#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a7m n PRO 2 N 0.00 3.26 -3.70 4.33 -0.04 -1.26 -4.80 135.00 132.78 1a7m n PRO 2 Ca 0.00 -2.21 -0.33 0.00 -0.04 0.00 0.00 63.50 60.92 1a7m n PRO 2 Cb 0.00 -2.89 -0.08 0.00 -0.04 0.00 0.00 33.50 30.49 1a7m n PRO 2 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1a7m n LEU 3 N 4.39 3.83 -4.58 1.53 -0.00 -1.26 -5.08 117.00 115.84 1a7m n LEU 3 Ca 0.68 -5.19 -0.30 0.00 -0.00 0.00 0.00 56.01 51.21 1a7m n LEU 3 Cb 0.26 -0.96 0.24 0.00 -0.00 0.00 0.00 43.42 42.96 1a7m n LEU 3 CO 0.86 1.67 0.60 -2.16 -0.00 0.00 0.00 177.39 178.36 1a7m s PRO 4 N -1.53 -1.17 -0.60 1.47 0.04 -1.26 -5.01 135.00 126.93 1a7m s PRO 4 Ca 0.28 0.04 0.06 0.00 0.04 0.00 0.00 61.00 61.41 1a7m s PRO 4 Cb -0.04 -1.59 0.27 0.00 0.04 0.00 0.00 34.50 33.18 1a7m s PRO 4 CO -0.13 -3.70 0.78 0.44 0.04 0.00 0.00 177.00 174.43 1a7m n ILE 5 N -4.77 2.27 -4.34 0.56 -0.00 -1.26 -5.08 119.36 106.74 1a7m n ILE 5 Ca 0.12 -5.22 -0.24 0.00 -0.00 0.00 0.00 62.75 57.41 1a7m n ILE 5 Cb 0.59 -1.87 -0.09 0.00 -0.00 0.00 0.00 39.64 38.27 1a7m n ILE 5 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.55 176.97 1a7m s THR 6 N -2.88 3.09 -1.12 7.28 -4.23 -1.26 -5.04 115.64 111.48 1a7m s THR 6 Ca 0.42 -1.97 -0.15 0.00 -1.18 0.00 0.00 61.69 58.81 1a7m s THR 6 Cb 0.19 -2.61 -0.07 0.00 1.34 0.00 0.00 72.50 71.35 1a7m s THR 6 CO -0.05 -0.29 2.20 -0.81 -0.54 0.00 0.00 174.62 175.12 1a7m n PRO 7 N -0.51 2.33 -2.38 3.99 -0.04 -1.26 -4.65 135.00 132.47 1a7m n PRO 7 Ca -0.08 -2.04 -0.34 0.00 -0.04 0.00 0.00 63.50 61.01 1a7m n PRO 7 Cb 0.58 -2.91 0.01 0.00 -0.04 0.00 0.00 33.50 31.14 1a7m n PRO 7 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1a7m n VAL 8 N 5.03 3.45 -0.45 0.52 3.14 -1.26 -4.63 118.33 124.13 1a7m n VAL 8 Ca 0.53 -4.97 0.10 0.00 -2.96 0.00 0.00 64.34 57.05 1a7m n VAL 8 Cb 0.32 -1.32 0.31 0.00 -1.06 0.00 0.00 33.84 32.09 1a7m n VAL 8 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1a7m n ASN 9 N -0.41 4.08 -2.33 6.55 2.85 -1.26 -4.21 115.26 120.54 1a7m n ASN 9 Ca 0.44 -2.19 -0.14 0.00 -0.11 0.00 0.00 54.58 52.57 1a7m n ASN 9 Cb 0.41 -0.48 0.03 0.00 1.24 0.00 0.00 39.78 40.98 1a7m n ASN 9 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1a7m n ALA 10 N 1.21 4.05 0.02 5.20 0.00 -1.26 -4.73 120.51 125.01 1a7m n ALA 10 Ca 0.23 -3.38 0.06 0.00 0.00 0.00 0.00 53.44 50.36 1a7m n ALA 10 Cb 0.70 -0.54 0.14 0.00 0.00 0.00 0.00 19.45 19.75 1a7m n ALA 10 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1a7m n THR 11 N -0.66 0.69 -3.47 0.00 -1.04 -1.26 -4.18 114.28 104.35 1a7m n THR 11 Ca 0.29 -0.85 -0.22 0.00 -2.04 0.00 0.00 64.05 61.24 1a7m n THR 11 Cb 0.90 0.73 -0.05 0.00 -1.82 0.00 0.00 70.33 70.09 1a7m n THR 11 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1a7m n ALA 13 N -2.92 2.62 -1.31 0.00 0.00 -1.26 -4.10 120.51 113.54 1a7m n ALA 13 Ca -0.08 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.03 1a7m n ALA 13 Cb 0.35 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.89 1a7m n ALA 13 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1a7m n ILE 14 N -1.93 3.59 0.00 0.00 -0.00 -1.26 -4.59 119.36 115.16 1a7m n ILE 14 Ca 0.00 -2.81 0.00 0.00 -0.00 0.00 0.00 62.75 59.94 1a7m n ILE 14 Cb 0.00 -1.09 0.00 0.00 -0.00 0.00 0.00 39.64 38.55 1a7m n ILE 14 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.55 175.41 1a7m n ARG 15 N -0.93 0.00 -4.04 6.28 0.63 -1.26 -5.06 116.66 112.27 1a7m n ARG 15 Ca 0.62 0.00 -0.08 0.00 -0.92 0.00 0.00 57.85 57.48 1a7m n ARG 15 Cb 0.77 0.00 -0.10 0.00 0.45 0.00 0.00 32.46 33.58 1a7m n ARG 15 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 1a7m s HIS 16 N 0.11 0.42 -0.05 -0.14 5.04 -1.26 -5.08 115.29 114.34 1a7m s HIS 16 Ca 0.00 -0.91 0.13 0.00 -1.54 0.00 0.00 55.06 52.73 1a7m s HIS 16 Cb 0.00 -0.31 -0.21 0.00 0.04 0.00 0.00 32.58 32.10 1a7m s HIS 16 CO 0.00 -0.39 0.72 -1.00 -2.34 0.00 0.00 174.74 171.74 1a7m h PRO 17 N 3.26 0.00 0.00 2.88 0.13 -1.90 -3.45 132.00 132.93 1a7m h PRO 17 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1a7m h PRO 17 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1a7m h PRO 17 CO 0.61 0.48 0.00 0.00 -0.23 0.00 0.00 178.00 178.87 1a7m s HIS 19 N 0.00 2.09 -1.03 0.00 0.09 -1.26 -5.06 115.29 110.13 1a7m s HIS 19 Ca 0.00 -0.85 -0.01 0.00 -0.00 0.00 0.00 55.06 54.20 1a7m s HIS 19 Cb 0.00 -1.37 0.32 0.00 -0.00 0.00 0.00 32.58 31.53 1a7m s HIS 19 CO 0.00 0.16 1.82 0.41 -0.00 0.00 0.00 174.74 177.12 1a7m n GLY 20 N -0.74 6.13 0.00 -2.22 0.00 -1.26 -4.75 105.19 102.36 1a7m n GLY 20 Ca -0.03 -2.58 0.00 0.00 0.00 0.00 0.00 46.02 43.40 1a7m n GLY 20 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1a7m n ASN 21 N -0.04 0.00 0.00 1.61 4.13 -1.26 -4.99 115.26 114.72 1a7m n ASN 21 Ca 0.47 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.73 1a7m n ASN 21 Cb 0.26 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.50 1a7m n ASN 21 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1a7m n LEU 22 N 0.00 0.00 -0.00 3.41 0.00 -1.26 -4.60 117.00 114.55 1a7m n LEU 22 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 56.01 56.01 1a7m n LEU 22 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 43.42 43.42 1a7m n LEU 22 CO 0.00 0.00 0.00 0.80 0.00 0.00 0.00 177.39 178.19 1a7m n MET 23 N 0.00 -0.00 -0.42 1.96 1.56 -1.26 0.42 117.12 119.38 1a7m n MET 23 Ca 0.00 0.01 0.08 0.00 -0.27 0.00 0.00 57.70 57.52 1a7m n MET 23 Cb 0.00 -0.01 0.25 0.00 2.15 0.00 0.00 33.22 35.61 1a7m n MET 23 CO 0.00 0.00 0.00 0.27 -0.73 0.00 0.00 175.97 175.51 1a7m n ASN 24 N -2.11 3.80 -0.00 6.12 6.94 -1.26 -4.23 115.26 124.52 1a7m n ASN 24 Ca 0.00 -2.89 -0.00 0.00 -0.02 0.00 0.00 54.58 51.66 1a7m n ASN 24 Cb 0.00 -0.51 -0.00 0.00 -2.36 0.00 0.00 39.78 36.91 1a7m n ASN 24 CO 0.00 0.00 0.00 1.67 -1.03 0.00 0.00 177.26 177.90 1a7m n GLN 25 N -0.37 0.01 0.02 -3.83 0.00 0.17 -2.65 117.38 110.72 1a7m n GLN 25 Ca 0.20 0.14 0.07 0.00 -0.00 0.00 0.00 57.00 57.41 1a7m n GLN 25 Cb 0.84 -0.65 0.29 0.00 0.00 0.00 0.00 30.24 30.73 1a7m n GLN 25 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.06 177.50 1a7m n ILE 26 N -2.39 1.13 0.02 1.69 -5.35 -0.70 -1.31 119.36 112.45 1a7m n ILE 26 Ca -0.00 0.30 -0.04 0.00 -0.27 0.00 0.00 62.75 62.74 1a7m n ILE 26 Cb 0.01 -1.12 -0.03 0.00 -1.74 0.00 0.00 39.64 36.76 1a7m n ILE 26 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1a7m h LYS 27 N 0.00 -0.16 -0.53 6.28 1.63 -1.73 0.29 116.57 122.35 1a7m h LYS 27 Ca 0.00 0.01 0.07 0.00 -0.85 0.00 0.00 60.65 59.88 1a7m h LYS 27 Cb 0.22 0.04 -0.06 0.00 -0.60 0.00 0.00 32.23 31.83 1a7m h LYS 27 CO 0.00 0.00 0.21 -0.97 -3.45 0.00 0.00 179.45 175.24 1a7m h ASN 28 N -1.03 0.24 0.60 4.20 -0.73 -1.22 -1.76 115.58 115.87 1a7m h ASN 28 Ca -0.02 0.06 -0.03 0.00 1.87 0.00 0.00 56.30 58.18 1a7m h ASN 28 Cb 0.24 0.03 0.01 0.00 0.27 0.00 0.00 38.32 38.86 1a7m h ASN 28 CO 0.03 0.16 -0.29 -0.61 -0.37 0.00 0.00 177.43 176.35 1a7m h GLN 29 N 0.40 -0.77 -0.83 6.67 4.15 -1.26 -2.75 115.11 120.72 1a7m h GLN 29 Ca 0.25 0.05 0.18 0.00 0.77 0.00 0.00 58.65 59.90 1a7m h GLN 29 Cb 0.25 0.18 -0.15 0.00 0.21 0.00 0.00 27.48 27.97 1a7m h GLN 29 CO -0.24 -0.50 -0.12 1.25 -1.93 0.00 0.00 178.83 177.29 1a7m h LEU 30 N -0.83 -0.63 -0.40 -2.39 7.12 0.06 0.20 115.31 118.44 1a7m h LEU 30 Ca -0.08 0.24 0.07 0.00 0.13 0.00 0.00 57.88 58.24 1a7m h LEU 30 Cb 0.63 0.47 -0.07 0.00 -0.53 0.00 0.00 40.66 41.16 1a7m h LEU 30 CO 0.13 -0.26 -0.02 0.00 -0.13 0.00 0.00 178.44 178.16 1a7m h ALA 31 N 1.82 0.34 -1.44 1.25 0.00 -1.17 0.37 119.26 120.44 1a7m h ALA 31 Ca 0.43 0.12 0.46 0.00 0.00 0.00 0.00 54.91 55.92 1a7m h ALA 31 Cb 0.72 0.22 -0.12 0.00 0.00 0.00 0.00 17.79 18.61 1a7m h ALA 31 CO -0.82 -0.41 0.96 0.37 0.00 0.00 0.00 179.25 179.35 1a7m h GLN 32 N 0.08 0.06 0.04 0.00 5.75 -0.30 0.55 115.11 121.28 1a7m h GLN 32 Ca 0.20 -0.00 -0.30 0.00 -0.15 0.00 0.00 58.65 58.39 1a7m h GLN 32 Cb 0.28 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.79 1a7m h GLN 32 CO -0.35 0.04 -1.65 1.28 -2.65 0.00 0.00 178.83 175.51 1a7m n LEU 33 N -4.53 2.14 -0.30 -2.39 4.32 0.91 -4.19 117.00 112.96 1a7m n LEU 33 Ca 0.38 0.33 -0.05 0.00 -0.02 0.00 0.00 56.01 56.65 1a7m n LEU 33 Cb 1.53 -1.00 -0.00 0.00 -1.62 0.00 0.00 43.42 42.33 1a7m n LEU 33 CO 0.26 0.50 0.58 -1.13 -1.22 0.00 0.00 177.39 176.38 1a7m h ASN 34 N -0.64 -1.48 -0.95 -1.43 -1.24 0.18 0.75 115.58 110.76 1a7m h ASN 34 Ca -0.41 0.28 0.26 0.00 0.71 0.00 0.00 56.30 57.13 1a7m h ASN 34 Cb 1.58 0.72 -0.13 0.00 0.73 0.00 0.00 38.32 41.21 1a7m h ASN 34 CO -0.14 -0.30 0.48 1.23 -1.29 0.00 0.00 177.43 177.41 1a7m h GLY 35 N -0.10 1.77 1.97 1.57 0.00 -1.59 0.22 103.07 106.91 1a7m h GLY 35 Ca 0.25 -0.21 -0.21 0.00 0.00 0.00 0.00 47.33 47.17 1a7m h GLY 35 CO -0.83 -0.34 -1.01 1.48 0.00 0.00 0.00 176.54 175.83 1a7m h SER 36 N 0.40 0.00 -0.97 0.19 4.64 0.07 -1.23 113.55 116.65 1a7m h SER 36 Ca 0.63 0.00 0.23 0.00 -0.47 0.00 0.00 61.79 62.18 1a7m h SER 36 Cb 1.30 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.27 1a7m h SER 36 CO -0.56 0.99 0.54 0.00 -0.87 0.00 0.00 176.83 176.93 1a7m h ALA 37 N 1.01 1.67 0.03 5.18 0.00 0.32 2.38 119.26 129.85 1a7m h ALA 37 Ca -0.02 0.13 -0.32 0.00 0.00 0.00 0.00 54.91 54.70 1a7m h ALA 37 Cb 1.77 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 19.55 1a7m h ALA 37 CO 0.13 -0.26 -1.84 -1.71 0.00 0.00 0.00 179.25 175.57 1a7m n ASN 38 N -4.91 1.15 -0.06 0.00 4.05 -1.02 -3.73 115.26 110.74 1a7m n ASN 38 Ca 0.25 0.33 -0.03 0.00 0.45 0.00 0.00 54.58 55.57 1a7m n ASN 38 Cb 0.70 -0.20 -0.01 0.00 1.23 0.00 0.00 39.78 41.49 1a7m n ASN 38 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1a7m h ALA 39 N 0.75 0.00 -0.78 5.20 0.00 0.62 -3.33 119.26 121.72 1a7m h ALA 39 Ca -0.34 -0.40 0.12 0.00 0.00 0.00 0.00 54.91 54.29 1a7m h ALA 39 Cb 2.03 0.37 -0.13 0.00 0.00 0.00 0.00 17.79 20.06 1a7m h ALA 39 CO 0.07 0.37 -0.38 1.25 0.00 0.00 0.00 179.25 180.56 1a7m h LEU 40 N -0.89 -1.37 -0.59 0.00 7.12 0.36 0.51 115.31 120.45 1a7m h LEU 40 Ca 0.00 0.27 0.11 0.00 0.13 0.00 0.00 57.88 58.39 1a7m h LEU 40 Cb 0.37 0.68 -0.10 0.00 -0.53 0.00 0.00 40.66 41.08 1a7m h LEU 40 CO 0.00 -0.30 -0.19 0.33 -0.13 0.00 0.00 178.44 178.15 1a7m n PHE 41 N -5.44 0.12 -0.02 1.25 7.35 -0.77 0.13 117.46 120.08 1a7m n PHE 41 Ca 0.06 0.73 -0.13 0.00 -0.76 0.00 0.00 57.45 57.35 1a7m n PHE 41 Cb 0.37 -0.79 -0.09 0.00 0.35 0.00 0.00 39.48 39.33 1a7m n PHE 41 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 1a7m h ILE 42 N 0.00 1.35 0.00 -2.13 5.03 -0.17 0.26 117.51 121.86 1a7m h ILE 42 Ca 0.25 -1.09 0.00 0.00 -0.12 0.00 0.00 64.86 63.90 1a7m h ILE 42 Cb 0.40 1.98 0.00 0.00 -3.03 0.00 0.00 36.82 36.17 1a7m h ILE 42 CO -0.60 0.30 0.00 -1.28 -0.68 0.00 0.00 178.15 175.89 1a7m h SER 43 N -0.31 0.00 0.00 1.72 0.87 0.16 -2.47 113.55 113.52 1a7m h SER 43 Ca 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1a7m h SER 43 Cb 0.49 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.45 1a7m h SER 43 CO 0.01 0.00 -0.09 0.00 -0.53 0.00 0.00 176.83 176.22 1a7m n TYR 44 N -2.32 0.12 0.32 2.24 9.36 0.34 -4.16 117.16 123.06 1a7m n TYR 44 Ca -0.00 0.05 0.16 0.00 3.32 0.00 0.00 57.90 61.43 1a7m n TYR 44 Cb 0.11 -0.28 0.84 0.00 -0.63 0.00 0.00 39.34 39.38 1a7m n TYR 44 CO 0.00 0.00 0.00 0.10 0.22 0.00 0.00 176.86 177.18 1a7m h TYR 45 N -0.15 0.00 0.12 2.98 -0.00 -0.48 0.22 116.97 119.65 1a7m h TYR 45 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 58.73 58.45 1a7m h TYR 45 Cb 0.09 0.00 0.03 0.00 -0.00 0.00 0.00 36.73 36.85 1a7m h TYR 45 CO -0.04 0.00 -1.17 1.79 -0.00 0.00 0.00 178.16 178.74 1a7m h THR 46 N 0.00 1.31 0.00 -0.90 1.35 -1.65 -2.77 112.91 110.24 1a7m h THR 46 Ca 0.00 -2.44 0.00 0.00 -0.55 0.00 0.00 66.41 63.42 1a7m h THR 46 Cb 0.54 2.74 0.00 0.00 -1.73 0.00 0.00 68.15 69.69 1a7m h THR 46 CO 0.00 0.74 0.00 0.00 -0.25 0.00 0.00 175.52 176.01 1a7m h ALA 47 N 0.27 1.00 -0.06 6.62 0.00 -0.73 0.11 119.26 126.47 1a7m h ALA 47 Ca -0.18 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.55 1a7m h ALA 47 Cb 1.86 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.66 1a7m h ALA 47 CO 0.23 0.00 -0.65 1.96 0.00 0.00 0.00 179.25 180.78 1a7m h GLN 48 N 0.00 0.55 0.00 0.00 1.08 -1.31 -3.42 115.11 112.02 1a7m h GLN 48 Ca 0.00 -0.51 0.00 0.00 -1.45 0.00 0.00 58.65 56.69 1a7m h GLN 48 Cb 0.01 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 1a7m h GLN 48 CO 0.00 1.14 0.00 0.41 -0.95 0.00 0.00 178.83 179.43 1a7m n GLY 49 N 0.88 -1.69 2.67 3.46 0.00 0.40 -4.97 105.19 105.94 1a7m n GLY 49 Ca -0.09 -1.39 -0.33 0.00 0.00 0.00 0.00 46.02 44.21 1a7m n GLY 49 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1a7m n GLU 50 N -0.69 0.00 -2.42 1.61 0.28 -1.26 -4.47 120.64 113.69 1a7m n GLU 50 Ca 0.00 0.00 -0.37 0.00 -0.16 0.00 0.00 57.16 56.63 1a7m n GLU 50 Cb 0.00 -0.89 -0.04 0.00 1.43 0.00 0.00 31.44 31.94 1a7m n GLU 50 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 1a7m s PRO 51 N -1.78 3.29 0.07 3.44 0.04 -1.26 -5.05 135.00 133.75 1a7m s PRO 51 Ca 0.34 -0.84 0.00 0.00 0.04 0.00 0.00 61.00 60.54 1a7m s PRO 51 Cb -0.03 -5.21 0.00 0.00 0.04 0.00 0.00 34.50 29.29 1a7m s PRO 51 CO 0.67 -2.51 0.00 1.19 0.04 0.00 0.00 177.00 176.38 1a7m n PHE 52 N 10.26 -0.60 -0.24 0.56 3.72 -1.26 -4.70 117.46 125.19 1a7m n PHE 52 Ca 0.33 0.11 0.26 0.00 -0.05 0.00 0.00 57.45 58.09 1a7m n PHE 52 Cb 0.50 0.50 0.39 0.00 -0.94 0.00 0.00 39.48 39.93 1a7m n PHE 52 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1a7m n PRO 53 N -2.74 0.01 -0.00 -1.08 -0.04 -1.26 0.15 135.00 130.04 1a7m n PRO 53 Ca 0.00 0.80 0.01 0.00 -0.04 0.00 0.00 63.50 64.26 1a7m n PRO 53 Cb 0.00 -1.95 -0.01 0.00 -0.04 0.00 0.00 33.50 31.50 1a7m n PRO 53 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1a7m n ASN 54 N -2.93 3.12 -0.25 3.54 5.15 -1.26 -4.67 115.26 117.97 1a7m n ASN 54 Ca 0.21 -0.18 0.04 0.00 -0.60 0.00 0.00 54.58 54.06 1a7m n ASN 54 Cb 1.26 1.03 0.09 0.00 -0.53 0.00 0.00 39.78 41.64 1a7m n ASN 54 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1a7m n ASN 55 N -1.36 2.48 -0.25 1.20 3.02 0.31 -4.58 115.26 116.09 1a7m n ASN 55 Ca -0.00 -2.37 -0.06 0.00 -0.03 0.00 0.00 54.58 52.12 1a7m n ASN 55 Cb 0.03 -0.21 0.05 0.00 -0.61 0.00 0.00 39.78 39.03 1a7m n ASN 55 CO 0.00 0.00 0.00 0.17 -2.62 0.00 0.00 177.26 174.81 1a7m h LEU 56 N 0.62 0.90 0.00 3.41 8.10 0.11 0.36 115.31 128.81 1a7m h LEU 56 Ca 0.00 -0.13 0.00 0.00 0.11 0.00 0.00 57.88 57.86 1a7m h LEU 56 Cb 0.77 -0.23 0.00 0.00 -0.44 0.00 0.00 40.66 40.76 1a7m h LEU 56 CO 0.02 0.78 0.00 0.47 -4.11 0.00 0.00 178.44 175.60 1a7m n ASP 57 N -4.45 0.00 -0.01 0.17 9.92 -1.26 0.15 116.55 121.07 1a7m n ASP 57 Ca 0.05 0.47 0.01 0.00 -0.53 0.00 0.00 54.79 54.79 1a7m n ASP 57 Cb 0.13 -0.48 -0.04 0.00 -0.64 0.00 0.00 41.12 40.10 1a7m n ASP 57 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1a7m n LYS 58 N -1.48 1.08 -0.00 -1.24 5.02 0.35 -4.34 118.16 117.55 1a7m n LYS 58 Ca 0.01 -0.03 0.01 0.00 -2.02 0.00 0.00 58.31 56.27 1a7m n LYS 58 Cb 0.03 -1.11 -0.01 0.00 -0.02 0.00 0.00 35.03 33.92 1a7m n LYS 58 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1a7m n LEU 59 N -1.81 0.02 -1.70 -0.35 4.32 1.00 -4.78 117.00 113.71 1a7m n LEU 59 Ca -0.03 -0.24 -0.02 0.00 -0.02 0.00 0.00 56.01 55.71 1a7m n LEU 59 Cb 0.28 0.00 0.07 0.00 -1.62 0.00 0.00 43.42 42.15 1a7m n LEU 59 CO 0.10 0.01 0.14 0.00 -1.22 0.00 0.00 177.39 176.41 1a7m n GLY 61 N -0.40 -0.18 3.78 0.00 0.00 -0.80 -2.98 105.19 104.62 1a7m n GLY 61 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1a7m n GLY 61 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1a7m s PRO 62 N -0.88 2.45 -0.26 1.61 0.04 -1.26 -2.24 135.00 134.46 1a7m s PRO 62 Ca 0.00 1.09 -0.10 0.00 0.04 0.00 0.00 61.00 62.03 1a7m s PRO 62 Cb 0.00 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.57 1a7m s PRO 62 CO 0.00 -1.49 0.16 0.54 0.04 0.00 0.00 177.00 176.25 1a7m s ASN 63 N -3.52 5.88 0.00 6.66 4.22 -1.26 -4.71 114.94 122.21 1a7m s ASN 63 Ca 0.60 -0.00 0.00 0.00 -2.14 0.00 0.00 52.86 51.32 1a7m s ASN 63 Cb -0.16 -2.08 0.00 0.00 1.28 0.00 0.00 41.25 40.29 1a7m s ASN 63 CO 0.56 -0.00 0.19 1.33 -2.04 0.00 0.00 177.10 177.13 1a7m n VAL 64 N 4.74 0.00 -1.36 3.54 0.24 -1.26 -5.05 118.33 119.18 1a7m n VAL 64 Ca -0.15 -0.34 0.00 0.00 -2.04 0.00 0.00 64.34 61.81 1a7m n VAL 64 Cb 0.52 1.18 0.00 0.00 -1.47 0.00 0.00 33.84 34.07 1a7m n VAL 64 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 1a7m n THR 65 N -0.30 0.00 -1.47 3.34 5.66 -1.26 -5.00 114.28 115.25 1a7m n THR 65 Ca 0.00 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.66 1a7m n THR 65 Cb 0.05 -0.36 0.07 0.00 -1.55 0.00 0.00 70.33 68.54 1a7m n THR 65 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1a7m n ASP 66 N 0.00 7.41 -4.67 1.09 5.75 -1.26 -4.98 116.55 119.89 1a7m n ASP 66 Ca 0.00 -3.79 -0.42 0.00 -0.01 0.00 0.00 54.79 50.57 1a7m n ASP 66 Cb 0.00 -0.92 -0.03 0.00 -1.03 0.00 0.00 41.12 39.14 1a7m n ASP 66 CO 0.00 0.00 0.00 0.12 -0.11 0.00 0.00 177.20 177.21 1a7m s PHE 67 N -3.83 2.17 0.24 2.11 5.36 -1.26 -4.94 117.98 117.83 1a7m s PHE 67 Ca 0.62 0.30 -0.30 0.00 -0.96 0.00 0.00 56.93 56.60 1a7m s PHE 67 Cb 0.49 -3.89 -0.09 0.00 -0.34 0.00 0.00 43.02 39.19 1a7m s PHE 67 CO -0.05 -3.65 1.36 -1.25 -1.46 0.00 0.00 175.22 170.17 1a7m s PRO 68 N 3.58 4.34 -1.53 10.12 0.04 -1.26 -4.87 135.00 145.42 1a7m s PRO 68 Ca 0.72 2.17 -0.09 0.00 0.04 0.00 0.00 61.00 63.84 1a7m s PRO 68 Cb -0.34 -3.14 -0.02 0.00 0.04 0.00 0.00 34.50 31.03 1a7m s PRO 68 CO 0.29 -0.30 2.78 -0.35 0.04 0.00 0.00 177.00 179.46 1a7m n PRO 69 N 2.26 3.97 -0.22 0.56 -0.04 -1.26 -4.91 135.00 135.35 1a7m n PRO 69 Ca 0.05 -2.60 -0.08 0.00 -0.04 0.00 0.00 63.50 60.84 1a7m n PRO 69 Cb 0.42 -2.76 -0.02 0.00 -0.04 0.00 0.00 33.50 31.10 1a7m n PRO 69 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1a7m n PHE 70 N 3.06 0.14 -3.26 0.54 -0.00 -1.26 -4.82 117.46 111.85 1a7m n PHE 70 Ca 0.73 0.10 -0.25 0.00 -0.00 0.00 0.00 57.45 58.03 1a7m n PHE 70 Cb 0.24 -0.37 -0.07 0.00 -0.00 0.00 0.00 39.48 39.28 1a7m n PHE 70 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.76 174.37 1a7m n HIS 71 N 1.42 1.81 -0.58 -5.13 1.44 -1.26 -5.02 115.22 107.90 1a7m n HIS 71 Ca 0.10 -3.88 -0.05 0.00 -2.01 0.00 0.00 57.72 51.88 1a7m n HIS 71 Cb -0.00 -0.46 -0.05 0.00 0.12 0.00 0.00 29.99 29.60 1a7m n HIS 71 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1a7m n ALA 72 N 0.91 0.38 -0.87 1.59 0.00 -1.26 -4.64 120.51 116.62 1a7m n ALA 72 Ca 0.26 -0.42 0.03 0.00 0.00 0.00 0.00 53.44 53.31 1a7m n ALA 72 Cb 0.48 -0.67 0.37 0.00 0.00 0.00 0.00 19.45 19.62 1a7m n ALA 72 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1a7m n ASN 73 N 2.32 5.39 -0.70 0.00 4.05 -1.26 -4.85 115.26 120.22 1a7m n ASN 73 Ca 0.16 -2.97 0.00 0.00 0.45 0.00 0.00 54.58 52.21 1a7m n ASN 73 Cb 0.15 -0.70 0.00 0.00 1.23 0.00 0.00 39.78 40.46 1a7m n ASN 73 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1a7m n GLY 74 N 0.42 0.67 2.67 8.20 0.00 -1.26 -5.06 105.19 110.82 1a7m n GLY 74 Ca 0.30 -0.50 -0.28 0.00 0.00 0.00 0.00 46.02 45.55 1a7m n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1a7m s THR 75 N -2.81 0.28 0.13 2.61 2.01 -1.26 -5.01 115.64 111.58 1a7m s THR 75 Ca 0.00 -0.57 -0.33 0.00 0.31 0.00 0.00 61.69 61.10 1a7m s THR 75 Cb 0.00 -0.96 -0.11 0.00 0.01 0.00 0.00 72.50 71.43 1a7m s THR 75 CO 0.00 -0.37 1.55 -0.33 -0.69 0.00 0.00 174.62 174.78 1a7m h GLU 76 N 8.31 -0.45 -0.80 4.92 3.07 -1.98 0.41 114.58 128.06 1a7m h GLU 76 Ca -0.16 0.03 0.19 0.00 -0.50 0.00 0.00 59.36 58.92 1a7m h GLU 76 Cb 1.10 0.10 -0.12 0.00 -0.84 0.00 0.00 28.75 28.99 1a7m h GLU 76 CO 0.36 -0.30 0.19 1.57 -1.40 0.00 0.00 179.01 179.43 1a7m h LYS 77 N -0.46 0.23 -0.32 2.33 2.10 -1.97 0.28 116.57 118.76 1a7m h LYS 77 Ca 0.06 -0.01 -0.04 0.00 -2.00 0.00 0.00 60.65 58.66 1a7m h LYS 77 Cb 0.63 -0.05 -0.01 0.00 -0.90 0.00 0.00 32.23 31.89 1a7m h LYS 77 CO -0.54 0.15 0.05 0.00 -2.00 0.00 0.00 179.45 177.12 1a7m h ALA 78 N 1.69 0.42 -0.56 0.07 0.00 -0.78 0.98 119.26 121.09 1a7m h ALA 78 Ca 0.47 -0.19 0.09 0.00 0.00 0.00 0.00 54.91 55.28 1a7m h ALA 78 Cb 0.87 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.47 1a7m h ALA 78 CO -0.58 0.11 0.18 0.87 0.00 0.00 0.00 179.25 179.82 1a7m h LYS 79 N 0.35 0.33 0.00 0.00 1.57 0.19 0.32 116.57 119.33 1a7m h LYS 79 Ca 0.10 -0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1a7m h LYS 79 Cb 0.34 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.57 1a7m h LYS 79 CO 0.01 0.22 -0.55 -0.07 -0.57 0.00 0.00 179.45 178.48 1a7m h LEU 80 N 0.34 0.00 -1.21 2.94 3.38 -0.39 -2.57 115.31 117.80 1a7m h LEU 80 Ca 0.28 -0.08 0.22 0.00 0.09 0.00 0.00 57.88 58.39 1a7m h LEU 80 Cb 0.35 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.01 1a7m h LEU 80 CO -0.31 0.83 0.62 0.58 0.09 0.00 0.00 178.44 180.26 1a7m h VAL 81 N -1.00 0.63 0.07 1.22 2.07 0.96 0.56 116.25 120.76 1a7m h VAL 81 Ca -0.05 -0.19 -0.27 0.00 0.82 0.00 0.00 66.70 67.01 1a7m h VAL 81 Cb 0.57 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 1a7m h VAL 81 CO -0.03 0.10 -1.32 -0.08 0.02 0.00 0.00 177.57 176.26 1a7m h GLU 82 N 0.57 0.16 0.37 1.57 4.81 -0.41 -1.03 114.58 120.62 1a7m h GLU 82 Ca 0.57 -0.26 -0.02 0.00 -0.13 0.00 0.00 59.36 59.52 1a7m h GLU 82 Cb 1.16 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.65 1a7m h GLU 82 CO -0.33 1.04 -0.18 1.37 -0.73 0.00 0.00 179.01 180.19 1a7m h LEU 83 N 0.04 -0.42 0.00 1.64 8.10 -0.37 0.31 115.31 124.61 1a7m h LEU 83 Ca -0.15 -0.09 0.00 0.00 0.11 0.00 0.00 57.88 57.75 1a7m h LEU 83 Cb 1.93 0.11 0.00 0.00 -0.44 0.00 0.00 40.66 42.26 1a7m h LEU 83 CO 0.15 -0.15 0.00 0.00 -4.11 0.00 0.00 178.44 174.33 1a7m n TYR 84 N -5.23 0.00 -0.28 0.17 4.19 0.17 0.63 117.16 116.81 1a7m n TYR 84 Ca -0.10 0.00 -0.06 0.00 3.31 0.00 0.00 57.90 61.04 1a7m n TYR 84 Cb 0.26 -0.14 -0.02 0.00 0.49 0.00 0.00 39.34 39.93 1a7m n TYR 84 CO 0.00 0.00 0.00 -0.09 0.91 0.00 0.00 176.86 177.68 1a7m h ARG 85 N 0.00 -0.13 -0.82 2.98 2.43 -1.22 0.75 114.38 118.37 1a7m h ARG 85 Ca 0.00 0.01 0.20 0.00 -0.81 0.00 0.00 59.98 59.38 1a7m h ARG 85 Cb 0.00 0.03 -0.13 0.00 -0.42 0.00 0.00 29.97 29.45 1a7m h ARG 85 CO 0.00 -0.08 0.20 1.98 -1.51 0.00 0.00 179.97 180.56 1a7m h MET 86 N -0.13 0.22 0.06 0.20 4.05 0.75 0.99 114.93 121.08 1a7m h MET 86 Ca 0.23 -0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.63 1a7m h MET 86 Cb 0.55 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.30 1a7m h MET 86 CO -0.80 0.15 -0.03 0.28 0.23 0.00 0.00 176.91 176.74 1a7m h VAL 87 N 0.23 0.00 -0.66 -5.77 2.07 0.35 -1.11 116.25 111.35 1a7m h VAL 87 Ca 0.49 -0.08 0.22 0.00 0.82 0.00 0.00 66.70 68.16 1a7m h VAL 87 Cb 0.94 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.58 1a7m h VAL 87 CO -0.60 0.00 0.16 0.00 0.02 0.00 0.00 177.57 177.15 1a7m n ALA 88 N -2.10 0.48 -0.02 1.67 0.00 0.23 0.19 120.51 120.96 1a7m n ALA 88 Ca -0.01 0.70 -0.16 0.00 0.00 0.00 0.00 53.44 53.96 1a7m n ALA 88 Cb 0.03 -0.59 -0.13 0.00 0.00 0.00 0.00 19.45 18.77 1a7m n ALA 88 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 1a7m h TYR 89 N 0.00 0.27 0.19 0.00 -0.00 -0.87 -2.52 116.97 114.03 1a7m h TYR 89 Ca 0.47 -0.18 -0.01 0.00 0.00 0.00 0.00 58.73 59.02 1a7m h TYR 89 Cb 1.11 -0.02 -0.00 0.00 0.00 0.00 0.00 36.73 37.82 1a7m h TYR 89 CO -0.20 1.07 -0.14 1.25 -0.00 0.00 0.00 178.16 180.14 1a7m h LEU 90 N -0.60 -0.36 -0.89 0.10 7.12 0.28 -2.55 115.31 118.42 1a7m h LEU 90 Ca -0.05 0.02 0.13 0.00 0.13 0.00 0.00 57.88 58.11 1a7m h LEU 90 Cb 1.19 0.11 -0.14 0.00 -0.53 0.00 0.00 40.66 41.29 1a7m h LEU 90 CO 0.07 -0.20 -0.42 0.77 -0.13 0.00 0.00 178.44 178.53 1a7m h SER 91 N -0.31 -1.53 -0.92 1.25 4.64 0.20 0.36 113.55 117.23 1a7m h SER 91 Ca -0.02 0.30 0.25 0.00 -0.47 0.00 0.00 61.79 61.84 1a7m h SER 91 Cb 0.26 0.76 -0.17 0.00 -0.31 0.00 0.00 62.40 62.94 1a7m h SER 91 CO 0.01 -0.29 0.07 0.00 -0.87 0.00 0.00 176.83 175.75 1a7m h ALA 92 N 1.09 1.12 -0.04 5.18 0.00 -1.29 0.62 119.26 125.94 1a7m h ALA 92 Ca 0.28 0.30 -0.02 0.00 0.00 0.00 0.00 54.91 55.47 1a7m h ALA 92 Cb 0.56 0.51 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1a7m h ALA 92 CO -0.90 -0.53 -0.06 1.03 0.00 0.00 0.00 179.25 178.79 1a7m h SER 93 N 0.06 0.12 -0.16 0.00 0.87 -0.02 -1.18 113.55 113.24 1a7m h SER 93 Ca 0.56 -0.53 0.05 0.00 -1.23 0.00 0.00 61.79 60.63 1a7m h SER 93 Cb 1.13 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 63.04 1a7m h SER 93 CO -0.82 0.63 0.35 0.25 -0.53 0.00 0.00 176.83 176.71 1a7m h LEU 94 N -0.39 0.00 0.00 2.23 5.85 0.22 -1.31 115.31 121.92 1a7m h LEU 94 Ca 0.00 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 1a7m h LEU 94 Cb 0.61 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1a7m h LEU 94 CO 0.01 0.00 -0.80 0.41 -0.34 0.00 0.00 178.44 177.72 1a7m n THR 95 N -3.26 1.46 -0.34 1.05 -1.04 0.18 -3.02 114.28 109.31 1a7m n THR 95 Ca 0.01 0.12 -0.01 0.00 -2.04 0.00 0.00 64.05 62.14 1a7m n THR 95 Cb 0.45 -2.26 0.13 0.00 -1.82 0.00 0.00 70.33 66.82 1a7m n THR 95 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1a7m h ASN 96 N -1.00 0.98 0.51 8.00 7.08 -0.91 -1.40 115.58 128.84 1a7m h ASN 96 Ca -0.14 -0.01 -0.02 0.00 -3.08 0.00 0.00 56.30 53.06 1a7m h ASN 96 Cb 0.81 -0.22 -0.01 0.00 -2.08 0.00 0.00 38.32 36.82 1a7m h ASN 96 CO -0.08 0.67 -0.36 -0.29 -2.08 0.00 0.00 177.43 175.28 1a7m h ILE 97 N 1.14 0.26 -0.95 6.14 6.09 -1.44 -2.05 117.51 126.70 1a7m h ILE 97 Ca 0.37 0.00 0.15 0.00 -1.37 0.00 0.00 64.86 64.01 1a7m h ILE 97 Cb 0.03 0.26 -0.16 0.00 0.47 0.00 0.00 36.82 37.42 1a7m h ILE 97 CO -0.13 0.00 -0.37 0.74 -3.07 0.00 0.00 178.15 175.32 1a7m h THR 98 N -0.85 0.02 0.00 2.19 2.02 -1.20 0.65 112.91 115.75 1a7m h THR 98 Ca -0.06 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.11 1a7m h THR 98 Cb 0.71 0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 67.14 1a7m h THR 98 CO 0.02 0.00 -0.06 -0.09 0.37 0.00 0.00 175.52 175.77 1a7m h ARG 99 N -0.02 0.00 0.00 6.66 2.43 -1.05 0.12 114.38 122.52 1a7m h ARG 99 Ca 0.35 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.49 1a7m h ARG 99 Cb 0.60 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.15 1a7m h ARG 99 CO -0.96 0.06 -0.53 0.22 -1.51 0.00 0.00 179.97 177.25 1a7m h ASP 100 N 0.00 0.00 -0.69 -3.80 3.58 0.36 -3.33 116.42 112.54 1a7m h ASP 100 Ca -0.00 -0.07 0.15 0.00 0.42 0.00 0.00 57.03 57.52 1a7m h ASP 100 Cb 0.13 0.00 -0.11 0.00 1.72 0.00 0.00 39.33 41.07 1a7m h ASP 100 CO 0.01 0.81 0.13 1.56 -2.88 0.00 0.00 179.24 178.87 1a7m h GLN 101 N -1.00 0.22 -0.00 0.28 1.08 0.17 0.95 115.11 116.81 1a7m h GLN 101 Ca -0.04 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 1a7m h GLN 101 Cb 0.55 -0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 27.93 1a7m h GLN 101 CO -0.02 0.15 0.00 1.57 -0.95 0.00 0.00 178.83 179.57 1a7m h LYS 102 N 0.23 0.00 0.00 1.46 2.10 -0.94 0.12 116.57 119.54 1a7m h LYS 102 Ca 0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.03 1a7m h LYS 102 Cb 0.64 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 1a7m h LYS 102 CO -0.50 0.00 -1.85 0.28 -2.00 0.00 0.00 179.45 175.38 1a7m n VAL 103 N -4.04 0.09 -0.02 0.07 0.31 0.14 -4.52 118.33 110.36 1a7m n VAL 103 Ca -0.03 -0.51 -0.14 0.00 -0.01 0.00 0.00 64.34 63.66 1a7m n VAL 103 Cb 0.08 -0.05 -0.14 0.00 -0.91 0.00 0.00 33.84 32.82 1a7m n VAL 103 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1a7m n LEU 104 N -2.32 1.55 -3.93 7.52 0.00 0.28 -5.00 117.00 115.11 1a7m n LEU 104 Ca -0.03 0.31 -0.14 0.00 0.00 0.00 0.00 56.01 56.14 1a7m n LEU 104 Cb 0.57 -0.33 -0.14 0.00 0.00 0.00 0.00 43.42 43.52 1a7m n LEU 104 CO 0.45 0.58 -0.39 0.20 0.00 0.00 0.00 177.39 178.24 1a7m s ASN 105 N -6.43 0.38 0.44 1.96 -0.87 0.33 -5.04 114.94 105.71 1a7m s ASN 105 Ca -0.12 -0.08 0.30 0.00 -1.57 0.00 0.00 52.86 51.39 1a7m s ASN 105 Cb 0.07 -0.04 1.46 0.00 -0.02 0.00 0.00 41.25 42.73 1a7m s ASN 105 CO 0.80 0.03 1.91 1.55 -2.57 0.00 0.00 177.10 178.82 1a7m h PRO 106 N 6.00 0.00 0.00 -0.60 0.13 -1.90 -2.66 132.00 132.98 1a7m h PRO 106 Ca -0.27 0.00 -0.42 0.00 -0.87 0.00 0.00 66.00 64.45 1a7m h PRO 106 Cb 1.20 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.26 1a7m h PRO 106 CO 0.50 0.00 -2.48 0.45 -0.23 0.00 0.00 178.00 176.24 1a7m n SER 107 N -2.63 1.97 -0.29 1.44 2.88 -1.26 -4.40 113.62 111.34 1a7m n SER 107 Ca -0.00 0.06 0.07 0.00 -1.33 0.00 0.00 58.87 57.66 1a7m n SER 107 Cb 0.15 -0.59 0.18 0.00 -0.75 0.00 0.00 64.21 63.20 1a7m n SER 107 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1a7m h ALA 108 N -0.39 0.82 -0.84 -1.46 0.00 -1.74 0.31 119.26 115.96 1a7m h ALA 108 Ca -0.62 0.28 0.28 0.00 0.00 0.00 0.00 54.91 54.85 1a7m h ALA 108 Cb 1.79 0.51 -0.15 0.00 0.00 0.00 0.00 17.79 19.93 1a7m h ALA 108 CO -0.22 -0.45 0.20 1.33 0.00 0.00 0.00 179.25 180.11 1a7m n VAL 109 N -5.42 -0.35 0.35 0.00 0.24 -1.03 0.11 118.33 112.23 1a7m n VAL 109 Ca 0.15 1.78 -0.15 0.00 -2.04 0.00 0.00 64.34 64.09 1a7m n VAL 109 Cb 0.53 -2.72 -0.07 0.00 -1.47 0.00 0.00 33.84 30.10 1a7m n VAL 109 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1a7m h SER 110 N 0.00 -0.78 -0.93 -1.34 0.02 -0.67 -1.73 113.55 108.12 1a7m h SER 110 Ca 0.59 0.01 0.25 0.00 -0.84 0.00 0.00 61.79 61.80 1a7m h SER 110 Cb 1.40 0.20 -0.17 0.00 0.14 0.00 0.00 62.40 63.96 1a7m h SER 110 CO -0.73 -0.41 -0.00 -0.11 -1.14 0.00 0.00 176.83 174.44 1a7m n LEU 111 N -5.40 -0.13 0.07 5.07 0.00 0.31 -0.32 117.00 116.59 1a7m n LEU 111 Ca -0.12 1.58 -0.15 0.00 0.00 0.00 0.00 56.01 57.32 1a7m n LEU 111 Cb 0.37 -0.57 -0.07 0.00 0.00 0.00 0.00 43.42 43.16 1a7m n LEU 111 CO 0.30 -1.60 0.13 1.12 0.00 0.00 0.00 177.39 177.34 1a7m h HIS 112 N 0.00 0.70 -0.72 1.96 2.07 -0.78 -2.52 115.15 115.85 1a7m h HIS 112 Ca 0.55 -0.39 0.16 0.00 -2.85 0.00 0.00 60.37 57.84 1a7m h HIS 112 Cb 1.12 -0.07 -0.12 0.00 2.57 0.00 0.00 27.41 30.91 1a7m h HIS 112 CO -0.50 1.22 0.10 0.66 -3.07 0.00 0.00 177.93 176.34 1a7m h SER 113 N 0.25 -0.15 -0.08 3.10 4.64 0.28 0.73 113.55 122.31 1a7m h SER 113 Ca -0.10 0.16 0.03 0.00 -0.47 0.00 0.00 61.79 61.42 1a7m h SER 113 Cb 1.65 0.26 -0.04 0.00 -0.31 0.00 0.00 62.40 63.96 1a7m h SER 113 CO 0.18 -0.10 -0.13 0.50 -0.87 0.00 0.00 176.83 176.41 1a7m h LYS 114 N 0.19 -0.17 -0.81 4.77 1.63 -1.47 -1.42 116.57 119.29 1a7m h LYS 114 Ca 0.40 0.01 0.14 0.00 -0.85 0.00 0.00 60.65 60.35 1a7m h LYS 114 Cb 0.69 0.04 -0.09 0.00 -0.60 0.00 0.00 32.23 32.27 1a7m h LYS 114 CO -0.56 -0.11 0.40 -0.07 -3.45 0.00 0.00 179.45 175.65 1a7m h LEU 115 N -0.17 0.47 -0.49 5.20 3.38 0.65 -1.67 115.31 122.68 1a7m h LEU 115 Ca 0.07 0.09 0.10 0.00 0.09 0.00 0.00 57.88 58.23 1a7m h LEU 115 Cb 0.28 0.02 -0.10 0.00 0.09 0.00 0.00 40.66 40.95 1a7m h LEU 115 CO -0.18 0.20 -0.22 0.78 0.09 0.00 0.00 178.44 179.11 1a7m h ASN 116 N 0.58 -0.78 0.98 -0.43 4.21 0.90 0.87 115.58 121.92 1a7m h ASN 116 Ca 0.44 0.18 -0.05 0.00 1.21 0.00 0.00 56.30 58.08 1a7m h ASN 116 Cb 0.60 0.42 0.01 0.00 -1.12 0.00 0.00 38.32 38.23 1a7m h ASN 116 CO -0.36 -0.25 -0.49 0.00 -1.29 0.00 0.00 177.43 175.05 1a7m h ALA 117 N 1.20 -1.35 -0.99 -0.83 0.00 -1.02 0.13 119.26 116.39 1a7m h ALA 117 Ca 0.23 -0.29 0.33 0.00 0.00 0.00 0.00 54.91 55.17 1a7m h ALA 117 Cb 0.47 0.54 -0.15 0.00 0.00 0.00 0.00 17.79 18.65 1a7m h ALA 117 CO -0.56 -1.26 0.53 1.79 0.00 0.00 0.00 179.25 179.75 1a7m h THR 118 N -1.34 0.26 -0.13 0.00 1.35 -1.00 0.35 112.91 112.41 1a7m h THR 118 Ca -0.13 -0.09 -0.23 0.00 -0.55 0.00 0.00 66.41 65.40 1a7m h THR 118 Cb 1.03 -0.04 0.01 0.00 -1.73 0.00 0.00 68.15 67.43 1a7m h THR 118 CO 0.21 0.05 -0.82 0.40 -0.25 0.00 0.00 175.52 175.11 1a7m h ILE 119 N 0.27 1.28 -0.01 6.82 2.04 -0.44 -2.05 117.51 125.43 1a7m h ILE 119 Ca 0.73 -2.03 -0.03 0.00 1.00 0.00 0.00 64.86 64.54 1a7m h ILE 119 Cb 1.69 2.05 0.00 0.00 -0.74 0.00 0.00 36.82 39.83 1a7m h ILE 119 CO -0.63 0.64 -0.12 -0.78 0.00 0.00 0.00 178.15 177.26 1a7m h ASP 120 N 0.51 0.11 -0.81 1.72 1.82 0.19 0.11 116.42 120.08 1a7m h ASP 120 Ca -0.07 -0.74 0.12 0.00 -0.39 0.00 0.00 57.03 55.95 1a7m h ASP 120 Cb 1.46 -0.03 -0.06 0.00 0.68 0.00 0.00 39.33 41.37 1a7m h ASP 120 CO 0.17 0.84 0.53 -0.37 -1.61 0.00 0.00 179.24 178.80 1a7m h VAL 121 N -0.60 0.90 0.07 2.25 -1.51 -0.56 0.85 116.25 117.63 1a7m h VAL 121 Ca -0.01 -0.23 -0.00 0.00 -1.23 0.00 0.00 66.70 65.23 1a7m h VAL 121 Cb 0.85 0.17 0.00 0.00 -2.13 0.00 0.00 31.29 30.19 1a7m h VAL 121 CO 0.02 0.12 -0.03 0.24 -1.23 0.00 0.00 177.57 176.69 1a7m h MET 122 N 0.67 -0.09 -0.87 5.19 2.86 -1.19 0.56 114.93 122.07 1a7m h MET 122 Ca 0.38 0.01 0.13 0.00 -2.06 0.00 0.00 59.70 58.16 1a7m h MET 122 Cb 0.58 0.02 -0.14 0.00 0.06 0.00 0.00 31.60 32.12 1a7m h MET 122 CO -0.15 0.09 -0.42 -0.09 1.06 0.00 0.00 176.91 177.39 1a7m h ARG 123 N -0.25 -0.06 -0.34 1.72 9.65 0.17 0.56 114.38 125.83 1a7m h ARG 123 Ca -0.01 0.00 0.02 0.00 -1.10 0.00 0.00 59.98 58.89 1a7m h ARG 123 Cb 0.21 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.78 1a7m h ARG 123 CO 0.01 -0.04 0.19 0.78 2.80 0.00 0.00 179.97 183.72 1a7m h GLY 124 N -0.06 0.47 0.21 2.80 0.00 -1.08 0.06 103.07 105.47 1a7m h GLY 124 Ca 0.27 -0.14 0.10 0.00 0.00 0.00 0.00 47.33 47.56 1a7m h GLY 124 CO -0.89 0.12 0.06 -2.00 0.00 0.00 0.00 176.54 173.83 1a7m h LEU 125 N 0.39 -0.11 0.05 3.11 6.46 0.22 0.30 115.31 125.74 1a7m h LEU 125 Ca 0.14 0.11 -0.00 0.00 -0.12 0.00 0.00 57.88 58.00 1a7m h LEU 125 Cb 0.02 0.18 0.00 0.00 -0.73 0.00 0.00 40.66 40.12 1a7m h LEU 125 CO -0.07 -0.03 -0.02 -0.07 -0.62 0.00 0.00 178.44 177.62 1a7m h LEU 126 N 0.18 -0.06 -0.67 2.25 4.07 0.08 0.35 115.31 121.51 1a7m h LEU 126 Ca 0.27 -0.23 0.10 0.00 0.08 0.00 0.00 57.88 58.11 1a7m h LEU 126 Cb 0.40 0.01 -0.12 0.00 1.08 0.00 0.00 40.66 42.03 1a7m h LEU 126 CO -0.39 0.20 -0.40 -1.28 -1.08 0.00 0.00 178.44 175.48 1a7m h SER 127 N -0.31 -1.40 -0.53 -0.43 0.87 0.07 0.59 113.55 112.41 1a7m h SER 127 Ca -0.01 0.25 0.10 0.00 -1.23 0.00 0.00 61.79 60.90 1a7m h SER 127 Cb 0.28 0.67 -0.08 0.00 -0.44 0.00 0.00 62.40 62.83 1a7m h SER 127 CO 0.01 -0.31 0.07 0.78 -0.53 0.00 0.00 176.83 176.85 1a7m h ASN 128 N -0.16 -0.08 0.73 6.23 2.35 -0.25 0.27 115.58 124.68 1a7m h ASN 128 Ca 0.23 0.11 -0.04 0.00 -0.55 0.00 0.00 56.30 56.05 1a7m h ASN 128 Cb 0.56 0.16 0.01 0.00 0.05 0.00 0.00 38.32 39.10 1a7m h ASN 128 CO -0.75 -0.02 -0.35 0.58 -1.65 0.00 0.00 177.43 175.25 1a7m h VAL 129 N 0.20 0.00 -0.02 2.81 2.07 0.22 0.18 116.25 121.71 1a7m h VAL 129 Ca 0.27 -0.24 0.01 0.00 0.82 0.00 0.00 66.70 67.56 1a7m h VAL 129 Cb 0.39 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 1a7m h VAL 129 CO -0.38 0.00 0.03 0.25 0.02 0.00 0.00 177.57 177.49 1a7m h LEU 130 N -1.22 0.00 0.12 2.57 7.12 -0.32 0.47 115.31 124.05 1a7m h LEU 130 Ca -0.10 0.00 -0.32 0.00 0.13 0.00 0.00 57.88 57.59 1a7m h LEU 130 Cb 0.75 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.87 1a7m h LEU 130 CO 0.16 0.00 -1.61 0.00 -0.13 0.00 0.00 178.44 176.87 1a7m h ARG 132 N 0.07 -0.53 -0.39 0.00 9.65 0.20 -3.30 114.38 120.07 1a7m h ARG 132 Ca -0.27 0.04 0.05 0.00 -1.10 0.00 0.00 59.98 58.69 1a7m h ARG 132 Cb 2.03 0.12 -0.06 0.00 -1.39 0.00 0.00 29.97 30.67 1a7m h ARG 132 CO 0.15 -0.22 -0.19 1.28 2.80 0.00 0.00 179.97 183.80 1a7m n LEU 133 N -5.18 -0.32 -0.16 3.80 4.77 0.14 0.09 117.00 120.13 1a7m n LEU 133 Ca -0.10 0.69 0.06 0.00 -0.03 0.00 0.00 56.01 56.64 1a7m n LEU 133 Cb 0.29 -0.13 0.12 0.00 -2.33 0.00 0.00 43.42 41.37 1a7m n LEU 133 CO 0.28 -0.60 0.35 0.00 -1.33 0.00 0.00 177.39 176.09 1a7m n ASN 135 N -4.57 -0.23 -0.25 0.00 5.03 0.11 -1.88 115.26 113.48 1a7m n ASN 135 Ca 0.10 0.51 0.00 0.00 0.87 0.00 0.00 54.58 56.06 1a7m n ASN 135 Cb 0.33 -0.10 0.00 0.00 -1.02 0.00 0.00 39.78 38.99 1a7m n ASN 135 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1a7m n LYS 136 N -4.40 0.01 -2.68 3.52 5.02 0.08 -4.86 118.16 114.85 1a7m n LYS 136 Ca 0.02 -0.75 -0.18 0.00 -2.02 0.00 0.00 58.31 55.38 1a7m n LYS 136 Cb 0.10 -0.50 0.01 0.00 -0.02 0.00 0.00 35.03 34.62 1a7m n LYS 136 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1a7m n TYR 137 N -0.00 2.11 -2.21 2.13 4.01 0.14 -4.88 117.16 118.47 1a7m n TYR 137 Ca 0.00 -3.14 -0.40 0.00 -0.16 0.00 0.00 57.90 54.21 1a7m n TYR 137 Cb 0.60 -0.29 0.02 0.00 -0.31 0.00 0.00 39.34 39.36 1a7m n TYR 137 CO 0.00 0.00 0.00 2.89 -0.46 0.00 0.00 176.86 179.29 1a7m n ARG 138 N -0.19 3.99 -0.00 -0.72 1.85 -1.16 -4.03 116.66 116.40 1a7m n ARG 138 Ca 0.23 -3.94 -0.03 0.00 -1.00 0.00 0.00 57.85 53.12 1a7m n ARG 138 Cb 0.71 -2.37 -0.01 0.00 -1.05 0.00 0.00 32.46 29.74 1a7m n ARG 138 CO 0.00 0.00 0.00 1.55 -0.01 0.00 0.00 177.63 179.17 1a7m n VAL 139 N -0.13 0.47 0.00 8.89 3.14 -1.22 -4.78 118.33 124.70 1a7m n VAL 139 Ca 0.51 0.07 0.00 0.00 -2.96 0.00 0.00 64.34 61.96 1a7m n VAL 139 Cb 0.26 -1.58 0.00 0.00 -1.06 0.00 0.00 33.84 31.46 1a7m n VAL 139 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1a7m n GLY 140 N 2.92 0.52 2.75 7.55 0.00 -1.26 -4.83 105.19 112.85 1a7m n GLY 140 Ca -0.05 -0.76 -0.03 0.00 0.00 0.00 0.00 46.02 45.18 1a7m n GLY 140 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1a7m n HIS 141 N 0.00 1.38 0.03 1.61 1.44 -1.26 -4.89 115.22 113.53 1a7m n HIS 141 Ca 0.00 -2.24 -0.22 0.00 -2.01 0.00 0.00 57.72 53.25 1a7m n HIS 141 Cb 0.00 -0.26 -0.14 0.00 0.12 0.00 0.00 29.99 29.71 1a7m n HIS 141 CO 0.00 0.00 0.00 -0.24 -2.81 0.00 0.00 176.34 173.29 1a7m h VAL 142 N 5.00 0.95 -4.81 0.61 3.04 -1.97 -3.50 116.25 115.57 1a7m h VAL 142 Ca -0.09 -2.43 0.00 0.00 -1.01 0.00 0.00 66.70 63.17 1a7m h VAL 142 Cb 1.27 2.71 -0.01 0.00 -2.01 0.00 0.00 31.29 33.25 1a7m h VAL 142 CO 0.27 0.77 -0.28 0.47 -1.01 0.00 0.00 177.57 177.79 1a7m n ASP 143 N -3.77 -3.61 -3.77 3.17 8.00 -1.26 -4.95 116.55 110.36 1a7m n ASP 143 Ca -0.26 1.15 -0.28 0.00 0.71 0.00 0.00 54.79 56.11 1a7m n ASP 143 Cb 0.97 -2.37 -0.12 0.00 -0.02 0.00 0.00 41.12 39.58 1a7m n ASP 143 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1a7m s VAL 144 N -0.14 2.13 0.35 2.53 -7.23 -1.26 -4.92 120.40 111.85 1a7m s VAL 144 Ca -0.03 -3.65 -0.23 0.00 -1.81 0.00 0.00 61.98 56.27 1a7m s VAL 144 Cb 0.00 -2.42 -0.10 0.00 0.56 0.00 0.00 36.38 34.42 1a7m s VAL 144 CO 0.07 -1.03 0.91 -2.16 -0.31 0.00 0.00 175.10 172.58 1a7m s PRO 145 N -0.82 4.37 -1.31 4.82 0.04 -1.26 -4.99 135.00 135.85 1a7m s PRO 145 Ca 0.25 1.15 -0.17 0.00 0.04 0.00 0.00 61.00 62.27 1a7m s PRO 145 Cb -0.06 -2.55 0.07 0.00 0.04 0.00 0.00 34.50 32.00 1a7m s PRO 145 CO -0.14 0.17 1.78 -0.35 0.04 0.00 0.00 177.00 178.49 1a7m n PRO 146 N 0.06 3.17 -3.62 0.56 -0.04 -1.26 -4.77 135.00 129.09 1a7m n PRO 146 Ca 0.04 -3.24 -0.40 0.00 -0.04 0.00 0.00 63.50 59.86 1a7m n PRO 146 Cb 0.52 -3.45 -0.11 0.00 -0.04 0.00 0.00 33.50 30.42 1a7m n PRO 146 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1a7m s VAL 147 N 3.93 4.55 -0.22 0.52 1.01 -1.26 -4.98 120.40 123.95 1a7m s VAL 147 Ca 0.52 -0.72 -0.16 0.00 0.00 0.00 0.00 61.98 61.63 1a7m s VAL 147 Cb 0.05 -3.46 -0.09 0.00 0.00 0.00 0.00 36.38 32.87 1a7m s VAL 147 CO 0.06 -0.13 -0.27 -0.81 0.00 0.00 0.00 175.10 173.94 1a7m n PRO 148 N 4.98 0.55 -0.33 2.72 -0.04 -1.26 -4.94 135.00 136.67 1a7m n PRO 148 Ca -0.13 0.30 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 1a7m n PRO 148 Cb 0.47 -1.52 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 1a7m n PRO 148 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1a7m n ASP 149 N -4.39 0.00 -1.77 3.54 -0.08 -1.26 -4.79 116.55 107.79 1a7m n ASP 149 Ca -0.31 0.00 -0.17 0.00 -1.51 0.00 0.00 54.79 52.80 1a7m n ASP 149 Cb 0.65 0.00 0.06 0.00 2.34 0.00 0.00 41.12 44.17 1a7m n ASP 149 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 1a7m n HIS 150 N 0.50 2.13 -1.64 -0.67 8.25 -1.26 -4.64 115.22 117.90 1a7m n HIS 150 Ca 0.00 -2.06 -0.31 0.00 -0.26 0.00 0.00 57.72 55.09 1a7m n HIS 150 Cb 0.00 -0.32 -0.04 0.00 1.12 0.00 0.00 29.99 30.76 1a7m n HIS 150 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1a7m n SER 151 N -0.77 6.83 -0.05 0.41 2.88 -1.26 -3.95 113.62 117.71 1a7m n SER 151 Ca 0.37 -3.28 -0.07 0.00 -1.33 0.00 0.00 58.87 54.57 1a7m n SER 151 Cb 0.91 -1.23 -0.04 0.00 -0.75 0.00 0.00 64.21 63.09 1a7m n SER 151 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1a7m n ASP 152 N 0.83 2.94 -3.92 -3.46 5.75 -1.26 -5.02 116.55 112.41 1a7m n ASP 152 Ca 0.51 -0.03 -0.17 0.00 -0.01 0.00 0.00 54.79 55.10 1a7m n ASP 152 Cb 0.47 -0.17 -0.15 0.00 -1.03 0.00 0.00 41.12 40.23 1a7m n ASP 152 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1a7m s LYS 153 N -2.19 0.47 0.00 0.11 1.02 -1.25 -5.06 119.74 112.83 1a7m s LYS 153 Ca -0.13 -0.12 0.00 0.00 0.02 0.00 0.00 55.97 55.74 1a7m s LYS 153 Cb 0.04 -0.49 0.00 0.00 -0.52 0.00 0.00 37.83 36.85 1a7m s LYS 153 CO 0.22 0.03 0.00 0.39 -0.92 0.00 0.00 175.35 175.07 1a7m n GLU 154 N 3.38 0.00 -0.32 1.68 1.02 -1.26 0.12 120.64 125.27 1a7m n GLU 154 Ca -0.18 0.00 0.30 0.00 -0.02 0.00 0.00 57.16 57.26 1a7m n GLU 154 Cb 0.55 0.00 0.56 0.00 -0.02 0.00 0.00 31.44 32.53 1a7m n GLU 154 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1a7m n VAL 155 N 0.00 -0.41 0.00 2.62 0.31 -1.26 0.18 118.33 119.76 1a7m n VAL 155 Ca 0.00 2.02 -0.02 0.00 -0.01 0.00 0.00 64.34 66.33 1a7m n VAL 155 Cb 0.00 -3.25 -0.01 0.00 -0.91 0.00 0.00 33.84 29.67 1a7m n VAL 155 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 1a7m h PHE 156 N 0.00 -0.19 -0.50 3.52 0.04 -1.95 -2.03 116.94 115.82 1a7m h PHE 156 Ca 0.82 0.01 0.07 0.00 2.80 0.00 0.00 57.97 61.66 1a7m h PHE 156 Cb 2.13 0.09 -0.07 0.00 2.20 0.00 0.00 35.95 40.29 1a7m h PHE 156 CO -0.05 -0.07 -0.23 0.94 -0.60 0.00 0.00 178.31 178.30 1a7m n GLN 157 N -2.89 -0.15 -0.13 1.51 7.27 0.47 0.98 117.38 124.43 1a7m n GLN 157 Ca -0.01 0.77 -0.04 0.00 0.07 0.00 0.00 57.00 57.80 1a7m n GLN 157 Cb 0.05 -1.14 0.04 0.00 2.41 0.00 0.00 30.24 31.59 1a7m n GLN 157 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 1a7m h LYS 158 N 0.00 0.10 0.00 3.69 1.57 -1.14 0.30 116.57 121.09 1a7m h LYS 158 Ca 0.14 -0.01 -0.19 0.00 -1.87 0.00 0.00 60.65 58.73 1a7m h LYS 158 Cb 0.27 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.52 1a7m h LYS 158 CO -0.49 0.07 -1.22 0.87 -0.57 0.00 0.00 179.45 178.11 1a7m h LYS 159 N 0.10 0.00 -0.00 3.15 1.57 0.11 -3.35 116.57 118.15 1a7m h LYS 159 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1a7m h LYS 159 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 1a7m h LYS 159 CO -0.36 0.50 -0.53 0.36 -0.57 0.00 0.00 179.45 178.85 1a7m n LYS 160 N -3.07 0.19 -0.27 3.15 2.85 0.21 -4.13 118.16 117.08 1a7m n LYS 160 Ca -0.07 -0.12 0.24 0.00 -1.05 0.00 0.00 58.31 57.31 1a7m n LYS 160 Cb 0.88 -1.50 0.42 0.00 -0.65 0.00 0.00 35.03 34.18 1a7m n LYS 160 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 177.40 177.24 1a7m n LEU 161 N -1.30 0.16 -0.13 -5.58 7.94 0.11 0.10 117.00 118.30 1a7m n LEU 161 Ca 0.07 0.94 -0.25 0.00 -1.11 0.00 0.00 56.01 55.65 1a7m n LEU 161 Cb 0.34 -0.46 -0.10 0.00 0.53 0.00 0.00 43.42 43.73 1a7m n LEU 161 CO 0.34 -1.03 -1.37 0.61 -1.11 0.00 0.00 177.39 174.83 1a7m n GLY 162 N -1.28 -0.40 0.33 -3.96 0.00 -1.26 -4.52 105.19 94.09 1a7m n GLY 162 Ca 0.25 -0.14 -0.06 0.00 0.00 0.00 0.00 46.02 46.08 1a7m n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a7m h GLN 164 N -0.19 0.00 0.07 0.00 -0.00 -0.55 0.30 115.11 114.74 1a7m h GLN 164 Ca 0.21 0.00 -0.32 0.00 -0.00 0.00 0.00 58.65 58.54 1a7m h GLN 164 Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 27.48 27.98 1a7m h GLN 164 CO -0.60 0.00 -1.75 1.28 0.00 0.00 0.00 178.83 177.75 1a7m n LEU 165 N -3.05 2.34 -0.33 -2.39 4.32 0.11 -3.28 117.00 114.72 1a7m n LEU 165 Ca -0.03 0.28 0.02 0.00 -0.02 0.00 0.00 56.01 56.27 1a7m n LEU 165 Cb 0.10 -1.05 0.16 0.00 -1.62 0.00 0.00 43.42 41.01 1a7m n LEU 165 CO 0.19 0.64 1.22 -0.07 -1.22 0.00 0.00 177.39 178.15 1a7m h LEU 166 N -0.35 0.90 0.10 2.23 -0.00 0.51 0.45 115.31 119.15 1a7m h LEU 166 Ca -0.41 0.02 -0.00 0.00 -0.00 0.00 0.00 57.88 57.49 1a7m h LEU 166 Cb 1.75 -0.17 -0.00 0.00 -0.00 0.00 0.00 40.66 42.24 1a7m h LEU 166 CO -0.04 0.56 -0.07 1.23 -0.00 0.00 0.00 178.44 180.12 1a7m h GLY 167 N 1.03 -0.56 -0.35 0.83 0.00 -1.04 0.31 103.07 103.30 1a7m h GLY 167 Ca 0.41 0.24 0.03 0.00 0.00 0.00 0.00 47.33 48.01 1a7m h GLY 167 CO -0.19 -0.20 -0.22 -0.91 0.00 0.00 0.00 176.54 175.02 1a7m h THR 168 N -0.16 0.00 -0.78 4.70 1.35 -1.25 0.18 112.91 116.96 1a7m h THR 168 Ca -0.01 0.00 0.10 0.00 -0.55 0.00 0.00 66.41 65.95 1a7m h THR 168 Cb 0.14 0.00 -0.11 0.00 -1.73 0.00 0.00 68.15 66.44 1a7m h THR 168 CO 0.01 0.00 -0.35 0.00 -0.25 0.00 0.00 175.52 174.93 1a7m n TYR 169 N -3.83 -0.09 -0.24 4.73 9.36 0.16 0.11 117.16 127.35 1a7m n TYR 169 Ca 0.00 0.96 -0.06 0.00 3.32 0.00 0.00 57.90 62.13 1a7m n TYR 169 Cb 0.10 -0.72 0.05 0.00 -0.63 0.00 0.00 39.34 38.14 1a7m n TYR 169 CO 0.00 0.00 0.00 -0.22 0.22 0.00 0.00 176.86 176.86 1a7m h LYS 170 N 0.00 0.93 -0.23 2.98 3.11 0.26 0.93 116.57 124.54 1a7m h LYS 170 Ca 0.22 -0.10 -0.13 0.00 -2.81 0.00 0.00 60.65 57.83 1a7m h LYS 170 Cb 0.42 -0.19 -0.01 0.00 -1.00 0.00 0.00 32.23 31.45 1a7m h LYS 170 CO -0.76 0.69 -0.41 0.37 -2.81 0.00 0.00 179.45 176.53 1a7m h GLN 171 N 0.92 0.55 0.01 1.90 4.15 0.23 -2.33 115.11 120.54 1a7m h GLN 171 Ca 0.24 -0.28 -0.12 0.00 0.77 0.00 0.00 58.65 59.26 1a7m h GLN 171 Cb 0.01 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 1a7m h GLN 171 CO -0.04 0.86 -0.63 -0.39 -1.93 0.00 0.00 178.83 176.70 1a7m h VAL 172 N 0.46 1.37 -1.00 2.39 -1.51 -0.24 -3.34 116.25 114.37 1a7m h VAL 172 Ca 0.04 -2.28 0.17 0.00 -1.23 0.00 0.00 66.70 63.40 1a7m h VAL 172 Cb 0.90 2.84 -0.10 0.00 -2.13 0.00 0.00 31.29 32.81 1a7m h VAL 172 CO 0.08 0.48 0.62 0.40 -1.23 0.00 0.00 177.57 177.92 1a7m h ILE 173 N -0.96 0.78 0.00 7.19 1.08 0.80 0.90 117.51 127.29 1a7m h ILE 173 Ca -0.17 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 64.01 1a7m h ILE 173 Cb 1.18 -0.13 0.00 0.00 -3.07 0.00 0.00 36.82 34.79 1a7m h ILE 173 CO -0.09 0.15 0.00 -0.24 -0.69 0.00 0.00 178.15 177.28 1a7m n SER 174 N -4.71 0.07 0.00 1.72 2.88 -0.88 -0.26 113.62 112.44 1a7m n SER 174 Ca 0.22 -1.16 0.00 0.00 -1.33 0.00 0.00 58.87 56.60 1a7m n SER 174 Cb 0.50 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.93 1a7m n SER 174 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1a7m n VAL 175 N -0.41 0.00 0.06 2.46 0.31 0.28 -4.40 118.33 116.63 1a7m n VAL 175 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.26 1a7m n VAL 175 Cb 0.02 -0.52 -0.12 0.00 -0.91 0.00 0.00 33.84 32.31 1a7m n VAL 175 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 1a7m h VAL 176 N 0.00 1.71 0.00 2.52 -1.51 0.39 0.23 116.25 119.59 1a7m h VAL 176 Ca 0.00 -3.39 -0.03 0.00 -1.23 0.00 0.00 66.70 62.05 1a7m h VAL 176 Cb 0.69 2.84 -0.00 0.00 -2.13 0.00 0.00 31.29 32.69 1a7m h VAL 176 CO 0.00 0.97 -0.15 1.62 -1.23 0.00 0.00 177.57 178.78 1a7m h VAL 177 N 0.00 1.02 0.00 7.19 3.04 -0.86 0.72 116.25 127.36 1a7m h VAL 177 Ca -0.01 -0.54 0.00 0.00 -1.01 0.00 0.00 66.70 65.14 1a7m h VAL 177 Cb 1.77 1.30 0.00 0.00 -2.01 0.00 0.00 31.29 32.34 1a7m h VAL 177 CO 0.13 0.15 -1.27 1.67 -1.01 0.00 0.00 177.57 177.24 1a7m n GLN 178 N -4.23 0.48 0.06 4.17 7.27 -0.99 -4.36 117.38 119.78 1a7m n GLN 178 Ca -0.02 -0.02 -0.13 0.00 0.07 0.00 0.00 57.00 56.90 1a7m n GLN 178 Cb 0.22 -1.65 -0.09 0.00 2.41 0.00 0.00 30.24 31.14 1a7m n GLN 178 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1a7m h ALA 179 N 2.24 -0.14 0.00 1.69 0.00 0.19 -3.50 119.26 119.74 1a7m h ALA 179 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1a7m h ALA 179 Cb 0.88 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1a7m h ALA 179 CO 0.00 -0.42 0.00 1.97 0.00 0.00 0.00 179.25 180.80