#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 1.01 -0.38 1.61 3.04 -1.72 -2.16 116.25 117.65 3a70 h VAL 3 Ca 0.00 -0.16 0.00 0.00 -1.01 0.00 0.00 66.70 65.53 3a70 h VAL 3 Cb 0.00 1.09 0.00 0.00 -2.01 0.00 0.00 31.29 30.37 3a70 h VAL 3 CO 0.00 0.04 0.00 -1.22 -1.01 0.00 0.00 177.57 175.38 3a70 n TYR 4 N -4.46 1.14 -1.53 3.17 4.01 -1.26 -3.81 117.16 114.41 3a70 n TYR 4 Ca -0.03 -0.75 -0.48 0.00 -0.16 0.00 0.00 57.90 56.48 3a70 n TYR 4 Cb 0.13 -0.29 -0.03 0.00 -0.31 0.00 0.00 39.34 38.84 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 0.08 0.61 -3.76 7.72 8.00 -0.81 -4.68 116.55 123.71 3a70 n ASP 5 Ca 0.21 1.15 -0.17 0.00 0.71 0.00 0.00 54.79 56.70 3a70 n ASP 5 Cb 0.87 -1.16 -0.16 0.00 -0.02 0.00 0.00 41.12 40.64 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 -0.70 0.13 0.00 1.24 5.04 -1.26 -5.03 117.35 116.77 3a70 s TYR 6 Ca 0.67 0.11 0.00 0.00 -2.44 0.00 0.00 57.07 55.41 3a70 s TYR 6 Cb -0.84 -0.35 0.00 0.00 0.35 0.00 0.00 41.96 41.12 3a70 s TYR 6 CO 0.56 -0.13 0.00 1.63 -1.34 0.00 0.00 175.55 176.28 3a70 n LYS 7 N 4.43 0.00 -1.13 4.97 5.02 -1.26 -1.89 118.16 128.30 3a70 n LYS 7 Ca -0.22 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.09 3a70 n LYS 7 Cb 0.50 0.00 0.13 0.00 -0.02 0.00 0.00 35.03 35.64 3a70 n LYS 7 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3a70 n ASN 8 N 5.27 1.90 0.24 4.39 2.04 -1.26 -4.75 115.26 123.10 3a70 n ASN 8 Ca 0.00 -3.29 0.13 0.00 -0.44 0.00 0.00 54.58 50.98 3a70 n ASN 8 Cb 0.00 -0.44 0.48 0.00 -2.53 0.00 0.00 39.78 37.29 3a70 n ASN 8 CO 0.00 0.00 0.00 -0.26 -0.44 0.00 0.00 177.26 176.56 3a70 h PHE 9 N 1.23 0.00 0.00 -2.53 0.04 -1.79 -3.50 116.94 110.39 3a70 h PHE 9 Ca -0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.75 3a70 h PHE 9 Cb 1.31 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.46 3a70 h PHE 9 CO 0.60 0.09 0.00 0.41 -0.60 0.00 0.00 178.31 178.82 3a70 n GLY 10 N 0.35 -2.67 0.44 -1.45 0.00 -1.26 -4.01 105.19 96.58 3a70 n GLY 10 Ca 0.01 -1.65 -0.18 0.00 0.00 0.00 0.00 46.02 44.20 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 0.00 0.13 -0.37 2.61 2.02 -1.97 -1.04 112.91 114.29 3a70 h THR 11 Ca 0.00 -0.11 -0.09 0.00 0.77 0.00 0.00 66.41 66.98 3a70 h THR 11 Cb 0.00 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 66.55 3a70 h THR 11 CO 0.00 0.01 -0.14 0.00 0.37 0.00 0.00 175.52 175.76 3a70 h ALA 12 N -1.07 0.51 0.00 6.16 0.00 -2.00 -2.56 119.26 120.30 3a70 h ALA 12 Ca -0.11 -0.34 -0.17 0.00 0.00 0.00 0.00 54.91 54.29 3a70 h ALA 12 Cb 0.85 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 3a70 h ALA 12 CO 0.18 0.41 -0.81 -0.44 0.00 0.00 0.00 179.25 178.59 3a70 h ASP 13 N 0.54 0.00 -0.64 0.00 3.32 -1.69 -2.43 116.42 115.52 3a70 h ASP 13 Ca 0.09 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.07 3a70 h ASP 13 Cb 0.67 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.20 3a70 h ASP 13 CO 0.05 0.81 0.15 0.28 -1.72 0.00 0.00 179.24 178.81 3a70 h SER 14 N 0.00 0.98 -0.19 6.45 0.02 -1.16 -1.49 113.55 118.16 3a70 h SER 14 Ca -0.01 -0.24 0.04 0.00 -0.84 0.00 0.00 61.79 60.74 3a70 h SER 14 Cb 1.49 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 63.73 3a70 h SER 14 CO 0.11 0.96 -0.07 0.11 -1.14 0.00 0.00 176.83 176.80 3a70 h LYS 15 N 0.95 -0.04 -0.88 3.45 1.57 -1.36 -0.42 116.57 119.83 3a70 h LYS 15 Ca 0.20 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.99 3a70 h LYS 15 Cb 0.37 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.65 3a70 h LYS 15 CO 0.00 -0.03 0.58 0.00 -0.57 0.00 0.00 179.45 179.44 3a70 h ALA 16 N 1.13 1.36 -0.18 3.86 0.00 -1.22 -0.92 119.26 123.30 3a70 h ALA 16 Ca 0.10 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3a70 h ALA 16 Cb 0.19 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3a70 h ALA 16 CO -0.22 0.59 0.11 1.25 0.00 0.00 0.00 179.25 180.98 3a70 h LEU 17 N 1.20 0.21 -0.94 0.00 5.85 -1.05 -2.00 115.31 118.58 3a70 h LEU 17 Ca 0.32 -0.04 0.03 0.00 0.84 0.00 0.00 57.88 59.03 3a70 h LEU 17 Cb -0.13 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 40.79 3a70 h LEU 17 CO -0.07 0.19 0.62 0.15 -0.34 0.00 0.00 178.44 178.99 3a70 h PHE 18 N 0.21 1.16 -0.42 1.25 3.57 -0.70 -1.17 116.94 120.84 3a70 h PHE 18 Ca 0.06 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.49 3a70 h PHE 18 Cb 0.02 -0.39 -0.02 0.00 2.79 0.00 0.00 35.95 38.35 3a70 h PHE 18 CO -0.05 0.69 -0.16 0.77 -2.23 0.00 0.00 178.31 177.32 3a70 h SER 19 N 1.22 0.80 0.05 0.41 0.02 -0.92 -1.95 113.55 113.18 3a70 h SER 19 Ca 0.37 -0.26 -0.00 0.00 -0.84 0.00 0.00 61.79 61.05 3a70 h SER 19 Cb -0.04 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.29 3a70 h SER 19 CO -0.11 0.96 -0.02 0.44 -1.14 0.00 0.00 176.83 176.96 3a70 h ASP 20 N 0.71 -0.06 -0.68 3.07 3.32 -0.98 -1.86 116.42 119.94 3a70 h ASP 20 Ca 0.11 -0.02 0.15 0.00 0.02 0.00 0.00 57.03 57.28 3a70 h ASP 20 Cb 0.67 0.01 -0.11 0.00 0.22 0.00 0.00 39.33 40.12 3a70 h ASP 20 CO 0.05 -0.01 0.11 0.00 -1.72 0.00 0.00 179.24 177.66 3a70 h ALA 21 N 0.85 0.80 -0.46 3.45 0.00 -1.14 -1.37 119.26 121.41 3a70 h ALA 21 Ca -0.01 0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.99 3a70 h ALA 21 Cb 0.08 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3a70 h ALA 21 CO 0.01 -0.36 -0.06 1.98 0.00 0.00 0.00 179.25 180.82 3a70 h MET 22 N 0.21 0.85 -0.27 0.00 1.85 -1.35 -1.04 114.93 115.19 3a70 h MET 22 Ca 0.37 -0.30 0.02 0.00 -0.61 0.00 0.00 59.70 59.18 3a70 h MET 22 Cb 0.62 -0.06 -0.02 0.00 0.43 0.00 0.00 31.60 32.57 3a70 h MET 22 CO -0.51 0.93 0.13 0.00 -0.40 0.00 0.00 176.91 177.06 3a70 h ALA 23 N 0.89 0.32 -0.02 0.39 0.00 -0.73 -0.04 119.26 120.07 3a70 h ALA 23 Ca 0.12 0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.85 3a70 h ALA 23 Cb 0.59 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3a70 h ALA 23 CO 0.04 -0.27 -0.85 -0.84 0.00 0.00 0.00 179.25 177.32 3a70 h ILE 24 N 0.27 1.44 -0.20 0.00 3.07 -1.27 -2.16 117.51 118.65 3a70 h ILE 24 Ca 0.11 -2.44 0.04 0.00 1.55 0.00 0.00 64.86 64.12 3a70 h ILE 24 Cb 0.04 2.36 -0.04 0.00 -0.27 0.00 0.00 36.82 38.91 3a70 h ILE 24 CO -0.08 0.72 -0.07 0.74 -1.05 0.00 0.00 178.15 178.41 3a70 h THR 25 N 0.17 0.74 -0.63 0.16 2.02 -0.90 -2.24 112.91 112.24 3a70 h THR 25 Ca -0.05 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.10 3a70 h THR 25 Cb 1.46 0.74 -0.03 0.00 -1.74 0.00 0.00 68.15 68.59 3a70 h THR 25 CO 0.14 0.00 0.29 -0.07 0.37 0.00 0.00 175.52 176.25 3a70 h LEU 26 N -0.03 0.83 -0.57 2.58 3.38 -0.97 -2.89 115.31 117.63 3a70 h LEU 26 Ca 0.10 -0.14 0.08 0.00 0.09 0.00 0.00 57.88 58.02 3a70 h LEU 26 Cb 0.19 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.66 3a70 h LEU 26 CO -0.23 0.74 0.21 0.22 0.09 0.00 0.00 178.44 179.47 3a70 h TYR 27 N 0.87 0.36 -0.35 1.13 3.20 -1.27 -2.13 116.97 118.78 3a70 h TYR 27 Ca 0.21 0.03 0.10 0.00 3.14 0.00 0.00 58.73 62.21 3a70 h TYR 27 Cb 0.14 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.32 3a70 h TYR 27 CO 0.00 0.10 0.33 0.66 -1.64 0.00 0.00 178.16 177.61 3a70 h SER 28 N 0.39 0.00 0.13 -2.11 4.64 -1.18 0.21 113.55 115.62 3a70 h SER 28 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 3a70 h SER 28 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 3a70 h SER 28 CO -0.29 0.00 -0.19 -1.22 -0.87 0.00 0.00 176.83 174.27 3a70 n TYR 29 N -3.93 0.00 -4.15 4.77 4.01 -0.81 -4.79 117.16 112.25 3a70 n TYR 29 Ca 0.06 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.46 3a70 n TYR 29 Cb 0.50 -0.07 -0.02 0.00 -0.31 0.00 0.00 39.34 39.44 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 -0.25 -1.78 -2.65 -0.72 8.25 0.74 -0.98 115.22 117.83 3a70 n HIS 30 Ca 0.14 0.80 -0.21 0.00 -0.26 0.00 0.00 57.72 58.19 3a70 n HIS 30 Cb 0.37 -3.18 0.01 0.00 1.12 0.00 0.00 29.99 28.31 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 -2.73 -5.68 -0.31 0.41 3.02 -1.26 -4.33 115.26 104.38 3a70 n ASN 31 Ca 0.00 -0.10 0.04 0.00 -0.03 0.00 0.00 54.58 54.49 3a70 n ASN 31 Cb 0.53 -4.68 0.23 0.00 -0.61 0.00 0.00 39.78 35.25 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 -0.50 0.93 -1.73 3.41 5.85 -1.40 -1.96 115.31 119.91 3a70 h LEU 32 Ca -0.48 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.24 3a70 h LEU 32 Cb 1.35 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.19 3a70 h LEU 32 CO 0.55 0.59 0.00 -0.90 -0.34 0.00 0.00 178.44 178.35 3a70 n ASP 33 N -4.49 2.53 -0.09 1.25 5.75 -1.26 -4.36 116.55 115.87 3a70 n ASP 33 Ca 0.14 -2.20 -0.09 0.00 -0.01 0.00 0.00 54.79 52.62 3a70 n ASP 33 Cb 0.20 -0.40 -0.02 0.00 -1.03 0.00 0.00 41.12 39.87 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 2.00 0.39 -0.58 -1.12 -0.00 -1.47 -0.76 115.58 114.03 3a70 h ASN 34 Ca 0.00 -0.10 -0.06 0.00 -0.00 0.00 0.00 56.30 56.14 3a70 h ASN 34 Cb 0.81 -0.10 -0.03 0.00 -0.00 0.00 0.00 38.32 39.01 3a70 h ASN 34 CO 0.11 0.38 0.13 1.23 -0.00 0.00 0.00 177.43 179.28 3a70 h GLY 35 N 0.37 1.04 0.90 1.57 0.00 -1.20 -1.50 103.07 104.25 3a70 h GLY 35 Ca 0.11 -0.64 -0.00 0.00 0.00 0.00 0.00 47.33 46.79 3a70 h GLY 35 CO -0.02 0.60 -0.05 -2.75 0.00 0.00 0.00 176.54 174.32 3a70 h PHE 36 N 0.92 -0.13 -0.13 5.60 3.57 -1.60 0.63 116.94 125.81 3a70 h PHE 36 Ca 0.19 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.74 3a70 h PHE 36 Cb 0.36 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 39.09 3a70 h PHE 36 CO 0.02 0.01 -0.19 0.00 -2.23 0.00 0.00 178.31 175.93 3a70 h ALA 37 N 0.65 -0.13 -0.75 2.41 0.00 -1.04 0.14 119.26 120.53 3a70 h ALA 37 Ca -0.01 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3a70 h ALA 37 Cb 0.20 0.38 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 3a70 h ALA 37 CO 0.02 -0.65 0.42 0.00 0.00 0.00 0.00 179.25 179.05 3a70 h ALA 38 N 0.77 0.96 -0.55 0.00 0.00 -1.28 -0.59 119.26 118.58 3a70 h ALA 38 Ca 0.10 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 3a70 h ALA 38 Cb 0.38 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3a70 h ALA 38 CO -0.27 0.47 0.11 0.78 0.00 0.00 0.00 179.25 180.34 3a70 h GLY 39 N 1.04 0.96 0.93 0.00 0.00 -0.41 -2.36 103.07 103.23 3a70 h GLY 39 Ca 0.27 -0.62 0.01 0.00 0.00 0.00 0.00 47.33 46.99 3a70 h GLY 39 CO -0.04 0.58 0.29 -1.82 0.00 0.00 0.00 176.54 175.54 3a70 h TYR 40 N 0.79 0.54 -0.61 5.60 3.20 -0.62 0.65 116.97 126.50 3a70 h TYR 40 Ca 0.17 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.08 3a70 h TYR 40 Cb 0.38 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.43 3a70 h TYR 40 CO 0.03 0.32 0.38 0.37 -1.64 0.00 0.00 178.16 177.62 3a70 h GLN 41 N 0.58 0.73 -0.08 1.82 5.75 -0.72 0.20 115.11 123.39 3a70 h GLN 41 Ca 0.18 -0.04 -0.10 0.00 -0.15 0.00 0.00 58.65 58.53 3a70 h GLN 41 Cb -0.02 -0.17 0.00 0.00 1.07 0.00 0.00 27.48 28.37 3a70 h GLN 41 CO -0.07 0.49 -0.34 1.25 -2.65 0.00 0.00 178.83 177.50 3a70 h HIS 42 N 0.76 0.51 0.00 3.99 2.76 -1.33 0.06 115.15 121.89 3a70 h HIS 42 Ca 0.24 -0.22 -0.13 0.00 -2.20 0.00 0.00 60.37 58.06 3a70 h HIS 42 Cb 0.00 -0.08 -0.03 0.00 1.55 0.00 0.00 27.41 28.86 3a70 h HIS 42 CO -0.05 0.95 -1.98 0.09 -1.30 0.00 0.00 177.93 175.65 3a70 n ASN 43 N -4.39 0.81 -0.12 3.26 4.13 0.21 -4.51 115.26 114.65 3a70 n ASN 43 Ca -0.08 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.18 3a70 n ASN 43 Cb 0.51 1.44 0.00 0.00 -1.54 0.00 0.00 39.78 40.19 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 1.68 -1.53 0.15 7.41 0.00 0.67 -3.78 105.19 109.77 3a70 n GLY 44 Ca -0.14 -1.29 0.07 0.00 0.00 0.00 0.00 46.02 44.66 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 -0.24 0.00 0.00 1.61 7.35 -1.26 -3.66 117.46 121.25 3a70 n PHE 45 Ca 0.00 -0.74 0.00 0.00 -0.76 0.00 0.00 57.45 55.95 3a70 n PHE 45 Cb 0.00 -0.12 0.00 0.00 0.35 0.00 0.00 39.48 39.71 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 -1.05 1.12 0.38 7.13 0.00 -1.26 -4.57 105.19 106.94 3a70 n GLY 46 Ca 0.11 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.32 3a70 n GLY 46 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3a70 h LEU 47 N 0.00 0.09 -0.19 0.99 5.85 -1.92 -1.67 115.31 118.47 3a70 h LEU 47 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3a70 h LEU 47 Cb 0.00 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.02 3a70 h LEU 47 CO 0.00 0.05 -0.10 0.61 -0.34 0.00 0.00 178.44 178.66 3a70 n GLY 48 N -1.61 -1.01 0.20 3.75 0.00 -1.25 -4.43 105.19 100.84 3a70 n GLY 48 Ca 0.10 -0.25 -0.07 0.00 0.00 0.00 0.00 46.02 45.81 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 0.46 -0.49 -0.63 0.99 5.85 -1.37 -1.21 115.31 118.91 3a70 h LEU 49 Ca 0.00 0.12 0.12 0.00 0.84 0.00 0.00 57.88 58.96 3a70 h LEU 49 Cb 0.35 0.27 -0.09 0.00 0.37 0.00 0.00 40.66 41.56 3a70 h LEU 49 CO 0.00 -0.18 0.15 -0.65 -0.34 0.00 0.00 178.44 177.41 3a70 h PRO 50 N -0.11 0.27 -0.67 5.25 0.11 -1.82 -0.28 132.00 134.75 3a70 h PRO 50 Ca 0.15 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.22 3a70 h PRO 50 Cb 0.34 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 31.36 3a70 h PRO 50 CO -0.36 0.18 0.33 0.00 -0.21 0.00 0.00 178.00 177.94 3a70 h ALA 51 N 1.50 0.86 -0.44 -0.75 0.00 -1.76 -1.72 119.26 116.96 3a70 h ALA 51 Ca 0.33 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.16 3a70 h ALA 51 Cb 0.51 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 3a70 h ALA 51 CO -0.42 0.42 0.16 1.15 0.00 0.00 0.00 179.25 180.56 3a70 h THR 52 N 0.93 0.87 -0.79 0.00 2.02 -0.42 -2.00 112.91 113.52 3a70 h THR 52 Ca 0.23 -0.11 -0.05 0.00 0.77 0.00 0.00 66.41 67.25 3a70 h THR 52 Cb 0.10 0.51 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 3a70 h THR 52 CO -0.03 0.06 0.31 -0.07 0.37 0.00 0.00 175.52 176.16 3a70 h LEU 53 N 0.33 1.09 -0.48 2.58 3.38 -0.94 0.08 115.31 121.35 3a70 h LEU 53 Ca 0.20 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 58.05 3a70 h LEU 53 Cb 0.19 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.61 3a70 h LEU 53 CO -0.20 0.97 0.22 0.58 0.09 0.00 0.00 178.44 180.10 3a70 h VAL 54 N 1.15 0.92 -0.17 1.22 2.07 -0.89 -1.73 116.25 118.82 3a70 h VAL 54 Ca 0.26 -0.15 -0.14 0.00 0.82 0.00 0.00 66.70 67.50 3a70 h VAL 54 Cb 0.22 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 3a70 h VAL 54 CO -0.02 0.08 -0.47 0.74 0.02 0.00 0.00 177.57 177.92 3a70 h THR 55 N 0.44 1.32 -0.81 2.57 2.02 -1.13 0.18 112.91 117.50 3a70 h THR 55 Ca 0.22 -1.68 0.08 0.00 0.77 0.00 0.00 66.41 65.80 3a70 h THR 55 Cb 0.16 1.71 -0.05 0.00 -1.74 0.00 0.00 68.15 68.22 3a70 h THR 55 CO -0.17 0.52 0.53 0.00 0.37 0.00 0.00 175.52 176.76 3a70 h ALA 56 N 1.13 1.69 0.10 6.16 0.00 -0.35 0.37 119.26 128.37 3a70 h ALA 56 Ca 0.02 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.60 3a70 h ALA 56 Cb 0.97 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 3a70 h ALA 56 CO 0.08 0.16 -1.72 -0.07 0.00 0.00 0.00 179.25 177.70 3a70 h LEU 57 N 0.81 0.35 -0.33 0.00 3.38 -0.72 -1.44 115.31 117.35 3a70 h LEU 57 Ca 0.37 -0.85 0.00 0.00 0.09 0.00 0.00 57.88 57.49 3a70 h LEU 57 Cb 0.36 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3a70 h LEU 57 CO -0.14 1.74 -0.39 0.18 0.09 0.00 0.00 178.44 179.91 3a70 n LEU 58 N -3.77 0.85 0.00 1.67 4.77 0.59 -1.76 117.00 119.36 3a70 n LEU 58 Ca -0.30 -0.61 0.00 0.00 -0.03 0.00 0.00 56.01 55.07 3a70 n LEU 58 Cb 0.95 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.04 3a70 n LEU 58 CO 0.38 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 3a70 n GLY 59 N 1.13 1.09 0.00 -0.72 0.00 0.13 -4.36 105.19 102.45 3a70 n GLY 59 Ca 0.03 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 3.41 0.24 -0.02 0.00 -0.22 -4.52 105.19 104.09 3a70 n GLY 60 Ca 0.00 -0.77 0.13 0.00 0.00 0.00 0.00 46.02 45.38 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 0.21 -0.03 2.61 1.35 -1.94 -3.30 112.91 111.81 3a70 h THR 61 Ca 0.00 -0.91 0.00 0.00 -0.55 0.00 0.00 66.41 64.95 3a70 h THR 61 Cb 0.00 1.76 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 3a70 h THR 61 CO 0.00 0.09 0.00 -0.90 -0.25 0.00 0.00 175.52 174.46 3a70 n ASP 62 N -3.18 2.25 -3.76 5.36 3.85 -1.26 -4.26 116.55 115.54 3a70 n ASP 62 Ca 0.01 -2.45 -0.09 0.00 -0.71 0.00 0.00 54.79 51.55 3a70 n ASP 62 Cb 0.42 -0.20 -0.06 0.00 -1.35 0.00 0.00 41.12 39.94 3a70 n ASP 62 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 3a70 s SER 63 N -1.75 -0.03 -0.12 -1.12 1.04 -1.24 -4.88 113.70 105.59 3a70 s SER 63 Ca 0.15 -0.51 0.03 0.00 0.48 0.00 0.00 55.95 56.10 3a70 s SER 63 Cb 0.13 0.40 0.01 0.00 0.10 0.00 0.00 66.02 66.65 3a70 s SER 63 CO 0.02 -0.78 -0.22 -1.58 0.98 0.00 0.00 173.24 171.66 3a70 s GLN 64 N -3.84 2.94 0.00 4.02 0.74 -1.26 -1.05 119.66 121.21 3a70 s GLN 64 Ca 0.04 -0.83 0.00 0.00 0.05 0.00 0.00 55.36 54.62 3a70 s GLN 64 Cb 0.04 -2.32 0.00 0.00 1.10 0.00 0.00 33.01 31.83 3a70 s GLN 64 CO -0.11 0.05 0.00 0.41 -0.55 0.00 0.00 175.29 175.09 3a70 n GLY 65 N 3.88 0.96 0.21 2.59 0.00 -1.26 -0.85 105.19 110.72 3a70 n GLY 65 Ca -0.20 -1.79 0.09 0.00 0.00 0.00 0.00 46.02 44.13 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 0.51 -3.44 1.61 2.07 -0.79 -3.44 116.25 112.78 3a70 h VAL 66 Ca 0.00 -1.29 -0.60 0.00 0.82 0.00 0.00 66.70 65.64 3a70 h VAL 66 Cb 0.00 1.91 -0.10 0.00 -1.52 0.00 0.00 31.29 31.58 3a70 h VAL 66 CO 0.00 0.23 0.06 -0.63 0.02 0.00 0.00 177.57 177.25 3a70 s ILE 67 N -3.46 5.05 0.70 4.57 1.01 -0.72 -4.80 121.20 123.55 3a70 s ILE 67 Ca 0.02 1.10 -0.11 0.00 0.00 0.00 0.00 60.65 61.66 3a70 s ILE 67 Cb 0.09 -3.91 0.01 0.00 0.01 0.00 0.00 42.46 38.66 3a70 s ILE 67 CO 0.66 0.14 1.08 -2.16 0.00 0.00 0.00 174.94 174.65 3a70 s PRO 68 N 1.81 2.92 -0.94 2.79 0.04 -1.26 -4.51 135.00 135.85 3a70 s PRO 68 Ca 0.27 0.57 0.00 0.00 0.04 0.00 0.00 61.00 61.88 3a70 s PRO 68 Cb -0.16 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.36 3a70 s PRO 68 CO 0.10 -1.01 0.00 0.41 0.04 0.00 0.00 177.00 176.54 3a70 n GLY 69 N -2.79 0.19 3.59 0.56 0.00 -1.26 -5.01 105.19 100.48 3a70 n GLY 69 Ca 0.07 -0.47 -0.41 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.49 4.97 0.32 -0.61 1.01 -1.26 -4.98 121.20 118.15 3a70 s ILE 70 Ca 0.00 0.76 0.04 0.00 0.00 0.00 0.00 60.65 61.45 3a70 s ILE 70 Cb 0.00 -3.97 0.30 0.00 0.01 0.00 0.00 42.46 38.79 3a70 s ILE 70 CO 0.00 -0.13 1.88 -0.65 0.00 0.00 0.00 174.94 176.04 3a70 h PRO 71 N 8.23 0.86 -0.00 2.79 0.11 -2.00 -2.10 132.00 139.89 3a70 h PRO 71 Ca -0.27 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3a70 h PRO 71 Cb 1.12 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.04 3a70 h PRO 71 CO 0.79 0.57 -0.16 -2.67 -0.21 0.00 0.00 178.00 176.32 3a70 n TRP 72 N -4.55 0.00 -2.36 0.65 2.14 -1.26 -4.88 117.44 107.17 3a70 n TRP 72 Ca 0.16 0.00 -0.36 0.00 2.07 0.00 0.00 57.50 59.37 3a70 n TRP 72 Cb 0.34 -0.26 -0.02 0.00 -0.81 0.00 0.00 31.31 30.57 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 -2.67 6.32 0.72 -0.67 0.02 -0.79 -4.19 114.94 113.69 3a70 s ASN 73 Ca 0.23 2.19 -0.12 0.00 -1.02 0.00 0.00 52.86 54.13 3a70 s ASN 73 Cb 0.19 -2.59 0.03 0.00 0.02 0.00 0.00 41.25 38.90 3a70 s ASN 73 CO 0.52 -0.81 1.10 -2.16 0.02 0.00 0.00 177.10 175.78 3a70 s PRO 74 N -2.73 2.48 -1.02 -0.60 0.04 -1.26 -4.93 135.00 126.98 3a70 s PRO 74 Ca 0.63 1.26 -0.23 0.00 0.04 0.00 0.00 61.00 62.70 3a70 s PRO 74 Cb -0.25 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.36 3a70 s PRO 74 CO 0.31 -1.48 1.77 0.34 0.04 0.00 0.00 177.00 177.98 3a70 s ASP 75 N -3.05 5.72 0.48 6.66 -1.08 -1.26 -4.54 116.67 119.61 3a70 s ASP 75 Ca 0.64 -1.26 0.29 0.00 -0.52 0.00 0.00 52.55 51.70 3a70 s ASP 75 Cb -0.19 -2.57 0.89 0.00 -1.46 0.00 0.00 42.92 39.60 3a70 s ASP 75 CO 0.50 -2.25 1.81 0.77 0.52 0.00 0.00 175.17 176.52 3a70 h SER 76 N 10.19 0.00 -0.20 -0.34 4.64 -1.92 -2.23 113.55 123.69 3a70 h SER 76 Ca 0.18 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.32 3a70 h SER 76 Cb 0.98 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.08 3a70 h SER 76 CO 1.31 0.00 -0.62 -0.33 -0.87 0.00 0.00 176.83 176.32 3a70 h GLU 77 N 0.00 0.77 -0.58 4.77 5.08 -1.87 -0.06 114.58 122.68 3a70 h GLU 77 Ca 0.00 -0.56 -0.06 0.00 -1.00 0.00 0.00 59.36 57.74 3a70 h GLU 77 Cb 0.73 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.05 3a70 h GLU 77 CO 0.00 1.18 0.14 -0.22 -1.00 0.00 0.00 179.01 179.11 3a70 h LYS 78 N 0.50 0.93 -0.48 2.33 3.64 -1.89 -1.70 116.57 119.90 3a70 h LYS 78 Ca -0.02 -0.23 0.05 0.00 -1.27 0.00 0.00 60.65 59.19 3a70 h LYS 78 Cb 1.24 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.89 3a70 h LYS 78 CO 0.13 0.86 0.21 -0.07 -2.27 0.00 0.00 179.45 178.32 3a70 h LEU 79 N 0.84 0.28 -0.71 5.20 3.38 -1.36 0.12 115.31 123.05 3a70 h LEU 79 Ca 0.18 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.25 3a70 h LEU 79 Cb 0.35 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.04 3a70 h LEU 79 CO 0.00 0.19 0.41 0.00 0.09 0.00 0.00 178.44 179.14 3a70 h ALA 80 N 1.29 0.96 -0.18 1.53 0.00 -0.91 0.95 119.26 122.91 3a70 h ALA 80 Ca 0.22 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 3a70 h ALA 80 Cb 0.18 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3a70 h ALA 80 CO -0.19 0.10 0.01 1.25 0.00 0.00 0.00 179.25 180.42 3a70 h LEU 81 N 0.76 0.30 -0.60 0.00 5.85 -0.79 -1.57 115.31 119.25 3a70 h LEU 81 Ca 0.32 -0.30 0.08 0.00 0.84 0.00 0.00 57.88 58.82 3a70 h LEU 81 Cb 0.18 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.07 3a70 h LEU 81 CO -0.18 0.52 0.26 0.44 -0.34 0.00 0.00 178.44 179.15 3a70 h ASP 82 N 0.06 0.32 -0.81 1.25 3.32 -0.64 -1.88 116.42 118.04 3a70 h ASP 82 Ca 0.05 0.06 0.04 0.00 0.02 0.00 0.00 57.03 57.19 3a70 h ASP 82 Cb 0.37 0.01 -0.05 0.00 0.22 0.00 0.00 39.33 39.88 3a70 h ASP 82 CO 0.01 0.20 0.52 0.00 -1.72 0.00 0.00 179.24 178.24 3a70 h ALA 83 N 1.37 1.07 -0.06 3.45 0.00 -0.57 -0.61 119.26 123.91 3a70 h ALA 83 Ca 0.29 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.99 3a70 h ALA 83 Cb 0.30 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3a70 h ALA 83 CO -0.25 0.33 -0.72 -0.24 0.00 0.00 0.00 179.25 178.37 3a70 h VAL 84 N 1.00 1.40 -0.43 0.00 3.04 -0.93 -2.59 116.25 117.74 3a70 h VAL 84 Ca 0.33 -2.17 -0.04 0.00 -1.01 0.00 0.00 66.70 63.81 3a70 h VAL 84 Cb 0.03 2.14 -0.02 0.00 -2.01 0.00 0.00 31.29 31.43 3a70 h VAL 84 CO -0.12 0.65 0.11 0.11 -1.01 0.00 0.00 177.57 177.31 3a70 h LYS 85 N 0.22 0.68 -0.46 4.17 1.57 -1.18 -2.08 116.57 119.49 3a70 h LYS 85 Ca -0.03 -0.16 0.04 0.00 -1.87 0.00 0.00 60.65 58.64 3a70 h LYS 85 Cb 1.28 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.47 3a70 h LYS 85 CO 0.12 0.69 0.31 -0.22 -0.57 0.00 0.00 179.45 179.77 3a70 h LYS 86 N 0.56 0.44 0.00 3.15 3.64 -0.98 0.61 116.57 123.99 3a70 h LYS 86 Ca 0.14 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 3a70 h LYS 86 Cb 0.30 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 3a70 h LYS 86 CO -0.00 0.29 0.00 0.00 -2.27 0.00 0.00 179.45 177.47 3a70 n ALA 87 N -2.50 2.25 0.00 5.00 0.00 -0.99 -4.90 120.51 119.37 3a70 n ALA 87 Ca 0.05 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.37 3a70 n ALA 87 Cb 0.19 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.27 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 0.53 0.59 3.70 0.00 0.00 0.20 -4.99 105.19 105.23 3a70 n GLY 88 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 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 3.24 -0.08 1.61 0.52 -0.80 -4.16 118.94 117.28 3a70 s TRP 89 Ca 0.00 0.22 0.01 0.00 0.02 0.00 0.00 56.10 56.35 3a70 s TRP 89 Cb 0.00 -1.85 0.02 0.00 -1.15 0.00 0.00 33.47 30.49 3a70 s TRP 89 CO 0.00 0.46 -0.08 0.99 0.02 0.00 0.00 176.95 178.34 3a70 s THR 90 N -0.72 0.93 0.34 2.01 2.01 -0.06 -3.11 115.64 117.04 3a70 s THR 90 Ca 0.12 -0.31 -0.29 0.00 0.31 0.00 0.00 61.69 61.52 3a70 s THR 90 Cb -0.12 -0.91 -0.12 0.00 0.01 0.00 0.00 72.50 71.37 3a70 s THR 90 CO 0.02 0.33 1.44 -2.65 -0.69 0.00 0.00 174.62 173.07 3a70 n PRO 91 N 4.30 2.48 -2.92 4.92 -0.02 -1.26 -0.80 135.00 141.70 3a70 n PRO 91 Ca -0.19 0.87 -0.41 0.00 -2.02 0.00 0.00 63.50 61.75 3a70 n PRO 91 Cb 0.51 -2.56 -0.04 0.00 -0.02 0.00 0.00 33.50 31.39 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 -0.86 4.90 0.70 4.25 1.01 0.10 -4.82 121.20 126.48 3a70 s ILE 92 Ca 0.57 1.58 -0.14 0.00 0.00 0.00 0.00 60.65 62.65 3a70 s ILE 92 Cb -0.52 -4.11 0.02 0.00 0.01 0.00 0.00 42.46 37.86 3a70 s ILE 92 CO 0.60 0.05 1.14 0.42 0.00 0.00 0.00 174.94 177.15 3a70 s THR 93 N 2.03 2.89 0.47 2.92 -4.23 -1.26 -4.79 115.64 113.67 3a70 s THR 93 Ca 0.37 0.40 0.14 0.00 -1.18 0.00 0.00 61.69 61.43 3a70 s THR 93 Cb -0.17 -2.91 0.29 0.00 1.34 0.00 0.00 72.50 71.05 3a70 s THR 93 CO 0.13 -0.26 2.08 0.00 -0.54 0.00 0.00 174.62 176.02 3a70 h ALA 94 N -0.24 1.97 0.10 3.99 0.00 -1.90 -2.82 119.26 120.36 3a70 h ALA 94 Ca -0.47 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 3a70 h ALA 94 Cb 1.26 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3a70 h ALA 94 CO 0.52 -0.02 -0.05 1.03 0.00 0.00 0.00 179.25 180.73 3a70 h SER 95 N 0.24 -0.12 -0.81 0.00 0.87 -1.92 0.19 113.55 112.00 3a70 h SER 95 Ca 0.12 -0.17 0.16 0.00 -1.23 0.00 0.00 61.79 60.67 3a70 h SER 95 Cb 0.19 0.03 -0.06 0.00 -0.44 0.00 0.00 62.40 62.12 3a70 h SER 95 CO -0.02 0.10 0.54 1.56 -0.53 0.00 0.00 176.83 178.47 3a70 h GLN 96 N -0.34 0.44 0.00 2.24 4.20 -1.88 -0.32 115.11 119.45 3a70 h GLN 96 Ca -0.01 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.67 3a70 h GLN 96 Cb 0.28 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.96 3a70 h GLN 96 CO 0.02 0.29 -0.26 1.28 -0.67 0.00 0.00 178.83 179.50 3a70 n LEU 97 N -4.50 0.40 -3.95 1.46 4.77 -1.10 -4.93 117.00 109.15 3a70 n LEU 97 Ca 0.16 0.32 -0.30 0.00 -0.03 0.00 0.00 56.01 56.15 3a70 n LEU 97 Cb 0.56 -0.34 0.02 0.00 -2.33 0.00 0.00 43.42 41.33 3a70 n LEU 97 CO 0.32 -0.00 0.06 0.61 -1.33 0.00 0.00 177.39 177.05 3a70 n GLY 98 N 1.44 -0.46 3.70 -0.72 0.00 -0.07 -4.85 105.19 104.22 3a70 n GLY 98 Ca 0.06 0.18 -0.40 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.35 3.50 -2.01 1.61 5.04 0.46 -4.99 117.35 117.61 3a70 s TYR 99 Ca 0.61 1.10 0.25 0.00 -2.44 0.00 0.00 57.07 56.58 3a70 s TYR 99 Cb -0.31 -2.77 0.38 0.00 0.35 0.00 0.00 41.96 39.62 3a70 s TYR 99 CO 0.85 0.01 1.34 -0.40 -1.34 0.00 0.00 175.55 176.01 3a70 n ASP 100 N 4.18 1.64 -2.65 4.32 5.75 -1.26 -4.72 116.55 123.81 3a70 n ASP 100 Ca -0.02 -1.29 0.00 0.00 -0.01 0.00 0.00 54.79 53.47 3a70 n ASP 100 Cb 0.51 0.28 0.00 0.00 -1.03 0.00 0.00 41.12 40.88 3a70 n ASP 100 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3a70 n GLY 101 N 1.37 0.04 3.82 6.12 0.00 -1.26 -5.06 105.19 110.22 3a70 n GLY 101 Ca 0.11 -1.63 -0.36 0.00 0.00 0.00 0.00 46.02 44.14 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 0.38 3.65 0.20 1.61 2.20 -1.26 -5.06 119.74 121.47 3a70 s LYS 102 Ca 0.00 -0.17 0.03 0.00 -0.36 0.00 0.00 55.97 55.46 3a70 s LYS 102 Cb 0.00 -3.24 -0.05 0.00 -1.51 0.00 0.00 37.83 33.03 3a70 s LYS 102 CO 0.00 0.63 -0.00 0.95 -0.36 0.00 0.00 175.35 176.57 3a70 s THR 103 N -0.60 0.87 0.06 3.43 -4.23 -1.26 -1.82 115.64 112.09 3a70 s THR 103 Ca 0.13 -2.01 0.01 0.00 -1.18 0.00 0.00 61.69 58.63 3a70 s THR 103 Cb -0.12 -2.24 0.01 0.00 1.34 0.00 0.00 72.50 71.49 3a70 s THR 103 CO 0.02 -0.39 0.06 -0.90 -0.54 0.00 0.00 174.62 172.87 3a70 n ASP 104 N -0.34 0.71 0.30 3.99 5.75 -0.69 -4.95 116.55 121.32 3a70 n ASP 104 Ca -0.06 -1.18 0.20 0.00 -0.01 0.00 0.00 54.79 53.74 3a70 n ASP 104 Cb 0.64 -0.02 0.97 0.00 -1.03 0.00 0.00 41.12 41.67 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 0.60 1.00 0.00 2.12 0.00 -2.02 -1.29 119.26 119.67 3a70 h ALA 105 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3a70 h ALA 105 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3a70 h ALA 105 CO 0.05 0.00 -0.36 0.54 0.00 0.00 0.00 179.25 179.48 3a70 n ARG 106 N -3.03 0.12 -0.52 0.00 1.74 -1.26 -4.94 116.66 108.78 3a70 n ARG 106 Ca -0.01 0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.12 3a70 n ARG 106 Cb 0.16 -1.59 0.00 0.00 -1.02 0.00 0.00 32.46 30.01 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 1.43 0.75 3.75 -0.13 0.00 -0.49 -5.05 105.19 105.45 3a70 n GLY 107 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.26 2.68 -0.02 2.61 2.01 -1.26 -4.77 115.64 114.63 3a70 s THR 108 Ca 0.00 0.60 -0.18 0.00 0.31 0.00 0.00 61.69 62.42 3a70 s THR 108 Cb 0.00 -3.38 -0.05 0.00 0.01 0.00 0.00 72.50 69.07 3a70 s THR 108 CO 0.00 0.11 0.50 -0.36 -0.69 0.00 0.00 174.62 174.19 3a70 s PHE 109 N -0.37 3.67 0.14 4.92 0.08 -0.35 -1.71 117.98 124.36 3a70 s PHE 109 Ca 0.56 1.07 0.07 0.00 0.12 0.00 0.00 56.93 58.75 3a70 s PHE 109 Cb -0.41 -2.48 -0.04 0.00 -0.57 0.00 0.00 43.02 39.52 3a70 s PHE 109 CO 0.47 0.43 -0.05 -0.06 -0.10 0.00 0.00 175.22 175.90 3a70 s PHE 110 N -0.40 2.78 0.65 0.36 2.99 -0.76 -0.96 117.98 122.64 3a70 s PHE 110 Ca 0.27 -0.15 -0.17 0.00 0.00 0.00 0.00 56.93 56.89 3a70 s PHE 110 Cb -0.17 -1.40 -0.00 0.00 0.00 0.00 0.00 43.02 41.44 3a70 s PHE 110 CO 0.15 0.48 1.18 0.20 -0.00 0.00 0.00 175.22 177.22 3a70 s GLY 111 N -2.57 2.46 -0.07 4.36 0.00 -0.50 -4.59 107.32 106.40 3a70 s GLY 111 Ca 0.25 0.83 0.21 0.00 0.00 0.00 0.00 44.72 46.01 3a70 s GLY 111 CO 0.16 1.22 0.39 1.18 0.00 0.00 0.00 173.10 176.05 3a70 n GLU 112 N -2.14 0.67 -4.43 2.90 1.02 0.10 -4.28 120.64 114.48 3a70 n GLU 112 Ca 0.13 -0.14 -0.25 0.00 -0.02 0.00 0.00 57.16 56.87 3a70 n GLU 112 Cb 0.50 -1.53 -0.11 0.00 -0.02 0.00 0.00 31.44 30.29 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 -3.25 1.66 0.15 3.49 1.02 -1.26 -5.02 119.74 116.53 3a70 s LYS 113 Ca -0.08 -1.61 -0.34 0.00 0.02 0.00 0.00 55.97 53.95 3a70 s LYS 113 Cb 0.12 -1.84 -0.15 0.00 -0.52 0.00 0.00 37.83 35.43 3a70 s LYS 113 CO 0.89 0.37 1.39 0.00 -0.92 0.00 0.00 175.35 177.07 3a70 n ALA 114 N -0.19 0.07 -0.35 5.17 0.00 -1.26 -0.99 120.51 122.96 3a70 n ALA 114 Ca -0.09 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.82 3a70 n ALA 114 Cb 0.58 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.85 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 2.62 0.90 0.10 0.00 0.00 -1.26 -4.85 105.19 102.70 3a70 n GLY 115 Ca 0.16 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.19 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 0.93 1.61 4.01 -0.17 -4.84 117.16 116.71 3a70 n TYR 116 Ca 0.00 -0.20 0.12 0.00 -0.16 0.00 0.00 57.90 57.66 3a70 n TYR 116 Cb 0.00 -0.03 0.54 0.00 -0.31 0.00 0.00 39.34 39.54 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 -0.23 0.32 1.00 -0.72 -2.24 -1.18 -1.83 114.28 109.39 3a70 n THR 117 Ca 0.01 0.08 0.12 0.00 -2.27 0.00 0.00 64.05 61.99 3a70 n THR 117 Cb 0.49 -0.67 0.05 0.00 -2.10 0.00 0.00 70.33 68.10 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 -1.43 0.00 -2.08 4.28 -2.24 -1.26 -4.30 114.28 107.25 3a70 n THR 118 Ca 0.08 -0.40 -0.41 0.00 -2.27 0.00 0.00 64.05 61.05 3a70 n THR 118 Cb 0.25 1.40 -0.02 0.00 -2.10 0.00 0.00 70.33 69.86 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 -2.20 3.54 0.02 6.98 0.00 -0.76 -4.86 121.76 124.48 3a70 s ALA 119 Ca 0.24 1.28 0.05 0.00 0.00 0.00 0.00 51.96 53.53 3a70 s ALA 119 Cb 0.19 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.79 3a70 s ALA 119 CO 0.42 -0.68 -0.15 -0.65 0.00 0.00 0.00 175.76 174.69 3a70 s GLN 120 N -1.25 1.11 -0.04 0.00 1.11 -1.26 -1.41 119.66 117.92 3a70 s GLN 120 Ca 0.53 -0.69 -0.04 0.00 0.01 0.00 0.00 55.36 55.17 3a70 s GLN 120 Cb -0.40 -1.11 0.01 0.00 -1.01 0.00 0.00 33.01 30.49 3a70 s GLN 120 CO 0.49 0.29 0.12 0.54 0.01 0.00 0.00 175.29 176.74 3a70 s VAL 121 N -0.63 0.01 -0.13 1.09 0.11 -0.13 -0.69 120.40 120.03 3a70 s VAL 121 Ca 0.04 -0.06 -0.06 0.00 -2.93 0.00 0.00 61.98 58.98 3a70 s VAL 121 Cb -0.07 -0.20 -0.04 0.00 -1.53 0.00 0.00 36.38 34.55 3a70 s VAL 121 CO 0.01 -0.03 0.07 -1.61 -3.33 0.00 0.00 175.10 170.20 3a70 s GLU 122 N -0.05 3.49 -0.23 1.54 0.41 0.15 -1.21 118.70 122.79 3a70 s GLU 122 Ca -0.01 -0.29 -0.01 0.00 -0.41 0.00 0.00 54.97 54.25 3a70 s GLU 122 Cb -0.01 -3.08 0.02 0.00 -1.78 0.00 0.00 34.13 29.28 3a70 s GLU 122 CO 0.00 0.58 -0.09 0.42 -0.49 0.00 0.00 175.26 175.69 3a70 s ILE 123 N -0.50 2.74 0.22 -1.63 -1.09 -1.26 -0.95 121.20 118.73 3a70 s ILE 123 Ca 0.10 -0.99 0.09 0.00 -2.23 0.00 0.00 60.65 57.62 3a70 s ILE 123 Cb -0.12 -2.35 -0.05 0.00 -1.58 0.00 0.00 42.46 38.36 3a70 s ILE 123 CO 0.02 0.27 -0.15 -0.76 -1.23 0.00 0.00 174.94 173.08 3a70 s LEU 124 N 1.32 2.56 0.01 2.97 1.02 0.18 0.01 118.68 126.76 3a70 s LEU 124 Ca 0.01 -1.02 0.06 0.00 0.02 0.00 0.00 54.13 53.20 3a70 s LEU 124 Cb -0.16 -0.75 -0.02 0.00 0.02 0.00 0.00 46.19 45.28 3a70 s LEU 124 CO -0.06 -0.13 -0.18 -0.83 0.02 0.00 0.00 176.35 175.17 3a70 s GLY 125 N -3.35 0.91 -0.08 -3.19 0.00 0.02 -0.67 107.32 100.97 3a70 s GLY 125 Ca 0.24 -0.85 -0.06 0.00 0.00 0.00 0.00 44.72 44.05 3a70 s GLY 125 CO 0.08 -0.76 0.16 1.25 0.00 0.00 0.00 173.10 173.84 3a70 s LYS 126 N -0.76 3.45 -0.05 2.90 2.20 -0.11 -0.88 119.74 126.48 3a70 s LYS 126 Ca 0.06 -0.18 0.03 0.00 -0.36 0.00 0.00 55.97 55.51 3a70 s LYS 126 Cb -0.07 -3.16 0.01 0.00 -1.51 0.00 0.00 37.83 33.10 3a70 s LYS 126 CO 0.00 0.74 -0.12 0.71 -0.36 0.00 0.00 175.35 176.32 3a70 s TYR 127 N -1.13 1.38 1.19 4.03 2.02 -1.26 -1.32 117.35 122.26 3a70 s TYR 127 Ca 0.19 -0.45 -0.20 0.00 -0.37 0.00 0.00 57.07 56.24 3a70 s TYR 127 Cb -0.12 -0.99 0.30 0.00 -0.40 0.00 0.00 41.96 40.74 3a70 s TYR 127 CO 0.09 -0.21 1.01 -0.40 -1.57 0.00 0.00 175.55 174.47 3a70 n ASP 128 N 3.58 -2.26 0.25 2.29 5.68 0.51 -4.86 116.55 121.73 3a70 n ASP 128 Ca -0.21 -1.10 0.10 0.00 -0.50 0.00 0.00 54.79 53.08 3a70 n ASP 128 Cb 0.52 -0.95 0.64 0.00 -1.14 0.00 0.00 41.12 40.20 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 -2.80 1.50 -0.37 2.12 0.00 -2.02 -1.65 119.26 116.04 3a70 h ALA 129 Ca -0.39 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3a70 h ALA 129 Cb 1.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3a70 h ALA 129 CO 0.25 0.17 0.00 1.04 0.00 0.00 0.00 179.25 180.71 3a70 n GLN 130 N -3.97 2.01 -0.10 0.00 1.13 -1.26 -4.93 117.38 110.25 3a70 n GLN 130 Ca -0.02 -1.55 0.00 0.00 -1.94 0.00 0.00 57.00 53.49 3a70 n GLN 130 Cb 0.23 -1.38 0.00 0.00 0.11 0.00 0.00 30.24 29.20 3a70 n GLN 130 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3a70 n GLY 131 N 1.22 0.69 3.77 1.08 0.00 -0.62 -5.06 105.19 106.27 3a70 n GLY 131 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.35 3.23 0.11 1.61 3.76 -1.26 -4.72 115.29 115.68 3a70 s HIS 132 Ca 0.00 1.60 -0.31 0.00 -0.15 0.00 0.00 55.06 56.20 3a70 s HIS 132 Cb 0.00 -3.34 -0.08 0.00 1.11 0.00 0.00 32.58 30.27 3a70 s HIS 132 CO 0.00 -1.04 1.42 -1.17 -0.85 0.00 0.00 174.74 173.10 3a70 s LEU 133 N -2.19 4.37 -0.06 0.89 2.96 -1.26 -0.36 118.68 123.02 3a70 s LEU 133 Ca 0.53 2.34 0.09 0.00 -0.22 0.00 0.00 54.13 56.87 3a70 s LEU 133 Cb -0.30 -3.58 -0.13 0.00 0.50 0.00 0.00 46.19 42.67 3a70 s LEU 133 CO 0.38 -0.68 0.12 0.35 -1.32 0.00 0.00 176.35 175.20 3a70 n THR 134 N 4.04 0.35 -3.67 3.68 -2.24 -0.43 -4.87 114.28 111.12 3a70 n THR 134 Ca 0.12 -0.32 -0.15 0.00 -2.27 0.00 0.00 64.05 61.44 3a70 n THR 134 Cb 0.42 -0.29 -0.08 0.00 -2.10 0.00 0.00 70.33 68.27 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 -2.43 0.73 -0.10 -0.78 2.12 -1.22 -4.90 118.70 112.12 3a70 s GLU 135 Ca -0.04 0.30 0.03 0.00 0.36 0.00 0.00 54.97 55.62 3a70 s GLU 135 Cb 0.04 0.34 -0.01 0.00 0.26 0.00 0.00 34.13 34.77 3a70 s GLU 135 CO 0.39 -0.17 -0.19 0.42 -0.54 0.00 0.00 175.26 175.17 3a70 s ILE 136 N -0.61 2.55 -0.12 -3.70 1.01 0.03 -0.94 121.20 119.41 3a70 s ILE 136 Ca -0.07 -0.86 -0.03 0.00 0.00 0.00 0.00 60.65 59.70 3a70 s ILE 136 Cb -0.03 -2.01 -0.03 0.00 0.01 0.00 0.00 42.46 40.39 3a70 s ILE 136 CO 0.04 0.55 -0.02 -0.83 0.00 0.00 0.00 174.94 174.68 3a70 s GLY 137 N 0.20 1.77 -0.30 6.18 0.00 0.16 -0.63 107.32 114.69 3a70 s GLY 137 Ca -0.11 -0.82 0.00 0.00 0.00 0.00 0.00 44.72 43.78 3a70 s GLY 137 CO 0.06 -0.31 -0.00 -0.42 0.00 0.00 0.00 173.10 172.43 3a70 s ILE 138 N -0.20 2.72 -0.37 0.90 1.01 0.24 -0.64 121.20 124.86 3a70 s ILE 138 Ca 0.04 -1.62 -0.03 0.00 0.00 0.00 0.00 60.65 59.04 3a70 s ILE 138 Cb -0.13 -2.65 0.09 0.00 0.01 0.00 0.00 42.46 39.78 3a70 s ILE 138 CO 0.02 -0.19 0.14 0.00 0.00 0.00 0.00 174.94 174.91 3a70 s ALA 139 N 1.16 3.06 0.02 9.38 0.00 -0.12 -0.09 121.76 135.17 3a70 s ALA 139 Ca -0.03 -2.23 -0.30 0.00 0.00 0.00 0.00 51.96 49.40 3a70 s ALA 139 Cb -0.20 -2.28 -0.04 0.00 0.00 0.00 0.00 23.12 20.60 3a70 s ALA 139 CO -0.03 -1.60 1.09 -0.06 0.00 0.00 0.00 175.76 175.16 3a70 s PHE 140 N 1.21 3.53 0.21 0.00 0.08 -0.47 -0.67 117.98 121.86 3a70 s PHE 140 Ca 0.03 1.49 -0.30 0.00 0.12 0.00 0.00 56.93 58.27 3a70 s PHE 140 Cb -0.22 -3.28 -0.08 0.00 -0.57 0.00 0.00 43.02 38.87 3a70 s PHE 140 CO -0.02 -0.67 1.19 0.50 -0.10 0.00 0.00 175.22 176.11 3a70 s ARG 141 N 1.14 4.51 1.15 0.44 3.52 0.14 -3.86 118.95 126.00 3a70 s ARG 141 Ca 0.55 1.88 -0.19 0.00 -0.13 0.00 0.00 55.73 57.84 3a70 s ARG 141 Cb -0.25 -3.22 0.28 0.00 -1.56 0.00 0.00 34.95 30.20 3a70 s ARG 141 CO 0.28 -0.04 1.18 0.41 -0.81 0.00 0.00 175.30 176.31 3a70 n GLY 142 N 1.95 -2.36 3.58 8.12 0.00 -1.18 -3.43 105.19 111.87 3a70 n GLY 142 Ca 0.03 -1.57 -0.46 0.00 0.00 0.00 0.00 46.02 44.02 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 -4.54 1.59 0.00 2.61 -1.04 -1.26 -4.75 114.28 106.89 3a70 n THR 143 Ca 0.16 -0.40 0.00 0.00 -2.04 0.00 0.00 64.05 61.77 3a70 n THR 143 Cb 0.59 -0.93 0.00 0.00 -1.82 0.00 0.00 70.33 68.17 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 1.56 0.00 -0.84 8.00 3.41 -1.26 -5.04 113.62 119.44 3a70 n SER 144 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.73 3a70 n SER 144 Cb 0.29 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 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 0.25 2.64 3.66 5.00 0.00 -1.26 -4.76 105.19 110.72 3a70 n GLY 145 Ca 0.00 -1.12 -0.44 0.00 0.00 0.00 0.00 46.02 44.45 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 1.90 -0.33 1.61 -0.02 -1.26 -4.59 135.00 132.31 3a70 n PRO 146 Ca 0.00 0.67 0.25 0.00 -2.02 0.00 0.00 63.50 62.40 3a70 n PRO 146 Cb 0.00 -2.26 0.49 0.00 -0.02 0.00 0.00 33.50 31.71 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 3.33 0.21 -1.21 -0.52 3.08 -1.97 -0.01 114.38 117.29 3a70 h ARG 147 Ca -0.44 -0.01 0.35 0.00 0.07 0.00 0.00 59.98 59.94 3a70 h ARG 147 Cb 1.29 -0.05 -0.09 0.00 0.08 0.00 0.00 29.97 31.20 3a70 h ARG 147 CO 0.69 0.14 0.81 0.93 -1.07 0.00 0.00 179.97 181.47 3a70 h GLU 148 N 0.22 0.19 -0.13 0.04 3.07 -1.91 -3.11 114.58 112.95 3a70 h GLU 148 Ca 0.75 -0.01 -0.19 0.00 -0.50 0.00 0.00 59.36 59.41 3a70 h GLU 148 Cb 1.78 -0.04 -0.32 0.00 -0.84 0.00 0.00 28.75 29.32 3a70 h GLU 148 CO -0.66 0.12 -0.86 -1.71 -1.40 0.00 0.00 179.01 174.50 3a70 n ASN 149 N -4.50 0.57 -0.20 1.42 4.05 -0.11 -4.98 115.26 111.50 3a70 n ASN 149 Ca 0.30 -2.03 -0.02 0.00 0.45 0.00 0.00 54.58 53.27 3a70 n ASN 149 Cb 1.19 -0.14 0.04 0.00 1.23 0.00 0.00 39.78 42.10 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 1.34 -0.73 0.17 1.20 5.85 -1.23 -2.38 115.31 119.53 3a70 h LEU 150 Ca -0.28 0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 3a70 h LEU 150 Cb 1.56 0.43 0.00 0.00 0.37 0.00 0.00 40.66 43.02 3a70 h LEU 150 CO 0.03 -0.24 -0.08 0.40 -0.34 0.00 0.00 178.44 178.21 3a70 h ILE 151 N -0.06 0.85 -0.74 4.05 1.08 -1.89 0.68 117.51 121.48 3a70 h ILE 151 Ca 0.28 -1.07 0.03 0.00 -0.39 0.00 0.00 64.86 63.70 3a70 h ILE 151 Cb 0.49 1.40 -0.04 0.00 -3.07 0.00 0.00 36.82 35.59 3a70 h ILE 151 CO -0.64 0.21 0.47 -0.07 -0.69 0.00 0.00 178.15 177.43 3a70 h LEU 152 N -0.84 0.78 -0.12 1.44 4.07 -1.99 0.85 115.31 119.49 3a70 h LEU 152 Ca -0.02 -0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.93 3a70 h LEU 152 Cb 0.52 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 42.08 3a70 h LEU 152 CO 0.04 0.54 0.08 -0.78 -1.08 0.00 0.00 178.44 177.24 3a70 h ASP 153 N 0.92 0.15 -0.91 -0.43 3.58 -1.39 -2.51 116.42 115.82 3a70 h ASP 153 Ca 0.29 -0.03 0.08 0.00 0.42 0.00 0.00 57.03 57.79 3a70 h ASP 153 Cb -0.00 -0.04 -0.06 0.00 1.72 0.00 0.00 39.33 40.95 3a70 h ASP 153 CO -0.10 0.13 0.59 0.28 -2.88 0.00 0.00 179.24 177.26 3a70 h SER 154 N 0.14 0.88 -0.34 2.28 0.02 -0.40 -1.45 113.55 114.68 3a70 h SER 154 Ca 0.04 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3a70 h SER 154 Cb 0.01 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 3a70 h SER 154 CO -0.01 0.55 0.20 0.40 -1.14 0.00 0.00 176.83 176.82 3a70 h ILE 155 N 0.99 1.13 -0.91 3.27 2.04 -0.61 -0.70 117.51 122.72 3a70 h ILE 155 Ca 0.41 -0.32 0.09 0.00 1.00 0.00 0.00 64.86 66.04 3a70 h ILE 155 Cb 0.28 0.72 -0.06 0.00 -0.74 0.00 0.00 36.82 37.02 3a70 h ILE 155 CO -0.17 0.13 0.59 1.23 0.00 0.00 0.00 178.15 179.93 3a70 h GLY 156 N 0.44 1.33 0.95 5.37 0.00 -0.97 -1.28 103.07 108.91 3a70 h GLY 156 Ca 0.12 -0.39 -0.11 0.00 0.00 0.00 0.00 47.33 46.95 3a70 h GLY 156 CO -0.02 0.23 -0.27 -0.55 0.00 0.00 0.00 176.54 175.93 3a70 h ASP 157 N 0.94 0.72 -0.03 0.19 3.32 -0.57 -2.44 116.42 118.53 3a70 h ASP 157 Ca 0.41 -0.47 -0.10 0.00 0.02 0.00 0.00 57.03 56.90 3a70 h ASP 157 Cb 0.36 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3a70 h ASP 157 CO -0.18 1.04 -0.26 0.58 -1.72 0.00 0.00 179.24 178.70 3a70 h VAL 158 N 0.40 1.27 -0.32 -1.35 2.07 -0.87 0.44 116.25 117.90 3a70 h VAL 158 Ca 0.04 -1.28 0.01 0.00 0.82 0.00 0.00 66.70 66.29 3a70 h VAL 158 Cb 0.84 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.96 3a70 h VAL 158 CO 0.07 0.41 0.19 0.40 0.02 0.00 0.00 177.57 178.65 3a70 h ILE 159 N 0.41 1.04 -0.47 4.57 2.04 -1.19 -1.09 117.51 122.83 3a70 h ILE 159 Ca 0.06 -0.13 0.03 0.00 1.00 0.00 0.00 64.86 65.82 3a70 h ILE 159 Cb 0.68 0.62 -0.04 0.00 -0.74 0.00 0.00 36.82 37.34 3a70 h ILE 159 CO 0.05 0.07 0.26 0.78 0.00 0.00 0.00 178.15 179.31 3a70 h ASN 160 N 0.39 0.39 -0.60 1.72 -0.26 -0.78 -2.38 115.58 114.06 3a70 h ASN 160 Ca 0.12 0.02 0.07 0.00 -0.56 0.00 0.00 56.30 55.95 3a70 h ASN 160 Cb -0.01 -0.06 -0.06 0.00 -1.06 0.00 0.00 38.32 37.13 3a70 h ASN 160 CO -0.05 0.27 0.29 0.44 -1.06 0.00 0.00 177.43 177.32 3a70 h ASP 161 N 0.51 0.37 0.11 5.81 3.32 0.10 -2.15 116.42 124.48 3a70 h ASP 161 Ca 0.20 0.05 -0.15 0.00 0.02 0.00 0.00 57.03 57.15 3a70 h ASP 161 Cb 0.07 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3a70 h ASP 161 CO -0.12 0.24 -0.53 -0.07 -1.72 0.00 0.00 179.24 177.03 3a70 h LEU 162 N 0.52 0.51 -1.33 1.55 3.38 -0.98 -2.82 115.31 116.15 3a70 h LEU 162 Ca 0.29 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 3a70 h LEU 162 Cb 0.26 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 3a70 h LEU 162 CO -0.23 0.95 -0.01 -0.07 0.09 0.00 0.00 178.44 179.17 3a70 h LEU 163 N 0.36 0.41 -1.55 1.67 3.38 -1.19 0.30 115.31 118.68 3a70 h LEU 163 Ca 0.01 -0.07 0.02 0.00 0.09 0.00 0.00 57.88 57.93 3a70 h LEU 163 Cb 1.05 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 3a70 h LEU 163 CO 0.09 0.48 0.33 0.00 0.09 0.00 0.00 178.44 179.44 3a70 h ALA 164 N 1.57 1.73 0.14 1.53 0.00 -1.13 0.80 119.26 123.90 3a70 h ALA 164 Ca 0.09 -0.03 -0.35 0.00 0.00 0.00 0.00 54.91 54.63 3a70 h ALA 164 Cb 0.30 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3a70 h ALA 164 CO 0.01 0.22 -1.82 0.00 0.00 0.00 0.00 179.25 177.66 3a70 h ALA 165 N 1.70 0.34 0.00 0.00 0.00 -1.21 -3.43 119.26 116.66 3a70 h ALA 165 Ca 0.20 -1.27 0.00 0.00 0.00 0.00 0.00 54.91 53.84 3a70 h ALA 165 Cb 0.05 0.54 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3a70 h ALA 165 CO -0.05 1.21 0.00 1.19 0.00 0.00 0.00 179.25 181.60 3a70 n PHE 166 N -3.48 0.00 -1.23 0.00 3.72 0.94 -4.42 117.46 112.99 3a70 n PHE 166 Ca -0.26 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.14 3a70 n PHE 166 Cb 1.06 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.60 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 0.25 1.46 3.70 1.37 0.00 0.27 -4.96 105.19 107.29 3a70 n GLY 167 Ca 0.00 -1.89 -0.41 0.00 0.00 0.00 0.00 46.02 43.72 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 1.94 -1.58 1.61 -0.02 -1.26 -4.89 135.00 130.80 3a70 n PRO 168 Ca 0.00 0.69 -0.44 0.00 -2.02 0.00 0.00 63.50 61.73 3a70 n PRO 168 Cb 0.00 -2.39 -0.01 0.00 -0.02 0.00 0.00 33.50 31.08 3a70 n PRO 168 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3a70 n LYS 169 N 0.04 1.27 -2.12 -0.52 4.81 -1.26 -1.34 118.16 119.04 3a70 n LYS 169 Ca 0.07 0.45 -0.16 0.00 -0.87 0.00 0.00 58.31 57.79 3a70 n LYS 169 Cb 0.40 -1.84 -0.03 0.00 0.02 0.00 0.00 35.03 33.58 3a70 n LYS 169 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 3a70 n ASP 170 N 1.11 -4.67 -0.01 3.14 3.85 -1.26 -4.91 116.55 113.80 3a70 n ASP 170 Ca 0.10 0.19 -0.09 0.00 -0.71 0.00 0.00 54.79 54.28 3a70 n ASP 170 Cb 0.34 -4.02 -0.03 0.00 -1.35 0.00 0.00 41.12 36.06 3a70 n ASP 170 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.20 176.41 3a70 h TYR 171 N 0.00 -0.35 -0.49 2.11 3.20 -1.52 -2.01 116.97 117.91 3a70 h TYR 171 Ca -0.37 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.50 3a70 h TYR 171 Cb 1.22 0.18 -0.02 0.00 1.54 0.00 0.00 36.73 39.64 3a70 h TYR 171 CO 0.58 -0.21 0.24 0.00 -1.64 0.00 0.00 178.16 177.13 3a70 h ALA 172 N 0.94 0.64 -0.78 1.82 0.00 -1.84 -2.34 119.26 117.69 3a70 h ALA 172 Ca 0.10 -0.12 0.11 0.00 0.00 0.00 0.00 54.91 55.00 3a70 h ALA 172 Cb 0.31 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 17.82 3a70 h ALA 172 CO -0.25 0.20 0.40 -0.22 0.00 0.00 0.00 179.25 179.37 3a70 h LYS 173 N 0.65 0.62 -0.01 0.00 3.64 -1.89 -2.35 116.57 117.23 3a70 h LYS 173 Ca 0.17 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 3a70 h LYS 173 Cb 0.11 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 3a70 h LYS 173 CO -0.02 0.41 -0.01 0.09 -2.27 0.00 0.00 179.45 177.65 3a70 n ASN 174 N -4.85 0.89 0.01 4.20 3.02 -0.76 -4.49 115.26 113.28 3a70 n ASN 174 Ca 0.13 -1.27 -0.10 0.00 -0.03 0.00 0.00 54.58 53.31 3a70 n ASN 174 Cb 0.33 -0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.45 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 1.38 -0.08 -0.22 3.10 3.20 -0.88 -2.00 116.97 121.47 3a70 h TYR 175 Ca 0.00 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 3a70 h TYR 175 Cb 0.30 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 3a70 h TYR 175 CO 0.00 -0.06 -0.15 0.28 -1.64 0.00 0.00 178.16 176.59 3a70 h VAL 176 N -0.03 1.22 -0.19 1.81 2.07 -1.80 -1.48 116.25 117.84 3a70 h VAL 176 Ca 0.05 -0.97 0.03 0.00 0.82 0.00 0.00 66.70 66.63 3a70 h VAL 176 Cb 0.10 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 3a70 h VAL 176 CO -0.10 0.31 -0.00 1.23 0.02 0.00 0.00 177.57 179.02 3a70 h GLY 177 N 0.88 0.18 0.49 2.17 0.00 -1.69 -0.93 103.07 104.17 3a70 h GLY 177 Ca 0.06 0.02 -0.00 0.00 0.00 0.00 0.00 47.33 47.42 3a70 h GLY 177 CO 0.03 -0.04 -0.01 0.83 0.00 0.00 0.00 176.54 177.35 3a70 h GLU 178 N 0.06 -0.03 -0.28 4.80 4.39 -1.21 -2.22 114.58 120.08 3a70 h GLU 178 Ca 0.09 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.63 3a70 h GLU 178 Cb 0.12 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.77 3a70 h GLU 178 CO -0.16 0.46 -0.49 0.00 -1.16 0.00 0.00 179.01 177.67 3a70 h ALA 179 N 0.39 0.60 0.00 3.43 0.00 -1.30 -3.35 119.26 119.04 3a70 h ALA 179 Ca -0.00 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3a70 h ALA 179 Cb 0.51 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3a70 h ALA 179 CO 0.01 0.68 -0.30 1.19 0.00 0.00 0.00 179.25 180.82 3a70 n PHE 180 N -4.01 0.00 -0.23 0.00 3.72 -0.36 0.02 117.46 116.60 3a70 n PHE 180 Ca -0.03 -0.16 0.03 0.00 -0.05 0.00 0.00 57.45 57.24 3a70 n PHE 180 Cb 0.59 -0.05 0.15 0.00 -0.94 0.00 0.00 39.48 39.22 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 0.00 0.92 0.47 1.37 0.00 -1.27 -0.69 103.07 103.86 3a70 h GLY 181 Ca 0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 47.33 47.23 3a70 h GLY 181 CO 0.00 -0.15 -0.25 -0.57 0.00 0.00 0.00 176.54 175.57 3a70 h ASN 182 N 0.28 0.23 -0.93 0.19 -1.24 -1.90 -2.82 115.58 109.39 3a70 h ASN 182 Ca 0.37 -0.76 0.23 0.00 0.71 0.00 0.00 56.30 56.85 3a70 h ASN 182 Cb 0.59 -0.07 -0.17 0.00 0.73 0.00 0.00 38.32 39.40 3a70 h ASN 182 CO -0.46 0.96 -0.04 0.25 -1.29 0.00 0.00 177.43 176.85 3a70 h LEU 183 N -0.47 -0.55 -0.83 0.34 5.85 -1.90 -2.09 115.31 115.66 3a70 h LEU 183 Ca -0.03 0.26 -0.12 0.00 0.84 0.00 0.00 57.88 58.83 3a70 h LEU 183 Cb 0.99 0.48 -0.02 0.00 0.37 0.00 0.00 40.66 42.48 3a70 h LEU 183 CO 0.05 -0.30 -0.58 -0.07 -0.34 0.00 0.00 178.44 177.19 3a70 h LEU 184 N 0.03 0.01 -0.46 2.25 3.38 -1.03 -1.50 115.31 117.99 3a70 h LEU 184 Ca 0.52 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.49 3a70 h LEU 184 Cb 0.99 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 3a70 h LEU 184 CO -0.88 0.59 0.30 0.78 0.09 0.00 0.00 178.44 179.32 3a70 h ASN 185 N 0.01 0.51 0.28 -0.43 2.35 -1.15 -1.47 115.58 115.68 3a70 h ASN 185 Ca -0.01 -0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 55.68 3a70 h ASN 185 Cb 1.03 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.27 3a70 h ASN 185 CO 0.08 0.37 -0.28 0.44 -1.65 0.00 0.00 177.43 176.39 3a70 h ASP 186 N 0.61 0.00 -0.21 5.81 3.32 -1.02 -2.22 116.42 122.72 3a70 h ASP 186 Ca 0.17 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.09 3a70 h ASP 186 Cb -0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.50 3a70 h ASP 186 CO -0.05 0.28 -0.40 0.58 -1.72 0.00 0.00 179.24 177.94 3a70 h VAL 187 N 0.00 1.32 -0.17 -1.35 2.07 -1.10 -1.53 116.25 115.49 3a70 h VAL 187 Ca -0.00 -1.62 0.04 0.00 0.82 0.00 0.00 66.70 65.94 3a70 h VAL 187 Cb 0.49 1.84 -0.04 0.00 -1.52 0.00 0.00 31.29 32.07 3a70 h VAL 187 CO 0.04 0.50 -0.10 0.58 0.02 0.00 0.00 177.57 178.61 3a70 h VAL 188 N 0.32 0.69 -0.77 2.57 2.07 -0.99 0.26 116.25 120.41 3a70 h VAL 188 Ca 0.01 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.54 3a70 h VAL 188 Cb 1.00 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 31.42 3a70 h VAL 188 CO 0.09 0.00 0.51 0.00 0.02 0.00 0.00 177.57 178.19 3a70 h ALA 189 N 1.05 1.47 -0.01 1.67 0.00 -1.44 0.17 119.26 122.17 3a70 h ALA 189 Ca 0.10 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.79 3a70 h ALA 189 Cb 0.24 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3a70 h ALA 189 CO -0.23 0.49 -0.77 0.35 0.00 0.00 0.00 179.25 179.09 3a70 h PHE 190 N 1.03 0.16 -0.01 0.00 3.57 -0.94 -1.54 116.94 119.22 3a70 h PHE 190 Ca 0.29 -0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.70 3a70 h PHE 190 Cb -0.10 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 38.62 3a70 h PHE 190 CO -0.00 0.83 -0.00 0.00 -2.23 0.00 0.00 178.31 176.91 3a70 h ALA 191 N 1.14 0.01 -0.52 2.41 0.00 -0.56 -3.06 119.26 118.68 3a70 h ALA 191 Ca -0.02 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 3a70 h ALA 191 Cb 1.35 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 3a70 h ALA 191 CO 0.11 -0.33 0.19 0.87 0.00 0.00 0.00 179.25 180.09 3a70 h LYS 192 N -0.30 0.79 0.00 0.00 1.57 -0.92 0.32 116.57 118.02 3a70 h LYS 192 Ca 0.00 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 3a70 h LYS 192 Cb 0.32 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.51 3a70 h LYS 192 CO 0.00 0.71 0.00 0.00 -0.57 0.00 0.00 179.45 179.59 3a70 h ALA 193 N 1.04 1.00 -0.14 3.86 0.00 -1.37 -2.06 119.26 121.59 3a70 h ALA 193 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3a70 h ALA 193 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3a70 h ALA 193 CO -0.01 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.33 3a70 n ASN 194 N -2.57 2.23 0.00 0.00 3.02 -0.67 -4.99 115.26 112.28 3a70 n ASN 194 Ca -0.01 -1.68 0.00 0.00 -0.03 0.00 0.00 54.58 52.86 3a70 n ASN 194 Cb 0.09 -0.09 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 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 0.40 0.61 3.93 7.41 0.00 -0.76 -4.87 105.19 111.91 3a70 n GLY 195 Ca 0.07 -0.37 -0.28 0.00 0.00 0.00 0.00 46.02 45.45 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 0.00 4.28 0.00 0.99 1.02 0.01 -5.00 118.68 119.99 3a70 s LEU 196 Ca 0.00 0.34 0.00 0.00 0.02 0.00 0.00 54.13 54.49 3a70 s LEU 196 Cb 0.00 -3.08 0.00 0.00 0.02 0.00 0.00 46.19 43.13 3a70 s LEU 196 CO 0.00 0.02 0.00 -1.54 0.02 0.00 0.00 176.35 174.85 3a70 n SER 197 N -0.46 1.87 -0.31 2.29 3.41 -1.26 -3.79 113.62 115.38 3a70 n SER 197 Ca -0.05 -0.81 0.11 0.00 -0.26 0.00 0.00 58.87 57.86 3a70 n SER 197 Cb 0.53 0.00 0.33 0.00 -0.26 0.00 0.00 64.21 64.81 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 1.42 2.00 5.00 0.00 -1.90 -1.98 103.07 107.61 3a70 h GLY 198 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.98 3a70 h GLY 198 CO 0.00 0.10 0.00 0.07 0.00 0.00 0.00 176.54 176.71 3a70 h LYS 199 N 0.80 0.00 -0.43 4.80 2.10 -1.85 -1.88 116.57 120.11 3a70 h LYS 199 Ca 0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.13 3a70 h LYS 199 Cb 0.67 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.00 3a70 h LYS 199 CO -0.25 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 176.95 3a70 n ASP 200 N -2.37 2.16 -4.35 7.07 8.00 -0.74 -4.78 116.55 121.54 3a70 n ASP 200 Ca 0.02 -2.06 -0.33 0.00 0.71 0.00 0.00 54.79 53.13 3a70 n ASP 200 Cb 0.27 -0.29 -0.15 0.00 -0.02 0.00 0.00 41.12 40.93 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 -1.56 2.95 -0.13 2.53 1.01 -0.71 -0.79 120.40 123.70 3a70 s VAL 201 Ca 0.25 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.54 3a70 s VAL 201 Cb 0.14 -2.24 -0.01 0.00 0.00 0.00 0.00 36.38 34.27 3a70 s VAL 201 CO 0.15 0.52 -0.14 -0.22 0.00 0.00 0.00 175.10 175.42 3a70 s LEU 202 N 0.44 2.67 -0.13 3.92 2.96 0.19 -0.22 118.68 128.52 3a70 s LEU 202 Ca -0.10 -0.34 0.02 0.00 -0.22 0.00 0.00 54.13 53.49 3a70 s LEU 202 Cb -0.16 -1.60 0.01 0.00 0.50 0.00 0.00 46.19 44.95 3a70 s LEU 202 CO 0.05 0.17 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.36 3a70 s VAL 203 N 0.31 1.89 0.26 1.68 1.01 0.22 0.83 120.40 126.60 3a70 s VAL 203 Ca -0.11 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 60.97 3a70 s VAL 203 Cb -0.16 -1.69 0.01 0.00 0.00 0.00 0.00 36.38 34.54 3a70 s VAL 203 CO 0.06 0.52 0.38 -0.24 0.00 0.00 0.00 175.10 175.81 3a70 n SER 204 N 4.09 -1.05 0.00 3.32 2.88 0.88 -1.74 113.62 122.00 3a70 n SER 204 Ca -0.20 -2.38 0.00 0.00 -1.33 0.00 0.00 58.87 54.97 3a70 n SER 204 Cb 0.51 1.94 0.00 0.00 -0.75 0.00 0.00 64.21 65.91 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 -0.42 3.17 3.22 0.46 0.00 -1.26 -1.37 105.19 108.98 3a70 n GLY 205 Ca -0.00 -1.40 -0.27 0.00 0.00 0.00 0.00 46.02 44.35 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 1.82 0.00 1.61 2.46 -1.25 -1.14 115.29 116.79 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 -1.16 0.00 0.00 -0.13 0.00 0.00 32.58 31.29 3a70 s HIS 206 CO 0.00 -0.02 0.00 0.45 -2.47 0.00 0.00 174.74 172.70 3a70 n SER 207 N 2.51 0.00 0.20 9.88 2.88 0.19 -0.33 113.62 128.95 3a70 n SER 207 Ca -0.15 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.53 3a70 n SER 207 Cb 0.53 0.00 0.76 0.00 -0.75 0.00 0.00 64.21 64.75 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 0.00 -1.10 2.46 5.85 -1.86 0.25 115.31 120.91 3a70 h LEU 208 Ca 0.00 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 3a70 h LEU 208 Cb 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3a70 h LEU 208 CO 0.00 0.00 -0.44 1.23 -0.34 0.00 0.00 178.44 178.89 3a70 h GLY 209 N 0.00 0.00 0.88 3.75 0.00 -0.70 -1.19 103.07 105.81 3a70 h GLY 209 Ca 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.30 3a70 h GLY 209 CO -0.00 0.00 -0.23 -1.33 0.00 0.00 0.00 176.54 174.98 3a70 h GLY 210 N 1.43 0.62 0.95 4.60 0.00 -0.55 -2.15 103.07 107.97 3a70 h GLY 210 Ca -0.00 -0.63 0.02 0.00 0.00 0.00 0.00 47.33 46.71 3a70 h GLY 210 CO 0.06 0.57 0.59 -2.00 0.00 0.00 0.00 176.54 175.76 3a70 h LEU 211 N 0.27 1.01 -0.91 3.11 6.46 -0.77 -2.39 115.31 122.09 3a70 h LEU 211 Ca 0.04 -0.02 -0.03 0.00 -0.12 0.00 0.00 57.88 57.75 3a70 h LEU 211 Cb 0.78 -0.24 -0.04 0.00 -0.73 0.00 0.00 40.66 40.43 3a70 h LEU 211 CO 0.06 0.71 0.38 0.00 -0.62 0.00 0.00 178.44 178.97 3a70 h ALA 212 N 1.35 1.14 -0.22 1.25 0.00 -1.12 0.62 119.26 122.28 3a70 h ALA 212 Ca 0.34 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.12 3a70 h ALA 212 Cb -0.08 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.36 3a70 h ALA 212 CO -0.09 0.64 0.01 0.28 0.00 0.00 0.00 179.25 180.10 3a70 h VAL 213 N 1.16 0.87 -0.61 0.00 2.07 -0.91 -0.61 116.25 118.21 3a70 h VAL 213 Ca 0.28 -0.03 -0.10 0.00 0.82 0.00 0.00 66.70 67.67 3a70 h VAL 213 Cb 0.13 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 3a70 h VAL 213 CO -0.03 0.02 -0.00 0.78 0.02 0.00 0.00 177.57 178.35 3a70 h ASN 214 N 0.09 1.07 0.04 0.57 2.35 -1.03 -1.71 115.58 116.95 3a70 h ASN 214 Ca 0.10 -0.31 0.03 0.00 -0.55 0.00 0.00 56.30 55.57 3a70 h ASN 214 Cb 0.12 -0.29 -0.05 0.00 0.05 0.00 0.00 38.32 38.15 3a70 h ASN 214 CO -0.16 1.11 -0.35 -1.28 -1.65 0.00 0.00 177.43 175.10 3a70 h SER 215 N 0.99 -1.06 -1.00 5.81 0.87 -0.75 -1.24 113.55 117.17 3a70 h SER 215 Ca 0.17 0.13 0.06 0.00 -1.23 0.00 0.00 61.79 60.93 3a70 h SER 215 Cb 0.57 0.41 -0.07 0.00 -0.44 0.00 0.00 62.40 62.88 3a70 h SER 215 CO 0.03 -0.42 0.65 -0.03 -0.53 0.00 0.00 176.83 176.53 3a70 h MET 216 N -0.53 1.15 -0.44 2.24 1.85 -0.84 -0.61 114.93 117.74 3a70 h MET 216 Ca 0.05 -0.07 -0.04 0.00 -0.61 0.00 0.00 59.70 59.03 3a70 h MET 216 Cb 0.60 -0.26 -0.02 0.00 0.43 0.00 0.00 31.60 32.35 3a70 h MET 216 CO -0.26 0.76 0.13 0.00 -0.40 0.00 0.00 176.91 177.14 3a70 h ALA 217 N 1.45 0.58 -0.78 0.39 0.00 -1.17 -1.19 119.26 118.55 3a70 h ALA 217 Ca 0.43 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 55.22 3a70 h ALA 217 Cb 0.16 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 3a70 h ALA 217 CO -0.17 0.24 0.51 -0.44 0.00 0.00 0.00 179.25 179.39 3a70 h ASP 218 N 0.58 0.76 0.26 0.00 3.32 -0.30 -2.88 116.42 118.16 3a70 h ASP 218 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 3a70 h ASP 218 Cb 0.27 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.66 3a70 h ASP 218 CO -0.00 0.50 -0.34 0.18 -1.72 0.00 0.00 179.24 177.86 3a70 n LEU 219 N -4.47 0.99 0.13 1.55 4.77 -0.32 -4.38 117.00 115.26 3a70 n LEU 219 Ca 0.11 -0.25 -0.01 0.00 -0.03 0.00 0.00 56.01 55.83 3a70 n LEU 219 Cb 0.19 -0.13 0.11 0.00 -2.33 0.00 0.00 43.42 41.26 3a70 n LEU 219 CO 0.34 0.19 0.43 0.77 -1.33 0.00 0.00 177.39 177.79 3a70 h SER 220 N 1.03 0.00 0.21 -1.43 4.64 -0.99 -1.10 113.55 115.91 3a70 h SER 220 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3a70 h SER 220 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 3a70 h SER 220 CO 0.00 0.67 -0.10 1.23 -0.87 0.00 0.00 176.83 177.76 3a70 h GLY 221 N 2.31 -0.29 0.80 -0.77 0.00 -1.76 -3.30 103.07 100.06 3a70 h GLY 221 Ca -0.01 0.11 -0.32 0.00 0.00 0.00 0.00 47.33 47.11 3a70 h GLY 221 CO 0.09 -0.11 -1.84 0.61 0.00 0.00 0.00 176.54 175.29 3a70 n GLY 222 N -0.96 -0.85 3.97 4.60 0.00 -1.17 -3.77 105.19 107.01 3a70 n GLY 222 Ca -0.09 -0.13 -0.21 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.58 3.25 -2.12 1.61 1.02 -0.42 -4.36 119.74 116.13 3a70 s LYS 223 Ca -0.11 -0.70 0.00 0.00 0.02 0.00 0.00 55.97 55.18 3a70 s LYS 223 Cb 0.07 -2.74 0.00 0.00 -0.52 0.00 0.00 37.83 34.64 3a70 s LYS 223 CO 0.80 0.08 0.00 0.91 -0.92 0.00 0.00 175.35 176.23 3a70 n TRP 224 N -1.72 -0.17 -1.69 3.18 8.01 -1.26 -1.48 117.44 122.31 3a70 n TRP 224 Ca -0.03 0.00 -0.04 0.00 -1.31 0.00 0.00 57.50 56.12 3a70 n TRP 224 Cb 0.57 -3.52 -0.01 0.00 -2.01 0.00 0.00 31.31 26.34 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 -0.48 0.40 2.72 6.99 0.00 -1.26 -2.72 105.19 110.85 3a70 n GLY 225 Ca -0.21 -0.78 -0.08 0.00 0.00 0.00 0.00 46.02 44.95 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 -1.60 0.81 0.32 -0.02 0.00 -0.55 -4.88 105.19 99.27 3a70 n GLY 226 Ca -0.05 -0.06 0.03 0.00 0.00 0.00 0.00 46.02 45.94 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 0.94 -0.46 1.61 3.57 -1.69 -2.29 116.94 118.62 3a70 h PHE 227 Ca -0.16 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.37 3a70 h PHE 227 Cb 1.01 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.45 3a70 h PHE 227 CO 0.53 0.42 0.00 1.19 -2.23 0.00 0.00 178.31 178.22 3a70 n PHE 228 N -4.68 0.91 -0.18 0.41 3.72 -1.26 -3.47 117.46 112.91 3a70 n PHE 228 Ca 0.14 -0.38 0.09 0.00 -0.05 0.00 0.00 57.45 57.24 3a70 n PHE 228 Cb 0.25 -0.13 0.39 0.00 -0.94 0.00 0.00 39.48 39.06 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 3.73 1.80 -0.25 4.37 0.00 -1.48 -1.99 119.26 125.44 3a70 h ALA 229 Ca 0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 3a70 h ALA 229 Cb 0.95 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.53 3a70 h ALA 229 CO 0.11 0.05 -0.07 -0.25 0.00 0.00 0.00 179.25 179.10 3a70 n ASP 230 N -4.49 2.89 -4.63 0.00 8.00 -1.26 -4.92 116.55 112.13 3a70 n ASP 230 Ca 0.12 -3.43 -0.29 0.00 0.71 0.00 0.00 54.79 51.90 3a70 n ASP 230 Cb 0.31 -0.57 0.19 0.00 -0.02 0.00 0.00 41.12 41.03 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 -2.43 2.38 -0.24 -2.24 0.01 -0.75 -3.68 113.70 106.76 3a70 s SER 231 Ca 0.42 1.14 -0.09 0.00 1.31 0.00 0.00 55.95 58.72 3a70 s SER 231 Cb 0.36 -1.78 -0.04 0.00 0.21 0.00 0.00 66.02 64.77 3a70 s SER 231 CO 0.03 -3.28 0.13 0.20 0.41 0.00 0.00 173.24 170.73 3a70 s ASN 232 N -3.46 5.82 -0.28 2.44 0.01 0.70 -4.95 114.94 115.21 3a70 s ASN 232 Ca 0.66 0.02 0.02 0.00 -0.71 0.00 0.00 52.86 52.85 3a70 s ASN 232 Cb -0.18 -2.05 0.08 0.00 0.41 0.00 0.00 41.25 39.51 3a70 s ASN 232 CO 0.58 0.04 -0.02 -0.31 -1.51 0.00 0.00 177.10 175.88 3a70 s TYR 233 N 1.19 3.00 -0.27 2.20 2.02 -1.26 0.68 117.35 124.91 3a70 s TYR 233 Ca 0.06 -2.31 0.03 0.00 -0.37 0.00 0.00 57.07 54.48 3a70 s TYR 233 Cb -0.14 -2.12 0.07 0.00 -0.40 0.00 0.00 41.96 39.37 3a70 s TYR 233 CO 0.05 -0.87 -0.07 0.42 -1.57 0.00 0.00 175.55 173.51 3a70 s ILE 234 N 1.18 2.09 -0.13 2.71 1.01 -0.71 -1.00 121.20 126.36 3a70 s ILE 234 Ca 0.00 -1.73 -0.07 0.00 0.00 0.00 0.00 60.65 58.85 3a70 s ILE 234 Cb -0.19 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 3a70 s ILE 234 CO -0.08 -0.17 0.12 0.00 0.00 0.00 0.00 174.94 174.80 3a70 s ALA 235 N 1.10 3.75 -0.14 9.38 0.00 0.15 -4.01 121.76 132.00 3a70 s ALA 235 Ca -0.04 -0.67 -0.03 0.00 0.00 0.00 0.00 51.96 51.21 3a70 s ALA 235 Cb -0.20 -1.93 -0.03 0.00 0.00 0.00 0.00 23.12 20.97 3a70 s ALA 235 CO -0.06 0.53 -0.03 0.71 0.00 0.00 0.00 175.76 176.91 3a70 s TYR 236 N -0.76 3.05 -1.51 0.00 2.02 -0.29 -0.97 117.35 118.89 3a70 s TYR 236 Ca 0.13 -0.18 -0.14 0.00 -0.37 0.00 0.00 57.07 56.52 3a70 s TYR 236 Cb -0.12 -1.92 0.10 0.00 -0.40 0.00 0.00 41.96 39.62 3a70 s TYR 236 CO 0.03 0.08 0.78 0.00 -1.57 0.00 0.00 175.55 174.87 3a70 n ALA 237 N 3.23 -1.20 -2.10 3.71 0.00 -0.21 0.54 120.51 124.49 3a70 n ALA 237 Ca -0.17 0.11 -0.42 0.00 0.00 0.00 0.00 53.44 52.96 3a70 n ALA 237 Cb 0.53 -3.73 -0.03 0.00 0.00 0.00 0.00 19.45 16.22 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 -3.10 6.76 0.54 0.00 0.15 -1.26 -3.41 113.70 113.38 3a70 s SER 238 Ca 0.60 2.41 0.32 0.00 0.70 0.00 0.00 55.95 59.99 3a70 s SER 238 Cb -0.31 -2.59 1.40 0.00 -1.71 0.00 0.00 66.02 62.81 3a70 s SER 238 CO 0.74 -0.69 2.01 1.55 1.20 0.00 0.00 173.24 178.05 3a70 h PRO 239 N 6.69 0.00 -5.96 5.44 0.13 -1.74 0.64 132.00 137.20 3a70 h PRO 239 Ca -0.42 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.12 3a70 h PRO 239 Cb 1.21 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.23 3a70 h PRO 239 CO 0.87 0.06 -0.59 0.95 -0.23 0.00 0.00 178.00 179.06 3a70 s THR 240 N -3.78 2.50 -0.04 1.56 -4.23 -1.26 -1.07 115.64 109.33 3a70 s THR 240 Ca -0.00 -1.92 0.00 0.00 -1.18 0.00 0.00 61.69 58.59 3a70 s THR 240 Cb 0.10 -2.86 0.02 0.00 1.34 0.00 0.00 72.50 71.11 3a70 s THR 240 CO 0.55 -0.14 -0.02 -1.10 -0.54 0.00 0.00 174.62 173.38 3a70 s GLN 241 N -3.75 0.52 1.09 3.99 1.11 -0.46 -4.85 119.66 117.31 3a70 s GLN 241 Ca 0.36 0.01 -0.12 0.00 0.01 0.00 0.00 55.36 55.62 3a70 s GLN 241 Cb 0.02 -0.66 0.24 0.00 -1.01 0.00 0.00 33.01 31.60 3a70 s GLN 241 CO 0.20 -0.13 1.06 -1.54 0.01 0.00 0.00 175.29 174.89 3a70 s SER 242 N 1.06 1.61 0.00 5.90 1.04 -1.26 -4.46 113.70 117.59 3a70 s SER 242 Ca -0.09 1.56 0.30 0.00 0.48 0.00 0.00 55.95 58.20 3a70 s SER 242 Cb -0.14 -2.27 1.39 0.00 0.10 0.00 0.00 66.02 65.10 3a70 s SER 242 CO -0.01 -3.82 1.94 -1.20 0.98 0.00 0.00 173.24 171.13 3a70 n SER 243 N -4.66 0.85 -4.79 7.02 7.64 -1.26 -4.91 113.62 113.51 3a70 n SER 243 Ca 0.05 -1.24 -0.22 0.00 1.01 0.00 0.00 58.87 58.46 3a70 n SER 243 Cb 0.54 -0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.83 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 -2.04 2.20 -0.24 0.44 -4.23 -1.26 -5.02 115.64 105.49 3a70 s THR 244 Ca 0.41 -0.70 0.14 0.00 -1.18 0.00 0.00 61.69 60.36 3a70 s THR 244 Cb 0.21 -2.50 0.78 0.00 1.34 0.00 0.00 72.50 72.33 3a70 s THR 244 CO 0.36 0.00 1.71 -0.90 -0.54 0.00 0.00 174.62 175.25 3a70 n ASP 245 N -2.64 5.40 0.05 3.99 5.68 -1.26 -4.61 116.55 123.16 3a70 n ASP 245 Ca 0.14 -2.98 0.11 0.00 -0.50 0.00 0.00 54.79 51.57 3a70 n ASP 245 Cb 0.61 -0.67 0.03 0.00 -1.14 0.00 0.00 41.12 39.94 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 0.38 0.38 -3.95 0.11 5.02 -1.26 -4.91 118.16 113.93 3a70 n LYS 246 Ca 0.28 0.02 -0.35 0.00 -2.02 0.00 0.00 58.31 56.24 3a70 n LYS 246 Cb 1.17 -1.65 -0.12 0.00 -0.02 0.00 0.00 35.03 34.41 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 -3.25 4.26 -0.50 -0.18 1.01 -1.26 -4.06 120.40 116.42 3a70 s VAL 247 Ca 0.02 -0.20 -0.26 0.00 0.00 0.00 0.00 61.98 61.54 3a70 s VAL 247 Cb 0.13 -2.95 0.03 0.00 0.00 0.00 0.00 36.38 33.59 3a70 s VAL 247 CO 0.79 0.40 0.98 -0.22 0.00 0.00 0.00 175.10 177.06 3a70 s LEU 248 N 1.09 3.93 -0.70 3.92 2.96 -0.17 -4.77 118.68 124.95 3a70 s LEU 248 Ca 0.03 0.02 -0.19 0.00 -0.22 0.00 0.00 54.13 53.78 3a70 s LEU 248 Cb -0.14 -3.13 0.12 0.00 0.50 0.00 0.00 46.19 43.54 3a70 s LEU 248 CO 0.02 -1.17 0.83 0.20 -1.32 0.00 0.00 176.35 174.92 3a70 s ASN 249 N 2.52 6.33 -0.12 3.68 0.02 0.04 -0.67 114.94 126.74 3a70 s ASN 249 Ca 0.37 -1.63 -0.14 0.00 -1.02 0.00 0.00 52.86 50.44 3a70 s ASN 249 Cb -0.10 -2.33 -0.05 0.00 0.02 0.00 0.00 41.25 38.79 3a70 s ASN 249 CO 0.25 -1.09 0.32 -0.69 0.02 0.00 0.00 177.10 175.90 3a70 s VAL 250 N 2.61 5.26 0.16 1.60 1.01 -0.14 -0.94 120.40 129.96 3a70 s VAL 250 Ca 0.18 0.61 -0.25 0.00 0.00 0.00 0.00 61.98 62.52 3a70 s VAL 250 Cb -0.18 -3.64 0.06 0.00 0.00 0.00 0.00 36.38 32.62 3a70 s VAL 250 CO 0.02 0.44 0.96 -0.83 0.00 0.00 0.00 175.10 175.69 3a70 s GLY 251 N 0.08 -0.21 0.04 4.51 0.00 -1.26 -1.05 107.32 109.43 3a70 s GLY 251 Ca 0.19 0.09 -0.25 0.00 0.00 0.00 0.00 44.72 44.74 3a70 s GLY 251 CO 0.06 0.08 0.78 -0.19 0.00 0.00 0.00 173.10 173.84 3a70 s TYR 252 N -3.24 3.73 0.37 1.90 2.02 -1.26 -4.49 117.35 116.38 3a70 s TYR 252 Ca 0.13 1.49 0.21 0.00 -0.37 0.00 0.00 57.07 58.53 3a70 s TYR 252 Cb -0.01 -2.85 1.09 0.00 -0.40 0.00 0.00 41.96 39.79 3a70 s TYR 252 CO 0.03 0.25 1.95 1.05 -1.57 0.00 0.00 175.55 177.25 3a70 h GLU 253 N 5.77 0.00 -0.11 -0.62 4.11 0.15 -1.61 114.58 122.27 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 0.22 0.00 0.27 0.07 0.00 0.00 179.01 180.29 3a70 n ASN 254 N -3.83 1.25 -4.59 3.06 6.94 -1.26 -4.76 115.26 112.06 3a70 n ASN 254 Ca -0.02 -1.60 -0.43 0.00 -0.02 0.00 0.00 54.58 52.52 3a70 n ASN 254 Cb 0.32 -0.07 -0.02 0.00 -2.36 0.00 0.00 39.78 37.65 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 -1.64 6.42 0.62 0.53 -1.08 -0.61 -4.76 116.67 116.16 3a70 s ASP 255 Ca 0.33 0.45 0.36 0.00 -0.52 0.00 0.00 52.55 53.17 3a70 s ASP 255 Cb 0.17 -2.55 2.09 0.00 -1.46 0.00 0.00 42.92 41.18 3a70 s ASP 255 CO 0.27 -1.43 2.31 1.55 0.52 0.00 0.00 175.17 178.38 3a70 h PRO 256 N 10.02 0.00 -0.28 4.34 0.13 -1.86 -2.00 132.00 142.35 3a70 h PRO 256 Ca -0.25 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.71 3a70 h PRO 256 Cb 1.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 3a70 h PRO 256 CO 1.14 0.00 -0.47 0.28 -0.23 0.00 0.00 178.00 178.72 3a70 h VAL 257 N 0.00 1.29 -2.19 1.56 2.07 -1.91 -3.40 116.25 113.67 3a70 h VAL 257 Ca -0.00 -1.66 -0.56 0.00 0.82 0.00 0.00 66.70 65.30 3a70 h VAL 257 Cb 0.01 1.64 0.01 0.00 -1.52 0.00 0.00 31.29 31.43 3a70 h VAL 257 CO 0.00 0.54 1.29 0.33 0.02 0.00 0.00 177.57 179.75 3a70 n PHE 258 N -4.09 2.34 -1.98 1.57 7.35 -0.75 -1.75 117.46 120.14 3a70 n PHE 258 Ca -0.04 -0.26 -0.16 0.00 -0.76 0.00 0.00 57.45 56.22 3a70 n PHE 258 Cb 0.58 -2.76 -0.03 0.00 0.35 0.00 0.00 39.48 37.62 3a70 n PHE 258 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 3a70 n ARG 259 N 7.76 -1.22 -0.13 -4.13 1.74 0.22 -4.89 116.66 116.00 3a70 n ARG 259 Ca 0.23 0.90 0.13 0.00 -0.77 0.00 0.00 57.85 58.34 3a70 n ARG 259 Cb 0.40 -5.21 0.49 0.00 -1.02 0.00 0.00 32.46 27.12 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 0.47 2.04 -2.69 7.54 0.00 -1.16 -3.42 119.26 122.04 3a70 h ALA 260 Ca -0.36 -0.01 -0.58 0.00 0.00 0.00 0.00 54.91 53.96 3a70 h ALA 260 Cb 1.19 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.80 3a70 h ALA 260 CO 0.47 -0.20 -0.63 -0.51 0.00 0.00 0.00 179.25 178.37 3a70 s LEU 261 N -9.38 3.39 -0.29 0.00 1.43 -0.23 -4.00 118.68 109.60 3a70 s LEU 261 Ca -0.08 -0.40 0.03 0.00 -1.03 0.00 0.00 54.13 52.65 3a70 s LEU 261 Cb 0.20 -2.00 0.08 0.00 0.03 0.00 0.00 46.19 44.50 3a70 s LEU 261 CO 0.76 0.06 -0.01 -0.62 0.23 0.00 0.00 176.35 176.77 3a70 s ASP 262 N -3.16 4.42 0.07 2.29 2.15 -0.18 -4.61 116.67 117.65 3a70 s ASP 262 Ca 0.29 -1.68 0.27 0.00 0.43 0.00 0.00 52.55 51.85 3a70 s ASP 262 Cb -0.09 -1.44 0.87 0.00 -0.30 0.00 0.00 42.92 41.96 3a70 s ASP 262 CO 0.20 -0.30 1.71 0.61 -0.17 0.00 0.00 175.17 177.22 3a70 n GLY 263 N 4.44 -1.50 0.00 2.66 0.00 -1.26 -0.96 105.19 108.57 3a70 n GLY 263 Ca -0.05 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.82 3a70 n GLY 263 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3a70 n SER 264 N -1.80 0.98 -4.76 1.61 2.88 -1.26 -1.35 113.62 109.92 3a70 n SER 264 Ca 0.06 -1.47 -0.36 0.00 -1.33 0.00 0.00 58.87 55.77 3a70 n SER 264 Cb 0.38 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.77 3a70 n SER 264 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 3a70 s THR 265 N -0.47 5.33 -0.12 2.46 2.01 -0.14 -4.71 115.64 120.00 3a70 s THR 265 Ca 0.00 0.45 -0.29 0.00 0.31 0.00 0.00 61.69 62.16 3a70 s THR 265 Cb 0.00 -3.57 -0.01 0.00 0.01 0.00 0.00 72.50 68.93 3a70 s THR 265 CO 0.00 0.45 1.07 0.12 -0.69 0.00 0.00 174.62 175.56 3a70 s PHE 266 N 0.12 3.37 0.49 4.92 5.36 -1.26 -1.01 117.98 129.97 3a70 s PHE 266 Ca 0.15 1.46 0.01 0.00 -0.96 0.00 0.00 56.93 57.59 3a70 s PHE 266 Cb -0.13 -3.27 -0.00 0.00 -0.34 0.00 0.00 43.02 39.28 3a70 s PHE 266 CO 0.03 -0.58 0.03 0.25 -1.46 0.00 0.00 175.22 173.49 3a70 n THR 267 N 4.77 0.00 -0.22 0.12 -2.24 -1.26 -5.00 114.28 110.45 3a70 n THR 267 Ca 0.10 -2.41 0.10 0.00 -2.27 0.00 0.00 64.05 59.57 3a70 n THR 267 Cb 0.47 0.55 0.38 0.00 -2.10 0.00 0.00 70.33 69.64 3a70 n THR 267 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3a70 h GLY 268 N 1.30 1.03 2.00 3.38 0.00 -1.98 -2.37 103.07 106.44 3a70 h GLY 268 Ca -0.41 -0.29 -0.03 0.00 0.00 0.00 0.00 47.33 46.61 3a70 h GLY 268 CO 0.67 0.14 -0.14 0.00 0.00 0.00 0.00 176.54 177.21 3a70 h ALA 269 N 1.61 1.30 -0.90 3.60 0.00 -1.94 -3.31 119.26 119.61 3a70 h ALA 269 Ca 0.38 -0.13 0.22 0.00 0.00 0.00 0.00 54.91 55.38 3a70 h ALA 269 Cb 0.55 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 3a70 h ALA 269 CO -0.15 0.18 0.61 0.77 0.00 0.00 0.00 179.25 180.66 3a70 h SER 270 N 0.00 0.29 -0.60 0.00 0.02 -1.55 0.24 113.55 111.94 3a70 h SER 270 Ca -0.00 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3a70 h SER 270 Cb 0.38 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.90 3a70 h SER 270 CO 0.02 0.11 0.00 1.33 -1.14 0.00 0.00 176.83 177.15 3a70 n VAL 271 N -4.45 0.92 0.00 2.27 0.24 -1.25 -4.63 118.33 111.44 3a70 n VAL 271 Ca 0.19 -0.96 0.00 0.00 -2.04 0.00 0.00 64.34 61.54 3a70 n VAL 271 Cb 0.79 0.58 0.00 0.00 -1.47 0.00 0.00 33.84 33.73 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 1.39 5.49 3.70 7.63 0.00 0.85 -4.42 105.19 119.84 3a70 n GLY 272 Ca 0.21 -1.16 -0.42 0.00 0.00 0.00 0.00 46.02 44.65 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 2.81 4.80 -0.46 1.61 1.01 -1.25 -4.63 120.40 124.29 3a70 s VAL 273 Ca 0.00 2.02 0.08 0.00 0.00 0.00 0.00 61.98 64.08 3a70 s VAL 273 Cb 0.00 -4.29 0.29 0.00 0.00 0.00 0.00 36.38 32.37 3a70 s VAL 273 CO 0.00 0.12 0.68 0.00 0.00 0.00 0.00 175.10 175.90 3a70 n HIS 274 N 4.17 1.25 -1.14 5.22 -0.00 -1.26 -4.74 115.22 118.71 3a70 n HIS 274 Ca 0.07 -3.82 0.05 0.00 -0.00 0.00 0.00 57.72 54.02 3a70 n HIS 274 Cb 0.50 -0.43 0.23 0.00 -0.00 0.00 0.00 29.99 30.29 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 0.77 3.29 -4.76 4.39 2.03 -1.26 -4.83 116.55 116.18 3a70 n ASP 275 Ca 0.25 -3.26 -0.41 0.00 0.52 0.00 0.00 54.79 51.89 3a70 n ASP 275 Cb 0.52 -0.56 -0.01 0.00 -0.72 0.00 0.00 41.12 40.34 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 -2.97 3.61 0.24 -1.67 0.00 -1.26 -4.60 121.76 115.12 3a70 s ALA 276 Ca 0.42 1.48 -0.31 0.00 0.00 0.00 0.00 51.96 53.55 3a70 s ALA 276 Cb 0.36 -3.59 -0.14 0.00 0.00 0.00 0.00 23.12 19.75 3a70 s ALA 276 CO 0.05 -0.91 1.38 -2.30 0.00 0.00 0.00 175.76 173.98 3a70 n PRO 277 N 1.28 1.96 -4.81 0.00 -0.02 -1.26 -5.00 135.00 127.15 3a70 n PRO 277 Ca 0.04 0.70 -0.26 0.00 -2.02 0.00 0.00 63.50 61.95 3a70 n PRO 277 Cb 0.39 -2.34 -0.16 0.00 -0.02 0.00 0.00 33.50 31.37 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 -0.47 1.90 0.30 -0.52 1.02 -1.26 -5.05 119.74 115.67 3a70 s LYS 278 Ca 0.68 -0.58 0.04 0.00 0.02 0.00 0.00 55.97 56.12 3a70 s LYS 278 Cb -0.66 -1.59 0.64 0.00 -0.52 0.00 0.00 37.83 35.69 3a70 s LYS 278 CO 0.50 0.17 1.84 1.49 -0.92 0.00 0.00 175.35 178.44 3a70 h GLU 279 N 6.52 0.88 0.00 1.68 4.22 -2.02 -1.55 114.58 124.30 3a70 h GLU 279 Ca -0.30 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.08 3a70 h GLU 279 Cb 1.19 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.24 3a70 h GLU 279 CO 0.48 0.58 -0.35 -1.13 -2.18 0.00 0.00 179.01 176.40 3a70 n SER 280 N -4.61 0.41 -4.71 1.04 3.41 -1.26 -4.91 113.62 102.98 3a70 n SER 280 Ca 0.19 0.07 -0.35 0.00 -0.26 0.00 0.00 58.87 58.52 3a70 n SER 280 Cb 0.40 -0.03 -0.09 0.00 -0.26 0.00 0.00 64.21 64.22 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 -3.03 3.38 -0.45 7.33 0.00 -0.59 -0.78 121.76 127.62 3a70 s ALA 281 Ca 0.11 -0.81 -0.27 0.00 0.00 0.00 0.00 51.96 50.99 3a70 s ALA 281 Cb 0.17 -1.53 -0.05 0.00 0.00 0.00 0.00 23.12 21.71 3a70 s ALA 281 CO 0.65 0.61 2.22 0.95 0.00 0.00 0.00 175.76 180.19 3a70 s THR 282 N -0.95 3.11 -0.51 0.00 -4.23 -0.11 -4.71 115.64 108.23 3a70 s THR 282 Ca 0.15 0.08 0.23 0.00 -1.18 0.00 0.00 61.69 60.98 3a70 s THR 282 Cb -0.11 -3.24 0.00 0.00 1.34 0.00 0.00 72.50 70.49 3a70 s THR 282 CO 0.04 -0.21 1.18 0.44 -0.54 0.00 0.00 174.62 175.54 3a70 h ASP 283 N 17.36 0.00 -0.25 3.99 3.32 -1.89 -3.40 116.42 135.54 3a70 h ASP 283 Ca -0.28 -0.18 -0.23 0.00 0.02 0.00 0.00 57.03 56.36 3a70 h ASP 283 Cb 1.23 0.00 -0.34 0.00 0.22 0.00 0.00 39.33 40.45 3a70 h ASP 283 CO 1.12 0.09 -0.95 0.59 -1.72 0.00 0.00 179.24 178.37 3a70 n ASN 284 N -2.26 1.86 -4.61 6.45 3.02 -1.26 -4.70 115.26 113.76 3a70 n ASN 284 Ca 0.02 -2.55 -0.39 0.00 -0.03 0.00 0.00 54.58 51.63 3a70 n ASN 284 Cb 0.47 -0.40 -0.09 0.00 -0.61 0.00 0.00 39.78 39.15 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 -2.45 5.17 -0.17 2.41 1.01 -1.26 -1.57 121.20 124.34 3a70 s ILE 285 Ca 0.35 0.62 -0.06 0.00 0.00 0.00 0.00 60.65 61.55 3a70 s ILE 285 Cb 0.37 -3.72 -0.04 0.00 0.01 0.00 0.00 42.46 39.08 3a70 s ILE 285 CO -0.08 0.16 0.03 -0.69 0.00 0.00 0.00 174.94 174.36 3a70 s VAL 286 N 2.01 4.48 -0.57 2.92 1.01 0.21 0.83 120.40 131.29 3a70 s VAL 286 Ca 0.16 -0.14 -0.25 0.00 0.00 0.00 0.00 61.98 61.75 3a70 s VAL 286 Cb -0.16 -3.00 0.04 0.00 0.00 0.00 0.00 36.38 33.26 3a70 s VAL 286 CO 0.10 0.47 1.01 -0.55 0.00 0.00 0.00 175.10 176.12 3a70 s SER 287 N 0.37 6.35 -1.19 3.32 0.15 -1.26 -1.32 113.70 120.11 3a70 s SER 287 Ca 0.01 -0.29 -0.19 0.00 0.70 0.00 0.00 55.95 56.17 3a70 s SER 287 Cb -0.13 -2.46 0.07 0.00 -1.71 0.00 0.00 66.02 61.79 3a70 s SER 287 CO 0.01 -1.31 1.61 0.12 1.20 0.00 0.00 173.24 174.86 3a70 s PHE 288 N 4.23 2.76 0.48 3.44 5.36 0.10 -4.74 117.98 129.60 3a70 s PHE 288 Ca 0.33 -1.40 0.06 0.00 -0.96 0.00 0.00 56.93 54.96 3a70 s PHE 288 Cb -0.12 -4.70 -0.00 0.00 -0.34 0.00 0.00 43.02 37.87 3a70 s PHE 288 CO 0.20 -1.81 0.32 0.54 -1.46 0.00 0.00 175.22 173.01 3a70 s ASN 289 N 4.36 4.65 0.31 6.13 2.20 -1.26 -0.59 114.94 130.74 3a70 s ASN 289 Ca 0.50 -1.11 0.03 0.00 -0.94 0.00 0.00 52.86 51.34 3a70 s ASN 289 Cb 0.02 -0.03 0.61 0.00 -2.00 0.00 0.00 41.25 39.85 3a70 s ASN 289 CO 0.01 -0.85 1.88 0.44 -2.94 0.00 0.00 177.10 175.65 3a70 h ASP 290 N 1.01 0.85 0.35 3.54 5.19 -1.93 -0.85 116.42 124.58 3a70 h ASP 290 Ca -0.40 0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.02 3a70 h ASP 290 Cb 1.28 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 40.64 3a70 h ASP 290 CO 0.61 0.50 -0.17 -0.74 -3.12 0.00 0.00 179.24 176.32 3a70 h HIS 291 N 0.94 -0.43 -0.82 4.55 2.76 -1.94 -2.80 115.15 117.41 3a70 h HIS 291 Ca 0.43 -0.01 0.11 0.00 -2.20 0.00 0.00 60.37 58.70 3a70 h HIS 291 Cb 0.39 0.14 -0.08 0.00 1.55 0.00 0.00 27.41 29.41 3a70 h HIS 291 CO -0.00 -0.27 0.45 -0.92 -1.30 0.00 0.00 177.93 175.89 3a70 h TYR 292 N -0.47 0.81 0.00 5.26 3.20 -1.71 -2.41 116.97 121.65 3a70 h TYR 292 Ca -0.05 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.83 3a70 h TYR 292 Cb 0.36 -0.24 -0.00 0.00 1.54 0.00 0.00 36.73 38.39 3a70 h TYR 292 CO -0.05 0.29 -0.12 0.00 -1.64 0.00 0.00 178.16 176.64 3a70 h ALA 293 N 1.48 1.06 -2.37 1.82 0.00 -1.18 -3.46 119.26 116.61 3a70 h ALA 293 Ca 0.41 -0.11 -0.59 0.00 0.00 0.00 0.00 54.91 54.62 3a70 h ALA 293 Cb 0.45 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.13 3a70 h ALA 293 CO -0.28 0.15 0.36 0.45 0.00 0.00 0.00 179.25 179.92 3a70 s SER 294 N -5.96 6.79 0.15 0.00 0.15 -0.91 -4.95 113.70 108.97 3a70 s SER 294 Ca -0.00 0.97 -0.16 0.00 0.70 0.00 0.00 55.95 57.46 3a70 s SER 294 Cb 0.10 -2.41 0.04 0.00 -1.71 0.00 0.00 66.02 62.04 3a70 s SER 294 CO 0.58 -0.44 1.77 0.74 1.20 0.00 0.00 173.24 177.10 3a70 h THR 295 N 5.36 0.97 -0.13 6.45 2.02 -1.88 -2.85 112.91 122.85 3a70 h THR 295 Ca -0.26 -0.12 0.01 0.00 0.77 0.00 0.00 66.41 66.81 3a70 h THR 295 Cb 1.11 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 3a70 h THR 295 CO 0.84 0.06 0.05 0.00 0.37 0.00 0.00 175.52 176.84 3a70 h ALA 296 N 1.19 0.15 -0.93 6.16 0.00 -1.95 -2.58 119.26 121.29 3a70 h ALA 296 Ca 0.15 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.10 3a70 h ALA 296 Cb 0.07 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 3a70 h ALA 296 CO -0.11 -0.39 0.61 -1.49 0.00 0.00 0.00 179.25 177.87 3a70 h TRP 297 N 0.13 1.15 -0.06 0.00 4.06 -1.87 -2.60 115.95 116.76 3a70 h TRP 297 Ca 0.05 0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.03 3a70 h TRP 297 Cb 0.02 -0.39 0.00 0.00 -1.00 0.00 0.00 29.16 27.79 3a70 h TRP 297 CO -0.10 0.69 0.00 0.09 -3.56 0.00 0.00 178.44 175.56 3a70 n ASN 298 N -4.42 0.78 -0.02 -3.49 4.13 -1.02 -2.08 115.26 109.14 3a70 n ASN 298 Ca 0.12 -1.48 0.03 0.00 1.68 0.00 0.00 54.58 54.92 3a70 n ASN 298 Cb 0.07 -0.04 0.37 0.00 -1.54 0.00 0.00 39.78 38.65 3a70 n ASN 298 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 3a70 h LEU 299 N 1.08 0.51 -9.95 3.41 3.38 -1.09 -3.43 115.31 109.23 3a70 h LEU 299 Ca 0.00 -0.04 -0.47 0.00 0.09 0.00 0.00 57.88 57.46 3a70 h LEU 299 Cb 0.24 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 3a70 h LEU 299 CO 0.00 0.43 0.38 -0.76 0.09 0.00 0.00 178.44 178.57 3a70 s LEU 300 N -9.41 4.19 0.24 1.67 1.43 -0.88 -5.00 118.68 110.92 3a70 s LEU 300 Ca -0.08 1.91 -0.30 0.00 -1.03 0.00 0.00 54.13 54.63 3a70 s LEU 300 Cb 0.17 -4.17 -0.10 0.00 0.03 0.00 0.00 46.19 42.13 3a70 s LEU 300 CO 0.74 -0.31 1.38 -2.84 0.23 0.00 0.00 176.35 175.55 3a70 s PRO 301 N -2.42 4.32 0.06 1.29 0.02 -1.26 -4.95 135.00 132.06 3a70 s PRO 301 Ca 0.55 2.20 -0.31 0.00 0.02 0.00 0.00 61.00 63.47 3a70 s PRO 301 Cb -0.19 -3.13 -0.08 0.00 0.02 0.00 0.00 34.50 31.12 3a70 s PRO 301 CO 0.24 -0.33 1.69 0.12 -0.33 0.00 0.00 177.00 178.39 3a70 s PHE 302 N -0.13 2.27 -0.25 6.54 5.36 -1.26 -4.80 117.98 125.70 3a70 s PHE 302 Ca 0.57 0.22 -0.26 0.00 -0.96 0.00 0.00 56.93 56.50 3a70 s PHE 302 Cb -0.40 -4.00 0.11 0.00 -0.34 0.00 0.00 43.02 38.40 3a70 s PHE 302 CO 0.43 -4.08 0.96 0.45 -1.46 0.00 0.00 175.22 171.52 3a70 s SER 303 N 2.68 -0.50 0.60 6.13 0.15 -1.26 -4.17 113.70 117.33 3a70 s SER 303 Ca 0.75 0.89 0.28 0.00 0.70 0.00 0.00 55.95 58.58 3a70 s SER 303 Cb -0.40 0.88 1.42 0.00 -1.71 0.00 0.00 66.02 66.22 3a70 s SER 303 CO 0.33 -0.21 1.83 -0.29 1.20 0.00 0.00 173.24 176.10 3a70 h ILE 304 N 3.50 0.29 0.00 6.45 2.10 -1.81 -1.17 117.51 126.86 3a70 h ILE 304 Ca -0.27 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.67 3a70 h ILE 304 Cb 1.17 0.56 0.00 0.00 -1.09 0.00 0.00 36.82 37.46 3a70 h ILE 304 CO 0.14 0.00 0.00 -0.07 -1.08 0.00 0.00 178.15 177.14 3a70 h LEU 305 N 0.00 0.00 -8.24 2.19 3.38 -1.92 -3.42 115.31 107.30 3a70 h LEU 305 Ca 0.22 0.00 -0.71 0.00 0.09 0.00 0.00 57.88 57.47 3a70 h LEU 305 Cb 1.31 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.85 3a70 h LEU 305 CO -0.00 0.00 -0.04 0.21 0.09 0.00 0.00 178.44 178.69 3a70 s ASN 306 N -4.57 6.19 0.22 -0.43 3.04 -0.44 -4.99 114.94 113.96 3a70 s ASN 306 Ca 0.09 -1.34 -0.08 0.00 0.04 0.00 0.00 52.86 51.57 3a70 s ASN 306 Cb 0.11 -2.26 0.19 0.00 -1.54 0.00 0.00 41.25 37.75 3a70 s ASN 306 CO 0.56 -0.92 1.86 0.40 -3.04 0.00 0.00 177.10 175.96 3a70 h ILE 307 N 5.87 1.24 -0.39 -5.21 1.08 -1.83 -1.96 117.51 116.30 3a70 h ILE 307 Ca -0.29 -0.53 0.11 0.00 -0.39 0.00 0.00 64.86 63.77 3a70 h ILE 307 Cb 1.10 0.07 -0.02 0.00 -3.07 0.00 0.00 36.82 34.90 3a70 h ILE 307 CO 1.01 0.25 0.42 -0.65 -0.69 0.00 0.00 178.15 178.49 3a70 h PRO 308 N 1.15 0.00 0.00 2.37 0.11 -1.94 0.28 132.00 133.97 3a70 h PRO 308 Ca 0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.41 3a70 h PRO 308 Cb -0.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.08 3a70 h PRO 308 CO -0.06 0.00 0.00 1.79 -0.21 0.00 0.00 178.00 179.52 3a70 h THR 309 N 0.00 0.00 0.00 -1.15 1.35 -1.65 -2.82 112.91 108.64 3a70 h THR 309 Ca 0.19 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.81 3a70 h THR 309 Cb 1.02 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 68.43 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 -2.43 0.62 -0.33 4.73 7.02 0.97 -2.60 117.44 125.41 3a70 n TRP 310 Ca 0.01 0.24 0.28 0.00 -1.02 0.00 0.00 57.50 57.01 3a70 n TRP 310 Cb 0.21 -0.89 0.59 0.00 -2.42 0.00 0.00 31.31 28.80 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 0.45 0.00 -0.99 2.10 -1.66 -0.30 117.51 117.11 3a70 h ILE 311 Ca 0.00 -0.09 0.00 0.00 1.08 0.00 0.00 64.86 65.85 3a70 h ILE 311 Cb 0.34 0.18 0.00 0.00 -1.09 0.00 0.00 36.82 36.25 3a70 h ILE 311 CO 0.00 0.05 0.00 -1.20 -1.08 0.00 0.00 178.15 175.92 3a70 n SER 312 N -4.50 0.00 0.00 2.19 7.64 -1.07 -3.21 113.62 114.67 3a70 n SER 312 Ca 0.26 -0.68 0.05 0.00 1.01 0.00 0.00 58.87 59.52 3a70 n SER 312 Cb 1.04 -0.05 -0.12 0.00 -1.01 0.00 0.00 64.21 64.07 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 -1.05 0.39 -1.64 1.43 -0.00 -0.12 -4.52 115.22 109.70 3a70 n HIS 313 Ca 0.18 0.12 -0.48 0.00 -0.00 0.00 0.00 57.72 57.55 3a70 n HIS 313 Cb 0.11 -0.80 -0.04 0.00 -0.00 0.00 0.00 29.99 29.25 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 -2.56 2.58 -0.32 0.27 4.77 -1.20 -4.86 117.00 115.68 3a70 n LEU 314 Ca -0.10 1.11 -0.01 0.00 -0.03 0.00 0.00 56.01 56.97 3a70 n LEU 314 Cb 0.73 -1.35 0.11 0.00 -2.33 0.00 0.00 43.42 40.59 3a70 n LEU 314 CO 0.44 -0.60 1.23 1.55 -1.33 0.00 0.00 177.39 178.68 3a70 h PRO 315 N 5.14 1.08 -0.75 3.23 0.13 -1.94 -2.57 132.00 136.33 3a70 h PRO 315 Ca -0.46 -0.07 0.09 0.00 -0.87 0.00 0.00 66.00 64.70 3a70 h PRO 315 Cb 1.29 -0.24 -0.07 0.00 0.13 0.00 0.00 31.00 32.10 3a70 h PRO 315 CO 0.83 0.72 0.40 1.15 -0.23 0.00 0.00 178.00 180.86 3a70 h THR 316 N 1.11 0.89 0.00 1.56 2.02 -1.91 0.55 112.91 117.13 3a70 h THR 316 Ca 0.35 -0.24 -0.05 0.00 0.77 0.00 0.00 66.41 67.24 3a70 h THR 316 Cb -0.01 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.53 3a70 h THR 316 CO -0.11 0.13 -0.26 0.00 0.37 0.00 0.00 175.52 175.65 3a70 h ALA 317 N 1.43 1.54 0.51 6.16 0.00 -1.89 0.22 119.26 127.22 3a70 h ALA 317 Ca 0.36 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3a70 h ALA 317 Cb 0.34 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3a70 h ALA 317 CO -0.25 0.32 -0.24 1.88 0.00 0.00 0.00 179.25 180.96 3a70 h TYR 318 N 0.00 -0.63 0.16 0.00 0.05 -0.91 -2.05 116.97 113.59 3a70 h TYR 318 Ca -0.00 -0.01 0.01 0.00 0.05 0.00 0.00 58.73 58.78 3a70 h TYR 318 Cb 0.46 0.21 -0.04 0.00 1.01 0.00 0.00 36.73 38.37 3a70 h TYR 318 CO 0.00 -0.31 -0.45 0.78 -1.05 0.00 0.00 178.16 177.13 3a70 h GLY 319 N -0.91 -0.95 0.60 3.88 0.00 -0.75 -1.14 103.07 103.80 3a70 h GLY 319 Ca -0.07 0.54 -0.01 0.00 0.00 0.00 0.00 47.33 47.79 3a70 h GLY 319 CO 0.11 -0.28 -0.10 -1.80 0.00 0.00 0.00 176.54 174.48 3a70 h ASP 320 N -0.71 -0.23 -0.36 0.19 3.58 -0.70 -1.95 116.42 116.24 3a70 h ASP 320 Ca 0.01 -0.26 0.08 0.00 0.42 0.00 0.00 57.03 57.27 3a70 h ASP 320 Cb 0.72 0.06 -0.08 0.00 1.72 0.00 0.00 39.33 41.75 3a70 h ASP 320 CO -0.23 0.18 -0.19 1.23 -2.88 0.00 0.00 179.24 177.34 3a70 h GLY 321 N -0.67 0.07 1.62 -0.78 0.00 -1.44 -2.79 103.07 99.08 3a70 h GLY 321 Ca -0.03 0.24 -0.02 0.00 0.00 0.00 0.00 47.33 47.53 3a70 h GLY 321 CO 0.04 -0.19 -0.44 -0.33 0.00 0.00 0.00 176.54 175.63 3a70 h MET 322 N -0.13 0.00 -0.22 4.80 2.86 -1.25 -2.51 114.93 118.48 3a70 h MET 322 Ca 0.18 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.73 3a70 h MET 322 Cb 0.41 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 3a70 h MET 322 CO -0.44 0.06 -0.27 -0.97 1.06 0.00 0.00 176.91 176.35 3a70 h ASN 323 N 0.00 0.42 0.13 1.22 -1.24 -1.33 -1.35 115.58 113.43 3a70 h ASN 323 Ca -0.01 -0.14 -0.09 0.00 0.71 0.00 0.00 56.30 56.77 3a70 h ASN 323 Cb 1.06 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 39.98 3a70 h ASN 323 CO 0.01 0.69 -0.31 0.03 -1.29 0.00 0.00 177.43 176.56 3a70 h ARG 324 N 0.37 0.28 -0.06 6.67 3.08 -1.18 -1.56 114.38 121.99 3a70 h ARG 324 Ca 0.05 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 3a70 h ARG 324 Cb 0.67 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.70 3a70 h ARG 324 CO 0.05 0.56 0.03 0.82 -1.07 0.00 0.00 179.97 180.36 3a70 h ILE 325 N 0.24 1.07 -0.88 2.04 2.04 -1.19 -2.47 117.51 118.36 3a70 h ILE 325 Ca 0.03 -0.19 0.18 0.00 1.00 0.00 0.00 64.86 65.88 3a70 h ILE 325 Cb 0.67 1.09 -0.11 0.00 -0.74 0.00 0.00 36.82 37.74 3a70 h ILE 325 CO 0.05 0.06 0.44 0.40 0.00 0.00 0.00 178.15 179.09 3a70 h ILE 326 N 0.01 0.64 -0.00 -0.67 1.08 -0.99 -1.76 117.51 115.82 3a70 h ILE 326 Ca 0.02 -0.19 0.00 0.00 -0.39 0.00 0.00 64.86 64.30 3a70 h ILE 326 Cb 0.07 0.03 0.00 0.00 -3.07 0.00 0.00 36.82 33.85 3a70 h ILE 326 CO -0.00 0.10 -0.08 -0.62 -0.69 0.00 0.00 178.15 176.86 3a70 n GLU 327 N -4.92 0.17 -1.90 2.37 1.02 -0.61 -4.89 120.64 111.88 3a70 n GLU 327 Ca 0.19 -0.03 -0.41 0.00 -0.02 0.00 0.00 57.16 56.89 3a70 n GLU 327 Cb 0.52 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.43 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 -2.85 6.49 0.62 1.62 0.15 -0.66 -4.89 113.70 114.18 3a70 s SER 328 Ca 0.18 2.89 0.40 0.00 0.70 0.00 0.00 55.95 60.12 3a70 s SER 328 Cb 0.19 -2.65 2.06 0.00 -1.71 0.00 0.00 66.02 63.91 3a70 s SER 328 CO 0.53 -0.78 2.25 0.11 1.20 0.00 0.00 173.24 176.55 3a70 h LYS 329 N 3.73 0.00 -0.01 5.44 1.79 -1.91 -1.66 116.57 123.96 3a70 h LYS 329 Ca -0.49 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 3a70 h LYS 329 Cb 1.23 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 3a70 h LYS 329 CO 0.69 0.01 -0.16 1.19 -1.08 0.00 0.00 179.45 180.11 3a70 n PHE 330 N -3.18 0.00 -0.23 -1.35 3.72 -1.26 -4.64 117.46 110.52 3a70 n PHE 330 Ca -0.02 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.37 3a70 n PHE 330 Cb 0.14 -0.13 0.06 0.00 -0.94 0.00 0.00 39.48 38.62 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 1.07 -0.44 0.00 1.38 3.20 -1.55 -0.21 116.97 120.42 3a70 h TYR 331 Ca 0.00 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.93 3a70 h TYR 331 Cb 0.43 0.30 0.00 0.00 1.54 0.00 0.00 36.73 39.00 3a70 h TYR 331 CO 0.00 -0.31 0.00 -0.40 -1.64 0.00 0.00 178.16 175.81 3a70 n ASP 332 N -5.45 0.00 0.16 -2.11 5.68 -1.26 -1.42 116.55 112.15 3a70 n ASP 332 Ca 0.08 -0.87 0.12 0.00 -0.50 0.00 0.00 54.79 53.61 3a70 n ASP 332 Cb 0.35 0.00 0.08 0.00 -1.14 0.00 0.00 41.12 40.41 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 0.00-10.32 -2.12 3.38 -1.37 -3.40 115.31 101.48 3a70 h LEU 333 Ca 0.00 -0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 3a70 h LEU 333 Cb 0.00 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.78 3a70 h LEU 333 CO 0.00 0.00 -0.04 0.42 0.09 0.00 0.00 178.44 178.91 3a70 s THR 334 N -3.29 4.50 0.23 0.22 -4.23 -0.51 -4.68 115.64 107.89 3a70 s THR 334 Ca 0.03 -0.26 0.01 0.00 -1.18 0.00 0.00 61.69 60.29 3a70 s THR 334 Cb 0.07 -3.68 -0.04 0.00 1.34 0.00 0.00 72.50 70.19 3a70 s THR 334 CO 0.73 -0.54 0.14 -0.94 -0.54 0.00 0.00 174.62 173.47 3a70 s SER 335 N -4.15 0.63 0.30 3.99 1.04 -1.26 -2.13 113.70 112.12 3a70 s SER 335 Ca 0.46 -1.43 0.03 0.00 0.48 0.00 0.00 55.95 55.49 3a70 s SER 335 Cb -0.10 0.34 0.77 0.00 0.10 0.00 0.00 66.02 67.14 3a70 s SER 335 CO 0.40 -0.84 1.61 0.50 0.98 0.00 0.00 173.24 175.89 3a70 h LYS 336 N 2.49 0.10 -0.55 4.02 3.64 -1.72 -1.19 116.57 123.36 3a70 h LYS 336 Ca -0.35 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 58.94 3a70 h LYS 336 Cb 1.25 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 33.00 3a70 h LYS 336 CO 0.53 0.06 0.09 -0.25 -2.27 0.00 0.00 179.45 177.62 3a70 n ASP 337 N -5.34 4.88 -4.77 4.20 8.00 -1.26 -3.99 116.55 118.27 3a70 n ASP 337 Ca 0.23 -3.10 -0.41 0.00 0.71 0.00 0.00 54.79 52.23 3a70 n ASP 337 Cb 0.76 -0.67 -0.01 0.00 -0.02 0.00 0.00 41.12 41.17 3a70 n ASP 337 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3a70 s SER 338 N -1.22 6.58 -0.40 -2.24 0.01 -0.45 -4.60 113.70 111.38 3a70 s SER 338 Ca 0.52 2.84 -0.28 0.00 1.31 0.00 0.00 55.95 60.33 3a70 s SER 338 Cb 0.41 -2.65 -0.00 0.00 0.21 0.00 0.00 66.02 63.98 3a70 s SER 338 CO 0.13 -0.70 1.61 -0.89 0.41 0.00 0.00 173.24 173.79 3a70 s THR 339 N -0.95 3.68 -0.13 1.44 2.01 -1.26 -4.35 115.64 116.08 3a70 s THR 339 Ca 0.52 0.67 0.03 0.00 0.31 0.00 0.00 61.69 63.22 3a70 s THR 339 Cb -0.43 -3.96 0.01 0.00 0.01 0.00 0.00 72.50 68.13 3a70 s THR 339 CO 0.55 -0.64 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.00 3a70 s ILE 340 N 6.30 1.98 -0.26 1.82 1.01 -0.61 -1.45 121.20 129.99 3a70 s ILE 340 Ca 0.69 -0.94 -0.07 0.00 0.00 0.00 0.00 60.65 60.33 3a70 s ILE 340 Cb -0.17 -1.75 -0.01 0.00 0.01 0.00 0.00 42.46 40.53 3a70 s ILE 340 CO 0.32 0.54 0.07 -0.63 0.00 0.00 0.00 174.94 175.24 3a70 s ILE 341 N 0.79 4.16 -0.25 2.92 -1.09 0.14 -0.62 121.20 127.24 3a70 s ILE 341 Ca -0.08 -0.36 -0.10 0.00 -2.23 0.00 0.00 60.65 57.88 3a70 s ILE 341 Cb -0.16 -3.01 -0.04 0.00 -1.58 0.00 0.00 42.46 37.67 3a70 s ILE 341 CO -0.01 0.25 0.14 -0.69 -1.23 0.00 0.00 174.94 173.40 3a70 s VAL 342 N 1.57 5.02 -0.39 2.92 1.01 -0.44 -0.61 120.40 129.49 3a70 s VAL 342 Ca 0.05 0.07 -0.27 0.00 0.00 0.00 0.00 61.98 61.83 3a70 s VAL 342 Cb -0.16 -3.35 -0.05 0.00 0.00 0.00 0.00 36.38 32.82 3a70 s VAL 342 CO 0.03 0.32 2.19 0.00 0.00 0.00 0.00 175.10 177.64 3a70 s ALA 343 N 1.37 2.26 -0.17 5.51 0.00 -0.10 0.01 121.76 130.65 3a70 s ALA 343 Ca 0.06 0.24 0.16 0.00 0.00 0.00 0.00 51.96 52.43 3a70 s ALA 343 Cb -0.15 -4.20 0.44 0.00 0.00 0.00 0.00 23.12 19.22 3a70 s ALA 343 CO 0.06 -3.54 1.19 0.09 0.00 0.00 0.00 175.76 173.56 3a70 n ASN 344 N 13.22 2.03 -4.84 0.00 3.02 0.24 -4.63 115.26 124.30 3a70 n ASN 344 Ca 0.30 -3.09 -0.32 0.00 -0.03 0.00 0.00 54.58 51.44 3a70 n ASN 344 Cb 0.50 -0.42 -0.04 0.00 -0.61 0.00 0.00 39.78 39.21 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 -2.41 3.69 0.90 3.41 1.43 -1.12 -4.35 118.68 120.23 3a70 s LEU 345 Ca 0.38 1.52 -0.11 0.00 -1.03 0.00 0.00 54.13 54.89 3a70 s LEU 345 Cb 0.38 -4.44 0.13 0.00 0.03 0.00 0.00 46.19 42.28 3a70 s LEU 345 CO -0.08 -0.54 1.09 -0.94 0.23 0.00 0.00 176.35 176.12 3a70 s SER 346 N -2.98 3.41 0.19 2.29 1.04 -1.26 -4.76 113.70 111.62 3a70 s SER 346 Ca 0.58 1.59 -0.13 0.00 0.48 0.00 0.00 55.95 58.47 3a70 s SER 346 Cb -0.10 -2.26 0.21 0.00 0.10 0.00 0.00 66.02 63.97 3a70 s SER 346 CO 0.29 -2.70 1.68 0.44 0.98 0.00 0.00 173.24 173.94 3a70 h ASP 347 N -1.59 -0.22 -0.46 7.02 3.32 -1.22 -0.47 116.42 122.80 3a70 h ASP 347 Ca -0.49 0.12 -0.05 0.00 0.02 0.00 0.00 57.03 56.63 3a70 h ASP 347 Cb 1.28 0.22 -0.02 0.00 0.22 0.00 0.00 39.33 41.03 3a70 h ASP 347 CO 0.53 -0.08 0.08 -0.65 -1.72 0.00 0.00 179.24 177.40 3a70 h PRO 348 N 0.12 0.76 -0.05 3.56 0.11 -1.79 -3.11 132.00 131.60 3a70 h PRO 348 Ca 0.26 -0.20 -0.11 0.00 0.11 0.00 0.00 66.00 66.06 3a70 h PRO 348 Cb 0.40 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 3a70 h PRO 348 CO -0.44 0.78 -0.47 0.00 -0.21 0.00 0.00 178.00 177.66 3a70 h ALA 349 N 0.95 1.12 -0.66 -0.75 0.00 -1.88 -3.18 119.26 114.86 3a70 h ALA 349 Ca 0.14 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 3a70 h ALA 349 Cb 0.38 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3a70 h ALA 349 CO 0.01 0.62 0.31 -0.09 0.00 0.00 0.00 179.25 180.09 3a70 h ARG 350 N 0.09 0.94 0.00 0.00 2.43 -1.02 0.83 114.38 117.66 3a70 h ARG 350 Ca 0.00 -0.13 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 3a70 h ARG 350 Cb 0.87 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 30.25 3a70 h ARG 350 CO 0.07 0.73 -0.03 0.00 -1.51 0.00 0.00 179.97 179.23 3a70 h ALA 351 N 1.40 1.94 0.00 2.80 0.00 -1.54 -3.33 119.26 120.54 3a70 h ALA 351 Ca 0.23 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3a70 h ALA 351 Cb 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3a70 h ALA 351 CO -0.03 0.04 -0.10 0.27 0.00 0.00 0.00 179.25 179.43 3a70 n ASN 352 N -4.50 0.68 -4.22 0.00 0.23 -0.93 -5.01 115.26 101.51 3a70 n ASN 352 Ca -0.03 -1.63 -0.33 0.00 -0.53 0.00 0.00 54.58 52.07 3a70 n ASN 352 Cb 0.12 -0.08 -0.16 0.00 -2.08 0.00 0.00 39.78 37.57 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 -0.50 2.28 -0.18 5.53 2.01 0.24 -5.10 115.64 119.92 3a70 s THR 353 Ca 0.03 -0.92 -0.29 0.00 0.31 0.00 0.00 61.69 60.82 3a70 s THR 353 Cb 0.03 -1.91 -0.00 0.00 0.01 0.00 0.00 72.50 70.62 3a70 s THR 353 CO 0.00 0.54 1.08 0.26 -0.69 0.00 0.00 174.62 175.81 3a70 s TRP 354 N 0.61 3.30 -0.11 4.92 0.52 -1.26 -4.45 118.94 122.47 3a70 s TRP 354 Ca -0.11 1.41 -0.29 0.00 0.02 0.00 0.00 56.10 57.13 3a70 s TRP 354 Cb -0.16 -3.30 -0.03 0.00 -1.15 0.00 0.00 33.47 28.83 3a70 s TRP 354 CO 0.03 -0.65 1.39 0.08 0.02 0.00 0.00 176.95 177.81 3a70 s VAL 355 N 2.90 4.01 0.17 4.03 1.01 0.36 -4.82 120.40 128.06 3a70 s VAL 355 Ca 0.47 1.25 -0.22 0.00 0.00 0.00 0.00 61.98 63.49 3a70 s VAL 355 Cb -0.17 -3.81 0.06 0.00 0.00 0.00 0.00 36.38 32.46 3a70 s VAL 355 CO 0.11 -0.09 0.59 0.00 0.00 0.00 0.00 175.10 175.70 3a70 s GLN 356 N 3.48 1.30 -0.86 2.72 -2.07 -1.26 0.27 119.66 123.23 3a70 s GLN 356 Ca 0.61 -0.54 -0.25 0.00 -1.82 0.00 0.00 55.36 53.37 3a70 s GLN 356 Cb -0.26 0.58 0.05 0.00 -1.09 0.00 0.00 33.01 32.28 3a70 s GLN 356 CO 0.21 -0.56 1.32 0.34 -1.32 0.00 0.00 175.29 175.28 3a70 s ASP 357 N -2.77 6.33 0.31 12.60 2.15 -1.26 -4.81 116.67 129.21 3a70 s ASP 357 Ca 0.02 -0.99 0.26 0.00 0.43 0.00 0.00 52.55 52.27 3a70 s ASP 357 Cb -0.01 -2.55 0.77 0.00 -0.30 0.00 0.00 42.92 40.84 3a70 s ASP 357 CO -0.11 -1.64 1.74 -0.07 -0.17 0.00 0.00 175.17 174.92 3a70 h LEU 358 N 12.70 0.00 2.73 -1.34 3.38 -1.98 -3.47 115.31 127.33 3a70 h LEU 358 Ca -0.06 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.58 3a70 h LEU 358 Cb 1.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 3a70 h LEU 358 CO 1.33 0.00 -0.43 -3.20 0.09 0.00 0.00 178.44 176.23 3a70 n ASN 359 N -2.54 -4.97 -4.75 -0.43 4.05 -1.26 -4.92 115.26 100.44 3a70 n ASN 359 Ca 0.04 0.10 -0.41 0.00 0.45 0.00 0.00 54.58 54.76 3a70 n ASN 359 Cb 0.41 -4.18 -0.03 0.00 1.23 0.00 0.00 39.78 37.21 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 -4.97 4.48 -1.31 1.20 3.52 -1.26 -4.04 118.95 116.57 3a70 s ARG 360 Ca 0.00 1.97 -0.00 0.00 -0.13 0.00 0.00 55.73 57.57 3a70 s ARG 360 Cb 0.00 -3.17 0.00 0.00 -1.56 0.00 0.00 34.95 30.22 3a70 s ARG 360 CO 0.00 -0.05 0.71 0.09 -0.81 0.00 0.00 175.30 175.23 3a70 n ASN 361 N 1.71 -1.23 -3.50 -2.12 3.02 -1.26 -4.95 115.26 106.93 3a70 n ASN 361 Ca 0.02 -0.82 -0.12 0.00 -0.03 0.00 0.00 54.58 53.63 3a70 n ASN 361 Cb 0.44 -4.07 -0.04 0.00 -0.61 0.00 0.00 39.78 35.50 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 -3.66 -1.77 0.68 5.41 0.00 -1.26 -4.83 121.76 116.32 3a70 s ALA 362 Ca 0.02 1.07 -0.16 0.00 0.00 0.00 0.00 51.96 52.88 3a70 s ALA 362 Cb -0.01 0.22 0.01 0.00 0.00 0.00 0.00 23.12 23.34 3a70 s ALA 362 CO 0.81 -0.56 1.21 -1.21 0.00 0.00 0.00 175.76 176.02 3a70 s GLU 363 N -2.41 2.47 -0.02 0.00 2.02 -1.26 -4.89 118.70 114.60 3a70 s GLU 363 Ca -0.01 1.80 -0.37 0.00 0.02 0.00 0.00 54.97 56.40 3a70 s GLU 363 Cb -0.01 -1.87 -0.16 0.00 0.10 0.00 0.00 34.13 32.20 3a70 s GLU 363 CO -0.03 -1.59 1.52 2.41 0.02 0.00 0.00 175.26 177.59 3a70 n THR 364 N -2.27 0.13 -2.32 3.63 -1.04 -1.26 -4.93 114.28 106.21 3a70 n THR 364 Ca 0.14 -0.02 -0.41 0.00 -2.04 0.00 0.00 64.05 61.71 3a70 n THR 364 Cb 0.50 -1.09 -0.03 0.00 -1.82 0.00 0.00 70.33 67.89 3a70 n THR 364 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 3a70 s HIS 365 N 1.66 3.36 0.13 -1.42 3.76 -1.26 -5.06 115.29 116.47 3a70 s HIS 365 Ca 0.88 1.48 0.11 0.00 -0.15 0.00 0.00 55.06 57.38 3a70 s HIS 365 Cb -0.94 -3.47 -0.04 0.00 1.11 0.00 0.00 32.58 29.24 3a70 s HIS 365 CO 0.52 -1.25 -0.26 0.15 -0.85 0.00 0.00 174.74 173.05 3a70 s LYS 366 N -0.98 1.37 0.46 1.40 -0.14 -1.26 -5.09 119.74 115.51 3a70 s LYS 366 Ca 0.50 -1.34 0.00 0.00 -1.36 0.00 0.00 55.97 53.76 3a70 s LYS 366 Cb -0.35 -1.81 0.00 0.00 -1.68 0.00 0.00 37.83 33.99 3a70 s LYS 366 CO 0.42 0.42 0.00 0.41 -0.76 0.00 0.00 175.35 175.84 3a70 n GLY 367 N 0.85 -2.18 3.74 -3.33 0.00 -1.26 -4.56 105.19 98.46 3a70 n GLY 367 Ca -0.18 -1.71 -0.35 0.00 0.00 0.00 0.00 46.02 43.79 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 -3.43 4.69 -0.11 1.61 0.01 -1.26 -4.77 113.70 110.44 3a70 s SER 368 Ca 0.00 2.34 -0.00 0.00 1.31 0.00 0.00 55.95 59.60 3a70 s SER 368 Cb 0.00 -2.59 -0.02 0.00 0.21 0.00 0.00 66.02 63.62 3a70 s SER 368 CO 0.00 -1.93 -0.11 -0.89 0.41 0.00 0.00 173.24 170.72 3a70 s THR 369 N -1.85 3.30 -0.24 1.44 2.01 -0.14 -4.25 115.64 115.91 3a70 s THR 369 Ca 0.75 -0.59 -0.08 0.00 0.31 0.00 0.00 61.69 62.08 3a70 s THR 369 Cb -0.29 -2.38 -0.04 0.00 0.01 0.00 0.00 72.50 69.80 3a70 s THR 369 CO 0.40 0.54 0.10 -0.36 -0.69 0.00 0.00 174.62 174.61 3a70 s PHE 370 N -0.00 3.17 -0.19 4.92 0.08 -0.53 0.22 117.98 125.64 3a70 s PHE 370 Ca -0.03 -0.14 0.00 0.00 0.12 0.00 0.00 56.93 56.89 3a70 s PHE 370 Cb -0.14 -2.23 0.02 0.00 -0.57 0.00 0.00 43.02 40.10 3a70 s PHE 370 CO 0.04 -0.16 -0.17 0.42 -0.10 0.00 0.00 175.22 175.25 3a70 s ILE 371 N 1.29 2.26 -0.30 0.64 1.01 0.58 0.25 121.20 126.94 3a70 s ILE 371 Ca 0.06 -0.95 -0.07 0.00 0.00 0.00 0.00 60.65 59.69 3a70 s ILE 371 Cb -0.15 -2.00 0.01 0.00 0.01 0.00 0.00 42.46 40.33 3a70 s ILE 371 CO 0.05 0.46 0.09 -0.63 0.00 0.00 0.00 174.94 174.91 3a70 s ILE 372 N 1.30 4.01 0.33 2.92 -1.09 0.22 -1.47 121.20 127.42 3a70 s ILE 372 Ca 0.04 -0.72 -0.06 0.00 -2.23 0.00 0.00 60.65 57.68 3a70 s ILE 372 Cb -0.14 -3.09 0.08 0.00 -1.58 0.00 0.00 42.46 37.73 3a70 s ILE 372 CO -0.11 0.05 0.35 0.61 -1.23 0.00 0.00 174.94 174.60 3a70 n GLY 373 N 4.87 -2.01 3.88 6.18 0.00 0.65 -0.92 105.19 117.85 3a70 n GLY 373 Ca -0.14 -1.55 -0.25 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 -2.39 4.67 0.00 1.61 1.04 -1.25 -4.66 113.70 112.72 3a70 s SER 374 Ca 0.21 -1.16 0.12 0.00 0.48 0.00 0.00 55.95 55.61 3a70 s SER 374 Cb -0.01 0.19 0.67 0.00 0.10 0.00 0.00 66.02 66.97 3a70 s SER 374 CO 0.16 -0.99 1.44 0.47 0.98 0.00 0.00 173.24 175.30 3a70 n ASP 375 N -1.69 0.27 -3.92 7.02 8.00 -1.26 -4.00 116.55 120.98 3a70 n ASP 375 Ca -0.01 -1.67 -0.16 0.00 0.71 0.00 0.00 54.79 53.67 3a70 n ASP 375 Cb 0.64 -0.02 0.02 0.00 -0.02 0.00 0.00 41.12 41.73 3a70 n ASP 375 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3a70 n SER 376 N -0.51 1.92 -4.62 -2.24 7.64 -1.25 -3.56 113.62 110.99 3a70 n SER 376 Ca 0.10 -2.19 -0.43 0.00 1.01 0.00 0.00 58.87 57.36 3a70 n SER 376 Cb 0.08 -0.11 -0.02 0.00 -1.01 0.00 0.00 64.21 63.14 3a70 n SER 376 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3a70 s ASN 377 N -3.24 6.33 0.16 6.43 0.01 -1.26 -4.35 114.94 119.01 3a70 s ASN 377 Ca 0.28 1.51 0.07 0.00 -0.71 0.00 0.00 52.86 54.01 3a70 s ASN 377 Cb -0.02 -2.53 -0.04 0.00 0.41 0.00 0.00 41.25 39.07 3a70 s ASN 377 CO 0.17 -1.32 -0.02 -1.81 -1.51 0.00 0.00 177.10 172.62 3a70 s ASP 378 N 4.38 4.73 -0.26 -1.22 1.01 -1.26 -4.76 116.67 119.29 3a70 s ASP 378 Ca 0.71 -0.38 -0.06 0.00 0.71 0.00 0.00 52.55 53.54 3a70 s ASP 378 Cb -0.23 -1.00 -0.00 0.00 1.01 0.00 0.00 42.92 42.69 3a70 s ASP 378 CO 0.30 0.11 0.04 -0.76 0.21 0.00 0.00 175.17 175.06 3a70 s LEU 379 N -2.77 3.48 -0.14 1.23 1.43 -1.26 -1.30 118.68 119.35 3a70 s LEU 379 Ca 0.26 -0.56 0.02 0.00 -1.03 0.00 0.00 54.13 52.83 3a70 s LEU 379 Cb -0.10 -1.83 0.01 0.00 0.03 0.00 0.00 46.19 44.30 3a70 s LEU 379 CO 0.18 -0.12 -0.19 -0.63 0.23 0.00 0.00 176.35 175.82 3a70 s ILE 380 N 1.50 1.88 -0.29 -0.59 1.01 -0.37 -0.48 121.20 123.85 3a70 s ILE 380 Ca 0.04 -0.86 0.02 0.00 0.00 0.00 0.00 60.65 59.85 3a70 s ILE 380 Cb -0.16 -1.68 0.07 0.00 0.01 0.00 0.00 42.46 40.69 3a70 s ILE 380 CO 0.01 0.51 -0.05 -1.58 0.00 0.00 0.00 174.94 173.83 3a70 s GLN 381 N 1.00 2.14 0.56 2.79 2.00 0.14 -1.30 119.66 126.99 3a70 s GLN 381 Ca -0.04 -1.44 -0.15 0.00 -2.00 0.00 0.00 55.36 51.73 3a70 s GLN 381 Cb -0.15 -3.04 -0.06 0.00 0.80 0.00 0.00 33.01 30.57 3a70 s GLN 381 CO -0.04 -0.66 1.01 0.20 -0.50 0.00 0.00 175.29 175.30 3a70 s GLY 382 N 1.13 2.02 0.18 2.59 0.00 0.10 -4.30 107.32 109.04 3a70 s GLY 382 Ca -0.04 0.21 -0.01 0.00 0.00 0.00 0.00 44.72 44.88 3a70 s GLY 382 CO -0.05 0.50 0.24 0.61 0.00 0.00 0.00 173.10 174.40 3a70 n GLY 383 N -1.55 0.12 0.08 0.20 0.00 -1.26 -1.31 105.19 101.47 3a70 n GLY 383 Ca 0.07 -1.88 0.13 0.00 0.00 0.00 0.00 46.02 44.34 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 -3.05 0.69 -1.84 1.61 3.41 -1.26 -2.36 113.62 110.82 3a70 n SER 384 Ca 0.04 0.40 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 3a70 n SER 384 Cb 0.13 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 63.64 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 1.34 0.94 3.73 5.00 0.00 -1.26 -3.01 105.19 111.93 3a70 n GLY 385 Ca 0.05 -1.70 -0.38 0.00 0.00 0.00 0.00 46.02 44.00 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 6.64 0.01 1.61 0.01 -1.26 -4.18 114.94 116.77 3a70 s ASN 386 Ca 0.00 0.76 0.04 0.00 -0.71 0.00 0.00 52.86 52.95 3a70 s ASN 386 Cb 0.00 -2.26 -0.01 0.00 0.41 0.00 0.00 41.25 39.38 3a70 s ASN 386 CO 0.00 0.03 -0.12 -1.81 -1.51 0.00 0.00 177.10 173.70 3a70 s ASP 387 N 0.54 1.35 -0.32 -1.22 1.01 -1.05 -0.97 116.67 116.02 3a70 s ASP 387 Ca 0.24 -0.32 0.01 0.00 0.71 0.00 0.00 52.55 53.18 3a70 s ASP 387 Cb -0.15 -0.11 0.07 0.00 1.01 0.00 0.00 42.92 43.75 3a70 s ASP 387 CO 0.09 0.06 0.01 -0.31 0.21 0.00 0.00 175.17 175.23 3a70 s TYR 388 N -0.58 3.43 -0.18 4.23 2.02 0.13 -0.85 117.35 125.55 3a70 s TYR 388 Ca 0.02 -2.33 -0.02 0.00 -0.37 0.00 0.00 57.07 54.37 3a70 s TYR 388 Cb -0.06 -2.41 -0.01 0.00 -0.40 0.00 0.00 41.96 39.08 3a70 s TYR 388 CO 0.00 -0.88 -0.08 -0.51 -1.57 0.00 0.00 175.55 172.51 3a70 s LEU 389 N 1.12 2.80 -0.21 -1.29 1.43 -0.11 -0.30 118.68 122.11 3a70 s LEU 389 Ca -0.01 -0.37 0.01 0.00 -1.03 0.00 0.00 54.13 52.73 3a70 s LEU 389 Cb -0.20 -1.68 0.05 0.00 0.03 0.00 0.00 46.19 44.39 3a70 s LEU 389 CO -0.04 0.06 -0.10 -0.70 0.23 0.00 0.00 176.35 175.79 3a70 s GLU 390 N 1.01 2.07 0.18 1.70 2.12 -0.54 -0.04 118.70 125.19 3a70 s GLU 390 Ca -0.00 -0.95 0.10 0.00 0.36 0.00 0.00 54.97 54.47 3a70 s GLU 390 Cb -0.15 -2.53 -0.08 0.00 0.26 0.00 0.00 34.13 31.63 3a70 s GLU 390 CO -0.01 -0.46 1.36 0.78 -0.54 0.00 0.00 175.26 176.39 3a70 h GLY 391 N 7.93 0.00 0.00 -1.50 0.00 -1.28 0.19 103.07 108.41 3a70 h GLY 391 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 3a70 h GLY 391 CO 0.47 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.55 3a70 n ARG 392 N -3.35 0.00 -1.16 4.80 1.74 -1.26 -3.91 116.66 113.52 3a70 n ARG 392 Ca 0.00 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.80 3a70 n ARG 392 Cb 0.86 0.00 0.17 0.00 -1.02 0.00 0.00 32.46 32.47 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 -1.99 1.00 0.00 7.54 0.00 -1.26 -3.26 121.76 123.80 3a70 s ALA 393 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 51.64 3a70 s ALA 393 Cb 0.00 -3.13 0.00 0.00 0.00 0.00 0.00 23.12 19.99 3a70 s ALA 393 CO 0.00 -2.80 0.00 0.41 0.00 0.00 0.00 175.76 173.37 3a70 n GLY 394 N -1.05 0.51 3.52 0.00 0.00 -1.23 -3.77 105.19 103.17 3a70 n GLY 394 Ca 0.05 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.91 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 -1.43 6.36 0.08 1.61 0.01 -1.26 -4.25 114.94 116.06 3a70 s ASN 395 Ca 0.00 -1.16 -0.05 0.00 -0.71 0.00 0.00 52.86 50.94 3a70 s ASN 395 Cb 0.00 -2.52 -0.05 0.00 0.41 0.00 0.00 41.25 39.09 3a70 s ASN 395 CO 0.00 -1.54 0.31 -1.81 -1.51 0.00 0.00 177.10 172.55 3a70 s ASP 396 N 4.20 6.48 -0.13 -1.22 1.01 -1.24 -3.99 116.67 121.77 3a70 s ASP 396 Ca 0.37 0.53 0.03 0.00 0.71 0.00 0.00 52.55 54.19 3a70 s ASP 396 Cb -0.06 -2.07 0.01 0.00 1.01 0.00 0.00 42.92 41.81 3a70 s ASP 396 CO 0.01 0.15 -0.22 -0.89 0.21 0.00 0.00 175.17 174.44 3a70 s THR 397 N -1.49 2.16 0.05 -1.27 2.01 -0.42 -0.63 115.64 116.05 3a70 s THR 397 Ca 0.35 -0.96 0.05 0.00 0.31 0.00 0.00 61.69 61.43 3a70 s THR 397 Cb -0.13 -1.86 -0.04 0.00 0.01 0.00 0.00 72.50 70.49 3a70 s THR 397 CO 0.22 0.55 -0.05 -0.36 -0.69 0.00 0.00 174.62 174.28 3a70 s PHE 398 N 0.67 2.88 0.10 4.92 0.08 0.16 -1.23 117.98 125.56 3a70 s PHE 398 Ca -0.10 -0.06 0.03 0.00 0.12 0.00 0.00 56.93 56.91 3a70 s PHE 398 Cb -0.16 -1.55 -0.04 0.00 -0.57 0.00 0.00 43.02 40.70 3a70 s PHE 398 CO 0.01 0.42 -0.08 1.03 -0.10 0.00 0.00 175.22 176.50 3a70 s ARG 399 N -1.87 0.85 -0.24 0.44 0.52 -0.42 -0.11 118.95 118.12 3a70 s ARG 399 Ca 0.21 -1.27 -0.21 0.00 -0.52 0.00 0.00 55.73 53.93 3a70 s ARG 399 Cb -0.11 -0.35 0.06 0.00 0.52 0.00 0.00 34.95 35.07 3a70 s ARG 399 CO 0.12 0.02 0.63 0.34 0.02 0.00 0.00 175.30 176.43 3a70 s ASP 400 N -2.83 -0.67 0.00 0.23 2.15 -1.26 0.00 116.67 114.30 3a70 s ASP 400 Ca 0.10 1.27 0.30 0.00 0.43 0.00 0.00 52.55 54.65 3a70 s ASP 400 Cb 0.02 1.28 1.49 0.00 -0.30 0.00 0.00 42.92 45.40 3a70 s ASP 400 CO -0.02 -0.22 2.04 0.61 -0.17 0.00 0.00 175.17 177.41 3a70 n GLY 401 N 2.89 -1.31 0.00 2.66 0.00 -0.42 -4.93 105.19 104.07 3a70 n GLY 401 Ca -0.14 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 1.31 0.93 6.87 -0.02 0.00 -1.19 -4.44 105.19 108.66 3a70 n GLY 402 Ca 0.13 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 44.20 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 -0.27 -0.85 3.19 -0.02 0.00 -1.16 -4.28 105.19 101.79 3a70 n GLY 403 Ca 0.00 -1.21 -0.32 0.00 0.00 0.00 0.00 46.02 44.49 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 2.59 0.03 1.61 2.02 -1.26 -2.71 117.35 119.63 3a70 s TYR 404 Ca 0.00 -1.20 -0.04 0.00 -0.37 0.00 0.00 57.07 55.46 3a70 s TYR 404 Cb 0.00 -1.75 -0.01 0.00 -0.40 0.00 0.00 41.96 39.80 3a70 s TYR 404 CO 0.00 -0.52 0.07 -0.80 -1.57 0.00 0.00 175.55 172.73 3a70 s ASN 405 N 0.61 0.18 -0.07 2.29 0.01 -0.07 -2.53 114.94 115.36 3a70 s ASN 405 Ca -0.12 -0.48 0.04 0.00 -0.71 0.00 0.00 52.86 51.58 3a70 s ASN 405 Cb -0.17 0.19 -0.02 0.00 0.41 0.00 0.00 41.25 41.67 3a70 s ASN 405 CO 0.03 -0.44 -0.18 -0.69 -1.51 0.00 0.00 177.10 174.32 3a70 s VAL 406 N -2.16 2.73 -0.24 1.60 1.01 -0.03 -1.08 120.40 122.23 3a70 s VAL 406 Ca -0.09 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.05 3a70 s VAL 406 Cb -0.04 -2.07 0.07 0.00 0.00 0.00 0.00 36.38 34.35 3a70 s VAL 406 CO -0.03 0.57 0.05 -0.63 0.00 0.00 0.00 175.10 175.06 3a70 s ILE 407 N -0.32 0.77 -0.44 2.22 1.01 -0.01 -0.94 121.20 123.49 3a70 s ILE 407 Ca 0.02 -0.94 -0.13 0.00 0.00 0.00 0.00 60.65 59.61 3a70 s ILE 407 Cb -0.13 -1.35 0.07 0.00 0.01 0.00 0.00 42.46 41.06 3a70 s ILE 407 CO 0.02 -0.36 0.32 -0.76 0.00 0.00 0.00 174.94 174.16 3a70 s LEU 408 N 1.72 5.33 0.53 2.97 1.43 0.94 -1.45 118.68 130.14 3a70 s LEU 408 Ca 0.02 -1.32 0.18 0.00 -1.03 0.00 0.00 54.13 51.99 3a70 s LEU 408 Cb -0.17 -2.10 1.35 0.00 0.03 0.00 0.00 46.19 45.30 3a70 s LEU 408 CO -0.14 -0.57 2.16 1.23 0.23 0.00 0.00 176.35 179.26 3a70 h GLY 409 N 8.59 0.00 0.00 -3.19 0.00 -1.11 -0.59 103.07 106.77 3a70 h GLY 409 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 3a70 h GLY 409 CO 0.80 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.95 3a70 n GLY 410 N -1.47 -0.40 3.66 4.60 0.00 -1.26 -4.12 105.19 106.20 3a70 n GLY 410 Ca -0.03 -1.09 -0.28 0.00 0.00 0.00 0.00 46.02 44.62 3a70 n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a70 s ALA 411 N -1.48 0.79 0.00 4.61 0.00 -1.20 -4.84 121.76 119.64 3a70 s ALA 411 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 51.96 51.57 3a70 s ALA 411 Cb 0.00 -3.11 0.00 0.00 0.00 0.00 0.00 23.12 20.01 3a70 s ALA 411 CO 0.00 -2.97 0.00 0.41 0.00 0.00 0.00 175.76 173.20 3a70 n GLY 412 N -0.97 -3.73 3.36 0.00 0.00 -1.26 -3.88 105.19 98.71 3a70 n GLY 412 Ca 0.05 -1.97 -0.45 0.00 0.00 0.00 0.00 46.02 43.65 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 -0.76 6.13 0.18 1.61 0.01 -1.26 -4.95 114.94 115.90 3a70 s ASN 413 Ca 0.00 -1.48 0.06 0.00 -0.71 0.00 0.00 52.86 50.73 3a70 s ASN 413 Cb 0.00 -2.18 -0.04 0.00 0.41 0.00 0.00 41.25 39.44 3a70 s ASN 413 CO 0.00 -0.70 0.10 0.20 -1.51 0.00 0.00 177.10 175.18 3a70 s ASN 414 N 2.87 5.24 -0.02 -1.22 0.01 -1.26 -3.71 114.94 116.85 3a70 s ASN 414 Ca 0.04 -0.25 0.01 0.00 -0.71 0.00 0.00 52.86 51.95 3a70 s ASN 414 Cb -0.26 -1.28 0.01 0.00 0.41 0.00 0.00 41.25 40.13 3a70 s ASN 414 CO 0.05 0.06 -0.04 -0.89 -1.51 0.00 0.00 177.10 174.77 3a70 s THR 415 N -1.83 0.40 -0.25 1.60 2.01 0.19 -2.80 115.64 114.97 3a70 s THR 415 Ca 0.30 -0.15 -0.06 0.00 0.31 0.00 0.00 61.69 62.09 3a70 s THR 415 Cb -0.09 -0.38 -0.01 0.00 0.01 0.00 0.00 72.50 72.02 3a70 s THR 415 CO 0.22 0.14 0.03 -0.22 -0.69 0.00 0.00 174.62 174.11 3a70 s LEU 416 N 0.26 3.34 -0.42 4.42 2.96 0.24 -0.67 118.68 128.81 3a70 s LEU 416 Ca -0.03 -0.38 -0.15 0.00 -0.22 0.00 0.00 54.13 53.35 3a70 s LEU 416 Cb -0.06 -1.85 0.04 0.00 0.50 0.00 0.00 46.19 44.81 3a70 s LEU 416 CO -0.00 -0.06 0.32 -0.62 -1.32 0.00 0.00 176.35 174.66 3a70 s ASP 417 N 1.54 6.07 0.14 3.68 2.15 0.84 -0.74 116.67 130.37 3a70 s ASP 417 Ca 0.05 -1.05 0.25 0.00 0.43 0.00 0.00 52.55 52.24 3a70 s ASP 417 Cb -0.15 -2.15 0.61 0.00 -0.30 0.00 0.00 42.92 40.92 3a70 s ASP 417 CO 0.01 -0.50 1.56 0.18 -0.17 0.00 0.00 175.17 176.24 3a70 n LEU 418 N 5.15 0.69 -0.25 -1.34 4.77 0.97 -4.49 117.00 122.51 3a70 n LEU 418 Ca -0.11 0.38 -0.03 0.00 -0.03 0.00 0.00 56.01 56.21 3a70 n LEU 418 Cb 0.46 -0.26 -0.01 0.00 -2.33 0.00 0.00 43.42 41.27 3a70 n LEU 418 CO 0.42 -0.09 -0.03 0.00 -1.33 0.00 0.00 177.39 176.36 3a70 n GLN 419 N -2.10 -1.57 -2.01 3.23 6.02 -1.25 -4.89 117.38 114.81 3a70 n GLN 419 Ca 0.05 0.54 -0.03 0.00 -0.01 0.00 0.00 57.00 57.55 3a70 n GLN 419 Cb 0.42 -4.79 0.00 0.00 1.02 0.00 0.00 30.24 26.90 3a70 n GLN 419 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 3a70 n LYS 420 N -0.21 0.28 -2.18 -1.09 2.85 -1.26 -4.70 118.16 111.85 3a70 n LYS 420 Ca -0.03 -0.73 -0.41 0.00 -1.05 0.00 0.00 58.31 56.09 3a70 n LYS 420 Cb 0.44 0.81 -0.03 0.00 -0.65 0.00 0.00 35.03 35.61 3a70 n LYS 420 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 3a70 s SER 421 N -1.62 6.86 0.56 -5.58 0.15 -0.74 -1.42 113.70 111.91 3a70 s SER 421 Ca 0.06 2.56 0.26 0.00 0.70 0.00 0.00 55.95 59.53 3a70 s SER 421 Cb -0.01 -2.63 1.49 0.00 -1.71 0.00 0.00 66.02 63.15 3a70 s SER 421 CO 0.05 -0.49 2.05 1.62 1.20 0.00 0.00 173.24 177.66 3a70 h VAL 422 N 3.25 0.64 0.00 4.45 3.04 -1.95 -1.91 116.25 123.77 3a70 h VAL 422 Ca -0.47 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.22 3a70 h VAL 422 Cb 1.22 0.80 0.00 0.00 -2.01 0.00 0.00 31.29 31.30 3a70 h VAL 422 CO 0.69 0.00 0.00 0.78 -1.01 0.00 0.00 177.57 178.03 3a70 h ASN 423 N 0.00 0.00 -0.25 3.17 -0.26 -1.97 -2.74 115.58 113.53 3a70 h ASN 423 Ca 0.15 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.89 3a70 h ASN 423 Cb 0.69 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.95 3a70 h ASN 423 CO -0.00 0.00 0.00 0.35 -1.06 0.00 0.00 177.43 176.72 3a70 n THR 424 N -2.98 0.33 -4.18 2.81 -2.24 -0.72 -4.89 114.28 102.42 3a70 n THR 424 Ca 0.00 -0.37 -0.17 0.00 -2.27 0.00 0.00 64.05 61.24 3a70 n THR 424 Cb 0.25 0.23 -0.11 0.00 -2.10 0.00 0.00 70.33 68.59 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 -1.67 1.18 0.11 4.78 0.08 -1.03 -2.55 117.98 118.88 3a70 s PHE 425 Ca 0.25 -0.52 0.05 0.00 0.12 0.00 0.00 56.93 56.82 3a70 s PHE 425 Cb 0.13 -0.65 -0.04 0.00 -0.57 0.00 0.00 43.02 41.89 3a70 s PHE 425 CO 0.18 0.05 0.01 -0.51 -0.10 0.00 0.00 175.22 174.86 3a70 s ASP 426 N -2.02 5.04 -0.03 1.36 1.01 -0.05 -4.98 116.67 117.01 3a70 s ASP 426 Ca 0.01 -0.20 0.03 0.00 0.71 0.00 0.00 52.55 53.10 3a70 s ASP 426 Cb -0.07 -1.20 0.00 0.00 1.01 0.00 0.00 42.92 42.66 3a70 s ASP 426 CO 0.02 0.15 -0.12 -0.36 0.21 0.00 0.00 175.17 175.07 3a70 s PHE 427 N -1.40 1.22 0.06 4.23 0.08 -1.26 -0.32 117.98 120.59 3a70 s PHE 427 Ca 0.26 -0.32 -0.00 0.00 0.12 0.00 0.00 56.93 56.99 3a70 s PHE 427 Cb -0.11 -0.84 -0.04 0.00 -0.57 0.00 0.00 43.02 41.45 3a70 s PHE 427 CO 0.19 -0.12 -0.04 0.00 -0.10 0.00 0.00 175.22 175.15 3a70 s ALA 428 N 0.13 0.65 -0.22 5.36 0.00 -0.41 -0.18 121.76 127.10 3a70 s ALA 428 Ca -0.03 -1.25 -0.07 0.00 0.00 0.00 0.00 51.96 50.60 3a70 s ALA 428 Cb -0.09 0.24 0.10 0.00 0.00 0.00 0.00 23.12 23.36 3a70 s ALA 428 CO 0.01 -0.33 0.45 1.21 0.00 0.00 0.00 175.76 177.10 3a70 s ASN 429 N -2.96 -0.38 0.00 0.00 3.84 -1.26 0.09 114.94 114.27 3a70 s ASN 429 Ca 0.08 1.05 0.27 0.00 0.21 0.00 0.00 52.86 54.48 3a70 s ASN 429 Cb 0.07 1.50 1.36 0.00 -0.55 0.00 0.00 41.25 43.63 3a70 s ASN 429 CO -0.08 -0.23 1.91 -0.90 -2.79 0.00 0.00 177.10 175.00 3a70 n ASP 430 N 5.40 0.70 0.00 -4.21 5.68 -1.08 -4.91 116.55 118.14 3a70 n ASP 430 Ca -0.09 -1.32 0.00 0.00 -0.50 0.00 0.00 54.79 52.89 3a70 n ASP 430 Cb 0.49 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.46 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 1.04 0.24 1.25 6.12 0.00 -1.26 -4.83 105.19 107.75 3a70 n GLY 431 Ca 0.20 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.26 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 1.00 3.56 -0.06 4.61 0.00 -1.26 -4.93 120.51 123.42 3a70 n ALA 432 Ca 0.00 -2.37 0.00 0.00 0.00 0.00 0.00 53.44 51.07 3a70 n ALA 432 Cb 0.15 -0.87 0.00 0.00 0.00 0.00 0.00 19.45 18.74 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 -0.38 0.76 3.57 0.00 0.00 -1.26 -5.06 105.19 102.83 3a70 n GLY 433 Ca 0.27 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.64 6.21 -0.26 1.61 0.01 -1.26 -4.35 114.94 114.26 3a70 s ASN 434 Ca 0.00 0.02 -0.08 0.00 -0.71 0.00 0.00 52.86 52.09 3a70 s ASN 434 Cb 0.00 -2.20 -0.03 0.00 0.41 0.00 0.00 41.25 39.43 3a70 s ASN 434 CO 0.00 -0.26 0.10 -0.22 -1.51 0.00 0.00 177.10 175.21 3a70 s LEU 435 N 2.05 3.60 -0.12 0.60 2.96 -0.63 -2.62 118.68 124.52 3a70 s LEU 435 Ca 0.13 -0.18 -0.12 0.00 -0.22 0.00 0.00 54.13 53.75 3a70 s LEU 435 Cb -0.16 -1.97 -0.05 0.00 0.50 0.00 0.00 46.19 44.51 3a70 s LEU 435 CO 0.11 -0.05 0.25 -0.31 -1.32 0.00 0.00 176.35 175.04 3a70 s TYR 436 N 1.65 3.55 -0.17 5.38 2.02 0.11 -0.91 117.35 128.98 3a70 s TYR 436 Ca 0.06 0.63 0.00 0.00 -0.37 0.00 0.00 57.07 57.39 3a70 s TYR 436 Cb -0.15 -2.20 0.03 0.00 -0.40 0.00 0.00 41.96 39.24 3a70 s TYR 436 CO 0.05 0.46 -0.11 0.08 -1.57 0.00 0.00 175.55 174.47 3a70 s VAL 437 N -0.27 1.54 -0.20 0.71 1.01 0.30 -1.29 120.40 122.20 3a70 s VAL 437 Ca 0.16 -0.79 -0.03 0.00 0.00 0.00 0.00 61.98 61.32 3a70 s VAL 437 Cb -0.13 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.69 3a70 s VAL 437 CO 0.05 0.29 -0.06 -0.60 0.00 0.00 0.00 175.10 174.78 3a70 s ARG 438 N 1.47 3.39 0.96 2.72 3.52 0.56 -0.44 118.95 131.12 3a70 s ARG 438 Ca 0.02 -0.63 -0.16 0.00 -0.13 0.00 0.00 55.73 54.83 3a70 s ARG 438 Cb -0.15 -2.93 0.19 0.00 -1.56 0.00 0.00 34.95 30.50 3a70 s ARG 438 CO -0.09 -0.10 1.28 0.16 -0.81 0.00 0.00 175.30 175.73 3a70 s ASP 439 N 1.22 3.14 0.58 -2.12 1.47 -0.14 -0.87 116.67 119.94 3a70 s ASP 439 Ca 0.03 0.40 0.37 0.00 1.18 0.00 0.00 52.55 54.52 3a70 s ASP 439 Cb -0.14 -0.55 1.67 0.00 -0.34 0.00 0.00 42.92 43.55 3a70 s ASP 439 CO -0.02 -2.73 2.09 0.00 0.68 0.00 0.00 175.17 175.19 3a70 h ALA 440 N -1.64 1.00 -0.34 2.11 0.00 -1.83 -1.67 119.26 116.89 3a70 h ALA 440 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3a70 h ALA 440 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3a70 h ALA 440 CO 0.43 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.77 3a70 n ASN 441 N -3.05 2.20 0.00 0.00 3.02 -1.26 -4.94 115.26 111.23 3a70 n ASN 441 Ca -0.00 -1.91 0.00 0.00 -0.03 0.00 0.00 54.58 52.64 3a70 n ASN 441 Cb 0.23 -0.23 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 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 1.20 1.17 3.70 7.41 0.00 -0.63 -5.03 105.19 113.01 3a70 n GLY 442 Ca 0.15 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 3a70 n GLY 442 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a70 n GLY 443 N -2.00 1.37 3.39 -0.02 0.00 -1.26 -4.75 105.19 101.92 3a70 n GLY 443 Ca 0.00 0.63 -0.33 0.00 0.00 0.00 0.00 46.02 46.31 3a70 n GLY 443 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3a70 s ILE 444 N 1.02 3.20 -0.16 -0.61 1.01 -1.10 -0.97 121.20 123.59 3a70 s ILE 444 Ca 0.76 -0.61 -0.05 0.00 0.00 0.00 0.00 60.65 60.75 3a70 s ILE 444 Cb -0.57 -2.36 -0.03 0.00 0.01 0.00 0.00 42.46 39.51 3a70 s ILE 444 CO 0.35 0.52 -0.01 -0.44 0.00 0.00 0.00 174.94 175.36 3a70 s SER 445 N 0.35 5.05 -0.28 3.58 0.01 0.41 -0.89 113.70 121.94 3a70 s SER 445 Ca -0.10 -0.07 -0.14 0.00 1.31 0.00 0.00 55.95 56.96 3a70 s SER 445 Cb -0.16 -1.84 -0.04 0.00 0.21 0.00 0.00 66.02 64.20 3a70 s SER 445 CO 0.05 0.17 0.33 -0.63 0.41 0.00 0.00 173.24 173.57 3a70 s ILE 446 N 0.37 5.20 0.03 1.44 1.01 -0.24 -0.54 121.20 128.47 3a70 s ILE 446 Ca -0.02 0.45 0.08 0.00 0.00 0.00 0.00 60.65 61.17 3a70 s ILE 446 Cb -0.14 -3.67 -0.03 0.00 0.01 0.00 0.00 42.46 38.64 3a70 s ILE 446 CO 0.02 0.16 -0.24 0.42 0.00 0.00 0.00 174.94 175.30 3a70 s THR 447 N 2.00 2.28 0.04 2.92 -4.23 -0.08 -0.83 115.64 117.74 3a70 s THR 447 Ca 0.13 -1.27 0.06 0.00 -1.18 0.00 0.00 61.69 59.43 3a70 s THR 447 Cb -0.16 -1.88 -0.02 0.00 1.34 0.00 0.00 72.50 71.78 3a70 s THR 447 CO 0.10 0.41 -0.17 -0.13 -0.54 0.00 0.00 174.62 174.30 3a70 s ARG 448 N -1.13 1.14 -1.79 3.99 0.52 -0.53 -1.60 118.95 119.54 3a70 s ARG 448 Ca 0.12 -0.82 0.00 0.00 -0.52 0.00 0.00 55.73 54.51 3a70 s ARG 448 Cb -0.10 -1.19 0.00 0.00 0.52 0.00 0.00 34.95 34.18 3a70 s ARG 448 CO 0.02 0.30 0.00 -0.25 0.02 0.00 0.00 175.30 175.39 3a70 n ASP 449 N 1.93 -5.36 -4.25 0.23 8.00 -1.26 -0.69 116.55 115.15 3a70 n ASP 449 Ca -0.17 0.21 -0.39 0.00 0.71 0.00 0.00 54.79 55.14 3a70 n ASP 449 Cb 0.54 -4.46 -0.10 0.00 -0.02 0.00 0.00 41.12 37.07 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 -2.83 4.06 -1.06 0.53 1.01 -1.26 -4.29 121.20 117.37 3a70 s ILE 450 Ca 0.00 -1.43 0.26 0.00 0.00 0.00 0.00 60.65 59.48 3a70 s ILE 450 Cb 0.00 -3.49 0.07 0.00 0.01 0.00 0.00 42.46 39.05 3a70 s ILE 450 CO 0.00 -0.48 1.52 0.61 0.00 0.00 0.00 174.94 176.59 3a70 n GLY 451 N 4.87 -1.25 3.00 6.18 0.00 -1.16 -4.79 105.19 112.04 3a70 n GLY 451 Ca -0.10 -0.31 -0.21 0.00 0.00 0.00 0.00 46.02 45.41 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 1.25 -0.12 1.61 0.01 -1.12 -1.49 113.70 110.87 3a70 s SER 452 Ca 0.13 -0.19 0.02 0.00 1.31 0.00 0.00 55.95 57.21 3a70 s SER 452 Cb 0.18 -0.34 -0.01 0.00 0.21 0.00 0.00 66.02 66.06 3a70 s SER 452 CO 0.66 0.07 -0.18 -0.63 0.41 0.00 0.00 173.24 173.56 3a70 s ILE 453 N 0.20 2.62 -0.19 1.44 -1.09 -0.07 -0.59 121.20 123.52 3a70 s ILE 453 Ca -0.03 -0.82 -0.05 0.00 -2.23 0.00 0.00 60.65 57.52 3a70 s ILE 453 Cb -0.09 -2.06 -0.03 0.00 -1.58 0.00 0.00 42.46 38.70 3a70 s ILE 453 CO 0.01 0.54 0.01 -0.69 -1.23 0.00 0.00 174.94 173.57 3a70 s VAL 454 N 0.35 4.07 0.37 2.92 1.01 0.09 0.20 120.40 129.41 3a70 s VAL 454 Ca -0.14 -0.28 0.08 0.00 0.00 0.00 0.00 61.98 61.64 3a70 s VAL 454 Cb -0.17 -2.83 -0.06 0.00 0.00 0.00 0.00 36.38 33.31 3a70 s VAL 454 CO 0.07 0.44 0.01 0.42 0.00 0.00 0.00 175.10 176.04 3a70 s THR 455 N 0.83 2.29 -0.23 3.92 -4.23 0.19 -0.02 115.64 118.38 3a70 s THR 455 Ca 0.01 -1.99 0.02 0.00 -1.18 0.00 0.00 61.69 58.55 3a70 s THR 455 Cb -0.14 -2.85 0.05 0.00 1.34 0.00 0.00 72.50 70.89 3a70 s THR 455 CO 0.02 -0.11 -0.12 -0.75 -0.54 0.00 0.00 174.62 173.13 3a70 s LYS 456 N -3.72 2.25 0.06 3.99 2.20 -0.51 -0.91 119.74 123.11 3a70 s LYS 456 Ca 0.35 -1.13 0.06 0.00 -0.36 0.00 0.00 55.97 54.88 3a70 s LYS 456 Cb 0.04 -2.72 -0.04 0.00 -1.51 0.00 0.00 37.83 33.61 3a70 s LYS 456 CO 0.19 -0.49 -0.08 -1.21 -0.36 0.00 0.00 175.35 173.39 3a70 s GLU 457 N 1.22 2.32 0.12 4.03 0.41 0.12 -1.78 118.70 125.12 3a70 s GLU 457 Ca -0.05 -0.90 -0.33 0.00 -0.41 0.00 0.00 54.97 53.29 3a70 s GLU 457 Cb -0.18 -2.39 -0.12 0.00 -1.78 0.00 0.00 34.13 29.66 3a70 s GLU 457 CO -0.07 0.55 1.75 -0.35 -0.49 0.00 0.00 175.26 176.65 3a70 n PRO 458 N 1.05 2.53 0.00 0.39 -0.04 -1.26 -0.47 135.00 137.19 3a70 n PRO 458 Ca -0.14 0.92 0.00 0.00 -0.04 0.00 0.00 63.50 64.24 3a70 n PRO 458 Cb 0.52 -2.76 0.00 0.00 -0.04 0.00 0.00 33.50 31.22 3a70 n PRO 458 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3a70 n GLY 459 N 3.99 3.33 3.73 0.55 0.00 0.14 -4.68 105.19 112.26 3a70 n GLY 459 Ca 0.18 -0.65 -0.37 0.00 0.00 0.00 0.00 46.02 45.18 3a70 n GLY 459 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3a70 s PHE 460 N 4.00 2.11 -1.17 1.61 0.40 -1.23 -1.22 117.98 122.49 3a70 s PHE 460 Ca 0.00 1.49 -0.04 0.00 -0.60 0.00 0.00 56.93 57.78 3a70 s PHE 460 Cb 0.00 -3.67 -0.02 0.00 0.51 0.00 0.00 43.02 39.84 3a70 s PHE 460 CO 0.00 -2.85 0.90 1.28 0.70 0.00 0.00 175.22 175.25 3a70 n LEU 461 N -1.88 -4.30 -3.74 -0.37 4.77 -1.26 -1.05 117.00 109.16 3a70 n LEU 461 Ca 0.16 -0.72 -0.28 0.00 -0.03 0.00 0.00 56.01 55.13 3a70 n LEU 461 Cb 0.48 -3.01 0.03 0.00 -2.33 0.00 0.00 43.42 38.59 3a70 n LEU 461 CO 0.47 0.30 0.10 0.79 -1.33 0.00 0.00 177.39 177.72 3a70 n TRP 462 N -3.86 -2.29 -0.42 -1.77 8.01 -1.22 -1.83 117.44 114.06 3a70 n TRP 462 Ca -0.20 0.84 0.00 0.00 -1.31 0.00 0.00 57.50 56.82 3a70 n TRP 462 Cb 0.65 -4.02 0.00 0.00 -2.01 0.00 0.00 31.31 25.93 3a70 n TRP 462 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3a70 n GLY 463 N -1.66 0.73 0.13 6.99 0.00 -0.36 -4.93 105.19 106.10 3a70 n GLY 463 Ca 0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 3a70 n GLY 463 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3a70 h LEU 464 N 0.00 -0.26-10.16 0.99 5.85 -1.28 -3.43 115.31 107.01 3a70 h LEU 464 Ca 0.00 0.07 -0.49 0.00 0.84 0.00 0.00 57.88 58.29 3a70 h LEU 464 Cb 0.00 0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 3a70 h LEU 464 CO 0.00 -0.10 -0.28 -0.36 -0.34 0.00 0.00 178.44 177.35 3a70 s PHE 465 N -6.19 3.48 -0.03 1.25 0.08 -0.21 -4.98 117.98 111.39 3a70 s PHE 465 Ca -0.14 0.29 0.07 0.00 0.12 0.00 0.00 56.93 57.27 3a70 s PHE 465 Cb 0.10 -1.83 -0.02 0.00 -0.57 0.00 0.00 43.02 40.71 3a70 s PHE 465 CO 0.68 0.27 -0.24 0.15 -0.10 0.00 0.00 175.22 175.99 3a70 s LYS 466 N -3.89 2.02 -0.14 0.44 -0.14 -1.26 0.29 119.74 117.06 3a70 s LYS 466 Ca 0.38 -0.85 -0.07 0.00 -1.36 0.00 0.00 55.97 54.08 3a70 s LYS 466 Cb -0.10 -1.90 -0.04 0.00 -1.68 0.00 0.00 37.83 34.11 3a70 s LYS 466 CO 0.32 0.48 0.10 -0.51 -0.76 0.00 0.00 175.35 174.98 3a70 s ASP 467 N -0.47 6.03 -0.21 2.83 1.01 0.38 -4.80 116.67 121.44 3a70 s ASP 467 Ca 0.07 0.31 -0.16 0.00 0.71 0.00 0.00 52.55 53.47 3a70 s ASP 467 Cb -0.10 -1.96 -0.04 0.00 1.01 0.00 0.00 42.92 41.84 3a70 s ASP 467 CO -0.00 0.32 0.41 -1.81 0.21 0.00 0.00 175.17 174.30 3a70 s ASP 468 N -0.52 6.42 -0.15 0.27 1.01 -1.26 -0.71 116.67 121.74 3a70 s ASP 468 Ca 0.11 0.50 0.02 0.00 0.71 0.00 0.00 52.55 53.89 3a70 s ASP 468 Cb -0.12 -2.23 0.01 0.00 1.01 0.00 0.00 42.92 41.59 3a70 s ASP 468 CO 0.02 -0.11 -0.21 -0.69 0.21 0.00 0.00 175.17 174.39 3a70 s VAL 469 N 1.48 2.02 -0.34 -1.27 1.01 -0.09 -4.98 120.40 118.24 3a70 s VAL 469 Ca 0.19 -0.95 -0.14 0.00 0.00 0.00 0.00 61.98 61.09 3a70 s VAL 469 Cb -0.15 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 3a70 s VAL 469 CO 0.08 0.54 0.29 -0.89 0.00 0.00 0.00 175.10 175.12 3a70 s THR 470 N 0.96 5.24 -0.09 3.92 2.01 -1.26 -0.64 115.64 125.78 3a70 s THR 470 Ca -0.04 -0.07 -0.08 0.00 0.31 0.00 0.00 61.69 61.82 3a70 s THR 470 Cb -0.15 -3.75 -0.04 0.00 0.01 0.00 0.00 72.50 68.57 3a70 s THR 470 CO -0.05 -0.03 0.18 -1.00 -0.69 0.00 0.00 174.62 173.04 3a70 s HIS 471 N 1.86 3.61 -0.08 4.92 3.76 0.13 -4.61 115.29 124.88 3a70 s HIS 471 Ca 0.09 0.59 -0.15 0.00 -0.15 0.00 0.00 55.06 55.43 3a70 s HIS 471 Cb -0.17 -1.98 -0.05 0.00 1.11 0.00 0.00 32.58 31.49 3a70 s HIS 471 CO 0.11 0.72 0.39 -1.12 -0.85 0.00 0.00 174.74 173.99 3a70 s SER 472 N -1.11 6.67 -0.29 1.40 0.01 0.83 -0.89 113.70 120.32 3a70 s SER 472 Ca 0.17 0.80 -0.29 0.00 1.31 0.00 0.00 55.95 57.94 3a70 s SER 472 Cb -0.13 -2.24 0.01 0.00 0.21 0.00 0.00 66.02 63.88 3a70 s SER 472 CO 0.07 0.17 1.09 -0.69 0.41 0.00 0.00 173.24 174.29 3a70 s VAL 473 N -0.19 4.51 0.38 3.43 1.01 -0.56 -0.27 120.40 128.71 3a70 s VAL 473 Ca 0.22 1.77 0.04 0.00 0.00 0.00 0.00 61.98 64.01 3a70 s VAL 473 Cb -0.15 -4.35 -0.04 0.00 0.00 0.00 0.00 36.38 31.83 3a70 s VAL 473 CO 0.10 -0.39 0.08 0.42 0.00 0.00 0.00 175.10 175.31 3a70 s THR 474 N 3.59 0.97 0.39 3.92 -4.23 -0.17 -4.96 115.64 115.15 3a70 s THR 474 Ca 0.46 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 59.03 3a70 s THR 474 Cb -0.14 -2.57 0.25 0.00 1.34 0.00 0.00 72.50 71.38 3a70 s THR 474 CO 0.14 0.00 2.03 0.00 -0.54 0.00 0.00 174.62 176.24 3a70 h ALA 475 N 1.91 1.63 -0.02 3.99 0.00 -2.03 -3.10 119.26 121.64 3a70 h ALA 475 Ca -0.39 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3a70 h ALA 475 Cb 1.26 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3a70 h ALA 475 CO 0.65 0.32 -0.10 -1.13 0.00 0.00 0.00 179.25 178.99 3a70 n SER 476 N -4.44 2.17 0.00 0.00 3.41 -1.26 -5.01 113.62 108.49 3a70 n SER 476 Ca 0.03 -1.65 0.00 0.00 -0.26 0.00 0.00 58.87 56.99 3a70 n SER 476 Cb 0.08 0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 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 1.31 0.61 3.74 5.00 0.00 -1.17 -4.29 105.19 110.38 3a70 n GLY 477 Ca 0.15 -1.76 -0.38 0.00 0.00 0.00 0.00 46.02 44.03 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 4.31 -0.09 0.99 1.43 0.08 -1.00 118.68 124.39 3a70 s LEU 478 Ca 0.00 0.78 0.03 0.00 -1.03 0.00 0.00 54.13 53.91 3a70 s LEU 478 Cb 0.00 -2.61 0.01 0.00 0.03 0.00 0.00 46.19 43.61 3a70 s LEU 478 CO 0.00 0.08 -0.19 -0.75 0.23 0.00 0.00 176.35 175.72 3a70 s LYS 479 N 0.28 2.54 -0.27 1.70 2.20 0.63 -0.13 119.74 126.70 3a70 s LYS 479 Ca 0.24 -0.70 0.00 0.00 -0.36 0.00 0.00 55.97 55.15 3a70 s LYS 479 Cb -0.15 -2.00 0.08 0.00 -1.51 0.00 0.00 37.83 34.25 3a70 s LYS 479 CO 0.10 0.09 0.03 0.08 -0.36 0.00 0.00 175.35 175.28 3a70 s VAL 480 N 0.56 1.24 0.00 4.02 1.01 -0.53 -0.12 120.40 126.58 3a70 s VAL 480 Ca -0.15 -1.36 0.00 0.00 0.00 0.00 0.00 61.98 60.47 3a70 s VAL 480 Cb -0.17 -1.77 0.00 0.00 0.00 0.00 0.00 36.38 34.45 3a70 s VAL 480 CO 0.05 -0.41 0.00 0.61 0.00 0.00 0.00 175.10 175.35 3a70 n GLY 481 N 4.73 3.85 0.01 4.51 0.00 -1.26 -1.41 105.19 115.63 3a70 n GLY 481 Ca -0.05 -0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.09 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 7.46 0.33 -4.66 1.61 3.41 -1.26 -4.87 113.62 115.63 3a70 n SER 482 Ca 0.00 0.17 -0.40 0.00 -0.26 0.00 0.00 58.87 58.37 3a70 n SER 482 Cb 0.00 -0.16 -0.06 0.00 -0.26 0.00 0.00 64.21 63.74 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 -3.24 6.73 -0.21 4.04 0.01 -0.50 -5.03 114.94 116.75 3a70 s ASN 483 Ca 0.12 0.89 -0.03 0.00 -0.71 0.00 0.00 52.86 53.12 3a70 s ASN 483 Cb 0.17 -2.36 -0.01 0.00 0.41 0.00 0.00 41.25 39.46 3a70 s ASN 483 CO 0.62 -0.29 -0.06 -0.69 -1.51 0.00 0.00 177.10 175.17 3a70 s VAL 484 N 1.91 3.26 -0.42 1.60 1.01 -1.26 -1.46 120.40 125.04 3a70 s VAL 484 Ca 0.30 -0.54 -0.21 0.00 0.00 0.00 0.00 61.98 61.53 3a70 s VAL 484 Cb -0.16 -2.46 0.02 0.00 0.00 0.00 0.00 36.38 33.78 3a70 s VAL 484 CO 0.11 0.44 0.66 -0.89 0.00 0.00 0.00 175.10 175.42 3a70 s THR 485 N 1.31 4.82 0.44 3.92 2.01 0.82 -4.94 115.64 124.02 3a70 s THR 485 Ca 0.04 0.23 -0.26 0.00 0.31 0.00 0.00 61.69 62.01 3a70 s THR 485 Cb -0.14 -4.20 -0.09 0.00 0.01 0.00 0.00 72.50 68.08 3a70 s THR 485 CO -0.03 -0.56 1.43 -1.58 -0.69 0.00 0.00 174.62 173.19 3a70 s GLN 486 N 2.86 3.74 0.61 4.92 2.00 -1.26 -0.74 119.66 131.79 3a70 s GLN 486 Ca 0.24 2.44 -0.16 0.00 -2.00 0.00 0.00 55.36 55.88 3a70 s GLN 486 Cb -0.14 -2.70 -0.03 0.00 0.80 0.00 0.00 33.01 30.95 3a70 s GLN 486 CO 0.19 -0.78 1.09 0.71 -0.50 0.00 0.00 175.29 176.00 3a70 s TYR 487 N -1.19 2.80 0.62 1.67 2.02 -1.26 -4.71 117.35 117.30 3a70 s TYR 487 Ca 0.60 1.53 -0.19 0.00 -0.37 0.00 0.00 57.07 58.65 3a70 s TYR 487 Cb -0.44 -3.11 -0.02 0.00 -0.40 0.00 0.00 41.96 37.99 3a70 s TYR 487 CO 0.57 -1.39 1.28 -0.51 -1.57 0.00 0.00 175.55 173.93 3a70 s ASP 488 N -2.54 4.82 0.25 2.29 1.11 0.75 -4.89 116.67 118.44 3a70 s ASP 488 Ca 0.66 2.59 -0.31 0.00 0.18 0.00 0.00 52.55 55.68 3a70 s ASP 488 Cb -0.19 -2.62 -0.14 0.00 1.07 0.00 0.00 42.92 41.05 3a70 s ASP 488 CO 0.37 -1.86 1.26 0.00 1.18 0.00 0.00 175.17 176.12 3a70 n ALA 489 N -1.72 0.44 -2.81 5.23 0.00 -1.26 -4.86 120.51 115.53 3a70 n ALA 489 Ca 0.15 0.41 -0.15 0.00 0.00 0.00 0.00 53.44 53.86 3a70 n ALA 489 Cb 0.48 -2.17 -0.12 0.00 0.00 0.00 0.00 19.45 17.64 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 -0.01 0.92 -0.16 0.00 0.01 -1.26 -1.53 113.70 111.67 3a70 s SER 490 Ca 0.66 -0.45 0.00 0.00 1.31 0.00 0.00 55.95 57.47 3a70 s SER 490 Cb -0.70 -0.00 0.00 0.00 0.21 0.00 0.00 66.02 65.53 3a70 s SER 490 CO 0.54 -0.12 -0.15 -0.69 0.41 0.00 0.00 173.24 173.22 3a70 s VAL 491 N -1.06 2.61 -0.19 3.43 1.01 -0.55 -4.94 120.40 120.72 3a70 s VAL 491 Ca -0.06 -0.78 -0.07 0.00 0.00 0.00 0.00 61.98 61.06 3a70 s VAL 491 Cb -0.08 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 3a70 s VAL 491 CO 0.00 0.51 0.06 -0.54 0.00 0.00 0.00 175.10 175.14 3a70 s LYS 492 N 0.89 3.96 0.00 2.72 1.02 -1.26 -0.95 119.74 126.11 3a70 s LYS 492 Ca -0.04 -0.35 0.00 0.00 0.02 0.00 0.00 55.97 55.60 3a70 s LYS 492 Cb -0.15 -3.22 0.00 0.00 -0.52 0.00 0.00 37.83 33.94 3a70 s LYS 492 CO -0.01 0.25 0.00 0.41 -0.92 0.00 0.00 175.35 175.07 3a70 n GLY 493 N 3.61 0.72 3.23 -3.33 0.00 0.18 -4.98 105.19 104.63 3a70 n GLY 493 Ca -0.17 -1.52 -0.14 0.00 0.00 0.00 0.00 46.02 44.19 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 0.07 0.01 -2.00 2.61 -4.23 -1.25 -4.96 115.64 105.90 3a70 s THR 494 Ca 0.00 -2.00 0.12 0.00 -1.18 0.00 0.00 61.69 58.63 3a70 s THR 494 Cb 0.00 -2.50 0.33 0.00 1.34 0.00 0.00 72.50 71.67 3a70 s THR 494 CO 0.00 0.00 1.26 0.59 -0.54 0.00 0.00 174.62 175.93 3a70 n ASN 495 N -0.64 0.00 -3.66 3.99 5.03 -1.26 -4.04 115.26 114.68 3a70 n ASN 495 Ca 0.04 -1.14 -0.14 0.00 0.87 0.00 0.00 54.58 54.21 3a70 n ASN 495 Cb 0.65 0.00 0.01 0.00 -1.02 0.00 0.00 39.78 39.42 3a70 n ASN 495 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3a70 n GLY 496 N 0.38 2.56 3.72 7.41 0.00 -1.25 -3.75 105.19 114.24 3a70 n GLY 496 Ca 0.09 -2.22 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 3a70 n GLY 496 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a70 s ALA 497 N -2.44 3.45 0.08 4.61 0.00 -1.26 -4.48 121.76 121.73 3a70 s ALA 497 Ca 0.24 0.94 0.05 0.00 0.00 0.00 0.00 51.96 53.19 3a70 s ALA 497 Cb -0.02 -3.47 -0.03 0.00 0.00 0.00 0.00 23.12 19.60 3a70 s ALA 497 CO 0.15 -0.47 -0.14 -0.51 0.00 0.00 0.00 175.76 174.79 3a70 s ASP 498 N 0.93 1.71 -0.17 0.00 1.01 -1.26 -5.00 116.67 113.90 3a70 s ASP 498 Ca 0.59 -0.68 -0.02 0.00 0.71 0.00 0.00 52.55 53.16 3a70 s ASP 498 Cb -0.32 -0.05 -0.01 0.00 1.01 0.00 0.00 42.92 43.55 3a70 s ASP 498 CO 0.31 -0.11 -0.10 -0.89 0.21 0.00 0.00 175.17 174.59 3a70 s THR 499 N -1.58 3.16 -0.07 -1.27 2.01 -1.26 0.34 115.64 116.96 3a70 s THR 499 Ca 0.01 -0.60 0.02 0.00 0.31 0.00 0.00 61.69 61.43 3a70 s THR 499 Cb -0.08 -2.37 0.02 0.00 0.01 0.00 0.00 72.50 70.07 3a70 s THR 499 CO 0.02 0.49 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.57 3a70 s LEU 500 N 0.85 1.55 -0.14 4.42 1.43 0.00 -4.99 118.68 121.81 3a70 s LEU 500 Ca -0.03 -0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 52.77 3a70 s LEU 500 Cb -0.15 -0.81 -0.01 0.00 0.03 0.00 0.00 46.19 45.24 3a70 s LEU 500 CO 0.01 0.00 -0.12 -0.54 0.23 0.00 0.00 176.35 175.93 3a70 s LYS 501 N 0.86 3.40 0.34 1.70 1.02 -1.26 -0.27 119.74 125.53 3a70 s LYS 501 Ca -0.11 -0.67 -0.26 0.00 0.02 0.00 0.00 55.97 54.95 3a70 s LYS 501 Cb -0.15 -2.67 -0.10 0.00 -0.52 0.00 0.00 37.83 34.39 3a70 s LYS 501 CO 0.01 0.19 0.97 0.00 -0.92 0.00 0.00 175.35 175.60 3a70 s ALA 502 N 0.43 3.19 0.74 5.17 0.00 0.13 -4.94 121.76 126.48 3a70 s ALA 502 Ca -0.09 0.57 -0.11 0.00 0.00 0.00 0.00 51.96 52.32 3a70 s ALA 502 Cb -0.16 -3.21 0.04 0.00 0.00 0.00 0.00 23.12 19.79 3a70 s ALA 502 CO 0.05 0.09 1.08 -1.01 0.00 0.00 0.00 175.76 175.96 3a70 s HIS 503 N -1.62 3.00 0.07 0.00 0.09 -1.26 -4.39 115.29 111.18 3a70 s HIS 503 Ca 0.52 1.27 0.33 0.00 -0.00 0.00 0.00 55.06 57.17 3a70 s HIS 503 Cb -0.19 -3.00 1.53 0.00 -0.00 0.00 0.00 32.58 30.91 3a70 s HIS 503 CO 0.25 -1.48 1.98 0.00 -0.00 0.00 0.00 174.74 175.49 3a70 h ALA 504 N -0.88 1.00 0.00 -1.40 0.00 -1.97 -2.55 119.26 113.45 3a70 h ALA 504 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3a70 h ALA 504 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3a70 h ALA 504 CO 0.58 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.24 3a70 n GLY 505 N -0.45 -1.59 0.00 0.00 0.00 -1.26 -2.49 105.19 99.41 3a70 n GLY 505 Ca -0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 1.12 2.51 3.15 -0.02 0.00 -0.96 -4.32 105.19 106.67 3a70 n GLY 506 Ca 0.05 -1.43 -0.11 0.00 0.00 0.00 0.00 46.02 44.53 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 0.00 1.13 -0.20 1.61 1.01 -1.26 -4.75 116.67 114.22 3a70 s ASP 507 Ca 0.00 -0.91 -0.23 0.00 0.71 0.00 0.00 52.55 52.13 3a70 s ASP 507 Cb 0.00 0.07 -0.02 0.00 1.01 0.00 0.00 42.92 43.99 3a70 s ASP 507 CO 0.00 -0.40 0.73 0.26 0.21 0.00 0.00 175.17 175.97 3a70 s TRP 508 N -3.10 3.37 -0.36 4.23 0.52 -0.58 -1.23 118.94 121.79 3a70 s TRP 508 Ca 0.07 1.06 -0.08 0.00 0.02 0.00 0.00 56.10 57.17 3a70 s TRP 508 Cb 0.02 -2.91 0.04 0.00 -1.15 0.00 0.00 33.47 29.46 3a70 s TRP 508 CO -0.03 -0.25 0.15 -0.51 0.02 0.00 0.00 176.95 176.33 3a70 s LEU 509 N 2.19 4.51 -0.55 2.99 1.43 0.31 -1.48 118.68 128.08 3a70 s LEU 509 Ca 0.33 -1.12 -0.13 0.00 -1.03 0.00 0.00 54.13 52.17 3a70 s LEU 509 Cb -0.16 -1.93 0.14 0.00 0.03 0.00 0.00 46.19 44.27 3a70 s LEU 509 CO 0.10 -0.36 0.48 -0.36 0.23 0.00 0.00 176.35 176.44 3a70 s PHE 510 N 1.45 3.35 0.16 0.29 0.08 -0.12 -1.21 117.98 121.98 3a70 s PHE 510 Ca -0.00 -1.56 -0.11 0.00 0.12 0.00 0.00 56.93 55.37 3a70 s PHE 510 Cb -0.20 -3.70 0.02 0.00 -0.57 0.00 0.00 43.02 38.57 3a70 s PHE 510 CO 0.04 -1.01 1.58 0.78 -0.10 0.00 0.00 175.22 176.51 3a70 h GLY 511 N 8.61 1.03 0.00 4.36 0.00 -1.44 0.51 103.07 116.15 3a70 h GLY 511 Ca -0.23 -0.83 0.00 0.00 0.00 0.00 0.00 47.33 46.27 3a70 h GLY 511 CO 0.95 0.76 0.00 1.04 0.00 0.00 0.00 176.54 179.30 3a70 n LEU 512 N -4.21 0.00 -4.67 3.11 4.77 -1.22 -3.79 117.00 110.99 3a70 n LEU 512 Ca 0.01 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.70 3a70 n LEU 512 Cb 0.39 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.65 3a70 n LEU 512 CO 0.44 -0.38 0.64 -1.81 -1.33 0.00 0.00 177.39 174.95 3a70 s ASP 513 N -4.00 2.74 0.00 -1.43 1.01 -1.26 -3.76 116.67 109.97 3a70 s ASP 513 Ca 0.00 1.41 0.00 0.00 0.71 0.00 0.00 52.55 54.67 3a70 s ASP 513 Cb 0.00 -2.08 0.00 0.00 1.01 0.00 0.00 42.92 41.85 3a70 s ASP 513 CO 0.00 -3.09 0.00 0.61 0.21 0.00 0.00 175.17 172.90 3a70 n GLY 514 N -0.77 -0.06 3.48 0.21 0.00 -1.22 -3.87 105.19 102.95 3a70 n GLY 514 Ca 0.06 -1.76 -0.43 0.00 0.00 0.00 0.00 46.02 43.89 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 -2.09 6.27 0.17 1.61 0.01 -1.26 -4.15 114.94 115.49 3a70 s ASN 515 Ca 0.00 -0.68 0.05 0.00 -0.71 0.00 0.00 52.86 51.52 3a70 s ASN 515 Cb 0.00 -2.34 -0.04 0.00 0.41 0.00 0.00 41.25 39.29 3a70 s ASN 515 CO 0.00 -0.97 0.16 -1.81 -1.51 0.00 0.00 177.10 172.96 3a70 s ASP 516 N 2.65 5.62 -0.34 -1.22 -0.00 -1.21 -4.00 116.67 118.17 3a70 s ASP 516 Ca 0.20 -0.10 -0.06 0.00 -0.00 0.00 0.00 52.55 52.60 3a70 s ASP 516 Cb -0.17 -1.50 0.04 0.00 -0.00 0.00 0.00 42.92 41.30 3a70 s ASP 516 CO 0.15 0.06 0.10 -2.28 -0.00 0.00 0.00 175.17 173.20 3a70 s HIS 517 N -1.76 3.26 -0.31 4.23 2.46 0.15 -0.47 115.29 122.85 3a70 s HIS 517 Ca 0.31 -1.46 -0.08 0.00 0.47 0.00 0.00 55.06 54.31 3a70 s HIS 517 Cb -0.10 -2.28 0.01 0.00 -0.13 0.00 0.00 32.58 30.09 3a70 s HIS 517 CO 0.24 -0.74 0.11 -0.51 -2.47 0.00 0.00 174.74 171.38 3a70 s LEU 518 N 1.39 4.07 -0.39 8.88 1.02 0.14 -0.82 118.68 132.98 3a70 s LEU 518 Ca -0.02 -0.78 -0.13 0.00 0.02 0.00 0.00 54.13 53.23 3a70 s LEU 518 Cb -0.20 -1.92 0.02 0.00 0.02 0.00 0.00 46.19 44.12 3a70 s LEU 518 CO 0.03 -0.24 0.25 -0.63 0.02 0.00 0.00 176.35 175.78 3a70 s ILE 519 N 1.51 4.89 0.84 -0.59 1.01 0.63 -1.24 121.20 128.26 3a70 s ILE 519 Ca 0.02 -0.76 -0.12 0.00 0.00 0.00 0.00 60.65 59.80 3a70 s ILE 519 Cb -0.18 -3.72 0.10 0.00 0.01 0.00 0.00 42.46 38.67 3a70 s ILE 519 CO 0.04 -0.26 1.11 -0.83 0.00 0.00 0.00 174.94 174.99 3a70 s GLY 520 N 1.61 1.61 0.00 6.18 0.00 0.19 -0.70 107.32 116.21 3a70 s GLY 520 Ca 0.03 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.46 3a70 s GLY 520 CO 0.08 0.18 0.00 0.61 0.00 0.00 0.00 173.10 173.97 3a70 n GLY 521 N -2.05 4.19 0.20 0.20 0.00 -1.21 -4.40 105.19 102.13 3a70 n GLY 521 Ca 0.07 -2.15 0.14 0.00 0.00 0.00 0.00 46.02 44.08 3a70 n GLY 521 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3a70 h VAL 522 N 0.56 0.00 -3.86 1.61 -1.51 -1.77 -3.25 116.25 108.02 3a70 h VAL 522 Ca 0.00 -0.32 -0.44 0.00 -1.23 0.00 0.00 66.70 64.71 3a70 h VAL 522 Cb 0.00 1.16 0.17 0.00 -2.13 0.00 0.00 31.29 30.49 3a70 h VAL 522 CO 0.00 0.00 0.29 -0.83 -1.23 0.00 0.00 177.57 175.80 3a70 s GLY 523 N -3.81 1.67 -0.59 5.19 0.00 -1.04 -2.62 107.32 106.13 3a70 s GLY 523 Ca 0.02 -1.00 -0.25 0.00 0.00 0.00 0.00 44.72 43.50 3a70 s GLY 523 CO 0.44 -0.22 1.00 -1.31 0.00 0.00 0.00 173.10 173.02 3a70 s ASN 524 N -4.38 6.31 0.19 1.64 0.01 -1.26 -4.30 114.94 113.16 3a70 s ASN 524 Ca 0.71 -0.41 0.04 0.00 -0.71 0.00 0.00 52.86 52.49 3a70 s ASN 524 Cb -0.08 -2.46 -0.03 0.00 0.41 0.00 0.00 41.25 39.09 3a70 s ASN 524 CO 0.54 -1.34 0.29 -1.81 -1.51 0.00 0.00 177.10 173.27 3a70 s ASP 525 N 3.06 6.17 -0.20 -1.22 1.01 -1.26 -4.04 116.67 120.18 3a70 s ASP 525 Ca 0.31 0.06 0.02 0.00 0.71 0.00 0.00 52.55 53.64 3a70 s ASP 525 Cb -0.12 -1.79 0.03 0.00 1.01 0.00 0.00 42.92 42.05 3a70 s ASP 525 CO 0.18 -0.00 -0.16 -0.69 0.21 0.00 0.00 175.17 174.71 3a70 s VAL 526 N -1.87 2.02 -0.21 -1.27 1.01 -0.37 -0.80 120.40 118.91 3a70 s VAL 526 Ca 0.34 -1.14 -0.11 0.00 0.00 0.00 0.00 61.98 61.07 3a70 s VAL 526 Cb -0.10 -1.95 -0.05 0.00 0.00 0.00 0.00 36.38 34.28 3a70 s VAL 526 CO 0.28 0.32 0.16 -0.36 0.00 0.00 0.00 175.10 175.50 3a70 s PHE 527 N 1.26 3.38 -0.49 5.22 0.08 0.25 -0.53 117.98 127.15 3a70 s PHE 527 Ca 0.00 0.32 0.03 0.00 0.12 0.00 0.00 56.93 57.40 3a70 s PHE 527 Cb -0.15 -2.22 0.16 0.00 -0.57 0.00 0.00 43.02 40.23 3a70 s PHE 527 CO -0.10 0.20 0.33 0.08 -0.10 0.00 0.00 175.22 175.63 3a70 s VAL 528 N 0.65 1.31 0.38 -0.44 1.01 -0.35 -0.54 120.40 122.42 3a70 s VAL 528 Ca 0.09 -2.93 0.16 0.00 0.00 0.00 0.00 61.98 59.29 3a70 s VAL 528 Cb -0.12 -1.90 0.37 0.00 0.00 0.00 0.00 36.38 34.73 3a70 s VAL 528 CO 0.01 -1.04 1.78 1.23 0.00 0.00 0.00 175.10 177.08 3a70 h GLY 529 N 6.08 1.28 0.00 4.51 0.00 -1.78 -1.61 103.07 111.55 3a70 h GLY 529 Ca 0.12 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.22 3a70 h GLY 529 CO 0.48 -0.11 0.00 0.61 0.00 0.00 0.00 176.54 177.53 3a70 n GLY 530 N -1.45 -2.05 3.68 4.60 0.00 -1.26 -3.41 105.19 105.29 3a70 n GLY 530 Ca 0.24 -1.42 -0.32 0.00 0.00 0.00 0.00 46.02 44.52 3a70 n GLY 530 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a70 s ALA 531 N -1.00 1.54 0.00 4.61 0.00 -1.25 -4.65 121.76 121.01 3a70 s ALA 531 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.63 3a70 s ALA 531 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.65 3a70 s ALA 531 CO 0.00 -2.68 0.00 0.41 0.00 0.00 0.00 175.76 173.49 3a70 n GLY 532 N 0.32 -0.57 3.49 0.00 0.00 -1.26 -3.45 105.19 103.71 3a70 n GLY 532 Ca 0.12 -1.76 -0.40 0.00 0.00 0.00 0.00 46.02 43.98 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 -1.54 5.90 -0.04 1.61 0.01 -1.26 -4.11 114.94 115.51 3a70 s ASN 533 Ca 0.00 -0.53 0.05 0.00 -0.71 0.00 0.00 52.86 51.67 3a70 s ASN 533 Cb 0.00 -2.09 -0.02 0.00 0.41 0.00 0.00 41.25 39.54 3a70 s ASN 533 CO 0.00 -0.25 -0.19 -1.81 -1.51 0.00 0.00 177.10 173.34 3a70 s ASP 534 N 1.68 3.65 -0.21 -1.22 1.01 -1.24 -3.35 116.67 116.98 3a70 s ASP 534 Ca 0.05 -0.30 -0.07 0.00 0.71 0.00 0.00 52.55 52.94 3a70 s ASP 534 Cb -0.18 -0.69 -0.03 0.00 1.01 0.00 0.00 42.92 43.04 3a70 s ASP 534 CO 0.09 0.33 0.06 -0.22 0.21 0.00 0.00 175.17 175.64 3a70 s LEU 535 N -0.65 3.55 -0.19 1.23 2.96 0.38 -0.88 118.68 125.09 3a70 s LEU 535 Ca 0.10 -0.09 -0.02 0.00 -0.22 0.00 0.00 54.13 53.90 3a70 s LEU 535 Cb -0.11 -1.92 0.06 0.00 0.50 0.00 0.00 46.19 44.72 3a70 s LEU 535 CO 0.00 0.07 0.02 -0.04 -1.32 0.00 0.00 176.35 175.07 3a70 s MET 536 N 1.01 0.84 -0.18 1.98 -1.94 -0.17 0.29 119.30 121.13 3a70 s MET 536 Ca 0.04 -0.49 -0.07 0.00 -1.71 0.00 0.00 55.69 53.46 3a70 s MET 536 Cb -0.14 -2.12 -0.04 0.00 2.01 0.00 0.00 34.83 34.54 3a70 s MET 536 CO 0.03 -0.61 0.05 -1.21 -0.01 0.00 0.00 175.02 173.27 3a70 s GLU 537 N 1.78 3.92 0.06 2.03 2.02 -0.37 -1.71 118.70 126.43 3a70 s GLU 537 Ca -0.01 -0.37 -0.23 0.00 0.02 0.00 0.00 54.97 54.38 3a70 s GLU 537 Cb -0.17 -3.19 -0.10 0.00 0.10 0.00 0.00 34.13 30.77 3a70 s GLU 537 CO -0.08 0.24 1.36 1.03 0.02 0.00 0.00 175.26 177.83 3a70 h SER 538 N 6.80 -0.97 0.00 -0.19 0.87 -1.31 0.53 113.55 119.28 3a70 h SER 538 Ca -0.36 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 3a70 h SER 538 Cb 1.17 0.34 0.00 0.00 -0.44 0.00 0.00 62.40 63.47 3a70 h SER 538 CO 0.68 -0.39 0.00 0.61 -0.53 0.00 0.00 176.83 177.20 3a70 n GLY 539 N -1.34 0.83 0.00 5.77 0.00 -1.26 -3.31 105.19 105.88 3a70 n GLY 539 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.30 0.00 -0.02 0.00 -1.23 -3.24 105.19 96.40 3a70 n GLY 540 Ca 0.00 -2.18 0.00 0.00 0.00 0.00 0.00 46.02 43.84 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 -0.25 -1.29 3.34 -0.02 0.00 -1.08 -4.48 105.19 101.40 3a70 n GLY 541 Ca 0.00 -1.54 -0.45 0.00 0.00 0.00 0.00 46.02 44.02 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 -1.07 3.60 0.14 4.61 0.00 -1.26 -4.80 121.76 122.98 3a70 s ALA 542 Ca 0.00 -2.37 0.03 0.00 0.00 0.00 0.00 51.96 49.62 3a70 s ALA 542 Cb 0.00 -3.17 -0.04 0.00 0.00 0.00 0.00 23.12 19.92 3a70 s ALA 542 CO 0.00 -1.90 0.24 -0.51 0.00 0.00 0.00 175.76 173.60 3a70 s ASP 543 N 3.16 6.17 -0.09 0.00 1.01 -1.26 -4.12 116.67 121.54 3a70 s ASP 543 Ca 0.03 0.12 0.03 0.00 0.71 0.00 0.00 52.55 53.45 3a70 s ASP 543 Cb -0.28 -1.82 0.00 0.00 1.01 0.00 0.00 42.92 41.84 3a70 s ASP 543 CO 0.04 0.07 -0.20 -0.89 0.21 0.00 0.00 175.17 174.40 3a70 s THR 544 N -1.71 1.78 -0.21 -1.27 2.01 0.02 -1.09 115.64 115.17 3a70 s THR 544 Ca 0.34 -0.85 -0.02 0.00 0.31 0.00 0.00 61.69 61.46 3a70 s THR 544 Cb -0.11 -1.55 0.00 0.00 0.01 0.00 0.00 72.50 70.85 3a70 s THR 544 CO 0.27 0.50 -0.08 -0.36 -0.69 0.00 0.00 174.62 174.26 3a70 s PHE 545 N 0.44 2.93 -0.17 4.92 0.08 -0.17 0.87 117.98 126.89 3a70 s PHE 545 Ca -0.18 -1.19 -0.07 0.00 0.12 0.00 0.00 56.93 55.62 3a70 s PHE 545 Cb -0.17 -2.06 -0.04 0.00 -0.57 0.00 0.00 43.02 40.18 3a70 s PHE 545 CO 0.07 -0.63 0.07 -1.17 -0.10 0.00 0.00 175.22 173.46 3a70 s LEU 546 N 1.41 3.89 -0.11 -0.37 2.96 0.30 -1.46 118.68 125.30 3a70 s LEU 546 Ca 0.05 0.14 0.01 0.00 -0.22 0.00 0.00 54.13 54.10 3a70 s LEU 546 Cb -0.14 -1.97 0.02 0.00 0.50 0.00 0.00 46.19 44.59 3a70 s LEU 546 CO -0.06 0.21 -0.12 -0.36 -1.32 0.00 0.00 176.35 174.71 3a70 s PHE 547 N 0.13 1.76 0.01 5.38 0.08 0.85 -4.38 117.98 121.81 3a70 s PHE 547 Ca 0.05 -0.87 -0.00 0.00 0.12 0.00 0.00 56.93 56.23 3a70 s PHE 547 Cb -0.12 -1.34 -0.01 0.00 -0.57 0.00 0.00 43.02 40.98 3a70 s PHE 547 CO 0.00 -0.50 -0.01 1.21 -0.10 0.00 0.00 175.22 175.82 3a70 s ASN 548 N 1.32 0.16 0.85 1.36 3.84 -1.25 -1.14 114.94 120.07 3a70 s ASN 548 Ca -0.01 -0.33 0.00 0.00 0.21 0.00 0.00 52.86 52.73 3a70 s ASN 548 Cb -0.14 0.08 0.00 0.00 -0.55 0.00 0.00 41.25 40.64 3a70 s ASN 548 CO -0.05 -0.22 0.00 0.61 -2.79 0.00 0.00 177.10 174.65 3a70 n GLY 549 N 2.03 0.76 3.31 1.21 0.00 0.29 -3.66 105.19 109.14 3a70 n GLY 549 Ca -0.20 -0.73 -0.43 0.00 0.00 0.00 0.00 46.02 44.66 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 4.30 4.20 1.62 4.61 0.00 -1.26 -4.60 120.51 129.38 3a70 n ALA 550 Ca 0.00 -3.90 0.13 0.00 0.00 0.00 0.00 53.44 49.67 3a70 n ALA 550 Cb 0.00 -3.53 0.78 0.00 0.00 0.00 0.00 19.45 16.70 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 7.41 0.00 -3.29 0.00 -1.74 -1.24 -4.51 117.46 114.10 3a70 n PHE 551 Ca 0.49 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.38 3a70 n PHE 551 Cb 0.43 -0.04 0.00 0.00 1.52 0.00 0.00 39.48 41.40 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 0.70 -1.84 3.34 4.97 0.00 -1.26 -4.26 105.19 106.85 3a70 n GLY 552 Ca 0.19 -1.50 -0.41 0.00 0.00 0.00 0.00 46.02 44.30 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 2.77 0.19 1.61 -1.52 -1.26 -1.39 119.66 120.06 3a70 s GLN 553 Ca 0.00 -1.26 0.09 0.00 -1.95 0.00 0.00 55.36 52.24 3a70 s GLN 553 Cb 0.00 -3.83 -0.04 0.00 -0.22 0.00 0.00 33.01 28.92 3a70 s GLN 553 CO 0.00 -0.85 -0.10 -0.51 -0.25 0.00 0.00 175.29 173.59 3a70 s ASP 554 N 1.93 4.24 -0.11 5.90 1.01 0.36 -3.69 116.67 126.30 3a70 s ASP 554 Ca 0.03 -0.59 0.03 0.00 0.71 0.00 0.00 52.55 52.72 3a70 s ASP 554 Cb -0.21 -0.71 -0.00 0.00 1.01 0.00 0.00 42.92 43.00 3a70 s ASP 554 CO 0.05 0.10 -0.21 -0.13 0.21 0.00 0.00 175.17 175.19 3a70 s ARG 555 N -2.87 3.12 -0.23 8.23 0.52 -0.05 -0.19 118.95 127.47 3a70 s ARG 555 Ca 0.25 -0.83 -0.01 0.00 -0.52 0.00 0.00 55.73 54.62 3a70 s ARG 555 Cb -0.09 -2.39 0.03 0.00 0.52 0.00 0.00 34.95 33.02 3a70 s ARG 555 CO 0.15 0.16 -0.09 0.08 0.02 0.00 0.00 175.30 175.63 3a70 s VAL 556 N 0.40 2.70 -0.13 3.52 1.01 0.02 -1.00 120.40 126.92 3a70 s VAL 556 Ca -0.16 -1.02 -0.04 0.00 0.00 0.00 0.00 61.98 60.76 3a70 s VAL 556 Cb -0.17 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.83 3a70 s VAL 556 CO 0.07 0.26 0.03 -0.69 0.00 0.00 0.00 175.10 174.77 3a70 s VAL 557 N 1.31 4.50 0.00 2.92 1.01 -0.69 -1.43 120.40 128.02 3a70 s VAL 557 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 61.83 3a70 s VAL 557 Cb -0.16 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.26 3a70 s VAL 557 CO -0.06 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.19 3a70 n GLY 558 N 2.84 0.57 3.68 4.51 0.00 -1.26 -0.93 105.19 114.60 3a70 n GLY 558 Ca -0.18 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 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 2.56 0.33 1.61 5.36 -1.26 -4.69 117.98 119.89 3a70 s PHE 559 Ca 0.00 0.59 0.01 0.00 -0.96 0.00 0.00 56.93 56.57 3a70 s PHE 559 Cb 0.00 -3.76 -0.00 0.00 -0.34 0.00 0.00 43.02 38.91 3a70 s PHE 559 CO 0.00 -2.98 0.03 0.25 -1.46 0.00 0.00 175.22 171.07 3a70 n THR 560 N 4.95 0.00 -0.23 0.12 -2.24 -1.26 -4.95 114.28 110.67 3a70 n THR 560 Ca 0.15 -1.67 0.30 0.00 -2.27 0.00 0.00 64.05 60.55 3a70 n THR 560 Cb 0.43 0.42 0.71 0.00 -2.10 0.00 0.00 70.33 69.79 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 0.94 0.04 -0.49 3.42 0.87 -1.94 -2.01 113.55 114.39 3a70 h SER 561 Ca -0.27 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 3a70 h SER 561 Cb 0.88 -0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.84 3a70 h SER 561 CO 0.45 0.01 0.00 -0.46 -0.53 0.00 0.00 176.83 176.30 3a70 n ASN 562 N -4.27 3.48 -4.92 6.23 6.94 -1.26 -4.96 115.26 116.51 3a70 n ASN 562 Ca 0.21 -2.11 -0.21 0.00 -0.02 0.00 0.00 54.58 52.44 3a70 n ASN 562 Cb 1.02 -0.36 0.05 0.00 -2.36 0.00 0.00 39.78 38.13 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 -1.05 5.10 -0.15 0.53 1.01 -0.76 -4.20 116.67 117.16 3a70 s ASP 563 Ca 0.35 -0.18 -0.12 0.00 0.71 0.00 0.00 52.55 53.31 3a70 s ASP 563 Cb 0.20 -0.60 0.04 0.00 1.01 0.00 0.00 42.92 43.57 3a70 s ASP 563 CO 0.21 -1.28 0.38 -0.75 0.21 0.00 0.00 175.17 173.95 3a70 s LYS 564 N -4.80 0.42 -0.03 8.23 2.20 -0.25 -4.68 119.74 120.83 3a70 s LYS 564 Ca 0.59 0.58 -0.02 0.00 -0.36 0.00 0.00 55.97 56.77 3a70 s LYS 564 Cb -0.09 0.15 -0.04 0.00 -1.51 0.00 0.00 37.83 36.35 3a70 s LYS 564 CO 0.39 -0.08 0.09 -0.51 -0.36 0.00 0.00 175.35 174.88 3a70 s LEU 565 N 0.49 3.97 -0.15 5.43 1.43 0.84 -1.00 118.68 129.70 3a70 s LEU 565 Ca -0.02 0.21 -0.02 0.00 -1.03 0.00 0.00 54.13 53.27 3a70 s LEU 565 Cb -0.04 -2.22 0.04 0.00 0.03 0.00 0.00 46.19 44.00 3a70 s LEU 565 CO -0.03 0.30 -0.00 -0.69 0.23 0.00 0.00 176.35 176.17 3a70 s VAL 566 N -1.14 0.66 -0.32 -1.59 1.01 -0.53 0.14 120.40 118.62 3a70 s VAL 566 Ca 0.21 -0.37 -0.11 0.00 0.00 0.00 0.00 61.98 61.71 3a70 s VAL 566 Cb -0.12 -0.96 -0.02 0.00 0.00 0.00 0.00 36.38 35.29 3a70 s VAL 566 CO 0.11 0.04 0.19 -0.36 0.00 0.00 0.00 175.10 175.09 3a70 s PHE 567 N 1.82 3.20 -0.07 5.22 0.08 0.57 -0.10 117.98 128.70 3a70 s PHE 567 Ca 0.01 -0.32 -0.03 0.00 0.12 0.00 0.00 56.93 56.71 3a70 s PHE 567 Cb -0.15 -2.40 0.04 0.00 -0.57 0.00 0.00 43.02 39.94 3a70 s PHE 567 CO -0.07 -0.37 0.12 -1.17 -0.10 0.00 0.00 175.22 173.63 3a70 s LEU 568 N 1.68 0.07 -0.77 -0.37 2.96 -0.29 -1.23 118.68 120.73 3a70 s LEU 568 Ca 0.06 0.24 -0.04 0.00 -0.22 0.00 0.00 54.13 54.17 3a70 s LEU 568 Cb -0.17 0.14 0.00 0.00 0.50 0.00 0.00 46.19 46.66 3a70 s LEU 568 CO 0.09 -0.24 0.67 0.61 -1.32 0.00 0.00 176.35 176.15 3a70 n GLY 569 N 5.22 0.03 3.55 7.98 0.00 -1.26 -3.89 105.19 116.82 3a70 n GLY 569 Ca -0.06 -0.13 -0.26 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.20 3.02 0.45 1.61 -7.23 -1.26 -0.54 120.40 113.25 3a70 s VAL 570 Ca 0.23 -1.83 -0.25 0.00 -1.81 0.00 0.00 61.98 58.32 3a70 s VAL 570 Cb -0.10 -2.52 -0.08 0.00 0.56 0.00 0.00 36.38 34.24 3a70 s VAL 570 CO 0.43 -0.18 1.40 -1.10 -0.31 0.00 0.00 175.10 175.34 3a70 s GLN 571 N -3.00 3.69 -0.48 4.82 -1.52 -1.26 -4.20 119.66 117.70 3a70 s GLN 571 Ca 0.26 2.36 0.00 0.00 -1.95 0.00 0.00 55.36 56.02 3a70 s GLN 571 Cb -0.08 -2.64 0.00 0.00 -0.22 0.00 0.00 33.01 30.07 3a70 s GLN 571 CO 0.15 -0.79 0.00 0.41 -0.25 0.00 0.00 175.29 174.81 3a70 n GLY 572 N 0.60 0.37 3.37 3.09 0.00 -1.26 -3.58 105.19 107.79 3a70 n GLY 572 Ca 0.05 -0.72 -0.45 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.24 5.04 0.57 1.61 1.01 -1.26 -4.90 120.40 120.24 3a70 s VAL 573 Ca 0.00 -1.51 -0.18 0.00 0.00 0.00 0.00 61.98 60.29 3a70 s VAL 573 Cb 0.00 -4.52 -0.04 0.00 0.00 0.00 0.00 36.38 31.82 3a70 s VAL 573 CO 0.00 -1.15 1.10 -0.76 0.00 0.00 0.00 175.10 174.29 3a70 s LEU 574 N 1.96 3.62 -0.28 3.92 1.43 -1.26 -4.83 118.68 123.23 3a70 s LEU 574 Ca 0.16 2.02 -0.39 0.00 -1.03 0.00 0.00 54.13 54.89 3a70 s LEU 574 Cb -0.18 -4.56 -0.15 0.00 0.03 0.00 0.00 46.19 41.33 3a70 s LEU 574 CO -0.01 -1.25 1.84 -2.65 0.23 0.00 0.00 176.35 174.51 3a70 n PRO 575 N -1.68 1.22 -1.00 1.29 -0.02 -1.26 -1.10 135.00 132.45 3a70 n PRO 575 Ca 0.10 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 3a70 n PRO 575 Cb 0.52 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 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 6.22 -3.84 -4.14 2.55 5.15 -1.26 -4.81 115.26 115.12 3a70 n ASN 576 Ca 0.29 0.00 -0.46 0.00 -0.60 0.00 0.00 54.58 53.81 3a70 n ASN 576 Cb 0.15 -1.40 -0.03 0.00 -0.53 0.00 0.00 39.78 37.97 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 -0.30 -1.07 -4.21 1.20 9.92 -0.26 -4.99 116.55 116.83 3a70 n ASP 577 Ca 0.00 1.06 -0.22 0.00 -0.53 0.00 0.00 54.79 55.10 3a70 n ASP 577 Cb 0.15 -0.89 -0.02 0.00 -0.64 0.00 0.00 41.12 39.72 3a70 n ASP 577 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 3a70 n ASP 578 N 1.84 2.62 0.27 -2.24 5.68 -1.26 -4.85 116.55 118.61 3a70 n ASP 578 Ca 0.17 -2.59 0.12 0.00 -0.50 0.00 0.00 54.79 51.99 3a70 n ASP 578 Cb 0.22 0.07 0.75 0.00 -1.14 0.00 0.00 41.12 41.02 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 0.81 0.00 0.00 2.11 -0.00 -1.96 -2.61 116.94 115.29 3a70 h PHE 579 Ca -0.30 0.00 -0.05 0.00 -0.00 0.00 0.00 57.97 57.63 3a70 h PHE 579 Cb 1.01 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.95 3a70 h PHE 579 CO 0.00 0.07 -0.22 0.00 -0.00 0.00 0.00 178.31 178.16 3a70 h ARG 580 N 0.00 0.00 0.00 6.09 3.08 -1.96 0.40 114.38 122.00 3a70 h ARG 580 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3a70 h ARG 580 Cb 0.17 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.22 3a70 h ARG 580 CO 0.01 0.22 0.00 0.00 -1.07 0.00 0.00 179.97 179.13 3a70 n ALA 581 N -2.46 2.52 -0.33 0.04 0.00 -0.98 -3.65 120.51 115.65 3a70 n ALA 581 Ca -0.02 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.25 3a70 n ALA 581 Cb 0.29 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.29 3a70 n ALA 581 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3a70 n HIS 582 N -1.03 0.00 -4.76 0.00 8.25 0.02 -5.04 115.22 112.65 3a70 n HIS 582 Ca 0.20 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.34 3a70 n HIS 582 Cb 0.11 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.09 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 -0.18 2.64 0.24 -1.41 0.00 -0.51 -0.96 121.76 121.59 3a70 s ALA 583 Ca 0.00 -1.09 -0.08 0.00 0.00 0.00 0.00 51.96 50.79 3a70 s ALA 583 Cb 0.00 -0.86 -0.01 0.00 0.00 0.00 0.00 23.12 22.25 3a70 s ALA 583 CO 0.00 0.57 0.37 -1.54 0.00 0.00 0.00 175.76 175.16 3a70 s SER 584 N -1.13 0.09 -0.09 0.00 1.04 -0.65 -4.93 113.70 108.03 3a70 s SER 584 Ca 0.13 -1.13 -0.14 0.00 0.48 0.00 0.00 55.95 55.30 3a70 s SER 584 Cb -0.11 0.53 -0.05 0.00 0.10 0.00 0.00 66.02 66.50 3a70 s SER 584 CO 0.03 -1.07 0.35 -0.04 0.98 0.00 0.00 173.24 173.49 3a70 s MET 585 N -3.96 4.06 -0.29 4.02 -1.94 -1.26 -0.57 119.30 119.36 3a70 s MET 585 Ca 0.28 0.24 0.02 0.00 -1.71 0.00 0.00 55.69 54.52 3a70 s MET 585 Cb 0.02 -3.33 0.08 0.00 2.01 0.00 0.00 34.83 33.61 3a70 s MET 585 CO 0.11 0.44 0.02 0.08 -0.01 0.00 0.00 175.02 175.66 3a70 s VAL 586 N -0.20 1.69 0.00 -6.03 1.01 0.63 -4.89 120.40 112.59 3a70 s VAL 586 Ca 0.20 -1.70 0.00 0.00 0.00 0.00 0.00 61.98 60.48 3a70 s VAL 586 Cb -0.14 -2.12 0.00 0.00 0.00 0.00 0.00 36.38 34.11 3a70 s VAL 586 CO 0.08 -0.42 0.00 0.61 0.00 0.00 0.00 175.10 175.37 3a70 n GLY 587 N 4.54 2.63 0.01 4.51 0.00 -1.26 -2.04 105.19 113.59 3a70 n GLY 587 Ca -0.04 0.20 0.11 0.00 0.00 0.00 0.00 46.02 46.29 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 6.37 0.10 -4.16 1.61 1.13 -1.26 -4.96 117.38 116.22 3a70 n GLN 588 Ca 0.00 0.00 -0.34 0.00 -1.94 0.00 0.00 57.00 54.72 3a70 n GLN 588 Cb 0.00 -1.54 -0.08 0.00 0.11 0.00 0.00 30.24 28.73 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 -3.35 5.60 -0.11 1.08 1.01 -0.87 -3.65 116.67 116.38 3a70 s ASP 589 Ca 0.08 0.17 -0.28 0.00 0.71 0.00 0.00 52.55 53.24 3a70 s ASP 589 Cb 0.16 -1.62 -0.02 0.00 1.01 0.00 0.00 42.92 42.45 3a70 s ASP 589 CO 0.76 0.32 0.92 -0.89 0.21 0.00 0.00 175.17 176.49 3a70 s THR 590 N -1.08 4.85 -0.15 -1.27 2.01 -0.93 -0.27 115.64 118.80 3a70 s THR 590 Ca 0.19 1.86 -0.04 0.00 0.31 0.00 0.00 61.69 64.01 3a70 s THR 590 Cb -0.12 -4.23 -0.03 0.00 0.01 0.00 0.00 72.50 68.13 3a70 s THR 590 CO 0.09 0.05 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.37 3a70 s VAL 591 N 1.83 4.11 -0.16 3.82 1.01 0.26 -0.00 120.40 131.27 3a70 s VAL 591 Ca 0.45 -0.29 -0.03 0.00 0.00 0.00 0.00 61.98 62.11 3a70 s VAL 591 Cb -0.18 -2.79 -0.02 0.00 0.00 0.00 0.00 36.38 33.38 3a70 s VAL 591 CO 0.17 0.51 -0.06 -0.76 0.00 0.00 0.00 175.10 174.96 3a70 s LEU 592 N 0.13 3.07 -0.09 3.92 1.02 0.47 -1.64 118.68 125.57 3a70 s LEU 592 Ca 0.00 -0.22 0.04 0.00 0.02 0.00 0.00 54.13 53.97 3a70 s LEU 592 Cb -0.13 -1.74 -0.01 0.00 0.02 0.00 0.00 46.19 44.33 3a70 s LEU 592 CO 0.02 0.13 -0.22 -0.54 0.02 0.00 0.00 176.35 175.77 3a70 s LYS 593 N 0.57 2.91 -0.29 1.70 1.02 -0.13 -0.76 119.74 124.76 3a70 s LYS 593 Ca -0.04 -0.84 -0.03 0.00 0.02 0.00 0.00 55.97 55.08 3a70 s LYS 593 Cb -0.15 -2.32 0.10 0.00 -0.52 0.00 0.00 37.83 34.94 3a70 s LYS 593 CO 0.03 0.28 0.11 -0.06 -0.92 0.00 0.00 175.35 174.79 3a70 s PHE 594 N 0.11 0.88 0.00 3.18 0.08 0.14 -4.78 117.98 117.59 3a70 s PHE 594 Ca -0.11 -1.19 0.00 0.00 0.12 0.00 0.00 56.93 55.76 3a70 s PHE 594 Cb -0.16 -1.21 0.00 0.00 -0.57 0.00 0.00 43.02 41.08 3a70 s PHE 594 CO 0.06 -0.83 0.00 0.41 -0.10 0.00 0.00 175.22 174.76 3a70 n GLY 595 N 5.09 3.35 0.13 4.36 0.00 -1.23 -1.20 105.19 115.68 3a70 n GLY 595 Ca -0.05 -0.14 0.11 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.70 3.87 -0.02 0.00 -1.26 -4.89 105.19 102.18 3a70 n GLY 596 Ca 0.00 -0.21 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.68 5.99 0.02 1.61 1.01 -0.34 -4.82 116.67 118.45 3a70 s ASP 597 Ca 0.33 0.10 -0.15 0.00 0.71 0.00 0.00 52.55 53.53 3a70 s ASP 597 Cb 0.16 -1.73 0.03 0.00 1.01 0.00 0.00 42.92 42.38 3a70 s ASP 597 CO 0.26 0.12 0.34 -0.94 0.21 0.00 0.00 175.17 175.16 3a70 s SER 598 N -2.79 -0.19 -0.11 0.27 1.04 -0.48 -0.68 113.70 110.75 3a70 s SER 598 Ca 0.33 -0.02 0.02 0.00 0.48 0.00 0.00 55.95 56.75 3a70 s SER 598 Cb -0.12 0.36 0.01 0.00 0.10 0.00 0.00 66.02 66.37 3a70 s SER 598 CO 0.26 -0.56 -0.17 -0.69 0.98 0.00 0.00 173.24 173.06 3a70 s VAL 599 N -2.04 1.61 -0.30 5.02 1.01 0.06 -0.49 120.40 125.27 3a70 s VAL 599 Ca -0.08 -0.72 -0.11 0.00 0.00 0.00 0.00 61.98 61.06 3a70 s VAL 599 Cb -0.02 -1.45 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 3a70 s VAL 599 CO 0.00 0.46 0.20 -0.89 0.00 0.00 0.00 175.10 174.87 3a70 s THR 600 N 0.85 5.17 -1.05 3.92 2.01 0.73 -0.40 115.64 126.88 3a70 s THR 600 Ca -0.09 -0.04 -0.15 0.00 0.31 0.00 0.00 61.69 61.72 3a70 s THR 600 Cb -0.15 -3.54 0.17 0.00 0.01 0.00 0.00 72.50 68.98 3a70 s THR 600 CO 0.00 0.15 1.21 -0.76 -0.69 0.00 0.00 174.62 174.53 3a70 s LEU 601 N 1.72 5.37 -0.27 4.42 1.43 0.99 -0.80 118.68 131.55 3a70 s LEU 601 Ca 0.06 -2.66 -0.40 0.00 -1.03 0.00 0.00 54.13 50.11 3a70 s LEU 601 Cb -0.17 -2.36 -0.15 0.00 0.03 0.00 0.00 46.19 43.54 3a70 s LEU 601 CO 0.10 -0.80 1.77 0.52 0.23 0.00 0.00 176.35 178.17 3a70 n VAL 602 N 4.69 0.34 0.00 -1.59 0.31 -0.52 -1.75 118.33 119.81 3a70 n VAL 602 Ca 0.28 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.55 3a70 n VAL 602 Cb 0.45 -1.30 0.00 0.00 -0.91 0.00 0.00 33.84 32.08 3a70 n VAL 602 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3a70 n GLY 603 N 4.30 2.48 3.71 2.92 0.00 -1.25 -4.59 105.19 112.76 3a70 n GLY 603 Ca 0.27 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.90 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 5.11 0.07 1.61 1.01 -0.72 -4.84 120.40 120.17 3a70 s VAL 604 Ca 0.00 1.20 -0.28 0.00 0.00 0.00 0.00 61.98 62.90 3a70 s VAL 604 Cb 0.00 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.40 3a70 s VAL 604 CO 0.00 0.27 0.90 0.00 0.00 0.00 0.00 175.10 176.27 3a70 s ALA 605 N 0.84 3.27 0.47 5.51 0.00 -1.26 -2.20 121.76 128.39 3a70 s ALA 605 Ca 0.32 0.46 0.23 0.00 0.00 0.00 0.00 51.96 52.97 3a70 s ALA 605 Cb -0.16 -3.19 1.25 0.00 0.00 0.00 0.00 23.12 21.02 3a70 s ALA 605 CO 0.14 -0.04 1.87 1.25 0.00 0.00 0.00 175.76 178.98 3a70 h LEU 606 N 5.86 0.24 -1.83 0.00 5.85 -1.93 0.67 115.31 124.18 3a70 h LEU 606 Ca -0.43 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.30 3a70 h LEU 606 Cb 1.21 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.22 3a70 h LEU 606 CO 0.72 0.09 -0.10 0.78 -0.34 0.00 0.00 178.44 179.59 3a70 h ASN 607 N 0.23 0.00 0.15 1.25 2.35 -2.01 -2.65 115.58 114.90 3a70 h ASN 607 Ca 0.45 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.20 3a70 h ASN 607 Cb 1.39 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.76 3a70 h ASN 607 CO -0.11 0.10 -0.06 -1.54 -1.65 0.00 0.00 177.43 174.17 3a70 n SER 608 N -3.42 0.74 -4.89 5.81 3.41 0.23 -4.93 113.62 110.56 3a70 n SER 608 Ca -0.01 -0.99 -0.29 0.00 -0.26 0.00 0.00 58.87 57.32 3a70 n SER 608 Cb 0.26 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.17 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 -2.22 3.91 -0.03 1.04 1.43 -1.00 -4.97 118.68 116.84 3a70 s LEU 609 Ca 0.36 0.90 0.01 0.00 -1.03 0.00 0.00 54.13 54.37 3a70 s LEU 609 Cb 0.21 -3.77 0.03 0.00 0.03 0.00 0.00 46.19 42.69 3a70 s LEU 609 CO 0.41 -0.33 -0.01 -0.55 0.23 0.00 0.00 176.35 176.10 3a70 s SER 610 N -3.32 0.54 0.56 2.29 0.15 -1.26 -5.01 113.70 107.65 3a70 s SER 610 Ca 0.47 -0.05 0.26 0.00 0.70 0.00 0.00 55.95 57.33 3a70 s SER 610 Cb -0.10 -0.27 1.52 0.00 -1.71 0.00 0.00 66.02 65.45 3a70 s SER 610 CO 0.33 -0.09 2.07 0.00 1.20 0.00 0.00 173.24 176.75 3a70 h ALA 611 N 7.24 2.05 -1.02 5.45 0.00 -1.99 0.16 119.26 131.16 3a70 h ALA 611 Ca -0.41 -0.01 0.25 0.00 0.00 0.00 0.00 54.91 54.74 3a70 h ALA 611 Cb 1.14 0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.85 3a70 h ALA 611 CO 0.47 -0.37 0.65 -0.44 0.00 0.00 0.00 179.25 179.56 3a70 h ASP 612 N 0.00 0.49 -0.11 0.00 5.19 -2.00 -3.00 116.42 116.99 3a70 h ASP 612 Ca 0.13 0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.62 3a70 h ASP 612 Cb 0.59 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.10 3a70 h ASP 612 CO -0.00 0.11 0.00 0.61 -3.12 0.00 0.00 179.24 176.84 3a70 n GLY 613 N -1.45 0.62 2.71 2.75 0.00 0.55 -4.80 105.19 105.56 3a70 n GLY 613 Ca 0.25 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.26 0.94 -0.25 -0.61 1.01 -1.09 -0.11 121.20 119.83 3a70 s ILE 614 Ca 0.21 -1.68 -0.20 0.00 0.00 0.00 0.00 60.65 58.99 3a70 s ILE 614 Cb 0.14 -1.70 -0.02 0.00 0.01 0.00 0.00 42.46 40.89 3a70 s ILE 614 CO 0.20 -0.75 0.61 -0.69 0.00 0.00 0.00 174.94 174.31 3a70 s VAL 615 N 1.30 5.00 -0.20 2.92 1.01 0.12 -4.73 120.40 125.83 3a70 s VAL 615 Ca 0.12 1.10 -0.01 0.00 0.00 0.00 0.00 61.98 63.19 3a70 s VAL 615 Cb -0.19 -3.92 0.01 0.00 0.00 0.00 0.00 36.38 32.28 3a70 s VAL 615 CO -0.18 0.05 -0.14 -0.63 0.00 0.00 0.00 175.10 174.21 3a70 s ILE 616 N 2.37 2.58 0.00 2.22 -1.09 -1.26 -0.32 121.20 125.70 3a70 s ILE 616 Ca 0.26 -0.76 0.00 0.00 -2.23 0.00 0.00 60.65 57.91 3a70 s ILE 616 Cb -0.16 -2.13 0.00 0.00 -1.58 0.00 0.00 42.46 38.60 3a70 s ILE 616 CO 0.09 0.49 0.17 0.00 -1.23 0.00 0.00 174.94 174.46