 0.00 176.91 176.66 3a70 h ALA 217 N 1.06 0.43 -0.80 0.39 0.00 -1.28 -0.02 119.26 119.04 3a70 h ALA 217 Ca 0.07 0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.16 3a70 h ALA 217 Cb -0.01 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 3a70 h ALA 217 CO -0.01 -0.36 0.47 -0.44 0.00 0.00 0.00 179.25 178.91 3a70 h ASP 218 N 0.16 0.71 1.25 0.00 3.32 -0.92 -2.55 116.42 118.39 3a70 h ASP 218 Ca 0.21 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.29 3a70 h ASP 218 Cb 0.28 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.72 3a70 h ASP 218 CO -0.31 0.44 -0.03 0.18 -1.72 0.00 0.00 179.24 177.79 3a70 n LEU 219 N -4.71 0.49 0.10 1.55 4.77 -0.26 -4.48 117.00 114.45 3a70 n LEU 219 Ca 0.12 0.52 -0.02 0.00 -0.03 0.00 0.00 56.01 56.61 3a70 n LEU 219 Cb 0.21 -0.38 0.23 0.00 -2.33 0.00 0.00 43.42 41.15 3a70 n LEU 219 CO 0.29 -0.10 0.65 0.77 -1.33 0.00 0.00 177.39 177.67 3a70 h SER 220 N 0.00 0.24 -0.59 -1.43 4.64 -0.57 0.72 113.55 116.57 3a70 h SER 220 Ca 0.00 -0.10 -0.02 0.00 -0.47 0.00 0.00 61.79 61.20 3a70 h SER 220 Cb 0.64 -0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 62.64 3a70 h SER 220 CO 0.00 0.62 0.30 1.23 -0.87 0.00 0.00 176.83 178.11 3a70 h GLY 221 N 1.20 0.90 0.00 -0.77 0.00 -1.79 -3.31 103.07 99.30 3a70 h GLY 221 Ca 0.02 -0.43 -0.28 0.00 0.00 0.00 0.00 47.33 46.64 3a70 h GLY 221 CO 0.06 0.41 -2.15 0.61 0.00 0.00 0.00 176.54 175.48 3a70 n GLY 222 N -0.98 -0.86 4.01 4.60 0.00 -1.04 -4.06 105.19 106.87 3a70 n GLY 222 Ca 0.04 -0.31 -0.18 0.00 0.00 0.00 0.00 46.02 45.57 3a70 n GLY 222 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a70 s LYS 223 N -2.53 2.74 -1.53 1.61 1.02 0.22 -4.53 119.74 116.74 3a70 s LYS 223 Ca -0.08 -1.25 -0.17 0.00 0.02 0.00 0.00 55.97 54.49 3a70 s LYS 223 Cb 0.06 -2.73 0.15 0.00 -0.52 0.00 0.00 37.83 34.79 3a70 s LYS 223 CO 0.72 -0.37 0.63 0.91 -0.92 0.00 0.00 175.35 176.31 3a70 n TRP 224 N -1.93 -1.64 -1.87 3.18 8.01 -1.26 -1.00 117.44 120.93 3a70 n TRP 224 Ca 0.09 0.64 -0.17 0.00 -1.31 0.00 0.00 57.50 56.76 3a70 n TRP 224 Cb 0.59 -2.55 -0.04 0.00 -2.01 0.00 0.00 31.31 27.30 3a70 n TRP 224 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3a70 n GLY 225 N -1.20 0.75 2.70 6.99 0.00 -1.26 -1.95 105.19 111.21 3a70 n GLY 225 Ca 0.06 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3a70 n GLY 225 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a70 n GLY 226 N -0.97 0.24 0.27 -0.02 0.00 -0.17 -4.91 105.19 99.62 3a70 n GLY 226 Ca -0.18 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.79 3a70 n GLY 226 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3a70 h PHE 227 N 0.00 0.85 -0.15 1.61 3.57 -1.56 -2.56 116.94 118.70 3a70 h PHE 227 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3a70 h PHE 227 Cb 0.50 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 38.96 3a70 h PHE 227 CO 0.32 0.52 0.00 1.19 -2.23 0.00 0.00 178.31 178.11 3a70 n PHE 228 N -4.62 0.20 0.25 0.41 3.72 -1.26 -3.70 117.46 112.46 3a70 n PHE 228 Ca 0.06 -0.10 0.10 0.00 -0.05 0.00 0.00 57.45 57.46 3a70 n PHE 228 Cb 0.03 0.00 0.68 0.00 -0.94 0.00 0.00 39.48 39.25 3a70 n PHE 228 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3a70 h ALA 229 N 3.41 1.97 -0.17 4.37 0.00 -1.54 -2.01 119.26 125.28 3a70 h ALA 229 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3a70 h ALA 229 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3a70 h ALA 229 CO 0.00 -0.04 0.00 -0.25 0.00 0.00 0.00 179.25 178.96 3a70 n ASP 230 N -4.44 2.97 -4.52 0.00 8.00 -1.26 -4.91 116.55 112.40 3a70 n ASP 230 Ca -0.02 -2.64 -0.29 0.00 0.71 0.00 0.00 54.79 52.55 3a70 n ASP 230 Cb 0.12 -0.36 0.20 0.00 -0.02 0.00 0.00 41.12 41.07 3a70 n ASP 230 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3a70 s SER 231 N -1.81 1.98 -0.28 -2.24 0.01 -0.76 -3.70 113.70 106.91 3a70 s SER 231 Ca 0.28 1.13 -0.09 0.00 1.31 0.00 0.00 55.95 58.59 3a70 s SER 231 Cb 0.22 -1.76 -0.02 0.00 0.21 0.00 0.00 66.02 64.67 3a70 s SER 231 CO 0.07 -3.52 0.11 0.20 0.41 0.00 0.00 173.24 170.51 3a70 s ASN 232 N -3.36 5.38 -0.28 2.44 0.01 -0.69 -4.97 114.94 113.46 3a70 s ASN 232 Ca 0.67 -0.34 0.00 0.00 -0.71 0.00 0.00 52.86 52.48 3a70 s ASN 232 Cb -0.18 -1.97 0.05 0.00 0.41 0.00 0.00 41.25 39.56 3a70 s ASN 232 CO 0.59 -0.11 -0.05 -0.31 -1.51 0.00 0.00 177.10 175.71 3a70 s TYR 233 N 1.62 3.26 -0.23 2.20 2.02 -1.26 0.90 117.35 125.86 3a70 s TYR 233 Ca 0.05 -2.06 0.01 0.00 -0.37 0.00 0.00 57.07 54.71 3a70 s TYR 233 Cb -0.16 -2.02 0.05 0.00 -0.40 0.00 0.00 41.96 39.43 3a70 s TYR 233 CO 0.05 -0.84 -0.08 0.42 -1.57 0.00 0.00 175.55 173.53 3a70 s ILE 234 N 1.19 1.73 -0.11 2.71 1.01 -0.58 -1.01 121.20 126.14 3a70 s ILE 234 Ca -0.07 -1.26 -0.03 0.00 0.00 0.00 0.00 60.65 59.30 3a70 s ILE 234 Cb -0.20 -1.89 -0.03 0.00 0.01 0.00 0.00 42.46 40.35 3a70 s ILE 234 CO -0.03 0.00 -0.00 0.00 0.00 0.00 0.00 174.94 174.91 3a70 s ALA 235 N 1.32 3.23 -0.16 9.38 0.00 0.20 -3.90 121.76 131.83 3a70 s ALA 235 Ca -0.05 -0.81 -0.05 0.00 0.00 0.00 0.00 51.96 51.05 3a70 s ALA 235 Cb -0.18 -1.52 -0.03 0.00 0.00 0.00 0.00 23.12 21.38 3a70 s ALA 235 CO -0.07 0.48 0.00 0.71 0.00 0.00 0.00 175.76 176.89 3a70 s TYR 236 N -0.53 3.12 -1.37 0.00 2.02 -0.00 0.08 117.35 120.68 3a70 s TYR 236 Ca 0.09 -0.10 -0.03 0.00 -0.37 0.00 0.00 57.07 56.65 3a70 s TYR 236 Cb -0.12 -1.98 0.02 0.00 -0.40 0.00 0.00 41.96 39.48 3a70 s TYR 236 CO 0.02 0.10 0.25 0.00 -1.57 0.00 0.00 175.55 174.35 3a70 n ALA 237 N 3.36 -0.86 -1.98 3.71 0.00 0.72 0.06 120.51 125.52 3a70 n ALA 237 Ca -0.17 0.15 -0.41 0.00 0.00 0.00 0.00 53.44 53.01 3a70 n ALA 237 Cb 0.52 -2.49 -0.03 0.00 0.00 0.00 0.00 19.45 17.45 3a70 n ALA 237 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3a70 s SER 238 N -2.35 7.10 0.42 0.00 0.15 -1.26 -3.07 113.70 114.69 3a70 s SER 238 Ca 0.16 2.27 0.29 0.00 0.70 0.00 0.00 55.95 59.37 3a70 s SER 238 Cb -0.08 -2.61 1.20 0.00 -1.71 0.00 0.00 66.02 62.82 3a70 s SER 238 CO 0.20 -0.34 1.87 1.55 1.20 0.00 0.00 173.24 177.71 3a70 h PRO 239 N 4.88 0.00 -6.19 5.44 0.13 -1.75 0.05 132.00 134.56 3a70 h PRO 239 Ca -0.45 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.09 3a70 h PRO 239 Cb 1.21 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.23 3a70 h PRO 239 CO 0.73 0.00 -0.70 0.95 -0.23 0.00 0.00 178.00 178.75 3a70 s THR 240 N -3.51 2.90 -0.07 1.56 -4.23 -1.26 -0.63 115.64 110.39 3a70 s THR 240 Ca 0.03 -2.17 0.03 0.00 -1.18 0.00 0.00 61.69 58.40 3a70 s THR 240 Cb 0.09 -2.57 0.01 0.00 1.34 0.00 0.00 72.50 71.37 3a70 s THR 240 CO 0.48 -0.37 -0.17 -1.10 -0.54 0.00 0.00 174.62 172.91 3a70 s GLN 241 N -3.59 2.12 0.47 3.99 1.11 0.36 -4.85 119.66 119.27 3a70 s GLN 241 Ca 0.31 -0.60 -0.21 0.00 0.01 0.00 0.00 55.36 54.87 3a70 s GLN 241 Cb -0.05 -1.71 -0.11 0.00 -1.01 0.00 0.00 33.01 30.13 3a70 s GLN 241 CO 0.17 0.13 0.62 0.45 0.01 0.00 0.00 175.29 176.67 3a70 n SER 242 N 3.56 -0.57 0.00 5.90 2.88 -1.26 -4.29 113.62 119.84 3a70 n SER 242 Ca -0.21 0.87 0.05 0.00 -1.33 0.00 0.00 58.87 58.25 3a70 n SER 242 Cb 0.52 -1.18 0.22 0.00 -0.75 0.00 0.00 64.21 63.03 3a70 n SER 242 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 3a70 n SER 243 N 0.87 0.00 -4.96 -3.46 7.64 -1.26 -4.86 113.62 107.58 3a70 n SER 243 Ca 0.11 0.32 -0.21 0.00 1.01 0.00 0.00 58.87 60.10 3a70 n SER 243 Cb 0.42 -0.39 0.08 0.00 -1.01 0.00 0.00 64.21 63.31 3a70 n SER 243 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3a70 s THR 244 N -2.77 2.04 -0.40 0.44 -4.23 -1.26 -5.00 115.64 104.46 3a70 s THR 244 Ca 0.07 -0.93 0.15 0.00 -1.18 0.00 0.00 61.69 59.80 3a70 s THR 244 Cb 0.06 -2.11 0.81 0.00 1.34 0.00 0.00 72.50 72.60 3a70 s THR 244 CO 0.16 0.00 1.74 -0.90 -0.54 0.00 0.00 174.62 175.08 3a70 n ASP 245 N -2.40 5.61 0.07 3.99 5.68 -1.26 -4.68 116.55 123.56 3a70 n ASP 245 Ca 0.17 -2.85 0.12 0.00 -0.50 0.00 0.00 54.79 51.72 3a70 n ASP 245 Cb 0.62 -0.67 0.09 0.00 -1.14 0.00 0.00 41.12 40.01 3a70 n ASP 245 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3a70 n LYS 246 N 0.72 0.39 -4.63 0.11 5.02 -1.26 -4.93 118.16 113.58 3a70 n LYS 246 Ca 0.28 0.08 -0.33 0.00 -2.02 0.00 0.00 58.31 56.31 3a70 n LYS 246 Cb 1.15 -1.71 -0.15 0.00 -0.02 0.00 0.00 35.03 34.31 3a70 n LYS 246 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3a70 s VAL 247 N -3.24 2.95 -0.38 -0.18 1.01 -1.26 -3.98 120.40 115.33 3a70 s VAL 247 Ca 0.04 -0.68 -0.21 0.00 0.00 0.00 0.00 61.98 61.12 3a70 s VAL 247 Cb 0.12 -2.25 0.01 0.00 0.00 0.00 0.00 36.38 34.26 3a70 s VAL 247 CO 0.76 0.51 0.66 -0.22 0.00 0.00 0.00 175.10 176.81 3a70 s LEU 248 N 0.59 4.28 -0.52 3.92 2.96 -0.18 -4.77 118.68 124.96 3a70 s LEU 248 Ca -0.08 0.07 -0.16 0.00 -0.22 0.00 0.00 54.13 53.74 3a70 s LEU 248 Cb -0.16 -2.81 0.11 0.00 0.50 0.00 0.00 46.19 43.84 3a70 s LEU 248 CO 0.03 -0.66 0.50 0.20 -1.32 0.00 0.00 176.35 175.10 3a70 s ASN 249 N 1.85 6.18 -0.14 3.68 0.02 0.45 -0.63 114.94 126.35 3a70 s ASN 249 Ca 0.25 -1.58 -0.08 0.00 -1.02 0.00 0.00 52.86 50.43 3a70 s ASN 249 Cb -0.14 -2.22 -0.04 0.00 0.02 0.00 0.00 41.25 38.87 3a70 s ASN 249 CO 0.16 -0.83 0.13 -0.69 0.02 0.00 0.00 177.10 175.89 3a70 s VAL 250 N 1.77 5.41 0.07 1.60 1.01 0.11 -1.97 120.40 128.40 3a70 s VAL 250 Ca 0.05 0.18 -0.26 0.00 0.00 0.00 0.00 61.98 61.94 3a70 s VAL 250 Cb -0.27 -3.39 0.09 0.00 0.00 0.00 0.00 36.38 32.81 3a70 s VAL 250 CO 0.05 0.56 1.18 -0.83 0.00 0.00 0.00 175.10 176.06 3a70 s GLY 251 N -0.60 -0.12 0.05 4.51 0.00 -1.26 -0.20 107.32 109.70 3a70 s GLY 251 Ca 0.13 0.06 -0.25 0.00 0.00 0.00 0.00 44.72 44.66 3a70 s GLY 251 CO 0.02 2.88 0.77 -0.19 0.00 0.00 0.00 173.10 176.58 3a70 s TYR 252 N -2.27 3.75 0.30 1.90 2.02 -1.26 -4.48 117.35 117.31 3a70 s TYR 252 Ca 0.22 1.49 0.29 0.00 -0.37 0.00 0.00 57.07 58.70 3a70 s TYR 252 Cb -0.00 -2.82 1.35 0.00 -0.40 0.00 0.00 41.96 40.09 3a70 s TYR 252 CO 0.01 0.29 2.00 1.05 -1.57 0.00 0.00 175.55 177.33 3a70 h GLU 253 N 5.58 0.00 -0.17 -0.62 4.11 0.21 -2.19 114.58 121.50 3a70 h GLU 253 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.99 3a70 h GLU 253 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 3a70 h GLU 253 CO 0.71 0.12 0.00 0.27 0.07 0.00 0.00 179.01 180.18 3a70 n ASN 254 N -3.43 1.78 -4.61 3.06 6.94 -1.26 -4.77 115.26 112.98 3a70 n ASN 254 Ca -0.01 -1.72 -0.43 0.00 -0.02 0.00 0.00 54.58 52.41 3a70 n ASN 254 Cb 0.30 -0.11 -0.02 0.00 -2.36 0.00 0.00 39.78 37.59 3a70 n ASN 254 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3a70 s ASP 255 N -1.60 6.64 0.29 0.53 -1.08 -0.83 -4.74 116.67 115.89 3a70 s ASP 255 Ca 0.33 0.58 0.25 0.00 -0.52 0.00 0.00 52.55 53.19 3a70 s ASP 255 Cb 0.18 -2.55 1.02 0.00 -1.46 0.00 0.00 42.92 40.11 3a70 s ASP 255 CO 0.27 -1.23 1.75 1.55 0.52 0.00 0.00 175.17 178.03 3a70 h PRO 256 N 9.23 0.00 -0.17 4.34 0.13 -1.86 -2.35 132.00 141.32 3a70 h PRO 256 Ca -0.23 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.73 3a70 h PRO 256 Cb 1.07 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 3a70 h PRO 256 CO 1.11 0.00 -0.58 0.28 -0.23 0.00 0.00 178.00 178.59 3a70 h VAL 257 N 0.00 1.32 -2.71 1.56 2.07 -1.91 -3.39 116.25 113.19 3a70 h VAL 257 Ca 0.00 -1.84 -0.56 0.00 0.82 0.00 0.00 66.70 65.13 3a70 h VAL 257 Cb 0.40 1.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.96 3a70 h VAL 257 CO 0.00 0.57 1.05 0.12 0.02 0.00 0.00 177.57 179.33 3a70 s PHE 258 N -3.95 2.20 -1.41 1.57 5.36 -0.88 -2.43 117.98 118.44 3a70 s PHE 258 Ca -0.07 0.45 0.00 0.00 -0.96 0.00 0.00 56.93 56.35 3a70 s PHE 258 Cb 0.11 -3.83 0.00 0.00 -0.34 0.00 0.00 43.02 38.96 3a70 s PHE 258 CO 0.84 -3.17 0.00 0.54 -1.46 0.00 0.00 175.22 171.98 3a70 n ARG 259 N 7.12 -1.09 -0.28 10.12 1.74 0.01 -4.89 116.66 129.39 3a70 n ARG 259 Ca 0.17 0.95 0.17 0.00 -0.77 0.00 0.00 57.85 58.37 3a70 n ARG 259 Cb 0.44 -5.08 0.45 0.00 -1.02 0.00 0.00 32.46 27.24 3a70 n ARG 259 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3a70 h ALA 260 N 0.00 2.03 -2.75 7.54 0.00 -1.50 -3.40 119.26 121.17 3a70 h ALA 260 Ca -0.27 0.03 -0.58 0.00 0.00 0.00 0.00 54.91 54.09 3a70 h ALA 260 Cb 0.95 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.62 3a70 h ALA 260 CO 0.40 -0.33 -0.56 -0.51 0.00 0.00 0.00 179.25 178.25 3a70 s LEU 261 N -9.69 3.87 -0.30 0.00 1.43 0.19 -4.13 118.68 110.06 3a70 s LEU 261 Ca -0.09 -0.07 0.00 0.00 -1.03 0.00 0.00 54.13 52.93 3a70 s LEU 261 Cb 0.23 -2.49 0.06 0.00 0.03 0.00 0.00 46.19 44.03 3a70 s LEU 261 CO 0.79 0.08 -0.01 -0.62 0.23 0.00 0.00 176.35 176.82 3a70 s ASP 262 N -3.02 4.79 0.42 2.29 2.15 -0.40 -4.61 116.67 118.29 3a70 s ASP 262 Ca 0.31 -1.48 0.21 0.00 0.43 0.00 0.00 52.55 52.03 3a70 s ASP 262 Cb -0.10 -1.67 1.18 0.00 -0.30 0.00 0.00 42.92 42.03 3a70 s ASP 262 CO 0.24 -0.28 1.77 1.23 -0.17 0.00 0.00 175.17 177.96 3a70 h GLY 263 N 7.90 1.04 -0.42 2.66 0.00 -1.93 0.29 103.07 112.61 3a70 h GLY 263 Ca -0.18 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 46.98 3a70 h GLY 263 CO 0.53 -0.13 0.00 1.44 0.00 0.00 0.00 176.54 178.38 3a70 n SER 264 N -4.57 2.34 -4.78 0.19 7.64 -1.26 -0.48 113.62 112.70 3a70 n SER 264 Ca 0.26 -2.07 -0.37 0.00 1.01 0.00 0.00 58.87 57.69 3a70 n SER 264 Cb 0.94 -0.10 -0.07 0.00 -1.01 0.00 0.00 64.21 63.97 3a70 n SER 264 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3a70 s THR 265 N -1.13 5.29 -0.07 0.44 2.01 0.09 -4.69 115.64 117.58 3a70 s THR 265 Ca 0.09 0.52 -0.30 0.00 0.31 0.00 0.00 61.69 62.32 3a70 s THR 265 Cb 0.06 -3.59 -0.02 0.00 0.01 0.00 0.00 72.50 68.95 3a70 s THR 265 CO 0.05 0.48 1.03 0.12 -0.69 0.00 0.00 174.62 175.60 3a70 s PHE 266 N -0.17 3.52 0.42 4.92 5.36 -1.26 -1.28 117.98 129.49 3a70 s PHE 266 Ca 0.17 1.57 0.03 0.00 -0.96 0.00 0.00 56.93 57.75 3a70 s PHE 266 Cb -0.13 -3.20 -0.03 0.00 -0.34 0.00 0.00 43.02 39.32 3a70 s PHE 266 CO 0.06 -0.31 0.11 0.95 -1.46 0.00 0.00 175.22 174.56 3a70 s THR 267 N 1.76 0.72 0.35 0.12 -4.23 -1.26 -5.02 115.64 108.08 3a70 s THR 267 Ca 0.50 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 59.08 3a70 s THR 267 Cb -0.20 -2.35 0.13 0.00 1.34 0.00 0.00 72.50 71.42 3a70 s THR 267 CO 0.21 0.00 1.85 1.23 -0.54 0.00 0.00 174.62 177.37 3a70 h GLY 268 N 1.75 0.38 2.00 3.99 0.00 -1.98 -2.71 103.07 106.50 3a70 h GLY 268 Ca -0.37 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 46.71 3a70 h GLY 268 CO 0.60 0.24 0.00 0.00 0.00 0.00 0.00 176.54 177.38 3a70 h ALA 269 N 1.52 1.00 -0.48 3.60 0.00 -1.94 -3.25 119.26 119.71 3a70 h ALA 269 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 3a70 h ALA 269 Cb 0.46 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 3a70 h ALA 269 CO 0.03 0.00 0.25 0.77 0.00 0.00 0.00 179.25 180.29 3a70 h SER 270 N 0.00 0.59 -0.60 0.00 0.02 -1.63 -0.32 113.55 111.60 3a70 h SER 270 Ca 0.00 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 3a70 h SER 270 Cb 0.20 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.59 3a70 h SER 270 CO 0.00 0.49 0.00 1.33 -1.14 0.00 0.00 176.83 177.51 3a70 n VAL 271 N -4.40 1.40 -0.19 2.27 0.24 -1.23 -4.55 118.33 111.88 3a70 n VAL 271 Ca 0.04 -0.99 0.00 0.00 -2.04 0.00 0.00 64.34 61.35 3a70 n VAL 271 Cb 0.11 0.18 0.00 0.00 -1.47 0.00 0.00 33.84 32.66 3a70 n VAL 271 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3a70 n GLY 272 N 1.19 5.59 3.68 7.63 0.00 -0.13 -4.45 105.19 118.71 3a70 n GLY 272 Ca 0.23 -1.05 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 3a70 n GLY 272 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a70 s VAL 273 N 2.27 4.37 -0.48 1.61 1.01 -1.24 -4.60 120.40 123.33 3a70 s VAL 273 Ca 0.00 1.67 0.07 0.00 0.00 0.00 0.00 61.98 63.73 3a70 s VAL 273 Cb 0.00 -4.08 0.26 0.00 0.00 0.00 0.00 36.38 32.56 3a70 s VAL 273 CO 0.00 -0.03 0.61 0.00 0.00 0.00 0.00 175.10 175.69 3a70 n HIS 274 N 5.41 1.12 -1.19 5.22 -0.00 -1.25 -4.70 115.22 119.82 3a70 n HIS 274 Ca 0.11 -3.78 0.05 0.00 -0.00 0.00 0.00 57.72 54.10 3a70 n HIS 274 Cb 0.46 -0.43 0.21 0.00 -0.00 0.00 0.00 29.99 30.24 3a70 n HIS 274 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 3a70 n ASP 275 N 1.14 2.96 -4.76 4.39 2.03 -1.26 -4.79 116.55 116.25 3a70 n ASP 275 Ca 0.24 -3.32 -0.38 0.00 0.52 0.00 0.00 54.79 51.85 3a70 n ASP 275 Cb 0.49 -0.54 0.01 0.00 -0.72 0.00 0.00 41.12 40.35 3a70 n ASP 275 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3a70 s ALA 276 N -2.99 2.99 0.30 -1.67 0.00 -1.26 -4.61 121.76 114.51 3a70 s ALA 276 Ca 0.40 1.11 -0.30 0.00 0.00 0.00 0.00 51.96 53.17 3a70 s ALA 276 Cb 0.35 -3.46 -0.12 0.00 0.00 0.00 0.00 23.12 19.89 3a70 s ALA 276 CO 0.04 -0.89 1.45 -2.30 0.00 0.00 0.00 175.76 174.06 3a70 n PRO 277 N -0.51 2.35 -4.19 0.00 -0.02 -1.26 -5.01 135.00 126.36 3a70 n PRO 277 Ca 0.07 0.83 -0.22 0.00 -2.02 0.00 0.00 63.50 62.17 3a70 n PRO 277 Cb 0.46 -2.52 -0.17 0.00 -0.02 0.00 0.00 33.50 31.26 3a70 n PRO 277 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3a70 s LYS 278 N -1.02 1.09 0.26 -0.52 1.02 -1.26 -5.05 119.74 114.25 3a70 s LYS 278 Ca 0.62 -0.17 -0.01 0.00 0.02 0.00 0.00 55.97 56.43 3a70 s LYS 278 Cb -0.56 -1.07 0.53 0.00 -0.52 0.00 0.00 37.83 36.22 3a70 s LYS 278 CO 0.54 -0.10 1.77 1.49 -0.92 0.00 0.00 175.35 178.13 3a70 h GLU 279 N 7.37 0.64 0.00 1.68 4.22 -2.02 -1.96 114.58 124.51 3a70 h GLU 279 Ca -0.33 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.07 3a70 h GLU 279 Cb 1.16 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.26 3a70 h GLU 279 CO 0.44 0.42 0.00 -1.13 -2.18 0.00 0.00 179.01 176.56 3a70 n SER 280 N -4.84 0.79 -4.68 1.04 3.41 -1.26 -4.92 113.62 103.16 3a70 n SER 280 Ca 0.17 0.60 -0.31 0.00 -0.26 0.00 0.00 58.87 59.07 3a70 n SER 280 Cb 0.43 -0.80 -0.08 0.00 -0.26 0.00 0.00 64.21 63.49 3a70 n SER 280 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3a70 s ALA 281 N -3.15 3.27 -0.47 7.33 0.00 -0.74 -0.41 121.76 127.59 3a70 s ALA 281 Ca 0.09 -1.04 -0.28 0.00 0.00 0.00 0.00 51.96 50.73 3a70 s ALA 281 Cb 0.12 -1.25 0.01 0.00 0.00 0.00 0.00 23.12 22.00 3a70 s ALA 281 CO 0.55 0.67 1.38 0.95 0.00 0.00 0.00 175.76 179.32 3a70 s THR 282 N -1.19 3.90 -0.77 0.00 -4.23 -0.83 -4.71 115.64 107.79 3a70 s THR 282 Ca 0.23 0.87 0.24 0.00 -1.18 0.00 0.00 61.69 61.85 3a70 s THR 282 Cb -0.12 -4.33 0.02 0.00 1.34 0.00 0.00 72.50 69.42 3a70 s THR 282 CO 0.14 -0.92 1.34 0.47 -0.54 0.00 0.00 174.62 175.11 3a70 n ASP 283 N 8.99 0.60 -2.01 3.99 8.00 -1.25 -4.46 116.55 130.40 3a70 n ASP 283 Ca 0.15 -0.03 -0.04 0.00 0.71 0.00 0.00 54.79 55.58 3a70 n ASP 283 Cb 0.49 0.24 0.06 0.00 -0.02 0.00 0.00 41.12 41.88 3a70 n ASP 283 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3a70 n ASN 284 N -1.87 2.25 -4.60 -2.24 3.02 -1.26 -4.69 115.26 105.88 3a70 n ASN 284 Ca 0.04 -2.69 -0.38 0.00 -0.03 0.00 0.00 54.58 51.51 3a70 n ASN 284 Cb 0.40 -0.41 -0.10 0.00 -0.61 0.00 0.00 39.78 39.05 3a70 n ASN 284 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3a70 s ILE 285 N -3.02 5.27 -0.19 2.41 1.01 -1.26 -1.41 121.20 124.01 3a70 s ILE 285 Ca 0.36 0.29 -0.06 0.00 0.00 0.00 0.00 60.65 61.24 3a70 s ILE 285 Cb 0.36 -3.58 -0.03 0.00 0.01 0.00 0.00 42.46 39.22 3a70 s ILE 285 CO -0.06 0.23 0.04 -0.69 0.00 0.00 0.00 174.94 174.46 3a70 s VAL 286 N 1.81 4.42 -0.59 2.92 1.01 0.74 0.88 120.40 131.59 3a70 s VAL 286 Ca 0.10 -0.16 -0.24 0.00 0.00 0.00 0.00 61.98 61.68 3a70 s VAL 286 Cb -0.16 -3.00 0.05 0.00 0.00 0.00 0.00 36.38 33.27 3a70 s VAL 286 CO 0.10 0.44 0.98 -0.55 0.00 0.00 0.00 175.10 176.07 3a70 s SER 287 N 0.69 6.30 -1.04 3.32 0.15 -1.26 -0.85 113.70 121.01 3a70 s SER 287 Ca 0.02 -0.47 -0.19 0.00 0.70 0.00 0.00 55.95 56.01 3a70 s SER 287 Cb -0.14 -2.45 0.11 0.00 -1.71 0.00 0.00 66.02 61.84 3a70 s SER 287 CO 0.02 -1.33 1.32 0.12 1.20 0.00 0.00 173.24 174.57 3a70 s PHE 288 N 4.15 3.02 0.55 3.44 5.36 -0.06 -4.72 117.98 129.72 3a70 s PHE 288 Ca 0.30 -1.43 0.04 0.00 -0.96 0.00 0.00 56.93 54.87 3a70 s PHE 288 Cb -0.13 -4.43 0.03 0.00 -0.34 0.00 0.00 43.02 38.15 3a70 s PHE 288 CO 0.17 -1.61 0.29 0.54 -1.46 0.00 0.00 175.22 173.15 3a70 s ASN 289 N 3.85 4.47 0.41 6.13 2.20 -1.26 -0.13 114.94 130.61 3a70 s ASN 289 Ca 0.40 -1.42 0.08 0.00 -0.94 0.00 0.00 52.86 50.97 3a70 s ASN 289 Cb -0.02 0.59 0.87 0.00 -2.00 0.00 0.00 41.25 40.69 3a70 s ASN 289 CO -0.06 -1.09 2.04 0.44 -2.94 0.00 0.00 177.10 175.49 3a70 h ASP 290 N 0.88 0.41 0.28 3.54 5.19 -1.92 -1.77 116.42 123.03 3a70 h ASP 290 Ca -0.39 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 55.99 3a70 h ASP 290 Cb 1.31 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 40.72 3a70 h ASP 290 CO 0.62 0.33 -0.14 -0.74 -3.12 0.00 0.00 179.24 176.19 3a70 h HIS 291 N 0.47 -0.35 -0.90 4.55 2.76 -1.95 -2.71 115.15 117.02 3a70 h HIS 291 Ca 0.12 -0.01 0.19 0.00 -2.20 0.00 0.00 60.37 58.47 3a70 h HIS 291 Cb 0.00 0.12 -0.11 0.00 1.55 0.00 0.00 27.41 28.97 3a70 h HIS 291 CO 0.00 -0.00 0.46 -0.92 -1.30 0.00 0.00 177.93 176.17 3a70 h TYR 292 N -0.80 0.79 0.00 5.26 3.20 -1.78 -2.30 116.97 121.34 3a70 h TYR 292 Ca -0.04 0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.82 3a70 h TYR 292 Cb 0.51 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 3a70 h TYR 292 CO 0.04 0.10 -0.22 0.00 -1.64 0.00 0.00 178.16 176.43 3a70 h ALA 293 N 1.64 0.95 -2.20 1.82 0.00 -1.36 -3.46 119.26 116.66 3a70 h ALA 293 Ca 0.53 -0.20 -0.57 0.00 0.00 0.00 0.00 54.91 54.67 3a70 h ALA 293 Cb 0.89 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 3a70 h ALA 293 CO -0.44 0.28 0.66 0.45 0.00 0.00 0.00 179.25 180.20 3a70 s SER 294 N -6.19 7.18 0.06 0.00 0.15 -0.87 -4.94 113.70 109.10 3a70 s SER 294 Ca 0.02 1.50 -0.21 0.00 0.70 0.00 0.00 55.95 57.96 3a70 s SER 294 Cb 0.09 -2.55 -0.12 0.00 -1.71 0.00 0.00 66.02 61.73 3a70 s SER 294 CO 0.65 -0.54 1.48 0.74 1.20 0.00 0.00 173.24 176.78 3a70 h THR 295 N 5.22 1.26 -0.17 6.45 2.02 -1.88 -2.91 112.91 122.90 3a70 h THR 295 Ca -0.27 -0.88 0.01 0.00 0.77 0.00 0.00 66.41 66.04 3a70 h THR 295 Cb 1.12 1.52 -0.01 0.00 -1.74 0.00 0.00 68.15 69.03 3a70 h THR 295 CO 0.90 0.26 0.10 0.00 0.37 0.00 0.00 175.52 177.15 3a70 h ALA 296 N 0.76 0.21 -1.00 6.16 0.00 -1.96 -2.38 119.26 121.06 3a70 h ALA 296 Ca 0.05 -0.00 0.15 0.00 0.00 0.00 0.00 54.91 55.11 3a70 h ALA 296 Cb 0.40 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.05 3a70 h ALA 296 CO 0.01 -0.32 0.62 -1.49 0.00 0.00 0.00 179.25 178.07 3a70 h TRP 297 N 0.21 1.08 -0.15 0.00 4.06 -1.87 -2.34 115.95 116.93 3a70 h TRP 297 Ca 0.07 0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.05 3a70 h TRP 297 Cb -0.00 -0.34 0.00 0.00 -1.00 0.00 0.00 29.16 27.82 3a70 h TRP 297 CO -0.08 0.35 0.00 0.09 -3.56 0.00 0.00 178.44 175.23 3a70 n ASN 298 N -4.67 1.60 0.09 -3.49 4.13 -0.96 -2.09 115.26 109.86 3a70 n ASN 298 Ca 0.21 -1.69 0.10 0.00 1.68 0.00 0.00 54.58 54.88 3a70 n ASN 298 Cb 0.46 -0.10 0.42 0.00 -1.54 0.00 0.00 39.78 39.03 3a70 n ASN 298 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3a70 n LEU 299 N 0.28 0.43 -4.92 3.41 4.77 -0.88 -4.74 117.00 115.35 3a70 n LEU 299 Ca 0.16 0.62 -0.30 0.00 -0.03 0.00 0.00 56.01 56.47 3a70 n LEU 299 Cb 0.32 -0.58 -0.04 0.00 -2.33 0.00 0.00 43.42 40.79 3a70 n LEU 299 CO 0.13 -0.52 -0.08 -0.76 -1.33 0.00 0.00 177.39 174.83 3a70 s LEU 300 N -3.99 4.32 0.23 2.23 1.43 -0.89 -5.06 118.68 116.96 3a70 s LEU 300 Ca 0.04 0.34 -0.30 0.00 -1.03 0.00 0.00 54.13 53.18 3a70 s LEU 300 Cb 0.08 -3.05 -0.09 0.00 0.03 0.00 0.00 46.19 43.16 3a70 s LEU 300 CO 0.31 0.10 1.14 -2.16 0.23 0.00 0.00 176.35 175.97 3a70 s PRO 301 N -2.78 4.57 -0.05 1.29 0.04 -1.26 -4.97 135.00 131.84 3a70 s PRO 301 Ca 0.37 1.83 -0.30 0.00 0.04 0.00 0.00 61.00 62.94 3a70 s PRO 301 Cb -0.12 -3.21 -0.06 0.00 0.04 0.00 0.00 34.50 31.14 3a70 s PRO 301 CO 0.28 0.07 1.70 0.12 0.04 0.00 0.00 177.00 179.21 3a70 s PHE 302 N -0.65 1.88 -0.28 0.56 5.36 -1.26 -4.81 117.98 118.78 3a70 s PHE 302 Ca 0.48 0.11 -0.20 0.00 -0.96 0.00 0.00 56.93 56.36 3a70 s PHE 302 Cb -0.32 -3.96 0.11 0.00 -0.34 0.00 0.00 43.02 38.51 3a70 s PHE 302 CO 0.39 -4.07 0.89 0.45 -1.46 0.00 0.00 175.22 171.42 3a70 s SER 303 N 3.54 -0.63 0.63 6.13 0.15 -1.26 -4.07 113.70 118.19 3a70 s SER 303 Ca 0.76 1.09 0.24 0.00 0.70 0.00 0.00 55.95 58.74 3a70 s SER 303 Cb -0.34 1.19 1.19 0.00 -1.71 0.00 0.00 66.02 66.35 3a70 s SER 303 CO 0.31 -0.18 1.65 -0.29 1.20 0.00 0.00 173.24 175.94 3a70 h ILE 304 N 4.43 0.13 0.00 6.45 2.10 -1.80 -0.84 117.51 127.98 3a70 h ILE 304 Ca -0.29 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.65 3a70 h ILE 304 Cb 1.19 0.42 0.00 0.00 -1.09 0.00 0.00 36.82 37.34 3a70 h ILE 304 CO 0.14 0.00 -0.18 -0.07 -1.08 0.00 0.00 178.15 176.95 3a70 h LEU 305 N 0.00 0.00 -8.14 2.19 3.38 -1.92 -3.41 115.31 107.40 3a70 h LEU 305 Ca 0.17 -0.05 -0.72 0.00 0.09 0.00 0.00 57.88 57.38 3a70 h LEU 305 Cb 1.49 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 42.03 3a70 h LEU 305 CO -0.00 0.03 0.05 0.21 0.09 0.00 0.00 178.44 178.81 3a70 s ASN 306 N -4.68 6.19 0.20 -0.43 3.04 -0.32 -4.98 114.94 113.96 3a70 s ASN 306 Ca 0.09 -1.53 -0.11 0.00 0.04 0.00 0.00 52.86 51.35 3a70 s ASN 306 Cb 0.12 -2.28 0.13 0.00 -1.54 0.00 0.00 41.25 37.67 3a70 s ASN 306 CO 0.64 -1.06 1.85 0.40 -3.04 0.00 0.00 177.10 175.90 3a70 h ILE 307 N 5.91 1.19 -0.23 -5.21 1.08 -1.81 -2.14 117.51 116.29 3a70 h ILE 307 Ca -0.29 -0.38 0.07 0.00 -0.39 0.00 0.00 64.86 63.87 3a70 h ILE 307 Cb 1.09 0.21 -0.01 0.00 -3.07 0.00 0.00 36.82 35.04 3a70 h ILE 307 CO 1.09 0.19 0.21 -0.65 -0.69 0.00 0.00 178.15 178.30 3a70 h PRO 308 N 0.93 0.00 0.00 2.37 0.11 -1.93 -1.07 132.00 132.41 3a70 h PRO 308 Ca 0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.36 3a70 h PRO 308 Cb -0.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.04 3a70 h PRO 308 CO -0.05 0.00 0.03 1.79 -0.21 0.00 0.00 178.00 179.56 3a70 h THR 309 N 0.00 0.00 0.00 -1.15 1.35 -1.69 -2.65 112.91 108.78 3a70 h THR 309 Ca 0.11 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.97 3a70 h THR 309 Cb 0.54 0.86 0.00 0.00 -1.73 0.00 0.00 68.15 67.82 3a70 h THR 309 CO -0.00 0.00 0.00 0.79 -0.25 0.00 0.00 175.52 176.06 3a70 n TRP 310 N -2.89 0.00 -0.34 4.73 7.02 -0.40 -2.89 117.44 122.67 3a70 n TRP 310 Ca -0.03 0.00 0.21 0.00 -1.02 0.00 0.00 57.50 56.67 3a70 n TRP 310 Cb 0.09 -0.45 0.46 0.00 -2.42 0.00 0.00 31.31 28.99 3a70 n TRP 310 CO 0.00 0.00 0.00 0.97 -2.02 0.00 0.00 177.69 176.64 3a70 h ILE 311 N 0.00 0.47 0.00 -0.99 2.10 -1.67 0.03 117.51 117.45 3a70 h ILE 311 Ca 0.00 -0.15 0.00 0.00 1.08 0.00 0.00 64.86 65.79 3a70 h ILE 311 Cb 0.32 -0.02 0.00 0.00 -1.09 0.00 0.00 36.82 36.04 3a70 h ILE 311 CO 0.00 0.08 0.00 -1.20 -1.08 0.00 0.00 178.15 175.95 3a70 n SER 312 N -4.80 0.00 0.09 2.19 7.64 -1.14 -2.86 113.62 114.74 3a70 n SER 312 Ca 0.28 0.02 0.11 0.00 1.01 0.00 0.00 58.87 60.29 3a70 n SER 312 Cb 0.87 -0.30 -0.01 0.00 -1.01 0.00 0.00 64.21 63.76 3a70 n SER 312 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 3a70 n HIS 313 N -1.30 0.88 -1.63 1.43 -0.00 -0.01 -4.53 115.22 110.07 3a70 n HIS 313 Ca 0.09 0.26 -0.50 0.00 -0.00 0.00 0.00 57.72 57.57 3a70 n HIS 313 Cb 0.17 -0.91 -0.05 0.00 -0.00 0.00 0.00 29.99 29.19 3a70 n HIS 313 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 3a70 n LEU 314 N -2.63 2.20 0.07 0.27 4.77 -1.13 -4.85 117.00 115.70 3a70 n LEU 314 Ca -0.00 1.10 0.02 0.00 -0.03 0.00 0.00 56.01 57.10 3a70 n LEU 314 Cb 0.55 -1.26 0.38 0.00 -2.33 0.00 0.00 43.42 40.76 3a70 n LEU 314 CO 0.41 -0.74 0.96 1.55 -1.33 0.00 0.00 177.39 178.23 3a70 h PRO 315 N 5.33 0.35 -0.40 3.23 0.13 -1.94 -2.13 132.00 136.58 3a70 h PRO 315 Ca -0.47 -0.07 -0.03 0.00 -0.87 0.00 0.00 66.00 64.57 3a70 h PRO 315 Cb 1.31 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 3a70 h PRO 315 CO 0.83 0.40 0.11 1.15 -0.23 0.00 0.00 178.00 180.26 3a70 h THR 316 N 0.34 1.17 -0.07 1.56 2.02 -1.91 -0.72 112.91 115.31 3a70 h THR 316 Ca 0.08 -0.60 -0.12 0.00 0.77 0.00 0.00 66.41 66.54 3a70 h THR 316 Cb 0.27 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 3a70 h THR 316 CO 0.01 0.22 -0.51 0.00 0.37 0.00 0.00 175.52 175.61 3a70 h ALA 317 N 1.56 1.01 0.37 6.16 0.00 -1.76 0.76 119.26 127.36 3a70 h ALA 317 Ca 0.13 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.55 3a70 h ALA 317 Cb 0.19 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3a70 h ALA 317 CO -0.01 0.66 -0.18 1.88 0.00 0.00 0.00 179.25 181.61 3a70 h TYR 318 N 0.15 -0.46 -0.32 0.00 0.05 -0.91 -2.06 116.97 113.42 3a70 h TYR 318 Ca 0.00 -0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 3a70 h TYR 318 Cb 0.96 0.15 -0.02 0.00 1.01 0.00 0.00 36.73 38.83 3a70 h TYR 318 CO 0.01 -0.23 0.17 0.78 -1.05 0.00 0.00 178.16 177.84 3a70 h GLY 319 N -0.58 0.49 0.49 3.88 0.00 -0.89 -1.89 103.07 104.56 3a70 h GLY 319 Ca -0.05 -0.23 -0.05 0.00 0.00 0.00 0.00 47.33 47.00 3a70 h GLY 319 CO 0.08 0.22 -0.17 -1.80 0.00 0.00 0.00 176.54 174.88 3a70 h ASP 320 N 0.39 0.20 -0.09 0.19 3.58 -0.93 -2.28 116.42 117.48 3a70 h ASP 320 Ca 0.11 -0.68 -0.20 0.00 0.42 0.00 0.00 57.03 56.68 3a70 h ASP 320 Cb 0.08 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.08 3a70 h ASP 320 CO -0.02 0.84 -0.69 1.23 -2.88 0.00 0.00 179.24 177.72 3a70 h GLY 321 N -0.44 0.80 2.00 -0.78 0.00 -1.44 -3.00 103.07 100.21 3a70 h GLY 321 Ca -0.01 -1.06 -0.08 0.00 0.00 0.00 0.00 47.33 46.18 3a70 h GLY 321 CO 0.03 0.94 -0.40 -0.33 0.00 0.00 0.00 176.54 176.79 3a70 h MET 322 N 0.52 0.00 -0.43 4.80 2.86 -1.46 -2.71 114.93 118.50 3a70 h MET 322 Ca -0.03 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.58 3a70 h MET 322 Cb 1.30 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.94 3a70 h MET 322 CO 0.14 0.40 0.12 -0.97 1.06 0.00 0.00 176.91 177.66 3a70 h ASN 323 N 0.00 0.58 0.72 1.22 -1.24 -1.41 -2.36 115.58 113.09 3a70 h ASN 323 Ca -0.00 -0.08 -0.07 0.00 0.71 0.00 0.00 56.30 56.85 3a70 h ASN 323 Cb 1.21 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 40.10 3a70 h ASN 323 CO 0.05 0.57 -0.36 0.03 -1.29 0.00 0.00 177.43 176.43 3a70 h ARG 324 N 0.62 0.00 0.47 6.67 3.08 -1.37 -0.55 114.38 123.29 3a70 h ARG 324 Ca 0.14 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 3a70 h ARG 324 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.27 3a70 h ARG 324 CO -0.01 0.36 -0.22 0.82 -1.07 0.00 0.00 179.97 179.85 3a70 h ILE 325 N 0.00 0.52 -0.81 2.04 2.04 -1.18 -2.44 117.51 117.69 3a70 h ILE 325 Ca -0.00 -0.23 0.19 0.00 1.00 0.00 0.00 64.86 65.82 3a70 h ILE 325 Cb 0.81 0.63 -0.14 0.00 -0.74 0.00 0.00 36.82 37.38 3a70 h ILE 325 CO 0.05 0.04 0.05 0.40 0.00 0.00 0.00 178.15 178.68 3a70 h ILE 326 N -0.77 0.30 0.00 -0.67 1.08 -1.17 -1.25 117.51 115.03 3a70 h ILE 326 Ca -0.06 -0.04 0.00 0.00 -0.39 0.00 0.00 64.86 64.37 3a70 h ILE 326 Cb 0.55 0.17 0.00 0.00 -3.07 0.00 0.00 36.82 34.47 3a70 h ILE 326 CO 0.11 0.02 0.00 -0.62 -0.69 0.00 0.00 178.15 176.97 3a70 n GLU 327 N -5.34 0.22 -2.00 2.37 1.02 -0.24 -4.89 120.64 111.78 3a70 n GLU 327 Ca 0.16 0.02 -0.41 0.00 -0.02 0.00 0.00 57.16 56.91 3a70 n GLU 327 Cb 0.54 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.44 3a70 n GLU 327 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3a70 s SER 328 N -2.77 6.64 0.64 1.62 0.15 -0.47 -4.89 113.70 114.62 3a70 s SER 328 Ca 0.21 2.66 0.38 0.00 0.70 0.00 0.00 55.95 59.90 3a70 s SER 328 Cb 0.19 -2.62 2.09 0.00 -1.71 0.00 0.00 66.02 63.97 3a70 s SER 328 CO 0.47 -0.72 2.18 0.11 1.20 0.00 0.00 173.24 176.47 3a70 h LYS 329 N 5.31 0.00 -0.10 5.44 1.79 -1.90 -1.17 116.57 125.93 3a70 h LYS 329 Ca -0.45 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.02 3a70 h LYS 329 Cb 1.22 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 3a70 h LYS 329 CO 0.80 0.00 0.00 1.19 -1.08 0.00 0.00 179.45 180.36 3a70 n PHE 330 N -2.96 0.11 -0.17 -1.35 3.72 -1.26 -4.66 117.46 110.88 3a70 n PHE 330 Ca -0.03 -0.05 -0.02 0.00 -0.05 0.00 0.00 57.45 57.31 3a70 n PHE 330 Cb 0.17 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.77 3a70 n PHE 330 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 3a70 h TYR 331 N 3.66 -0.13 0.00 1.38 3.20 -1.45 -1.49 116.97 122.13 3a70 h TYR 331 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 3a70 h TYR 331 Cb 0.78 0.14 0.00 0.00 1.54 0.00 0.00 36.73 39.20 3a70 h TYR 331 CO 0.05 -0.17 0.00 -0.40 -1.64 0.00 0.00 178.16 176.00 3a70 n ASP 332 N -5.30 0.00 0.16 -2.11 5.68 -1.26 -1.50 116.55 112.22 3a70 n ASP 332 Ca 0.06 -0.36 0.12 0.00 -0.50 0.00 0.00 54.79 54.11 3a70 n ASP 332 Cb 0.29 -0.13 0.20 0.00 -1.14 0.00 0.00 41.12 40.34 3a70 n ASP 332 CO 0.00 0.00 0.00 -0.07 -1.33 0.00 0.00 177.20 175.80 3a70 h LEU 333 N 0.00 0.00-10.07 -2.12 3.38 -1.61 -3.40 115.31 101.50 3a70 h LEU 333 Ca 0.00 -0.02 -0.52 0.00 0.09 0.00 0.00 57.88 57.43 3a70 h LEU 333 Cb 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3a70 h LEU 333 CO 0.00 0.01 -0.06 0.42 0.09 0.00 0.00 178.44 178.90 3a70 s THR 334 N -3.20 4.92 0.40 0.22 -4.23 -0.56 -4.71 115.64 108.48 3a70 s THR 334 Ca 0.07 0.38 0.05 0.00 -1.18 0.00 0.00 61.69 61.00 3a70 s THR 334 Cb 0.08 -3.69 -0.02 0.00 1.34 0.00 0.00 72.50 70.21 3a70 s THR 334 CO 0.67 -0.28 0.18 -0.94 -0.54 0.00 0.00 174.62 173.71 3a70 s SER 335 N -2.84 2.63 0.29 3.99 1.04 -1.26 0.15 113.70 117.70 3a70 s SER 335 Ca 0.47 -1.74 0.04 0.00 0.48 0.00 0.00 55.95 55.21 3a70 s SER 335 Cb -0.11 0.59 0.76 0.00 0.10 0.00 0.00 66.02 67.36 3a70 s SER 335 CO 0.27 -1.01 1.68 0.50 0.98 0.00 0.00 173.24 175.66 3a70 h LYS 336 N 1.82 0.32 -0.42 4.02 3.64 -1.73 -0.82 116.57 123.40 3a70 h LYS 336 Ca -0.32 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 58.92 3a70 h LYS 336 Cb 1.27 -0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 32.94 3a70 h LYS 336 CO 0.50 0.21 0.06 -0.25 -2.27 0.00 0.00 179.45 177.70 3a70 n ASP 337 N -5.10 3.67 -4.76 4.20 8.00 -1.26 -3.88 116.55 117.42 3a70 n ASP 337 Ca 0.23 -3.31 -0.41 0.00 0.71 0.00 0.00 54.79 52.00 3a70 n ASP 337 Cb 0.69 -0.63 0.00 0.00 -0.02 0.00 0.00 41.12 41.17 3a70 n ASP 337 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3a70 n SER 338 N -0.64 3.52 -4.63 -2.24 7.64 -0.31 -4.60 113.62 112.35 3a70 n SER 338 Ca 0.31 1.20 -0.43 0.00 1.01 0.00 0.00 58.87 60.96 3a70 n SER 338 Cb 1.08 -1.59 -0.02 0.00 -1.01 0.00 0.00 64.21 62.66 3a70 n SER 338 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3a70 s THR 339 N -1.13 4.06 -0.09 0.44 2.01 -1.26 -4.33 115.64 115.34 3a70 s THR 339 Ca 0.55 1.20 0.01 0.00 0.31 0.00 0.00 61.69 63.76 3a70 s THR 339 Cb -0.49 -4.07 0.02 0.00 0.01 0.00 0.00 72.50 67.97 3a70 s THR 339 CO 0.62 -0.44 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.38 3a70 s ILE 340 N 4.52 1.11 -0.32 1.82 1.01 -0.50 -1.35 121.20 127.49 3a70 s ILE 340 Ca 0.59 -0.40 -0.08 0.00 0.00 0.00 0.00 60.65 60.76 3a70 s ILE 340 Cb -0.18 -1.06 0.01 0.00 0.01 0.00 0.00 42.46 41.24 3a70 s ILE 340 CO 0.24 0.37 0.13 -0.63 0.00 0.00 0.00 174.94 175.04 3a70 s ILE 341 N 1.18 4.25 -0.28 2.92 -1.09 0.49 -0.18 121.20 128.49 3a70 s ILE 341 Ca -0.05 -0.69 -0.11 0.00 -2.23 0.00 0.00 60.65 57.57 3a70 s ILE 341 Cb -0.14 -3.24 -0.05 0.00 -1.58 0.00 0.00 42.46 37.45 3a70 s ILE 341 CO -0.02 -0.01 0.19 -0.69 -1.23 0.00 0.00 174.94 173.17 3a70 s VAL 342 N 1.53 5.30 -0.29 2.92 1.01 -0.03 -0.90 120.40 129.94 3a70 s VAL 342 Ca 0.03 0.17 -0.28 0.00 0.00 0.00 0.00 61.98 61.89 3a70 s VAL 342 Cb -0.18 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 3a70 s VAL 342 CO 0.04 0.26 1.96 0.00 0.00 0.00 0.00 175.10 177.36 3a70 s ALA 343 N 1.71 2.80 -0.19 5.51 0.00 0.15 -0.88 121.76 130.85 3a70 s ALA 343 Ca 0.07 0.43 0.18 0.00 0.00 0.00 0.00 51.96 52.65 3a70 s ALA 343 Cb -0.16 -4.04 0.46 0.00 0.00 0.00 0.00 23.12 19.38 3a70 s ALA 343 CO 0.10 -2.72 1.16 0.09 0.00 0.00 0.00 175.76 174.39 3a70 n ASN 344 N 10.88 2.16 -4.82 0.00 3.02 0.82 -4.61 115.26 122.71 3a70 n ASN 344 Ca 0.25 -2.69 -0.33 0.00 -0.03 0.00 0.00 54.58 51.79 3a70 n ASN 344 Cb 0.46 -0.41 -0.04 0.00 -0.61 0.00 0.00 39.78 39.18 3a70 n ASN 344 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3a70 s LEU 345 N -2.65 3.77 0.94 3.41 1.43 -1.11 -4.26 118.68 120.22 3a70 s LEU 345 Ca 0.36 1.75 -0.12 0.00 -1.03 0.00 0.00 54.13 55.09 3a70 s LEU 345 Cb 0.37 -4.54 0.15 0.00 0.03 0.00 0.00 46.19 42.20 3a70 s LEU 345 CO -0.06 -0.65 1.09 -0.94 0.23 0.00 0.00 176.35 176.02 3a70 s SER 346 N -2.43 3.02 0.14 2.29 1.04 -1.26 -4.74 113.70 111.76 3a70 s SER 346 Ca 0.63 1.56 -0.22 0.00 0.48 0.00 0.00 55.95 58.40 3a70 s SER 346 Cb -0.12 -2.22 0.01 0.00 0.10 0.00 0.00 66.02 63.78 3a70 s SER 346 CO 0.23 -2.93 1.65 0.44 0.98 0.00 0.00 173.24 173.61 3a70 h ASP 347 N -1.75 -0.59 -0.12 7.02 3.32 -0.77 -0.37 116.42 123.15 3a70 h ASP 347 Ca -0.51 0.11 -0.06 0.00 0.02 0.00 0.00 57.03 56.60 3a70 h ASP 347 Cb 1.29 0.28 -0.02 0.00 0.22 0.00 0.00 39.33 41.11 3a70 h ASP 347 CO 0.53 -0.23 -0.09 1.55 -1.72 0.00 0.00 179.24 179.28 3a70 h PRO 348 N -0.20 0.44 -0.17 3.56 0.13 -1.80 -3.15 132.00 130.81 3a70 h PRO 348 Ca 0.12 -0.11 -0.17 0.00 -0.87 0.00 0.00 66.00 64.97 3a70 h PRO 348 Cb 0.38 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 31.45 3a70 h PRO 348 CO -0.31 0.54 -0.60 0.00 -0.23 0.00 0.00 178.00 177.39 3a70 h ALA 349 N 1.50 0.62 -0.89 -0.56 0.00 -1.86 -3.18 119.26 114.91 3a70 h ALA 349 Ca 0.08 -0.54 0.16 0.00 0.00 0.00 0.00 54.91 54.61 3a70 h ALA 349 Cb 0.41 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.06 3a70 h ALA 349 CO 0.02 0.70 0.57 -0.09 0.00 0.00 0.00 179.25 180.46 3a70 h ARG 350 N 0.43 0.60 -0.04 0.00 2.43 -1.03 -0.60 114.38 116.18 3a70 h ARG 350 Ca -0.00 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.14 3a70 h ARG 350 Cb 1.17 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.58 3a70 h ARG 350 CO 0.11 0.40 0.04 0.00 -1.51 0.00 0.00 179.97 179.01 3a70 h ALA 351 N 1.61 1.67 0.00 2.80 0.00 -1.54 -3.33 119.26 120.46 3a70 h ALA 351 Ca 0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.36 3a70 h ALA 351 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 3a70 h ALA 351 CO -0.20 -0.06 -0.17 0.27 0.00 0.00 0.00 179.25 179.09 3a70 n ASN 352 N -3.97 0.00 -4.14 0.00 0.23 -0.74 -5.03 115.26 101.61 3a70 n ASN 352 Ca -0.02 -1.34 -0.30 0.00 -0.53 0.00 0.00 54.58 52.39 3a70 n ASN 352 Cb 0.13 -0.07 -0.17 0.00 -2.08 0.00 0.00 39.78 37.59 3a70 n ASN 352 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 3a70 s THR 353 N 0.00 1.73 -0.23 5.53 2.01 -0.31 -5.10 115.64 119.27 3a70 s THR 353 Ca 0.00 -0.82 -0.27 0.00 0.31 0.00 0.00 61.69 60.91 3a70 s THR 353 Cb 0.00 -1.53 0.00 0.00 0.01 0.00 0.00 72.50 70.99 3a70 s THR 353 CO 0.00 0.49 0.94 0.26 -0.69 0.00 0.00 174.62 175.62 3a70 s TRP 354 N 0.54 3.33 -0.08 4.92 0.52 -1.26 -4.42 118.94 122.49 3a70 s TRP 354 Ca -0.15 1.33 -0.30 0.00 0.02 0.00 0.00 56.10 57.00 3a70 s TRP 354 Cb -0.17 -3.17 -0.03 0.00 -1.15 0.00 0.00 33.47 28.95 3a70 s TRP 354 CO 0.05 -0.43 1.24 0.08 0.02 0.00 0.00 176.95 177.92 3a70 s VAL 355 N 2.99 4.20 0.19 4.03 1.01 0.63 -4.83 120.40 128.62 3a70 s VAL 355 Ca 0.40 1.51 -0.23 0.00 0.00 0.00 0.00 61.98 63.67 3a70 s VAL 355 Cb -0.15 -3.97 0.06 0.00 0.00 0.00 0.00 36.38 32.31 3a70 s VAL 355 CO 0.07 -0.04 0.65 0.00 0.00 0.00 0.00 175.10 175.77 3a70 s GLN 356 N 2.64 1.41 -0.92 2.72 -2.07 -1.26 -0.21 119.66 121.98 3a70 s GLN 356 Ca 0.57 -0.62 -0.23 0.00 -1.82 0.00 0.00 55.36 53.26 3a70 s GLN 356 Cb -0.25 0.59 0.07 0.00 -1.09 0.00 0.00 33.01 32.33 3a70 s GLN 356 CO 0.20 -0.63 1.29 0.34 -1.32 0.00 0.00 175.29 175.18 3a70 s ASP 357 N -2.79 6.44 0.48 12.60 2.15 -1.26 -4.77 116.67 129.51 3a70 s ASP 357 Ca 0.04 -1.39 0.28 0.00 0.43 0.00 0.00 52.55 51.91 3a70 s ASP 357 Cb -0.02 -2.51 0.83 0.00 -0.30 0.00 0.00 42.92 40.92 3a70 s ASP 357 CO -0.07 -1.44 1.79 -0.07 -0.17 0.00 0.00 175.17 175.20 3a70 h LEU 358 N 12.09 0.00 1.82 -1.34 3.38 -1.97 -3.47 115.31 125.82 3a70 h LEU 358 Ca 0.06 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.65 3a70 h LEU 358 Cb 1.03 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.68 3a70 h LEU 358 CO 1.30 0.00 -0.41 -3.20 0.09 0.00 0.00 178.44 176.22 3a70 n ASN 359 N -3.04 -5.25 -4.76 -0.43 4.05 -1.26 -4.93 115.26 99.64 3a70 n ASN 359 Ca 0.02 0.28 -0.41 0.00 0.45 0.00 0.00 54.58 54.92 3a70 n ASN 359 Cb 0.42 -4.54 -0.01 0.00 1.23 0.00 0.00 39.78 36.87 3a70 n ASN 359 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 177.26 173.61 3a70 s ARG 360 N -4.23 4.16 -1.33 1.20 3.52 -1.26 -3.89 118.95 117.11 3a70 s ARG 360 Ca 0.00 2.51 -0.09 0.00 -0.13 0.00 0.00 55.73 58.02 3a70 s ARG 360 Cb 0.00 -3.03 0.00 0.00 -1.56 0.00 0.00 34.95 30.37 3a70 s ARG 360 CO 0.00 -0.55 0.51 0.09 -0.81 0.00 0.00 175.30 174.54 3a70 n ASN 361 N 1.69 -1.89 -3.49 -2.12 3.02 -1.26 -4.93 115.26 106.28 3a70 n ASN 361 Ca 0.06 -1.07 -0.15 0.00 -0.03 0.00 0.00 54.58 53.39 3a70 n ASN 361 Cb 0.39 -2.86 -0.04 0.00 -0.61 0.00 0.00 39.78 36.65 3a70 n ASN 361 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3a70 s ALA 362 N -3.83 -1.72 0.85 5.41 0.00 -1.25 -4.86 121.76 116.36 3a70 s ALA 362 Ca 0.18 1.03 -0.11 0.00 0.00 0.00 0.00 51.96 53.06 3a70 s ALA 362 Cb -0.07 0.29 0.11 0.00 0.00 0.00 0.00 23.12 23.44 3a70 s ALA 362 CO 0.90 -0.52 1.13 -1.21 0.00 0.00 0.00 175.76 176.06 3a70 s GLU 363 N -2.18 1.53 0.12 0.00 2.02 -1.26 -4.89 118.70 114.04 3a70 s GLU 363 Ca -0.05 1.43 -0.31 0.00 0.02 0.00 0.00 54.97 56.06 3a70 s GLU 363 Cb -0.00 -1.79 -0.10 0.00 0.10 0.00 0.00 34.13 32.34 3a70 s GLU 363 CO 0.00 -2.23 1.66 0.99 0.02 0.00 0.00 175.26 175.70 3a70 s THR 364 N -2.69 2.72 0.29 3.63 2.01 -1.26 -4.95 115.64 115.38 3a70 s THR 364 Ca 0.65 0.36 -0.29 0.00 0.31 0.00 0.00 61.69 62.72 3a70 s THR 364 Cb -0.21 -3.23 -0.10 0.00 0.01 0.00 0.00 72.50 68.97 3a70 s THR 364 CO 0.56 0.01 1.11 -1.00 -0.69 0.00 0.00 174.62 174.61 3a70 s HIS 365 N 2.01 3.54 0.17 4.92 3.76 -1.26 -5.06 115.29 123.37 3a70 s HIS 365 Ca 0.74 1.68 0.09 0.00 -0.15 0.00 0.00 55.06 57.42 3a70 s HIS 365 Cb -0.43 -3.30 -0.04 0.00 1.11 0.00 0.00 32.58 29.92 3a70 s HIS 365 CO 0.33 -0.62 -0.18 0.15 -0.85 0.00 0.00 174.74 173.56 3a70 s LYS 366 N -1.50 1.29 1.30 1.40 -0.14 -1.26 -5.09 119.74 115.75 3a70 s LYS 366 Ca 0.45 -1.43 0.00 0.00 -1.36 0.00 0.00 55.97 53.63 3a70 s LYS 366 Cb -0.32 -1.34 0.00 0.00 -1.68 0.00 0.00 37.83 34.49 3a70 s LYS 366 CO 0.41 0.27 0.00 0.41 -0.76 0.00 0.00 175.35 175.68 3a70 n GLY 367 N 0.23 -1.82 3.77 -3.33 0.00 -1.26 -4.55 105.19 98.23 3a70 n GLY 367 Ca -0.13 -1.35 -0.33 0.00 0.00 0.00 0.00 46.02 44.21 3a70 n GLY 367 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3a70 s SER 368 N -4.00 5.12 -0.08 1.61 0.01 -1.26 -4.78 113.70 110.31 3a70 s SER 368 Ca 0.00 1.98 0.04 0.00 1.31 0.00 0.00 55.95 59.29 3a70 s SER 368 Cb 0.00 -2.55 -0.01 0.00 0.21 0.00 0.00 66.02 63.67 3a70 s SER 368 CO 0.00 -1.62 -0.22 -0.89 0.41 0.00 0.00 173.24 170.91 3a70 s THR 369 N -2.37 2.26 -0.22 1.44 2.01 -0.15 -4.15 115.64 114.47 3a70 s THR 369 Ca 0.67 -0.97 -0.07 0.00 0.31 0.00 0.00 61.69 61.63 3a70 s THR 369 Cb -0.20 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.42 3a70 s THR 369 CO 0.42 0.56 0.04 -0.36 -0.69 0.00 0.00 174.62 174.59 3a70 s PHE 370 N 0.04 3.10 -0.19 4.92 0.08 -0.46 -0.16 117.98 125.32 3a70 s PHE 370 Ca -0.09 -0.31 -0.00 0.00 0.12 0.00 0.00 56.93 56.65 3a70 s PHE 370 Cb -0.15 -2.15 0.01 0.00 -0.57 0.00 0.00 43.02 40.16 3a70 s PHE 370 CO 0.06 -0.20 -0.16 0.42 -0.10 0.00 0.00 175.22 175.24 3a70 s ILE 371 N 1.11 2.37 -0.26 0.64 1.01 0.92 -0.38 121.20 126.61 3a70 s ILE 371 Ca 0.04 -0.84 -0.05 0.00 0.00 0.00 0.00 60.65 59.80 3a70 s ILE 371 Cb -0.14 -2.02 0.01 0.00 0.01 0.00 0.00 42.46 40.32 3a70 s ILE 371 CO 0.03 0.51 0.01 -0.63 0.00 0.00 0.00 174.94 174.86 3a70 s ILE 372 N 1.29 3.55 1.07 2.92 -1.09 -0.08 -0.55 121.20 128.31 3a70 s ILE 372 Ca 0.04 -0.70 -0.18 0.00 -2.23 0.00 0.00 60.65 57.58 3a70 s ILE 372 Cb -0.13 -2.76 0.26 0.00 -1.58 0.00 0.00 42.46 38.24 3a70 s ILE 372 CO -0.10 0.21 1.17 0.61 -1.23 0.00 0.00 174.94 175.60 3a70 n GLY 373 N 4.80 -2.14 3.99 6.18 0.00 0.19 -0.68 105.19 117.53 3a70 n GLY 373 Ca -0.16 -1.60 -0.19 0.00 0.00 0.00 0.00 46.02 44.07 3a70 n GLY 373 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3a70 s SER 374 N -5.01 5.27 -0.00 1.61 1.04 -1.26 -4.68 113.70 110.67 3a70 s SER 374 Ca 0.70 -0.70 0.03 0.00 0.48 0.00 0.00 55.95 56.47 3a70 s SER 374 Cb -0.04 -0.21 0.10 0.00 0.10 0.00 0.00 66.02 65.97 3a70 s SER 374 CO 0.52 -0.98 1.03 0.47 0.98 0.00 0.00 173.24 175.26 3a70 n ASP 375 N -1.93 0.76 -4.91 7.02 8.00 -1.26 -4.05 116.55 120.18 3a70 n ASP 375 Ca 0.09 -2.02 -0.27 0.00 0.71 0.00 0.00 54.79 53.30 3a70 n ASP 375 Cb 0.61 -0.14 -0.00 0.00 -0.02 0.00 0.00 41.12 41.57 3a70 n ASP 375 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3a70 s SER 376 N -0.88 4.60 -0.24 -2.24 0.01 -1.24 -3.54 113.70 110.16 3a70 s SER 376 Ca 0.08 -1.30 -0.29 0.00 1.31 0.00 0.00 55.95 55.76 3a70 s SER 376 Cb 0.04 0.51 -0.03 0.00 0.21 0.00 0.00 66.02 66.75 3a70 s SER 376 CO 0.05 -1.14 1.88 0.20 0.41 0.00 0.00 173.24 174.64 3a70 s ASN 377 N -4.29 5.94 0.10 2.44 0.01 -1.26 -4.43 114.94 113.44 3a70 s ASN 377 Ca 0.32 1.66 0.07 0.00 -0.71 0.00 0.00 52.86 54.20 3a70 s ASN 377 Cb -0.02 -2.52 -0.04 0.00 0.41 0.00 0.00 41.25 39.07 3a70 s ASN 377 CO 0.20 -1.61 -0.11 -1.81 -1.51 0.00 0.00 177.10 172.25 3a70 s ASP 378 N 6.10 4.30 -0.37 -1.22 1.01 -1.26 -4.76 116.67 120.48 3a70 s ASP 378 Ca 0.84 -0.40 -0.11 0.00 0.71 0.00 0.00 52.55 53.59 3a70 s ASP 378 Cb -0.28 -0.79 0.02 0.00 1.01 0.00 0.00 42.92 42.88 3a70 s ASP 378 CO 0.34 0.19 0.21 -0.76 0.21 0.00 0.00 175.17 175.35 3a70 s LEU 379 N -2.12 4.65 -0.17 1.23 1.43 -1.26 -1.04 118.68 121.40 3a70 s LEU 379 Ca 0.20 -0.91 0.00 0.00 -1.03 0.00 0.00 54.13 52.40 3a70 s LEU 379 Cb -0.11 -2.03 0.00 0.00 0.03 0.00 0.00 46.19 44.08 3a70 s LEU 379 CO 0.12 -0.36 -0.16 -0.63 0.23 0.00 0.00 176.35 175.56 3a70 s ILE 380 N 1.57 2.53 -0.28 -0.59 1.01 -0.40 -0.27 121.20 124.78 3a70 s ILE 380 Ca 0.03 -0.80 0.01 0.00 0.00 0.00 0.00 60.65 59.89 3a70 s ILE 380 Cb -0.19 -2.07 0.06 0.00 0.01 0.00 0.00 42.46 40.27 3a70 s ILE 380 CO 0.07 0.51 -0.06 -1.58 0.00 0.00 0.00 174.94 173.88 3a70 s GLN 381 N 1.00 2.26 0.58 2.79 2.00 0.71 -0.62 119.66 128.38 3a70 s GLN 381 Ca -0.02 -1.36 -0.17 0.00 -2.00 0.00 0.00 55.36 51.81 3a70 s GLN 381 Cb -0.15 -3.02 -0.04 0.00 0.80 0.00 0.00 33.01 30.60 3a70 s GLN 381 CO -0.04 -0.62 1.08 0.20 -0.50 0.00 0.00 175.29 175.42 3a70 s GLY 382 N 1.16 2.30 0.82 2.59 0.00 0.47 -4.29 107.32 110.36 3a70 s GLY 382 Ca -0.06 0.55 -0.12 0.00 0.00 0.00 0.00 44.72 45.08 3a70 s GLY 382 CO -0.04 0.88 1.11 0.61 0.00 0.00 0.00 173.10 175.67 3a70 n GLY 383 N -0.53 -1.11 0.00 0.20 0.00 -1.26 -2.17 105.19 100.32 3a70 n GLY 383 Ca 0.10 -1.76 0.13 0.00 0.00 0.00 0.00 46.02 44.49 3a70 n GLY 383 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3a70 n SER 384 N -3.61 0.00 -1.43 1.61 3.41 -1.26 -2.53 113.62 109.81 3a70 n SER 384 Ca 0.14 0.18 0.00 0.00 -0.26 0.00 0.00 58.87 58.93 3a70 n SER 384 Cb 0.51 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 3a70 n SER 384 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3a70 n GLY 385 N 1.15 1.37 3.69 5.00 0.00 -1.26 -3.06 105.19 112.08 3a70 n GLY 385 Ca 0.10 -1.66 -0.38 0.00 0.00 0.00 0.00 46.02 44.08 3a70 n GLY 385 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a70 s ASN 386 N -1.00 6.51 0.04 1.61 0.01 -1.26 -4.09 114.94 116.76 3a70 s ASN 386 Ca 0.00 0.60 0.06 0.00 -0.71 0.00 0.00 52.86 52.81 3a70 s ASN 386 Cb 0.00 -2.24 -0.02 0.00 0.41 0.00 0.00 41.25 39.39 3a70 s ASN 386 CO 0.00 -0.04 -0.18 -1.81 -1.51 0.00 0.00 177.10 173.55 3a70 s ASP 387 N 0.88 2.17 -0.28 -1.22 1.01 -1.06 -0.98 116.67 117.19 3a70 s ASP 387 Ca 0.21 -0.49 0.02 0.00 0.71 0.00 0.00 52.55 53.00 3a70 s ASP 387 Cb -0.15 -0.17 0.07 0.00 1.01 0.00 0.00 42.92 43.68 3a70 s ASP 387 CO 0.08 0.12 -0.06 -0.31 0.21 0.00 0.00 175.17 175.20 3a70 s TYR 388 N -0.80 3.35 -0.22 4.23 2.02 0.77 -1.21 117.35 125.49 3a70 s TYR 388 Ca 0.05 -2.37 -0.07 0.00 -0.37 0.00 0.00 57.07 54.32 3a70 s TYR 388 Cb -0.08 -2.13 -0.03 0.00 -0.40 0.00 0.00 41.96 39.31 3a70 s TYR 388 CO 0.02 -0.88 0.05 -0.51 -1.57 0.00 0.00 175.55 172.65 3a70 s LEU 389 N 1.09 3.46 -0.19 -1.29 1.43 0.45 -0.06 118.68 123.57 3a70 s LEU 389 Ca -0.05 -0.15 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 3a70 s LEU 389 Cb -0.20 -1.90 0.03 0.00 0.03 0.00 0.00 46.19 44.15 3a70 s LEU 389 CO -0.05 0.04 -0.15 -0.70 0.23 0.00 0.00 176.35 175.72 3a70 s GLU 390 N 1.17 2.52 0.15 1.70 2.12 0.29 -0.67 118.70 125.98 3a70 s GLU 390 Ca 0.04 -0.85 -0.09 0.00 0.36 0.00 0.00 54.97 54.43 3a70 s GLU 390 Cb -0.14 -2.48 -0.01 0.00 0.26 0.00 0.00 34.13 31.75 3a70 s GLU 390 CO 0.03 -0.32 1.45 0.78 -0.54 0.00 0.00 175.26 176.66 3a70 h GLY 391 N 7.95 0.87 0.00 -1.50 0.00 -1.18 0.53 103.07 109.74 3a70 h GLY 391 Ca -0.36 -0.98 0.00 0.00 0.00 0.00 0.00 47.33 45.98 3a70 h GLY 391 CO 0.55 0.88 0.00 0.54 0.00 0.00 0.00 176.54 178.52 3a70 n ARG 392 N -4.00 0.00 -0.68 4.80 1.74 -1.26 -4.03 116.66 113.23 3a70 n ARG 392 Ca -0.04 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.75 3a70 n ARG 392 Cb 0.60 0.00 0.21 0.00 -1.02 0.00 0.00 32.46 32.25 3a70 n ARG 392 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3a70 s ALA 393 N -1.91 0.39 0.00 7.54 0.00 -1.26 -3.66 121.76 122.86 3a70 s ALA 393 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.07 3a70 s ALA 393 Cb 0.00 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.81 3a70 s ALA 393 CO 0.00 -3.32 0.00 0.41 0.00 0.00 0.00 175.76 172.85 3a70 n GLY 394 N 0.36 -0.20 3.51 0.00 0.00 -1.23 -3.70 105.19 103.93 3a70 n GLY 394 Ca 0.06 -1.70 -0.42 0.00 0.00 0.00 0.00 46.02 43.97 3a70 n GLY 394 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a70 s ASN 395 N -2.11 6.21 -0.00 1.61 0.01 -1.26 -4.34 114.94 115.05 3a70 s ASN 395 Ca 0.00 -0.61 -0.03 0.00 -0.71 0.00 0.00 52.86 51.50 3a70 s ASN 395 Cb 0.00 -2.49 -0.04 0.00 0.41 0.00 0.00 41.25 39.13 3a70 s ASN 395 CO 0.00 -1.58 0.20 -1.81 -1.51 0.00 0.00 177.10 172.40 3a70 s ASP 396 N 3.55 6.39 -0.12 -1.22 1.01 -1.25 -3.98 116.67 121.04 3a70 s ASP 396 Ca 0.30 0.39 0.03 0.00 0.71 0.00 0.00 52.55 53.98 3a70 s ASP 396 Cb -0.12 -2.02 0.00 0.00 1.01 0.00 0.00 42.92 41.79 3a70 s ASP 396 CO 0.14 0.26 -0.22 -0.89 0.21 0.00 0.00 175.17 174.67 3a70 s THR 397 N -1.32 2.17 -0.03 -1.27 2.01 -0.20 -0.83 115.64 116.17 3a70 s THR 397 Ca 0.27 -0.96 0.00 0.00 0.31 0.00 0.00 61.69 61.32 3a70 s THR 397 Cb -0.13 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.49 3a70 s THR 397 CO 0.18 0.55 0.00 -0.36 -0.69 0.00 0.00 174.62 174.30 3a70 s PHE 398 N 0.59 3.10 0.17 4.92 0.08 0.73 -1.28 117.98 126.29 3a70 s PHE 398 Ca -0.12 0.12 0.06 0.00 0.12 0.00 0.00 56.93 57.11 3a70 s PHE 398 Cb -0.17 -1.71 -0.04 0.00 -0.57 0.00 0.00 43.02 40.53 3a70 s PHE 398 CO 0.03 0.46 -0.12 1.03 -0.10 0.00 0.00 175.22 176.52 3a70 s ARG 399 N -1.31 1.17 -0.26 0.44 0.52 0.21 -0.43 118.95 119.29 3a70 s ARG 399 Ca 0.17 -1.49 -0.22 0.00 -0.52 0.00 0.00 55.73 53.68 3a70 s ARG 399 Cb -0.11 -0.85 0.07 0.00 0.52 0.00 0.00 34.95 34.58 3a70 s ARG 399 CO 0.07 0.13 0.67 0.34 0.02 0.00 0.00 175.30 176.54 3a70 s ASP 400 N -3.16 -0.76 0.00 0.23 2.15 -1.26 -0.40 116.67 113.47 3a70 s ASP 400 Ca 0.18 1.39 0.28 0.00 0.43 0.00 0.00 52.55 54.83 3a70 s ASP 400 Cb 0.01 1.37 1.12 0.00 -0.30 0.00 0.00 42.92 45.12 3a70 s ASP 400 CO 0.03 -0.24 1.80 0.61 -0.17 0.00 0.00 175.17 177.21 3a70 n GLY 401 N 3.11 -0.98 0.00 2.66 0.00 -0.92 -4.94 105.19 104.12 3a70 n GLY 401 Ca -0.16 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.59 3a70 n GLY 401 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a70 n GLY 402 N 1.32 0.67 7.00 -0.02 0.00 -1.18 -4.45 105.19 108.54 3a70 n GLY 402 Ca 0.13 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.37 3a70 n GLY 402 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a70 n GLY 403 N 0.00 0.04 3.19 -0.02 0.00 -1.17 -4.37 105.19 102.85 3a70 n GLY 403 Ca 0.00 -0.95 -0.33 0.00 0.00 0.00 0.00 46.02 44.74 3a70 n GLY 403 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3a70 s TYR 404 N 0.00 2.78 0.02 1.61 2.02 -1.26 -2.99 117.35 119.54 3a70 s TYR 404 Ca 0.00 -1.36 0.00 0.00 -0.37 0.00 0.00 57.07 55.34 3a70 s TYR 404 Cb 0.00 -1.91 -0.02 0.00 -0.40 0.00 0.00 41.96 39.63 3a70 s TYR 404 CO 0.00 -0.66 -0.03 -0.80 -1.57 0.00 0.00 175.55 172.49 3a70 s ASN 405 N 1.11 0.26 -0.17 2.29 0.01 -0.31 -2.57 114.94 115.56 3a70 s ASN 405 Ca 0.00 -0.51 0.00 0.00 -0.71 0.00 0.00 52.86 51.65 3a70 s ASN 405 Cb -0.14 0.10 0.00 0.00 0.41 0.00 0.00 41.25 41.62 3a70 s ASN 405 CO -0.07 -0.30 -0.16 -0.69 -1.51 0.00 0.00 177.10 174.38 3a70 s VAL 406 N -1.48 2.55 -0.29 1.60 1.01 -0.35 -0.78 120.40 122.65 3a70 s VAL 406 Ca -0.16 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.03 3a70 s VAL 406 Cb -0.10 -2.09 0.06 0.00 0.00 0.00 0.00 36.38 34.26 3a70 s VAL 406 CO -0.01 0.51 -0.03 -0.63 0.00 0.00 0.00 175.10 174.94 3a70 s ILE 407 N 1.02 2.66 -0.43 2.22 1.01 -0.03 -0.41 121.20 127.23 3a70 s ILE 407 Ca -0.02 -1.57 -0.11 0.00 0.00 0.00 0.00 60.65 58.96 3a70 s ILE 407 Cb -0.15 -2.58 0.08 0.00 0.01 0.00 0.00 42.46 39.82 3a70 s ILE 407 CO -0.04 -0.13 0.30 -0.76 0.00 0.00 0.00 174.94 174.31 3a70 s LEU 408 N 1.17 5.29 0.32 2.97 1.43 0.15 -1.59 118.68 128.42 3a70 s LEU 408 Ca -0.05 -1.45 0.05 0.00 -1.03 0.00 0.00 54.13 51.65 3a70 s LEU 408 Cb -0.20 -2.04 0.69 0.00 0.03 0.00 0.00 46.19 44.66 3a70 s LEU 408 CO -0.03 -0.57 1.85 1.23 0.23 0.00 0.00 176.35 179.06 3a70 h GLY 409 N 8.51 1.45 0.00 -3.19 0.00 -1.00 -0.10 103.07 108.74 3a70 h GLY 409 Ca -0.24 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.72 3a70 h GLY 409 CO 0.79 0.12 0.00 0.61 0.00 0.00 0.00 176.54 178.06 3a70 n GLY 410 N -1.38 -1.23 3.40 4.60 0.00 -1.26 -4.00 105.19 105.31 3a70 n GLY 410 Ca 0.18 -1.19 -0.33 0.00 0.00 0.00 0.00 46.02 44.68 3a70 n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a70 n ALA 411 N 0.61 -2.86 0.00 4.61 0.00 -1.24 -4.85 120.51 116.78 3a70 n ALA 411 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.68 3a70 n ALA 411 Cb 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 19.45 17.69 3a70 n ALA 411 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a70 n GLY 412 N 1.55 -3.15 3.29 0.00 0.00 -1.26 -4.06 105.19 101.56 3a70 n GLY 412 Ca 0.06 -1.86 -0.44 0.00 0.00 0.00 0.00 46.02 43.78 3a70 n GLY 412 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a70 s ASN 413 N -1.54 5.99 0.23 1.61 0.01 -1.26 -4.97 114.94 115.02 3a70 s ASN 413 Ca 0.00 -1.74 0.07 0.00 -0.71 0.00 0.00 52.86 50.48 3a70 s ASN 413 Cb 0.00 -2.13 -0.04 0.00 0.41 0.00 0.00 41.25 39.49 3a70 s ASN 413 CO 0.00 -0.75 0.12 0.20 -1.51 0.00 0.00 177.10 175.15 3a70 s ASN 414 N 3.06 5.21 -0.08 -1.22 0.01 -1.26 -3.92 114.94 116.75 3a70 s ASN 414 Ca 0.04 -0.34 -0.04 0.00 -0.71 0.00 0.00 52.86 51.81 3a70 s ASN 414 Cb -0.28 -1.24 0.04 0.00 0.41 0.00 0.00 41.25 40.19 3a70 s ASN 414 CO 0.02 0.00 0.17 -0.89 -1.51 0.00 0.00 177.10 174.90 3a70 s THR 415 N -2.07 -0.04 -0.24 1.60 2.01 -0.01 -2.82 115.64 114.06 3a70 s THR 415 Ca 0.32 0.15 -0.06 0.00 0.31 0.00 0.00 61.69 62.40 3a70 s THR 415 Cb -0.08 -0.28 -0.02 0.00 0.01 0.00 0.00 72.50 72.13 3a70 s THR 415 CO 0.23 0.06 0.04 -0.22 -0.69 0.00 0.00 174.62 174.04 3a70 s LEU 416 N 1.04 3.31 -0.49 4.42 2.96 0.08 -0.19 118.68 129.81 3a70 s LEU 416 Ca -0.08 -0.28 -0.15 0.00 -0.22 0.00 0.00 54.13 53.41 3a70 s LEU 416 Cb -0.10 -1.87 0.09 0.00 0.50 0.00 0.00 46.19 44.81 3a70 s LEU 416 CO -0.06 -0.04 0.41 -0.62 -1.32 0.00 0.00 176.35 174.73 3a70 s ASP 417 N 1.57 6.11 0.48 3.68 2.15 0.43 -0.45 116.67 130.64 3a70 s ASP 417 Ca 0.06 -1.48 0.27 0.00 0.43 0.00 0.00 52.55 51.84 3a70 s ASP 417 Cb -0.15 -2.17 0.81 0.00 -0.30 0.00 0.00 42.92 41.11 3a70 s ASP 417 CO 0.02 -0.70 1.78 -0.07 -0.17 0.00 0.00 175.17 176.03 3a70 h LEU 418 N 8.76 0.00 0.58 -1.34 3.38 -1.50 -3.41 115.31 121.77 3a70 h LEU 418 Ca -0.28 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.44 3a70 h LEU 418 Cb 1.10 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.76 3a70 h LEU 418 CO 0.91 0.05 -0.22 0.00 0.09 0.00 0.00 178.44 179.26 3a70 n GLN 419 N -3.13 -1.42 -4.05 1.13 6.02 -1.25 -4.90 117.38 109.77 3a70 n GLN 419 Ca 0.02 0.90 -0.11 0.00 -0.01 0.00 0.00 57.00 57.81 3a70 n GLN 419 Cb 0.44 -5.19 -0.06 0.00 1.02 0.00 0.00 30.24 26.45 3a70 n GLN 419 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 3a70 s LYS 420 N -2.94 1.56 0.32 -1.09 1.02 -1.26 -4.68 119.74 112.68 3a70 s LYS 420 Ca 0.00 -1.42 -0.29 0.00 0.02 0.00 0.00 55.97 54.28 3a70 s LYS 420 Cb 0.00 0.43 -0.10 0.00 -0.52 0.00 0.00 37.83 37.64 3a70 s LYS 420 CO 0.00 -0.63 1.37 0.45 -0.92 0.00 0.00 175.35 175.62 3a70 s SER 421 N -3.09 6.65 0.58 2.83 0.15 -1.02 -1.52 113.70 118.29 3a70 s SER 421 Ca 0.27 2.77 0.29 0.00 0.70 0.00 0.00 55.95 59.97 3a70 s SER 421 Cb 0.01 -2.65 1.48 0.00 -1.71 0.00 0.00 66.02 63.15 3a70 s SER 421 CO 0.12 -0.64 1.92 1.62 1.20 0.00 0.00 173.24 177.45 3a70 h VAL 422 N 3.12 0.42 0.00 4.45 3.04 -1.94 -1.41 116.25 123.93 3a70 h VAL 422 Ca -0.49 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.20 3a70 h VAL 422 Cb 1.23 0.63 0.00 0.00 -2.01 0.00 0.00 31.29 31.14 3a70 h VAL 422 CO 0.68 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 177.83 3a70 n ASN 423 N -3.84 0.57 -0.83 3.17 5.03 -1.26 -2.58 115.26 115.53 3a70 n ASN 423 Ca 0.09 0.61 0.10 0.00 0.87 0.00 0.00 54.58 56.26 3a70 n ASN 423 Cb 0.68 -0.75 0.28 0.00 -1.02 0.00 0.00 39.78 38.97 3a70 n ASN 423 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 3a70 n THR 424 N -2.10 0.41 -4.28 3.41 -2.24 -0.53 -4.92 114.28 104.02 3a70 n THR 424 Ca 0.03 -0.55 -0.19 0.00 -2.27 0.00 0.00 64.05 61.08 3a70 n THR 424 Cb 0.27 0.55 -0.11 0.00 -2.10 0.00 0.00 70.33 68.94 3a70 n THR 424 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3a70 s PHE 425 N -1.59 1.53 -0.05 4.78 0.08 -1.06 -2.13 117.98 119.54 3a70 s PHE 425 Ca 0.34 -0.56 0.02 0.00 0.12 0.00 0.00 56.93 56.85 3a70 s PHE 425 Cb 0.19 -0.77 -0.03 0.00 -0.57 0.00 0.00 43.02 41.84 3a70 s PHE 425 CO 0.27 0.22 -0.09 -0.51 -0.10 0.00 0.00 175.22 175.00 3a70 s ASP 426 N -2.71 4.44 0.01 1.36 1.01 0.55 -4.96 116.67 116.37 3a70 s ASP 426 Ca 0.13 -0.09 0.07 0.00 0.71 0.00 0.00 52.55 53.37 3a70 s ASP 426 Cb -0.04 -1.05 -0.02 0.00 1.01 0.00 0.00 42.92 42.82 3a70 s ASP 426 CO 0.04 0.35 -0.22 -0.36 0.21 0.00 0.00 175.17 175.19 3a70 s PHE 427 N -0.80 1.97 -0.01 4.23 0.08 -1.26 -0.55 117.98 121.64 3a70 s PHE 427 Ca 0.13 -0.38 -0.07 0.00 0.12 0.00 0.00 56.93 56.73 3a70 s PHE 427 Cb -0.11 -1.23 0.00 0.00 -0.57 0.00 0.00 43.02 41.12 3a70 s PHE 427 CO 0.02 0.03 0.14 0.00 -0.10 0.00 0.00 175.22 175.31 3a70 s ALA 428 N -0.64 -0.34 -0.01 5.36 0.00 -0.68 0.19 121.76 125.64 3a70 s ALA 428 Ca 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.00 3a70 s ALA 428 Cb -0.09 0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.11 3a70 s ALA 428 CO 0.00 -0.19 0.02 1.21 0.00 0.00 0.00 175.76 176.80 3a70 s ASN 429 N -1.18 0.09 0.00 0.00 3.84 -1.26 -0.55 114.94 115.87 3a70 s ASN 429 Ca -0.13 0.02 0.26 0.00 0.21 0.00 0.00 52.86 53.22 3a70 s ASN 429 Cb -0.07 -0.06 0.68 0.00 -0.55 0.00 0.00 41.25 41.25 3a70 s ASN 429 CO 0.01 -0.09 1.52 -0.90 -2.79 0.00 0.00 177.10 174.86 3a70 n ASP 430 N 3.85 1.74 0.00 -4.21 5.68 -1.06 -4.91 116.55 117.64 3a70 n ASP 430 Ca -0.23 -1.44 0.00 0.00 -0.50 0.00 0.00 54.79 52.61 3a70 n ASP 430 Cb 0.53 0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.60 3a70 n ASP 430 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3a70 n GLY 431 N 1.28 1.08 0.75 6.12 0.00 -1.26 -4.86 105.19 108.30 3a70 n GLY 431 Ca 0.15 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.20 3a70 n GLY 431 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a70 n ALA 432 N 0.92 3.63 0.00 4.61 0.00 -1.26 -4.96 120.51 123.45 3a70 n ALA 432 Ca 0.00 -3.05 0.00 0.00 0.00 0.00 0.00 53.44 50.39 3a70 n ALA 432 Cb 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 18.92 3a70 n ALA 432 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a70 n GLY 433 N -1.11 0.31 3.50 0.00 0.00 -1.26 -5.05 105.19 101.58 3a70 n GLY 433 Ca 0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.87 3a70 n GLY 433 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a70 s ASN 434 N -2.45 5.75 -0.30 1.61 0.01 -1.26 -4.34 114.94 113.95 3a70 s ASN 434 Ca 0.00 -0.31 -0.13 0.00 -0.71 0.00 0.00 52.86 51.71 3a70 s ASN 434 Cb 0.00 -2.06 -0.03 0.00 0.41 0.00 0.00 41.25 39.57 3a70 s ASN 434 CO 0.00 -0.14 0.29 -0.22 -1.51 0.00 0.00 177.10 175.52 3a70 s LEU 435 N 1.68 4.23 -0.15 0.60 2.96 -0.39 -2.56 118.68 125.06 3a70 s LEU 435 Ca 0.06 -0.07 -0.14 0.00 -0.22 0.00 0.00 54.13 53.75 3a70 s LEU 435 Cb -0.17 -2.25 -0.05 0.00 0.50 0.00 0.00 46.19 44.23 3a70 s LEU 435 CO 0.08 -0.19 0.32 -0.31 -1.32 0.00 0.00 176.35 174.93 3a70 s TYR 436 N 1.89 3.48 -0.20 5.38 2.02 0.28 -0.42 117.35 129.78 3a70 s TYR 436 Ca 0.10 0.65 0.01 0.00 -0.37 0.00 0.00 57.07 57.46 3a70 s TYR 436 Cb -0.16 -2.37 0.03 0.00 -0.40 0.00 0.00 41.96 39.05 3a70 s TYR 436 CO 0.11 0.24 -0.16 0.08 -1.57 0.00 0.00 175.55 174.25 3a70 s VAL 437 N 0.44 2.24 -0.19 0.71 1.01 -0.29 -1.69 120.40 122.64 3a70 s VAL 437 Ca 0.18 -1.05 -0.02 0.00 0.00 0.00 0.00 61.98 61.09 3a70 s VAL 437 Cb -0.13 -2.04 -0.01 0.00 0.00 0.00 0.00 36.38 34.20 3a70 s VAL 437 CO 0.05 0.40 -0.09 -0.60 0.00 0.00 0.00 175.10 174.86 3a70 s ARG 438 N 1.27 3.34 0.79 2.72 3.52 0.29 -0.81 118.95 130.08 3a70 s ARG 438 Ca 0.02 -0.66 -0.10 0.00 -0.13 0.00 0.00 55.73 54.86 3a70 s ARG 438 Cb -0.15 -2.84 0.10 0.00 -1.56 0.00 0.00 34.95 30.50 3a70 s ARG 438 CO -0.10 -0.07 1.13 0.16 -0.81 0.00 0.00 175.30 175.61 3a70 s ASP 439 N 1.09 4.34 0.58 -2.12 1.47 -0.24 -0.33 116.67 121.46 3a70 s ASP 439 Ca 0.01 0.47 0.39 0.00 1.18 0.00 0.00 52.55 54.59 3a70 s ASP 439 Cb -0.15 -0.92 2.08 0.00 -0.34 0.00 0.00 42.92 43.60 3a70 s ASP 439 CO -0.02 -1.95 2.19 0.00 0.68 0.00 0.00 175.17 176.07 3a70 h ALA 440 N -0.96 1.00 -0.33 2.11 0.00 -1.77 -0.35 119.26 118.96 3a70 h ALA 440 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3a70 h ALA 440 Cb 1.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3a70 h ALA 440 CO 0.56 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.90 3a70 n ASN 441 N -2.89 3.28 0.00 0.00 3.02 -1.26 -4.97 115.26 112.44 3a70 n ASN 441 Ca -0.02 -1.97 0.00 0.00 -0.03 0.00 0.00 54.58 52.55 3a70 n ASN 441 Cb 0.08 -0.21 0.00 0.00 -0.61 0.00 0.00 39.78 39.04 3a70 n ASN 441 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3a70 n GLY 442 N 1.47 0.90 3.75 7.41 0.00 -0.14 -5.05 105.19 113.53 3a70 n GLY 442 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 3a70 n GLY 442 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3a70 s GLY 443 N -1.67 2.61 -0.18 -0.02 0.00 -1.26 -4.75 107.32 102.05 3a70 s GLY 443 Ca 0.00 1.21 -0.02 0.00 0.00 0.00 0.00 44.72 45.92 3a70 s GLY 443 CO 0.00 2.06 -0.10 -0.42 0.00 0.00 0.00 173.10 174.64 3a70 s ILE 444 N -0.36 3.06 -0.18 0.90 1.01 -1.16 -1.08 121.20 123.39 3a70 s ILE 444 Ca 0.55 -0.62 -0.12 0.00 0.00 0.00 0.00 60.65 60.46 3a70 s ILE 444 Cb -0.39 -2.34 -0.05 0.00 0.01 0.00 0.00 42.46 39.70 3a70 s ILE 444 CO 0.44 0.48 0.20 -0.44 0.00 0.00 0.00 174.94 175.62 3a70 s SER 445 N 0.99 6.30 -0.27 3.58 0.01 0.01 -1.16 113.70 123.16 3a70 s SER 445 Ca -0.01 0.34 -0.14 0.00 1.31 0.00 0.00 55.95 57.46 3a70 s SER 445 Cb -0.15 -2.13 -0.04 0.00 0.21 0.00 0.00 66.02 63.91 3a70 s SER 445 CO -0.01 0.14 0.31 -0.63 0.41 0.00 0.00 173.24 173.46 3a70 s ILE 446 N 0.42 5.22 0.02 1.44 1.01 0.04 -1.13 121.20 128.21 3a70 s ILE 446 Ca 0.11 0.44 0.07 0.00 0.00 0.00 0.00 60.65 61.27 3a70 s ILE 446 Cb -0.12 -3.64 -0.03 0.00 0.01 0.00 0.00 42.46 38.68 3a70 s ILE 446 CO 0.00 0.19 -0.21 0.42 0.00 0.00 0.00 174.94 175.35 3a70 s THR 447 N 1.94 2.53 0.05 2.92 -4.23 0.44 -0.85 115.64 118.45 3a70 s THR 447 Ca 0.12 -1.16 0.05 0.00 -1.18 0.00 0.00 61.69 59.53 3a70 s THR 447 Cb -0.16 -2.00 -0.02 0.00 1.34 0.00 0.00 72.50 71.65 3a70 s THR 447 CO 0.10 0.42 -0.15 -0.13 -0.54 0.00 0.00 174.62 174.33 3a70 s ARG 448 N -1.14 0.94 -1.53 3.99 0.52 -0.62 -1.26 118.95 119.85 3a70 s ARG 448 Ca 0.13 -0.86 -0.03 0.00 -0.52 0.00 0.00 55.73 54.45 3a70 s ARG 448 Cb -0.10 -0.97 0.01 0.00 0.52 0.00 0.00 34.95 34.40 3a70 s ARG 448 CO 0.03 0.23 0.29 -0.25 0.02 0.00 0.00 175.30 175.62 3a70 n ASP 449 N 1.65 -5.44 -4.11 0.23 8.00 -1.26 -0.55 116.55 115.07 3a70 n ASP 449 Ca -0.19 -0.13 -0.33 0.00 0.71 0.00 0.00 54.79 54.85 3a70 n ASP 449 Cb 0.54 -4.48 -0.14 0.00 -0.02 0.00 0.00 41.12 37.02 3a70 n ASP 449 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3a70 s ILE 450 N -3.01 2.60 -1.07 0.53 1.01 -1.26 -4.26 121.20 115.74 3a70 s ILE 450 Ca 0.16 -1.65 0.24 0.00 0.00 0.00 0.00 60.65 59.40 3a70 s ILE 450 Cb -0.07 -2.58 -0.06 0.00 0.01 0.00 0.00 42.46 39.75 3a70 s ILE 450 CO 0.20 -0.18 1.24 0.61 0.00 0.00 0.00 174.94 176.81 3a70 n GLY 451 N 4.50 -1.10 3.01 6.18 0.00 -1.13 -4.79 105.19 111.86 3a70 n GLY 451 Ca -0.11 -0.44 -0.23 0.00 0.00 0.00 0.00 46.02 45.24 3a70 n GLY 451 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3a70 s SER 452 N -2.96 1.60 -0.11 1.61 0.01 -1.17 -0.61 113.70 112.07 3a70 s SER 452 Ca 0.11 -0.26 -0.00 0.00 1.31 0.00 0.00 55.95 57.11 3a70 s SER 452 Cb 0.17 -0.70 -0.02 0.00 0.21 0.00 0.00 66.02 65.68 3a70 s SER 452 CO 0.74 0.03 -0.11 -0.63 0.41 0.00 0.00 173.24 173.68 3a70 s ILE 453 N 0.62 3.28 -0.13 1.44 -1.09 0.27 -0.74 121.20 124.84 3a70 s ILE 453 Ca -0.12 -0.60 -0.03 0.00 -2.23 0.00 0.00 60.65 57.67 3a70 s ILE 453 Cb -0.15 -2.37 -0.03 0.00 -1.58 0.00 0.00 42.46 38.34 3a70 s ILE 453 CO 0.03 0.54 -0.04 -0.69 -1.23 0.00 0.00 174.94 173.54 3a70 s VAL 454 N 0.05 3.88 0.25 2.92 1.01 0.40 0.45 120.40 129.36 3a70 s VAL 454 Ca -0.04 -0.37 0.06 0.00 0.00 0.00 0.00 61.98 61.63 3a70 s VAL 454 Cb -0.14 -2.67 -0.05 0.00 0.00 0.00 0.00 36.38 33.51 3a70 s VAL 454 CO 0.04 0.52 -0.07 0.42 0.00 0.00 0.00 175.10 176.01 3a70 s THR 455 N 0.05 1.53 -0.28 3.92 -4.23 -0.01 -1.36 115.64 115.26 3a70 s THR 455 Ca -0.00 -2.13 -0.09 0.00 -1.18 0.00 0.00 61.69 58.29 3a70 s THR 455 Cb -0.13 -2.30 -0.03 0.00 1.34 0.00 0.00 72.50 71.37 3a70 s THR 455 CO 0.03 -0.40 0.14 -0.54 -0.54 0.00 0.00 174.62 173.30 3a70 s LYS 456 N -3.73 3.70 -0.49 3.99 1.02 -0.57 -0.94 119.74 122.70 3a70 s LYS 456 Ca 0.27 -0.47 0.04 0.00 0.02 0.00 0.00 55.97 55.82 3a70 s LYS 456 Cb 0.03 -3.52 0.13 0.00 -0.52 0.00 0.00 37.83 33.95 3a70 s LYS 456 CO 0.09 -0.24 0.23 -1.21 -0.92 0.00 0.00 175.35 173.30 3a70 s GLU 457 N 1.67 1.91 -0.66 1.68 0.41 -1.26 -2.43 118.70 120.03 3a70 s GLU 457 Ca 0.06 -2.48 -0.26 0.00 -0.41 0.00 0.00 54.97 51.88 3a70 s GLU 457 Cb -0.16 -3.32 -0.05 0.00 -1.78 0.00 0.00 34.13 28.82 3a70 s GLU 457 CO 0.07 -1.08 2.10 -2.14 -0.49 0.00 0.00 175.26 173.72 3a70 s PRO 458 N -0.06 2.33 0.00 0.39 0.02 -1.26 -4.86 135.00 131.56 3a70 s PRO 458 Ca 0.16 0.64 0.00 0.00 0.02 0.00 0.00 61.00 61.82 3a70 s PRO 458 Cb -0.24 -4.62 0.00 0.00 0.02 0.00 0.00 34.50 29.65 3a70 s PRO 458 CO -0.02 -3.24 0.00 -0.25 -0.33 0.00 0.00 177.00 173.17 3a70 n ASP 467 N 14.66 0.00 -4.73 2.53 8.00 -1.26 -5.21 116.55 130.54 3a70 n ASP 467 Ca 0.32 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.41 3a70 n ASP 467 Cb 0.51 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.56 3a70 n ASP 467 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3a70 s ASP 468 N 0.00 7.27 -0.05 -2.24 1.01 -1.26 -4.16 116.67 117.23 3a70 s ASP 468 Ca 0.00 1.52 0.02 0.00 0.71 0.00 0.00 52.55 54.81 3a70 s ASP 468 Cb 0.00 -2.51 0.01 0.00 1.01 0.00 0.00 42.92 41.43 3a70 s ASP 468 CO 0.00 -0.09 -0.12 -0.69 0.21 0.00 0.00 175.17 174.48 3a70 s VAL 469 N 0.37 1.06 -0.24 -1.27 1.01 -0.12 -4.94 120.40 116.26 3a70 s VAL 469 Ca 0.43 -0.46 -0.09 0.00 0.00 0.00 0.00 61.98 61.87 3a70 s VAL 469 Cb -0.21 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 3a70 s VAL 469 CO 0.25 0.33 0.11 -0.89 0.00 0.00 0.00 175.10 174.90 3a70 s THR 470 N 0.51 4.78 -0.15 3.92 2.01 -1.26 -0.83 115.64 124.62 3a70 s THR 470 Ca -0.11 -0.02 -0.05 0.00 0.31 0.00 0.00 61.69 61.82 3a70 s THR 470 Cb -0.14 -3.23 -0.03 0.00 0.01 0.00 0.00 72.50 69.11 3a70 s THR 470 CO 0.03 0.34 0.02 -1.00 -0.69 0.00 0.00 174.62 173.31 3a70 s HIS 471 N 1.38 3.17 0.12 4.92 3.76 0.17 -4.64 115.29 124.17 3a70 s HIS 471 Ca 0.06 -0.01 -0.30 0.00 -0.15 0.00 0.00 55.06 54.66 3a70 s HIS 471 Cb -0.15 -1.97 -0.06 0.00 1.11 0.00 0.00 32.58 31.51 3a70 s HIS 471 CO 0.05 0.18 1.00 -1.12 -0.85 0.00 0.00 174.74 174.00 3a70 s SER 472 N 0.06 7.42 -0.29 1.40 0.01 0.36 -0.57 113.70 122.10 3a70 s SER 472 Ca 0.03 1.86 -0.24 0.00 1.31 0.00 0.00 55.95 58.92 3a70 s SER 472 Cb -0.13 -2.59 -0.00 0.00 0.21 0.00 0.00 66.02 63.51 3a70 s SER 472 CO 0.02 -0.13 0.79 -0.69 0.41 0.00 0.00 173.24 173.64 3a70 s VAL 473 N 0.06 4.81 0.28 3.43 1.01 0.22 -1.26 120.40 128.95 3a70 s VAL 473 Ca 0.48 1.28 0.02 0.00 0.00 0.00 0.00 61.98 63.76 3a70 s VAL 473 Cb -0.25 -4.13 -0.05 0.00 0.00 0.00 0.00 36.38 31.95 3a70 s VAL 473 CO 0.31 -0.20 0.09 0.42 0.00 0.00 0.00 175.10 175.72 3a70 s THR 474 N 2.92 0.70 0.41 3.92 -4.23 -0.75 -4.95 115.64 113.66 3a70 s THR 474 Ca 0.33 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 59.04 3a70 s THR 474 Cb -0.14 -2.66 0.21 0.00 1.34 0.00 0.00 72.50 71.25 3a70 s THR 474 CO 0.11 0.00 1.98 0.00 -0.54 0.00 0.00 174.62 176.18 3a70 h ALA 475 N 2.28 1.43 -0.01 3.99 0.00 -2.03 -2.69 119.26 122.22 3a70 h ALA 475 Ca -0.38 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.35 3a70 h ALA 475 Cb 1.25 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3a70 h ALA 475 CO 0.62 0.25 -0.06 -1.13 0.00 0.00 0.00 179.25 178.93 3a70 n SER 476 N -3.95 1.39 0.00 0.00 3.41 -1.26 -5.04 113.62 108.17 3a70 n SER 476 Ca -0.02 -1.36 0.00 0.00 -0.26 0.00 0.00 58.87 57.23 3a70 n SER 476 Cb 0.28 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 3a70 n SER 476 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3a70 n GLY 477 N 1.22 0.98 3.71 5.00 0.00 -1.02 -4.54 105.19 110.54 3a70 n GLY 477 Ca 0.17 -1.94 -0.40 0.00 0.00 0.00 0.00 46.02 43.85 3a70 n GLY 477 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3a70 s LEU 478 N 0.00 4.32 -0.08 0.99 1.43 -0.40 -1.81 118.68 123.13 3a70 s LEU 478 Ca 0.00 1.28 0.04 0.00 -1.03 0.00 0.00 54.13 54.42 3a70 s LEU 478 Cb 0.00 -3.18 -0.01 0.00 0.03 0.00 0.00 46.19 43.03 3a70 s LEU 478 CO 0.00 -0.15 -0.22 -0.54 0.23 0.00 0.00 176.35 175.67 3a70 s LYS 479 N 0.89 2.86 -0.37 1.70 1.02 -0.39 -0.54 119.74 124.91 3a70 s LYS 479 Ca 0.40 -0.84 -0.01 0.00 0.02 0.00 0.00 55.97 55.54 3a70 s LYS 479 Cb -0.18 -2.31 0.10 0.00 -0.52 0.00 0.00 37.83 34.92 3a70 s LYS 479 CO 0.20 0.30 0.13 0.08 -0.92 0.00 0.00 175.35 175.14 3a70 s VAL 480 N 0.05 2.99 0.00 3.17 1.01 0.10 -0.48 120.40 127.24 3a70 s VAL 480 Ca -0.09 -1.99 0.00 0.00 0.00 0.00 0.00 61.98 59.90 3a70 s VAL 480 Cb -0.15 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.21 3a70 s VAL 480 CO 0.06 -0.55 0.00 0.61 0.00 0.00 0.00 175.10 175.21 3a70 n GLY 481 N 4.52 1.88 0.02 4.51 0.00 -1.26 -0.51 105.19 114.34 3a70 n GLY 481 Ca -0.03 0.42 0.12 0.00 0.00 0.00 0.00 46.02 46.52 3a70 n GLY 481 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3a70 n SER 482 N 9.23 0.66 -4.69 1.61 3.41 -1.26 -4.92 113.62 117.65 3a70 n SER 482 Ca 0.00 -0.47 -0.40 0.00 -0.26 0.00 0.00 58.87 57.74 3a70 n SER 482 Cb 0.00 0.42 -0.05 0.00 -0.26 0.00 0.00 64.21 64.32 3a70 n SER 482 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3a70 s ASN 483 N -2.97 6.88 -0.16 4.04 0.01 0.33 -5.04 114.94 118.03 3a70 s ASN 483 Ca 0.11 1.06 -0.02 0.00 -0.71 0.00 0.00 52.86 53.30 3a70 s ASN 483 Cb 0.17 -2.39 -0.01 0.00 0.41 0.00 0.00 41.25 39.43 3a70 s ASN 483 CO 0.73 -0.20 -0.10 -0.69 -1.51 0.00 0.00 177.10 175.34 3a70 s VAL 484 N 1.31 3.23 -0.38 1.60 1.01 -1.26 -0.72 120.40 125.19 3a70 s VAL 484 Ca 0.34 -0.58 -0.19 0.00 0.00 0.00 0.00 61.98 61.55 3a70 s VAL 484 Cb -0.17 -2.39 0.01 0.00 0.00 0.00 0.00 36.38 33.83 3a70 s VAL 484 CO 0.14 0.50 0.54 -0.89 0.00 0.00 0.00 175.10 175.39 3a70 s THR 485 N 0.64 4.97 0.36 3.92 2.01 0.30 -4.98 115.64 122.86 3a70 s THR 485 Ca -0.05 0.19 -0.27 0.00 0.31 0.00 0.00 61.69 61.87 3a70 s THR 485 Cb -0.15 -4.04 -0.09 0.00 0.01 0.00 0.00 72.50 68.22 3a70 s THR 485 CO 0.03 -0.35 1.15 -1.10 -0.69 0.00 0.00 174.62 173.66 3a70 s GLN 486 N 2.48 4.26 0.62 4.92 -0.21 -1.26 -1.27 119.66 129.20 3a70 s GLN 486 Ca 0.19 1.83 -0.18 0.00 0.02 0.00 0.00 55.36 57.22 3a70 s GLN 486 Cb -0.15 -2.84 -0.02 0.00 1.00 0.00 0.00 33.01 30.99 3a70 s GLN 486 CO 0.15 -0.13 1.23 0.71 -2.12 0.00 0.00 175.29 175.13 3a70 s TYR 487 N -1.35 2.28 0.49 0.91 2.02 -1.26 -4.70 117.35 115.73 3a70 s TYR 487 Ca 0.53 1.51 -0.23 0.00 -0.37 0.00 0.00 57.07 58.51 3a70 s TYR 487 Cb -0.31 -3.54 -0.08 0.00 -0.40 0.00 0.00 41.96 37.63 3a70 s TYR 487 CO 0.39 -2.45 1.19 -0.25 -1.57 0.00 0.00 175.55 172.87 3a70 n ASP 488 N -1.78 2.05 -4.55 2.29 8.00 0.13 -4.90 116.55 117.79 3a70 n ASP 488 Ca 0.14 1.01 -0.56 0.00 0.71 0.00 0.00 54.79 56.09 3a70 n ASP 488 Cb 0.49 -1.48 -0.07 0.00 -0.02 0.00 0.00 41.12 40.05 3a70 n ASP 488 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3a70 n ALA 489 N -0.74 -2.23 -2.90 2.24 0.00 -1.26 -4.85 120.51 110.77 3a70 n ALA 489 Ca 0.09 0.55 -0.10 0.00 0.00 0.00 0.00 53.44 53.99 3a70 n ALA 489 Cb 0.42 -1.93 -0.10 0.00 0.00 0.00 0.00 19.45 17.85 3a70 n ALA 489 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3a70 s SER 490 N 0.39 0.14 -0.21 0.00 0.01 -1.26 -0.97 113.70 111.81 3a70 s SER 490 Ca 0.88 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 57.73 3a70 s SER 490 Cb -1.12 0.19 0.03 0.00 0.21 0.00 0.00 66.02 65.33 3a70 s SER 490 CO 0.53 -0.42 -0.14 -0.69 0.41 0.00 0.00 173.24 172.93 3a70 s VAL 491 N -1.97 2.38 -0.06 3.43 1.01 0.37 -4.90 120.40 120.66 3a70 s VAL 491 Ca -0.10 -1.04 -0.18 0.00 0.00 0.00 0.00 61.98 60.66 3a70 s VAL 491 Cb -0.05 -2.13 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 3a70 s VAL 491 CO -0.02 0.35 0.49 -0.54 0.00 0.00 0.00 175.10 175.38 3a70 s LYS 492 N 1.28 4.22 0.00 2.72 1.02 -1.26 -1.64 119.74 126.08 3a70 s LYS 492 Ca 0.02 0.51 0.00 0.00 0.02 0.00 0.00 55.97 56.51 3a70 s LYS 492 Cb -0.15 -3.35 0.00 0.00 -0.52 0.00 0.00 37.83 33.81 3a70 s LYS 492 CO -0.09 0.36 0.00 0.41 -0.92 0.00 0.00 175.35 175.11 3a70 n GLY 493 N 2.65 1.03 3.47 -3.33 0.00 0.11 -4.95 105.19 104.18 3a70 n GLY 493 Ca -0.09 -1.79 -0.23 0.00 0.00 0.00 0.00 46.02 43.90 3a70 n GLY 493 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3a70 s THR 494 N 1.33 0.84 -1.86 2.61 -4.23 -1.25 -4.92 115.64 108.16 3a70 s THR 494 Ca 0.00 -2.00 0.19 0.00 -1.18 0.00 0.00 61.69 58.70 3a70 s THR 494 Cb 0.00 -2.55 0.50 0.00 1.34 0.00 0.00 72.50 71.79 3a70 s THR 494 CO 0.00 0.00 1.57 0.59 -0.54 0.00 0.00 174.62 176.24 3a70 n ASN 495 N -0.97 0.00 -4.59 3.99 5.03 -1.26 -3.97 115.26 113.49 3a70 n ASN 495 Ca -0.04 -0.46 -0.27 0.00 0.87 0.00 0.00 54.58 54.68 3a70 n ASN 495 Cb 0.66 -0.07 0.12 0.00 -1.02 0.00 0.00 39.78 39.47 3a70 n ASN 495 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 3a70 s GLY 496 N -2.14 1.72 -0.09 7.41 0.00 -1.26 -4.06 107.32 108.90 3a70 s GLY 496 Ca 0.27 -1.15 -0.30 0.00 0.00 0.00 0.00 44.72 43.54 3a70 s GLY 496 CO 0.24 -0.57 1.42 0.00 0.00 0.00 0.00 173.10 174.19 3a70 s ALA 497 N -3.50 3.63 0.20 3.20 0.00 -1.26 -4.48 121.76 119.54 3a70 s ALA 497 Ca 0.67 0.70 0.11 0.00 0.00 0.00 0.00 51.96 53.44 3a70 s ALA 497 Cb -0.07 -3.65 -0.04 0.00 0.00 0.00 0.00 23.12 19.35 3a70 s ALA 497 CO 0.48 -1.18 -0.19 -0.51 0.00 0.00 0.00 175.76 174.35 3a70 s ASP 498 N 2.40 3.69 -0.22 0.00 1.01 -1.26 -5.00 116.67 117.28 3a70 s ASP 498 Ca 0.63 -0.79 -0.05 0.00 0.71 0.00 0.00 52.55 53.04 3a70 s ASP 498 Cb -0.27 -0.40 -0.02 0.00 1.01 0.00 0.00 42.92 43.24 3a70 s ASP 498 CO 0.22 0.11 0.00 -0.89 0.21 0.00 0.00 175.17 174.82 3a70 s THR 499 N -1.74 3.85 -0.07 -1.27 2.01 -1.26 -0.60 115.64 116.55 3a70 s THR 499 Ca 0.23 -0.34 0.05 0.00 0.31 0.00 0.00 61.69 61.94 3a70 s THR 499 Cb -0.08 -2.76 -0.01 0.00 0.01 0.00 0.00 72.50 69.67 3a70 s THR 499 CO 0.12 0.41 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.46 3a70 s LEU 500 N 1.30 2.04 -0.10 4.42 1.43 -0.01 -4.99 118.68 122.77 3a70 s LEU 500 Ca 0.04 -0.50 0.04 0.00 -1.03 0.00 0.00 54.13 52.68 3a70 s LEU 500 Cb -0.15 -1.31 -0.00 0.00 0.03 0.00 0.00 46.19 44.76 3a70 s LEU 500 CO 0.01 0.20 -0.23 -0.75 0.23 0.00 0.00 176.35 175.80 3a70 s LYS 501 N 0.06 3.03 0.39 1.70 2.20 -1.26 0.47 119.74 126.33 3a70 s LYS 501 Ca -0.09 -0.87 -0.24 0.00 -0.36 0.00 0.00 55.97 54.41 3a70 s LYS 501 Cb -0.15 -2.31 -0.09 0.00 -1.51 0.00 0.00 37.83 33.77 3a70 s LYS 501 CO 0.05 0.20 1.04 0.00 -0.36 0.00 0.00 175.35 176.28 3a70 s ALA 502 N 0.30 3.10 0.69 3.13 0.00 -0.06 -4.94 121.76 123.98 3a70 s ALA 502 Ca -0.17 0.68 -0.11 0.00 0.00 0.00 0.00 51.96 52.36 3a70 s ALA 502 Cb -0.17 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.69 3a70 s ALA 502 CO 0.08 -0.17 1.06 -1.01 0.00 0.00 0.00 175.76 175.72 3a70 s HIS 503 N -1.66 3.17 0.57 0.00 0.09 -1.26 -4.40 115.29 111.80 3a70 s HIS 503 Ca 0.57 1.38 0.31 0.00 -0.00 0.00 0.00 55.06 57.32 3a70 s HIS 503 Cb -0.22 -2.87 1.82 0.00 -0.00 0.00 0.00 32.58 31.31 3a70 s HIS 503 CO 0.27 -1.19 2.24 0.00 -0.00 0.00 0.00 174.74 176.06 3a70 h ALA 504 N -0.68 1.43 0.00 -1.40 0.00 -1.97 -1.90 119.26 114.73 3a70 h ALA 504 Ca -0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3a70 h ALA 504 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3a70 h ALA 504 CO 0.58 0.03 0.00 0.41 0.00 0.00 0.00 179.25 180.26 3a70 n GLY 505 N -1.18 -1.12 0.00 0.00 0.00 -1.26 -2.27 105.19 99.36 3a70 n GLY 505 Ca -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.92 3a70 n GLY 505 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a70 n GLY 506 N 0.44 1.65 3.13 -0.02 0.00 -0.72 -4.49 105.19 105.19 3a70 n GLY 506 Ca 0.05 -1.53 -0.09 0.00 0.00 0.00 0.00 46.02 44.45 3a70 n GLY 506 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3a70 s ASP 507 N -0.18 0.18 -0.03 1.61 1.01 -1.25 -4.76 116.67 113.26 3a70 s ASP 507 Ca 0.00 -0.57 -0.28 0.00 0.71 0.00 0.00 52.55 52.41 3a70 s ASP 507 Cb 0.00 0.24 -0.03 0.00 1.01 0.00 0.00 42.92 44.14 3a70 s ASP 507 CO 0.00 -0.54 0.92 0.26 0.21 0.00 0.00 175.17 176.02 3a70 s TRP 508 N -2.82 3.62 -0.20 4.23 0.52 -0.14 -0.84 118.94 123.30 3a70 s TRP 508 Ca -0.03 1.58 0.00 0.00 0.02 0.00 0.00 56.10 57.67 3a70 s TRP 508 Cb 0.00 -3.06 0.02 0.00 -1.15 0.00 0.00 33.47 29.28 3a70 s TRP 508 CO -0.06 -0.03 -0.15 -0.51 0.02 0.00 0.00 176.95 176.23 3a70 s LEU 509 N 1.14 2.54 -0.47 2.99 1.43 0.51 -0.48 118.68 126.34 3a70 s LEU 509 Ca 0.48 -0.73 -0.01 0.00 -1.03 0.00 0.00 54.13 52.83 3a70 s LEU 509 Cb -0.20 -1.55 0.13 0.00 0.03 0.00 0.00 46.19 44.60 3a70 s LEU 509 CO 0.24 -0.04 0.26 -0.36 0.23 0.00 0.00 176.35 176.68 3a70 s PHE 510 N 1.30 3.52 0.20 0.29 0.08 -0.66 0.01 117.98 122.73 3a70 s PHE 510 Ca 0.03 -2.65 -0.19 0.00 0.12 0.00 0.00 56.93 54.24 3a70 s PHE 510 Cb -0.15 -3.14 0.17 0.00 -0.57 0.00 0.00 43.02 39.33 3a70 s PHE 510 CO -0.10 -0.91 1.59 0.78 -0.10 0.00 0.00 175.22 176.49 3a70 h GLY 511 N 7.55 0.05 0.00 4.36 0.00 -1.04 0.32 103.07 114.32 3a70 h GLY 511 Ca -0.08 0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.64 3a70 h GLY 511 CO 0.68 -0.22 0.00 1.04 0.00 0.00 0.00 176.54 178.04 3a70 n LEU 512 N -5.45 0.00 -4.60 3.11 4.77 -1.22 -3.80 117.00 109.81 3a70 n LEU 512 Ca 0.06 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.71 3a70 n LEU 512 Cb 0.36 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.58 3a70 n LEU 512 CO 0.00 -0.39 0.48 0.47 -1.33 0.00 0.00 177.39 176.62 3a70 n ASP 513 N -3.02 -0.09 0.00 -1.43 8.00 -1.25 -3.75 116.55 115.00 3a70 n ASP 513 Ca 0.00 0.49 0.00 0.00 0.71 0.00 0.00 54.79 55.99 3a70 n ASP 513 Cb 0.00 -1.40 0.00 0.00 -0.02 0.00 0.00 41.12 39.70 3a70 n ASP 513 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3a70 n GLY 514 N 0.81 1.83 3.52 0.44 0.00 -1.21 -4.17 105.19 106.40 3a70 n GLY 514 Ca 0.11 -1.97 -0.42 0.00 0.00 0.00 0.00 46.02 43.74 3a70 n GLY 514 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a70 s ASN 515 N 0.00 6.27 0.15 1.61 -0.87 -1.26 -4.28 114.94 116.56 3a70 s ASN 515 Ca 0.00 -0.48 0.05 0.00 -1.57 0.00 0.00 52.86 50.85 3a70 s ASN 515 Cb 0.00 -2.48 -0.04 0.00 -0.02 0.00 0.00 41.25 38.71 3a70 s ASN 515 CO 0.00 -1.47 0.13 -1.81 -2.57 0.00 0.00 177.10 171.38 3a70 s ASP 516 N 3.31 5.54 -0.32 -1.22 1.11 -1.25 -4.27 116.67 119.56 3a70 s ASP 516 Ca 0.31 -0.10 -0.06 0.00 0.18 0.00 0.00 52.55 52.88 3a70 s ASP 516 Cb -0.12 -1.46 0.03 0.00 1.07 0.00 0.00 42.92 42.44 3a70 s ASP 516 CO 0.17 0.08 0.08 -2.28 1.18 0.00 0.00 175.17 174.40 3a70 s HIS 517 N -1.70 3.22 -0.30 4.23 2.46 0.23 -0.78 115.29 122.64 3a70 s HIS 517 Ca 0.31 -1.36 -0.10 0.00 0.47 0.00 0.00 55.06 54.38 3a70 s HIS 517 Cb -0.10 -2.25 -0.02 0.00 -0.13 0.00 0.00 32.58 30.08 3a70 s HIS 517 CO 0.23 -0.70 0.17 -0.51 -2.47 0.00 0.00 174.74 171.47 3a70 s LEU 518 N 1.41 4.12 -0.47 8.88 1.02 0.63 -0.83 118.68 133.44 3a70 s LEU 518 Ca -0.01 -0.35 -0.10 0.00 0.02 0.00 0.00 54.13 53.70 3a70 s LEU 518 Cb -0.19 -2.05 0.11 0.00 0.02 0.00 0.00 46.19 44.08 3a70 s LEU 518 CO 0.02 -0.15 0.35 -0.63 0.02 0.00 0.00 176.35 175.95 3a70 s ILE 519 N 1.67 4.31 0.91 -0.59 1.01 0.18 -0.56 121.20 128.13 3a70 s ILE 519 Ca 0.06 -1.69 -0.11 0.00 0.00 0.00 0.00 60.65 58.91 3a70 s ILE 519 Cb -0.17 -3.80 0.14 0.00 0.01 0.00 0.00 42.46 38.64 3a70 s ILE 519 CO 0.08 -0.74 1.10 -0.83 0.00 0.00 0.00 174.94 174.55 3a70 s GLY 520 N 2.66 1.64 0.00 6.18 0.00 0.15 -0.88 107.32 117.07 3a70 s GLY 520 Ca 0.05 0.21 0.00 0.00 0.00 0.00 0.00 44.72 44.98 3a70 s GLY 520 CO 0.00 0.67 0.00 0.61 0.00 0.00 0.00 173.10 174.38 3a70 n GLY 521 N -0.49 5.33 0.08 0.20 0.00 -1.24 -4.15 105.19 104.91 3a70 n GLY 521 Ca 0.08 -2.10 0.10 0.00 0.00 0.00 0.00 46.02 44.10 3a70 n GLY 521 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3a70 n VAL 522 N -0.10 0.92 -2.10 1.61 0.24 -1.19 -3.61 118.33 114.11 3a70 n VAL 522 Ca 0.00 0.25 -0.28 0.00 -2.04 0.00 0.00 64.34 62.27 3a70 n VAL 522 Cb 0.00 -1.12 0.18 0.00 -1.47 0.00 0.00 33.84 31.43 3a70 n VAL 522 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3a70 s GLY 523 N -3.33 1.80 -0.60 7.63 0.00 -0.96 -3.14 107.32 108.73 3a70 s GLY 523 Ca 0.05 -1.42 -0.27 0.00 0.00 0.00 0.00 44.72 43.08 3a70 s GLY 523 CO 0.33 -0.65 1.14 -1.31 0.00 0.00 0.00 173.10 172.60 3a70 s ASN 524 N -4.91 6.37 0.20 1.64 0.01 -1.26 -4.36 114.94 112.63 3a70 s ASN 524 Ca 0.74 -0.12 0.05 0.00 -0.71 0.00 0.00 52.86 52.82 3a70 s ASN 524 Cb -0.03 -2.52 -0.04 0.00 0.41 0.00 0.00 41.25 39.07 3a70 s ASN 524 CO 0.52 -1.47 0.23 -1.81 -1.51 0.00 0.00 177.10 173.06 3a70 s ASP 525 N 3.06 5.90 -0.24 -1.22 1.01 -1.26 -3.78 116.67 120.14 3a70 s ASP 525 Ca 0.38 -0.04 0.01 0.00 0.71 0.00 0.00 52.55 53.62 3a70 s ASP 525 Cb -0.09 -1.64 0.04 0.00 1.01 0.00 0.00 42.92 42.24 3a70 s ASP 525 CO 0.22 0.01 -0.12 -0.69 0.21 0.00 0.00 175.17 174.81 3a70 s VAL 526 N -1.88 2.34 -0.22 -1.27 1.01 -0.02 -1.28 120.40 119.09 3a70 s VAL 526 Ca 0.33 -1.31 -0.12 0.00 0.00 0.00 0.00 61.98 60.87 3a70 s VAL 526 Cb -0.10 -2.24 -0.05 0.00 0.00 0.00 0.00 36.38 34.00 3a70 s VAL 526 CO 0.26 0.16 0.24 -0.36 0.00 0.00 0.00 175.10 175.40 3a70 s PHE 527 N 1.21 3.36 -0.45 5.22 0.08 0.59 -0.36 117.98 127.62 3a70 s PHE 527 Ca -0.03 0.39 0.02 0.00 0.12 0.00 0.00 56.93 57.43 3a70 s PHE 527 Cb -0.17 -2.34 0.14 0.00 -0.57 0.00 0.00 43.02 40.07 3a70 s PHE 527 CO -0.07 0.08 0.24 0.08 -0.10 0.00 0.00 175.22 175.46 3a70 s VAL 528 N 1.00 1.59 0.37 -0.44 1.01 0.10 -0.86 120.40 123.17 3a70 s VAL 528 Ca 0.12 -2.69 0.07 0.00 0.00 0.00 0.00 61.98 59.48 3a70 s VAL 528 Cb -0.14 -2.11 0.16 0.00 0.00 0.00 0.00 36.38 34.29 3a70 s VAL 528 CO 0.05 -0.88 1.90 1.23 0.00 0.00 0.00 175.10 177.39 3a70 h GLY 529 N 6.67 0.39 0.00 4.51 0.00 -1.79 0.33 103.07 113.18 3a70 h GLY 529 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.08 3a70 h GLY 529 CO 0.52 0.22 0.00 0.61 0.00 0.00 0.00 176.54 177.88 3a70 n GLY 530 N -0.88 -1.28 3.63 4.60 0.00 -1.26 -3.45 105.19 106.55 3a70 n GLY 530 Ca 0.00 -1.24 -0.31 0.00 0.00 0.00 0.00 46.02 44.48 3a70 n GLY 530 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a70 n ALA 531 N 0.99 -1.13 0.00 4.61 0.00 -1.25 -4.70 120.51 119.04 3a70 n ALA 531 Ca 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.83 3a70 n ALA 531 Cb 0.00 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.30 3a70 n ALA 531 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a70 n GLY 532 N 0.44 -0.50 3.42 0.00 0.00 -1.26 -3.35 105.19 103.93 3a70 n GLY 532 Ca 0.11 -1.72 -0.44 0.00 0.00 0.00 0.00 46.02 43.97 3a70 n GLY 532 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3a70 s ASN 533 N -2.78 6.20 -0.01 1.61 0.01 -1.26 -4.27 114.94 114.44 3a70 s ASN 533 Ca 0.00 -1.10 -0.01 0.00 -0.71 0.00 0.00 52.86 51.04 3a70 s ASN 533 Cb 0.00 -2.28 -0.04 0.00 0.41 0.00 0.00 41.25 39.34 3a70 s ASN 533 CO 0.00 -0.90 0.13 -1.81 -1.51 0.00 0.00 177.10 173.00 3a70 s ASP 534 N 2.90 5.99 -0.22 -1.22 1.01 -1.25 -3.95 116.67 119.92 3a70 s ASP 534 Ca 0.13 0.24 -0.06 0.00 0.71 0.00 0.00 52.55 53.56 3a70 s ASP 534 Cb -0.21 -1.80 -0.03 0.00 1.01 0.00 0.00 42.92 41.90 3a70 s ASP 534 CO 0.10 0.27 0.03 -0.22 0.21 0.00 0.00 175.17 175.56 3a70 s LEU 535 N -1.82 3.35 -0.12 1.23 2.96 0.04 -1.51 118.68 122.82 3a70 s LEU 535 Ca 0.25 -0.19 -0.00 0.00 -0.22 0.00 0.00 54.13 53.96 3a70 s LEU 535 Cb -0.12 -1.87 0.02 0.00 0.50 0.00 0.00 46.19 44.72 3a70 s LEU 535 CO 0.16 0.03 -0.10 -0.04 -1.32 0.00 0.00 176.35 175.08 3a70 s MET 536 N 1.23 1.73 -0.19 1.98 -1.94 -0.33 -0.27 119.30 121.51 3a70 s MET 536 Ca 0.04 -0.34 -0.04 0.00 -1.71 0.00 0.00 55.69 53.64 3a70 s MET 536 Cb -0.15 -1.70 -0.02 0.00 2.01 0.00 0.00 34.83 34.98 3a70 s MET 536 CO 0.02 -0.23 -0.03 -1.21 -0.01 0.00 0.00 175.02 173.56 3a70 s GLU 537 N 1.57 3.57 0.13 2.03 2.02 0.27 -0.45 118.70 127.84 3a70 s GLU 537 Ca 0.03 -0.55 -0.24 0.00 0.02 0.00 0.00 54.97 54.23 3a70 s GLU 537 Cb -0.13 -2.98 -0.03 0.00 0.10 0.00 0.00 34.13 31.09 3a70 s GLU 537 CO -0.08 0.06 1.64 1.03 0.02 0.00 0.00 175.26 177.93 3a70 h SER 538 N 7.32 -0.69 0.00 -0.19 0.87 -1.12 0.42 113.55 120.16 3a70 h SER 538 Ca -0.35 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.32 3a70 h SER 538 Cb 1.18 0.30 0.00 0.00 -0.44 0.00 0.00 62.40 63.44 3a70 h SER 538 CO 0.61 -0.29 0.00 0.61 -0.53 0.00 0.00 176.83 177.23 3a70 n GLY 539 N -1.35 0.74 0.00 5.77 0.00 -1.26 -3.63 105.19 105.45 3a70 n GLY 539 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3a70 n GLY 539 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a70 n GLY 540 N -2.00 0.66 6.37 -0.02 0.00 -1.24 -3.19 105.19 105.78 3a70 n GLY 540 Ca 0.00 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 43.87 3a70 n GLY 540 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a70 n GLY 541 N 0.00 -2.10 3.15 -0.02 0.00 -1.19 -4.45 105.19 100.58 3a70 n GLY 541 Ca 0.00 -1.47 -0.38 0.00 0.00 0.00 0.00 46.02 44.18 3a70 n GLY 541 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a70 s ALA 542 N -1.05 3.25 0.14 4.61 0.00 -1.26 -4.79 121.76 122.66 3a70 s ALA 542 Ca 0.00 -2.57 0.04 0.00 0.00 0.00 0.00 51.96 49.43 3a70 s ALA 542 Cb 0.00 -2.56 -0.04 0.00 0.00 0.00 0.00 23.12 20.52 3a70 s ALA 542 CO 0.00 -1.85 0.12 -0.51 0.00 0.00 0.00 175.76 173.52 3a70 s ASP 543 N 2.04 5.52 -0.08 0.00 1.01 -1.26 -4.27 116.67 119.65 3a70 s ASP 543 Ca 0.08 -0.09 0.04 0.00 0.71 0.00 0.00 52.55 53.29 3a70 s ASP 543 Cb -0.24 -1.45 -0.01 0.00 1.01 0.00 0.00 42.92 42.23 3a70 s ASP 543 CO -0.03 0.10 -0.22 -0.89 0.21 0.00 0.00 175.17 174.34 3a70 s THR 544 N -1.64 2.32 -0.17 -1.27 2.01 -0.40 -1.19 115.64 115.29 3a70 s THR 544 Ca 0.30 -0.96 -0.01 0.00 0.31 0.00 0.00 61.69 61.34 3a70 s THR 544 Cb -0.11 -1.88 -0.00 0.00 0.01 0.00 0.00 72.50 70.52 3a70 s THR 544 CO 0.23 0.56 -0.13 -0.36 -0.69 0.00 0.00 174.62 174.23 3a70 s PHE 545 N -0.04 2.83 -0.16 4.92 0.08 0.15 -0.30 117.98 125.46 3a70 s PHE 545 Ca -0.06 -1.08 -0.02 0.00 0.12 0.00 0.00 56.93 55.89 3a70 s PHE 545 Cb -0.15 -1.94 -0.01 0.00 -0.57 0.00 0.00 43.02 40.34 3a70 s PHE 545 CO 0.05 -0.52 -0.09 -1.17 -0.10 0.00 0.00 175.22 173.38 3a70 s LEU 546 N 1.02 2.85 -0.10 -0.37 2.96 -0.04 -0.66 118.68 124.34 3a70 s LEU 546 Ca -0.01 -0.31 0.02 0.00 -0.22 0.00 0.00 54.13 53.61 3a70 s LEU 546 Cb -0.15 -1.67 0.01 0.00 0.50 0.00 0.00 46.19 44.89 3a70 s LEU 546 CO -0.03 0.12 -0.14 -0.36 -1.32 0.00 0.00 176.35 174.62 3a70 s PHE 547 N 0.64 1.80 -0.04 5.38 0.08 -0.18 -4.34 117.98 121.32 3a70 s PHE 547 Ca -0.05 -0.80 -0.09 0.00 0.12 0.00 0.00 56.93 56.11 3a70 s PHE 547 Cb -0.15 -1.31 0.01 0.00 -0.57 0.00 0.00 43.02 41.00 3a70 s PHE 547 CO 0.03 -0.42 0.20 1.21 -0.10 0.00 0.00 175.22 176.14 3a70 s ASN 548 N 0.93 -0.13 0.89 1.36 3.84 -1.25 -1.09 114.94 119.48 3a70 s ASN 548 Ca -0.09 0.14 0.00 0.00 0.21 0.00 0.00 52.86 53.12 3a70 s ASN 548 Cb -0.15 0.34 0.00 0.00 -0.55 0.00 0.00 41.25 40.88 3a70 s ASN 548 CO -0.00 -0.25 0.00 0.61 -2.79 0.00 0.00 177.10 174.67 3a70 n GLY 549 N 2.11 1.66 3.23 1.21 0.00 0.19 -3.73 105.19 109.86 3a70 n GLY 549 Ca -0.18 -0.56 -0.44 0.00 0.00 0.00 0.00 46.02 44.84 3a70 n GLY 549 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a70 n ALA 550 N 6.65 4.48 1.19 4.61 0.00 -1.26 -4.63 120.51 131.54 3a70 n ALA 550 Ca 0.00 -4.39 0.12 0.00 0.00 0.00 0.00 53.44 49.17 3a70 n ALA 550 Cb 0.00 -2.87 0.62 0.00 0.00 0.00 0.00 19.45 17.20 3a70 n ALA 550 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 3a70 n PHE 551 N 4.26 0.00 -2.15 0.00 -1.74 -1.24 -4.53 117.46 112.05 3a70 n PHE 551 Ca 0.35 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.24 3a70 n PHE 551 Cb 0.39 -0.25 0.00 0.00 1.52 0.00 0.00 39.48 41.14 3a70 n PHE 551 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 3a70 n GLY 552 N 0.74 -1.74 3.24 4.97 0.00 -1.26 -4.19 105.19 106.96 3a70 n GLY 552 Ca 0.12 -1.65 -0.39 0.00 0.00 0.00 0.00 46.02 44.10 3a70 n GLY 552 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3a70 s GLN 553 N 0.00 2.51 0.15 1.61 -1.52 -1.26 -1.16 119.66 119.99 3a70 s GLN 553 Ca 0.00 -1.44 0.04 0.00 -1.95 0.00 0.00 55.36 52.01 3a70 s GLN 553 Cb 0.00 -3.65 -0.04 0.00 -0.22 0.00 0.00 33.01 29.10 3a70 s GLN 553 CO 0.00 -0.89 0.19 -0.51 -0.25 0.00 0.00 175.29 173.84 3a70 s ASP 554 N 1.87 5.89 -0.08 5.90 1.01 0.01 -3.82 116.67 127.45 3a70 s ASP 554 Ca 0.02 0.02 0.04 0.00 0.71 0.00 0.00 52.55 53.34 3a70 s ASP 554 Cb -0.22 -1.66 0.00 0.00 1.01 0.00 0.00 42.92 42.06 3a70 s ASP 554 CO 0.01 0.08 -0.20 -0.13 0.21 0.00 0.00 175.17 175.14 3a70 s ARG 555 N -3.06 2.47 -0.20 8.23 0.52 -0.57 -0.40 118.95 125.95 3a70 s ARG 555 Ca 0.32 -0.71 -0.02 0.00 -0.52 0.00 0.00 55.73 54.81 3a70 s ARG 555 Cb -0.11 -1.94 -0.00 0.00 0.52 0.00 0.00 34.95 33.43 3a70 s ARG 555 CO 0.26 0.15 -0.10 0.08 0.02 0.00 0.00 175.30 175.70 3a70 s VAL 556 N 0.39 2.92 -0.14 3.52 1.01 0.24 -1.19 120.40 127.14 3a70 s VAL 556 Ca -0.15 -0.66 -0.09 0.00 0.00 0.00 0.00 61.98 61.08 3a70 s VAL 556 Cb -0.16 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.88 3a70 s VAL 556 CO 0.06 0.47 0.16 -0.69 0.00 0.00 0.00 175.10 175.11 3a70 s VAL 557 N 1.28 5.44 0.00 2.92 1.01 0.41 -1.07 120.40 130.38 3a70 s VAL 557 Ca 0.03 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.27 3a70 s VAL 557 Cb -0.14 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.79 3a70 s VAL 557 CO -0.05 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.21 3a70 n GLY 558 N 2.55 0.54 3.70 4.51 0.00 -1.26 -0.61 105.19 114.62 3a70 n GLY 558 Ca -0.18 -0.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.57 3a70 n GLY 558 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3a70 s PHE 559 N -2.00 3.30 0.12 1.61 5.36 -1.26 -4.64 117.98 120.47 3a70 s PHE 559 Ca 0.00 1.22 0.01 0.00 -0.96 0.00 0.00 56.93 57.20 3a70 s PHE 559 Cb 0.00 -3.45 -0.00 0.00 -0.34 0.00 0.00 43.02 39.23 3a70 s PHE 559 CO 0.00 -1.42 0.03 0.25 -1.46 0.00 0.00 175.22 172.62 3a70 n THR 560 N 4.21 0.00 -0.34 0.12 -2.24 -1.26 -4.96 114.28 109.80 3a70 n THR 560 Ca 0.10 -0.64 0.14 0.00 -2.27 0.00 0.00 64.05 61.38 3a70 n THR 560 Cb 0.46 0.21 0.34 0.00 -2.10 0.00 0.00 70.33 69.24 3a70 n THR 560 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 3a70 h SER 561 N 0.42 0.69 -0.61 3.42 0.87 -1.95 -2.45 113.55 113.94 3a70 h SER 561 Ca -0.09 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 3a70 h SER 561 Cb 0.33 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 3a70 h SER 561 CO 0.15 0.18 0.00 -0.46 -0.53 0.00 0.00 176.83 176.17 3a70 n ASN 562 N -4.84 4.71 -4.94 6.23 6.94 -1.26 -4.95 115.26 117.15 3a70 n ASN 562 Ca 0.24 -2.49 -0.26 0.00 -0.02 0.00 0.00 54.58 52.06 3a70 n ASN 562 Cb 0.64 -0.58 -0.02 0.00 -2.36 0.00 0.00 39.78 37.45 3a70 n ASN 562 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 3a70 s ASP 563 N -0.85 6.35 -0.04 0.53 1.01 -0.92 -4.08 116.67 118.67 3a70 s ASP 563 Ca 0.49 0.39 0.03 0.00 0.71 0.00 0.00 52.55 54.17 3a70 s ASP 563 Cb 0.33 -2.00 0.00 0.00 1.01 0.00 0.00 42.92 42.26 3a70 s ASP 563 CO 0.22 -0.13 -0.12 -0.75 0.21 0.00 0.00 175.17 174.61 3a70 s LYS 564 N -3.73 1.33 -0.08 8.23 2.20 -0.34 -4.80 119.74 122.56 3a70 s LYS 564 Ca 0.39 -0.40 -0.04 0.00 -0.36 0.00 0.00 55.97 55.56 3a70 s LYS 564 Cb -0.10 -1.18 -0.04 0.00 -1.51 0.00 0.00 37.83 35.00 3a70 s LYS 564 CO 0.31 0.12 0.09 -0.51 -0.36 0.00 0.00 175.35 175.01 3a70 s LEU 565 N 0.28 4.07 -0.12 5.43 1.43 -0.39 -0.68 118.68 128.69 3a70 s LEU 565 Ca -0.06 0.31 -0.00 0.00 -1.03 0.00 0.00 54.13 53.35 3a70 s LEU 565 Cb -0.11 -2.08 0.02 0.00 0.03 0.00 0.00 46.19 44.06 3a70 s LEU 565 CO 0.02 0.36 -0.09 -0.69 0.23 0.00 0.00 176.35 176.18 3a70 s VAL 566 N -1.04 1.14 -0.19 -1.59 1.01 0.17 -0.26 120.40 119.64 3a70 s VAL 566 Ca 0.17 -0.36 -0.03 0.00 0.00 0.00 0.00 61.98 61.76 3a70 s VAL 566 Cb -0.12 -1.13 -0.01 0.00 0.00 0.00 0.00 36.38 35.12 3a70 s VAL 566 CO 0.06 0.39 -0.07 -0.36 0.00 0.00 0.00 175.10 175.13 3a70 s PHE 567 N 1.66 2.93 -0.14 5.22 0.08 0.16 -1.02 117.98 126.88 3a70 s PHE 567 Ca 0.05 -0.80 -0.05 0.00 0.12 0.00 0.00 56.93 56.25 3a70 s PHE 567 Cb -0.13 -2.02 0.07 0.00 -0.57 0.00 0.00 43.02 40.37 3a70 s PHE 567 CO -0.09 -0.41 0.30 -1.17 -0.10 0.00 0.00 175.22 173.76 3a70 s LEU 568 N 1.06 -0.34 -0.73 -0.37 2.96 -0.25 -0.69 118.68 120.32 3a70 s LEU 568 Ca 0.01 0.69 -0.05 0.00 -0.22 0.00 0.00 54.13 54.56 3a70 s LEU 568 Cb -0.15 0.86 0.01 0.00 0.50 0.00 0.00 46.19 47.41 3a70 s LEU 568 CO -0.01 -0.23 0.63 0.61 -1.32 0.00 0.00 176.35 176.04 3a70 n GLY 569 N 5.28 0.14 3.61 7.98 0.00 -1.26 -3.80 105.19 117.14 3a70 n GLY 569 Ca -0.08 -0.17 -0.25 0.00 0.00 0.00 0.00 46.02 45.51 3a70 n GLY 569 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3a70 s VAL 570 N -3.17 3.36 0.48 1.61 -7.23 -1.26 -0.63 120.40 113.55 3a70 s VAL 570 Ca 0.30 -1.73 -0.23 0.00 -1.81 0.00 0.00 61.98 58.51 3a70 s VAL 570 Cb -0.13 -2.72 -0.07 0.00 0.56 0.00 0.00 36.38 34.02 3a70 s VAL 570 CO 0.39 -0.22 1.24 -1.10 -0.31 0.00 0.00 175.10 175.11 3a70 s GLN 571 N -3.19 3.61 -0.39 4.82 -1.52 -1.26 -4.25 119.66 117.47 3a70 s GLN 571 Ca 0.28 1.97 0.00 0.00 -1.95 0.00 0.00 55.36 55.66 3a70 s GLN 571 Cb -0.08 -2.42 0.00 0.00 -0.22 0.00 0.00 33.01 30.29 3a70 s GLN 571 CO 0.18 -0.73 0.00 0.41 -0.25 0.00 0.00 175.29 174.89 3a70 n GLY 572 N 0.57 0.32 3.49 3.09 0.00 -1.26 -3.39 105.19 108.01 3a70 n GLY 572 Ca 0.08 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 44.92 3a70 n GLY 572 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a70 s VAL 573 N -2.20 4.91 0.41 1.61 1.01 -1.26 -4.84 120.40 120.04 3a70 s VAL 573 Ca 0.00 -0.16 -0.22 0.00 0.00 0.00 0.00 61.98 61.60 3a70 s VAL 573 Cb 0.00 -4.18 -0.11 0.00 0.00 0.00 0.00 36.38 32.09 3a70 s VAL 573 CO 0.00 -0.60 0.95 -0.76 0.00 0.00 0.00 175.10 174.70 3a70 s LEU 574 N 2.58 4.01 -0.26 3.92 1.43 -1.26 -4.87 118.68 124.23 3a70 s LEU 574 Ca 0.18 1.72 -0.42 0.00 -1.03 0.00 0.00 54.13 54.58 3a70 s LEU 574 Cb -0.16 -4.45 -0.18 0.00 0.03 0.00 0.00 46.19 41.43 3a70 s LEU 574 CO 0.16 -0.32 1.54 -2.65 0.23 0.00 0.00 176.35 175.30 3a70 n PRO 575 N -0.44 0.59 -1.01 1.29 -0.02 -1.26 0.23 135.00 134.38 3a70 n PRO 575 Ca 0.06 0.22 -0.00 0.00 -2.02 0.00 0.00 63.50 61.75 3a70 n PRO 575 Cb 0.53 -1.80 -0.00 0.00 -0.02 0.00 0.00 33.50 32.21 3a70 n PRO 575 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3a70 n ASN 576 N 3.92 -4.11 -4.59 2.55 5.15 -1.26 -4.81 115.26 112.10 3a70 n ASN 576 Ca 0.26 0.01 -0.46 0.00 -0.60 0.00 0.00 54.58 53.79 3a70 n ASN 576 Cb 0.07 -1.66 -0.02 0.00 -0.53 0.00 0.00 39.78 37.64 3a70 n ASN 576 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 3a70 n ASP 577 N -0.31 1.41 -3.06 1.20 8.00 0.14 -4.99 116.55 118.93 3a70 n ASP 577 Ca -0.00 1.17 -0.09 0.00 0.71 0.00 0.00 54.79 56.57 3a70 n ASP 577 Cb 0.19 -1.28 0.01 0.00 -0.02 0.00 0.00 41.12 40.02 3a70 n ASP 577 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3a70 n ASP 578 N 1.49 1.35 0.21 -2.24 5.68 -1.26 -4.80 116.55 116.98 3a70 n ASP 578 Ca 0.11 -1.65 0.05 0.00 -0.50 0.00 0.00 54.79 52.79 3a70 n ASP 578 Cb 0.30 -0.06 0.46 0.00 -1.14 0.00 0.00 41.12 40.67 3a70 n ASP 578 CO 0.00 0.00 0.00 2.19 -1.33 0.00 0.00 177.20 178.06 3a70 h PHE 579 N 0.38 0.00 -0.17 2.11 -0.00 -1.96 -2.83 116.94 114.48 3a70 h PHE 579 Ca -0.12 0.00 -0.05 0.00 -0.00 0.00 0.00 57.97 57.80 3a70 h PHE 579 Cb 0.47 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.40 3a70 h PHE 579 CO 0.00 0.27 -0.12 0.00 -0.00 0.00 0.00 178.31 178.46 3a70 h ARG 580 N 0.00 0.26 0.00 6.09 3.08 -1.96 0.17 114.38 122.02 3a70 h ARG 580 Ca -0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3a70 h ARG 580 Cb 0.50 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.52 3a70 h ARG 580 CO 0.04 0.39 0.00 0.00 -1.07 0.00 0.00 179.97 179.32 3a70 h ALA 581 N 1.64 1.00 0.00 0.04 0.00 -1.91 -3.22 119.26 116.81 3a70 h ALA 581 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3a70 h ALA 581 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3a70 h ALA 581 CO 0.02 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.99 3a70 n HIS 582 N -2.91 0.00 -4.42 0.00 8.25 -0.07 -5.04 115.22 111.03 3a70 n HIS 582 Ca -0.03 -0.07 -0.34 0.00 -0.26 0.00 0.00 57.72 57.03 3a70 n HIS 582 Cb 0.06 -0.01 -0.10 0.00 1.12 0.00 0.00 29.99 31.07 3a70 n HIS 582 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3a70 s ALA 583 N -0.13 3.20 0.27 -1.41 0.00 -0.52 -1.08 121.76 122.09 3a70 s ALA 583 Ca 0.00 -0.86 -0.04 0.00 0.00 0.00 0.00 51.96 51.06 3a70 s ALA 583 Cb 0.00 -1.39 -0.02 0.00 0.00 0.00 0.00 23.12 21.72 3a70 s ALA 583 CO 0.00 0.60 0.34 -1.54 0.00 0.00 0.00 175.76 175.16 3a70 s SER 584 N -0.99 0.44 -0.19 0.00 1.04 -0.22 -4.95 113.70 108.83 3a70 s SER 584 Ca 0.14 -1.31 -0.05 0.00 0.48 0.00 0.00 55.95 55.20 3a70 s SER 584 Cb -0.11 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.51 3a70 s SER 584 CO 0.03 -1.08 0.01 -0.04 0.98 0.00 0.00 173.24 173.15 3a70 s MET 585 N -3.75 3.73 -0.28 4.02 -1.94 -1.26 -0.86 119.30 118.96 3a70 s MET 585 Ca 0.32 -0.47 0.03 0.00 -1.71 0.00 0.00 55.69 53.86 3a70 s MET 585 Cb 0.02 -3.08 0.07 0.00 2.01 0.00 0.00 34.83 33.85 3a70 s MET 585 CO 0.15 0.14 -0.06 0.08 -0.01 0.00 0.00 175.02 175.32 3a70 s VAL 586 N 0.68 2.20 0.00 -6.03 1.01 0.54 -4.93 120.40 113.87 3a70 s VAL 586 Ca 0.00 -1.85 0.00 0.00 0.00 0.00 0.00 61.98 60.13 3a70 s VAL 586 Cb -0.14 -2.41 0.00 0.00 0.00 0.00 0.00 36.38 33.84 3a70 s VAL 586 CO 0.02 -0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.53 3a70 n GLY 587 N 4.38 2.51 0.80 4.51 0.00 -1.26 -2.25 105.19 113.87 3a70 n GLY 587 Ca -0.09 -0.30 0.11 0.00 0.00 0.00 0.00 46.02 45.75 3a70 n GLY 587 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3a70 n GLN 588 N 13.11 2.05 -4.65 1.61 1.13 -1.26 -4.95 117.38 124.42 3a70 n GLN 588 Ca 0.00 -1.58 -0.34 0.00 -1.94 0.00 0.00 57.00 53.14 3a70 n GLN 588 Cb 0.00 -1.44 -0.11 0.00 0.11 0.00 0.00 30.24 28.80 3a70 n GLN 588 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3a70 s ASP 589 N -1.53 4.57 -0.05 1.08 1.01 -0.96 -2.95 116.67 117.85 3a70 s ASP 589 Ca 0.34 -0.05 -0.27 0.00 0.71 0.00 0.00 52.55 53.28 3a70 s ASP 589 Cb 0.19 -1.13 -0.03 0.00 1.01 0.00 0.00 42.92 42.97 3a70 s ASP 589 CO 0.28 0.36 0.89 -0.89 0.21 0.00 0.00 175.17 176.01 3a70 s THR 590 N -0.81 4.91 -0.15 -1.27 2.01 -1.01 -0.34 115.64 118.98 3a70 s THR 590 Ca 0.13 1.83 -0.04 0.00 0.31 0.00 0.00 61.69 63.91 3a70 s THR 590 Cb -0.11 -4.22 -0.03 0.00 0.01 0.00 0.00 72.50 68.15 3a70 s THR 590 CO 0.02 0.15 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.38 3a70 s VAL 591 N 1.23 4.05 -0.21 3.82 1.01 -0.04 -0.65 120.40 129.61 3a70 s VAL 591 Ca 0.46 -0.30 -0.04 0.00 0.00 0.00 0.00 61.98 62.09 3a70 s VAL 591 Cb -0.19 -2.78 -0.01 0.00 0.00 0.00 0.00 36.38 33.40 3a70 s VAL 591 CO 0.22 0.50 -0.04 -0.76 0.00 0.00 0.00 175.10 175.02 3a70 s LEU 592 N 0.23 2.98 0.02 3.92 1.43 0.04 -1.06 118.68 126.23 3a70 s LEU 592 Ca -0.01 -0.34 0.07 0.00 -1.03 0.00 0.00 54.13 52.82 3a70 s LEU 592 Cb -0.14 -1.75 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 3a70 s LEU 592 CO 0.02 0.01 -0.20 -0.54 0.23 0.00 0.00 176.35 175.88 3a70 s LYS 593 N 1.29 2.11 -0.30 1.70 1.02 -0.24 -0.87 119.74 124.45 3a70 s LYS 593 Ca 0.04 -0.94 -0.00 0.00 0.02 0.00 0.00 55.97 55.08 3a70 s LYS 593 Cb -0.14 -2.17 0.13 0.00 -0.52 0.00 0.00 37.83 35.13 3a70 s LYS 593 CO -0.01 0.55 0.29 -0.06 -0.92 0.00 0.00 175.35 175.20 3a70 s PHE 594 N -0.82 -0.33 0.00 3.18 0.08 -0.21 -4.76 117.98 115.12 3a70 s PHE 594 Ca 0.13 -0.37 0.00 0.00 0.12 0.00 0.00 56.93 56.81 3a70 s PHE 594 Cb -0.10 -0.51 0.00 0.00 -0.57 0.00 0.00 43.02 41.83 3a70 s PHE 594 CO 0.03 -0.92 0.00 0.41 -0.10 0.00 0.00 175.22 174.64 3a70 n GLY 595 N 5.13 3.19 0.13 4.36 0.00 -1.22 -1.56 105.19 115.23 3a70 n GLY 595 Ca -0.00 -0.22 0.15 0.00 0.00 0.00 0.00 46.02 45.95 3a70 n GLY 595 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a70 n GLY 596 N 0.00 -0.79 3.95 -0.02 0.00 -1.26 -4.91 105.19 102.16 3a70 n GLY 596 Ca 0.00 -0.26 -0.25 0.00 0.00 0.00 0.00 46.02 45.51 3a70 n GLY 596 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3a70 s ASP 597 N -2.15 6.34 0.06 1.61 1.01 -0.60 -4.82 116.67 118.13 3a70 s ASP 597 Ca 0.40 0.25 -0.19 0.00 0.71 0.00 0.00 52.55 53.72 3a70 s ASP 597 Cb 0.21 -1.94 0.04 0.00 1.01 0.00 0.00 42.92 42.24 3a70 s ASP 597 CO 0.39 -0.06 0.45 -0.94 0.21 0.00 0.00 175.17 175.22 3a70 s SER 598 N -3.53 -0.33 -0.08 0.27 1.04 -0.31 -1.04 113.70 109.73 3a70 s SER 598 Ca 0.36 0.01 0.03 0.00 0.48 0.00 0.00 55.95 56.83 3a70 s SER 598 Cb -0.10 0.45 0.01 0.00 0.10 0.00 0.00 66.02 66.48 3a70 s SER 598 CO 0.30 -0.71 -0.16 -0.69 0.98 0.00 0.00 173.24 172.95 3a70 s VAL 599 N -2.67 1.46 -0.24 5.02 1.01 -0.05 -0.81 120.40 124.12 3a70 s VAL 599 Ca -0.04 -0.67 -0.06 0.00 0.00 0.00 0.00 61.98 61.21 3a70 s VAL 599 Cb -0.00 -1.29 -0.02 0.00 0.00 0.00 0.00 36.38 35.06 3a70 s VAL 599 CO -0.04 0.43 0.04 -0.89 0.00 0.00 0.00 175.10 174.63 3a70 s THR 600 N 0.52 3.98 -0.58 3.92 2.01 0.46 -0.78 115.64 125.17 3a70 s THR 600 Ca -0.15 -0.32 -0.17 0.00 0.31 0.00 0.00 61.69 61.36 3a70 s THR 600 Cb -0.16 -2.87 0.12 0.00 0.01 0.00 0.00 72.50 69.60 3a70 s THR 600 CO 0.05 0.34 0.60 -0.76 -0.69 0.00 0.00 174.62 174.17 3a70 s LEU 601 N 1.56 5.90 -0.05 4.42 1.43 0.18 0.79 118.68 132.90 3a70 s LEU 601 Ca 0.06 -1.70 -0.30 0.00 -1.03 0.00 0.00 54.13 51.16 3a70 s LEU 601 Cb -0.15 -2.25 -0.06 0.00 0.03 0.00 0.00 46.19 43.76 3a70 s LEU 601 CO 0.01 -0.95 1.80 -0.69 0.23 0.00 0.00 176.35 176.76 3a70 s VAL 602 N 1.96 3.35 0.00 -1.59 1.01 -0.23 -2.16 120.40 122.74 3a70 s VAL 602 Ca 0.07 0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.48 3a70 s VAL 602 Cb -0.26 -3.29 0.00 0.00 0.00 0.00 0.00 36.38 32.82 3a70 s VAL 602 CO 0.03 -0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.68 3a70 n GLY 603 N 4.44 0.62 3.67 4.51 0.00 -1.22 -4.61 105.19 112.60 3a70 n GLY 603 Ca 0.19 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 3a70 n GLY 603 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a70 s VAL 604 N -2.47 5.22 0.22 1.61 1.01 -0.92 -4.89 120.40 120.18 3a70 s VAL 604 Ca 0.00 0.64 -0.30 0.00 0.00 0.00 0.00 61.98 62.32 3a70 s VAL 604 Cb 0.00 -3.70 -0.08 0.00 0.00 0.00 0.00 36.38 32.60 3a70 s VAL 604 CO 0.00 0.26 1.03 0.00 0.00 0.00 0.00 175.10 176.40 3a70 s ALA 605 N 1.28 3.36 0.35 5.51 0.00 -1.26 -2.39 121.76 128.60 3a70 s ALA 605 Ca 0.17 0.75 0.02 0.00 0.00 0.00 0.00 51.96 52.91 3a70 s ALA 605 Cb -0.15 -3.29 0.64 0.00 0.00 0.00 0.00 23.12 20.32 3a70 s ALA 605 CO 0.07 -0.04 2.00 1.25 0.00 0.00 0.00 175.76 179.05 3a70 h LEU 606 N 4.49 0.73 -0.31 0.00 5.85 -1.92 -1.44 115.31 122.71 3a70 h LEU 606 Ca -0.45 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.25 3a70 h LEU 606 Cb 1.21 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.06 3a70 h LEU 606 CO 0.69 0.52 0.00 -0.46 -0.34 0.00 0.00 178.44 178.86 3a70 n ASN 607 N -4.44 0.26 0.05 1.25 6.94 -1.26 -2.31 115.26 115.76 3a70 n ASN 607 Ca 0.07 0.57 0.13 0.00 -0.02 0.00 0.00 54.58 55.33 3a70 n ASN 607 Cb 0.06 -0.62 0.51 0.00 -2.36 0.00 0.00 39.78 37.37 3a70 n ASN 607 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 3a70 n SER 608 N -1.80 0.40 -4.85 0.53 3.41 -0.54 -4.91 113.62 105.87 3a70 n SER 608 Ca 0.03 0.54 -0.33 0.00 -0.26 0.00 0.00 58.87 58.84 3a70 n SER 608 Cb 0.17 -0.65 -0.06 0.00 -0.26 0.00 0.00 64.21 63.42 3a70 n SER 608 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3a70 s LEU 609 N -3.76 4.17 0.04 1.04 1.43 -0.98 -5.01 118.68 115.61 3a70 s LEU 609 Ca 0.12 1.21 0.04 0.00 -1.03 0.00 0.00 54.13 54.48 3a70 s LEU 609 Cb 0.15 -3.81 -0.02 0.00 0.03 0.00 0.00 46.19 42.55 3a70 s LEU 609 CO 0.55 -0.10 -0.12 -0.94 0.23 0.00 0.00 176.35 175.97 3a70 s SER 610 N -2.10 1.45 0.45 2.29 1.04 -1.26 -5.05 113.70 110.52 3a70 s SER 610 Ca 0.49 -0.44 0.21 0.00 0.48 0.00 0.00 55.95 56.69 3a70 s SER 610 Cb -0.12 -0.08 1.19 0.00 0.10 0.00 0.00 66.02 67.10 3a70 s SER 610 CO 0.19 0.00 1.86 0.00 0.98 0.00 0.00 173.24 176.27 3a70 h ALA 611 N 4.96 2.37 0.00 5.32 0.00 -1.99 0.19 119.26 130.11 3a70 h ALA 611 Ca -0.37 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 3a70 h ALA 611 Cb 1.18 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 3a70 h ALA 611 CO 0.44 -0.65 -0.10 0.22 0.00 0.00 0.00 179.25 179.16 3a70 h ASP 612 N 0.30 0.00 0.49 0.00 3.58 -2.01 -1.54 116.42 117.23 3a70 h ASP 612 Ca 0.47 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.92 3a70 h ASP 612 Cb 1.33 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.38 3a70 h ASP 612 CO -0.14 0.10 -0.19 0.61 -2.88 0.00 0.00 179.24 176.73 3a70 n GLY 613 N -0.75 -1.07 2.68 -0.78 0.00 0.67 -4.80 105.19 101.14 3a70 n GLY 613 Ca -0.02 -0.27 -0.29 0.00 0.00 0.00 0.00 46.02 45.44 3a70 n GLY 613 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a70 s ILE 614 N -2.68 0.56 -0.26 -0.61 1.01 -0.58 -1.27 121.20 117.38 3a70 s ILE 614 Ca 0.22 -1.08 -0.21 0.00 0.00 0.00 0.00 60.65 59.58 3a70 s ILE 614 Cb 0.19 -1.37 -0.01 0.00 0.01 0.00 0.00 42.46 41.28 3a70 s ILE 614 CO 0.54 -0.61 0.68 -0.69 0.00 0.00 0.00 174.94 174.86 3a70 s VAL 615 N 1.79 4.94 -0.27 2.92 1.01 0.65 -4.74 120.40 126.69 3a70 s VAL 615 Ca 0.08 1.20 -0.00 0.00 0.00 0.00 0.00 61.98 63.25 3a70 s VAL 615 Cb -0.17 -3.99 0.04 0.00 0.00 0.00 0.00 36.38 32.26 3a70 s VAL 615 CO -0.25 -0.03 -0.06 -0.63 0.00 0.00 0.00 175.10 174.13 3a70 s ILE 616 N 2.61 2.70 0.00 2.22 -1.09 -1.26 0.40 121.20 126.77 3a70 s ILE 616 Ca 0.28 -1.33 0.00 0.00 -2.23 0.00 0.00 60.65 57.37 3a70 s ILE 616 Cb -0.15 -2.49 0.00 0.00 -1.58 0.00 0.00 42.46 38.24 3a70 s ILE 616 CO 0.09 0.03 0.41 0.00 -1.23 0.00 0.00 174.94 174.24