#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 -2.20 -4.14 1.43 -0.04 -1.26 -5.11 135.00 123.68 1a7m n PRO 2 Ca 0.00 -0.87 -0.23 0.00 -0.04 0.00 0.00 63.50 62.36 1a7m n PRO 2 Cb 0.00 -0.84 -0.07 0.00 -0.04 0.00 0.00 33.50 32.56 1a7m n PRO 2 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1a7m s LEU 3 N 0.00 3.22 0.51 1.53 2.01 -1.26 -5.15 118.68 119.53 1a7m s LEU 3 Ca 0.36 -0.80 0.09 0.00 0.01 0.00 0.00 54.13 53.78 1a7m s LEU 3 Cb -0.04 -1.68 0.05 0.00 0.01 0.00 0.00 46.19 44.53 1a7m s LEU 3 CO 0.27 -0.29 0.65 -2.16 1.01 0.00 0.00 176.35 175.84 1a7m s PRO 4 N -3.82 2.50 -0.25 1.29 0.04 -1.26 -5.03 135.00 128.47 1a7m s PRO 4 Ca 0.37 -1.52 -0.43 0.00 0.04 0.00 0.00 61.00 59.45 1a7m s PRO 4 Cb -0.02 -2.62 -0.20 0.00 0.04 0.00 0.00 34.50 31.70 1a7m s PRO 4 CO 0.22 -0.59 1.35 1.51 0.04 0.00 0.00 177.00 179.54 1a7m n ILE 5 N -2.02 0.01 -4.99 0.56 3.06 -1.26 -4.96 119.36 109.77 1a7m n ILE 5 Ca 0.11 -0.00 -0.31 0.00 -2.50 0.00 0.00 62.75 60.05 1a7m n ILE 5 Cb 0.61 -0.29 -0.15 0.00 0.54 0.00 0.00 39.64 40.35 1a7m n ILE 5 CO 0.00 0.00 0.00 -0.89 -2.50 0.00 0.00 176.55 173.16 1a7m s THR 6 N 1.58 2.33 -1.10 9.51 2.01 -1.26 -5.05 115.64 123.66 1a7m s THR 6 Ca 0.98 -1.20 -0.21 0.00 0.31 0.00 0.00 61.69 61.58 1a7m s THR 6 Cb -1.37 -1.89 -0.07 0.00 0.01 0.00 0.00 72.50 69.17 1a7m s THR 6 CO 0.69 0.45 1.94 -0.81 -0.69 0.00 0.00 174.62 176.20 1a7m n PRO 7 N 1.99 2.00 -3.24 4.92 -0.04 -1.26 -4.72 135.00 134.65 1a7m n PRO 7 Ca -0.17 -2.41 -0.24 0.00 -0.04 0.00 0.00 63.50 60.64 1a7m n PRO 7 Cb 0.52 -3.36 -0.07 0.00 -0.04 0.00 0.00 33.50 30.55 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 6.60 0.28 -3.23 0.52 3.14 -1.26 -5.00 118.33 119.38 1a7m n VAL 8 Ca 0.48 -4.43 -0.41 0.00 -2.96 0.00 0.00 64.34 57.02 1a7m n VAL 8 Cb 0.43 -1.85 -0.01 0.00 -1.06 0.00 0.00 33.84 31.35 1a7m n VAL 8 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1a7m n ASN 9 N 1.12 5.61 -2.92 6.55 5.03 -1.26 -4.75 115.26 124.65 1a7m n ASN 9 Ca 0.24 -3.27 -0.25 0.00 0.87 0.00 0.00 54.58 52.17 1a7m n ASN 9 Cb 0.50 -1.22 -0.03 0.00 -1.02 0.00 0.00 39.78 38.01 1a7m n ASN 9 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1a7m n ALA 10 N 1.81 4.35 -0.69 5.41 0.00 -1.26 -4.82 120.51 125.31 1a7m n ALA 10 Ca 0.25 -4.46 0.08 0.00 0.00 0.00 0.00 53.44 49.31 1a7m n ALA 10 Cb 0.36 -0.74 0.25 0.00 0.00 0.00 0.00 19.45 19.32 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 -0.20 1.87 -1.61 0.00 -1.04 -1.26 0.39 114.28 112.43 1a7m n THR 11 Ca 0.31 -1.50 -0.01 0.00 -2.04 0.00 0.00 64.05 60.80 1a7m n THR 11 Cb 0.46 0.02 -0.00 0.00 -1.82 0.00 0.00 70.33 68.99 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 -0.60 1.49 -0.44 0.00 0.00 -1.26 -4.61 120.51 115.09 1a7m n ALA 13 Ca 0.00 -0.68 0.05 0.00 0.00 0.00 0.00 53.44 52.81 1a7m n ALA 13 Cb 0.01 0.13 0.09 0.00 0.00 0.00 0.00 19.45 19.68 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 -4.13 1.39 -1.05 0.00 -0.00 -1.26 -4.68 119.36 109.63 1a7m n ILE 14 Ca -0.20 -1.47 -0.03 0.00 -0.00 0.00 0.00 62.75 61.05 1a7m n ILE 14 Cb 0.52 0.21 0.31 0.00 -0.00 0.00 0.00 39.64 40.67 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 -0.65 3.69 -2.42 6.28 0.00 -1.26 -4.63 116.66 117.66 1a7m n ARG 15 Ca 0.08 -3.09 -0.16 0.00 -0.00 0.00 0.00 57.85 54.69 1a7m n ARG 15 Cb 0.45 -2.17 0.03 0.00 0.00 0.00 0.00 32.46 30.77 1a7m n ARG 15 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.63 175.24 1a7m n HIS 16 N -0.16 2.23 1.65 -0.14 1.44 -1.26 -4.31 115.22 114.68 1a7m n HIS 16 Ca 0.37 -2.43 0.08 0.00 -2.01 0.00 0.00 57.72 53.73 1a7m n HIS 16 Cb 1.31 -0.27 0.46 0.00 0.12 0.00 0.00 29.99 31.61 1a7m n HIS 16 CO 0.00 0.00 0.00 -0.35 -2.81 0.00 0.00 176.34 173.18 1a7m n PRO 17 N -0.55 0.83 -2.80 -1.40 -0.04 -1.26 -4.72 135.00 125.06 1a7m n PRO 17 Ca 0.28 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.31 1a7m n PRO 17 Cb 0.85 -1.29 -0.04 0.00 -0.04 0.00 0.00 33.50 32.97 1a7m n PRO 17 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a7m n HIS 19 N 7.01 -0.06 0.00 0.00 8.25 -1.26 -4.87 115.22 124.29 1a7m n HIS 19 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 1a7m n HIS 19 Cb 0.48 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.59 1a7m n HIS 19 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1a7m n GLY 20 N 5.00 2.18 1.35 -1.41 0.00 -1.26 -4.19 105.19 106.86 1a7m n GLY 20 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 4.02 0.00 0.00 1.61 3.02 -1.26 -5.04 115.26 117.62 1a7m n ASN 21 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1a7m n ASN 21 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1a7m n ASN 21 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1a7m n LEU 22 N -2.08 0.00 -0.26 3.41 0.00 -1.26 -4.18 117.00 112.63 1a7m n LEU 22 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 56.01 55.91 1a7m n LEU 22 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 43.42 43.36 1a7m n LEU 22 CO 0.00 0.00 0.53 0.24 0.00 0.00 0.00 177.39 178.16 1a7m h MET 23 N 0.00 -0.19 0.00 1.96 2.86 -1.95 0.19 114.93 117.80 1a7m h MET 23 Ca 0.00 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1a7m h MET 23 Cb 0.00 0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.70 1a7m h MET 23 CO 0.00 -0.13 0.00 0.27 1.06 0.00 0.00 176.91 178.11 1a7m n ASN 24 N -5.37 0.00 -0.06 1.22 0.23 -1.26 -2.86 115.26 107.16 1a7m n ASN 24 Ca 0.01 -1.27 -0.03 0.00 -0.53 0.00 0.00 54.58 52.77 1a7m n ASN 24 Cb 0.33 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 38.02 1a7m n ASN 24 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 1a7m h GLN 25 N 0.00 0.00 -0.93 -3.83 -0.00 -0.94 -2.02 115.11 107.39 1a7m h GLN 25 Ca 0.00 0.00 0.24 0.00 -0.00 0.00 0.00 58.65 58.89 1a7m h GLN 25 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 27.48 27.42 1a7m h GLN 25 CO 0.00 0.00 0.64 -0.84 0.00 0.00 0.00 178.83 178.63 1a7m h ILE 26 N -0.93 0.59 0.85 2.39 3.07 -1.42 0.20 117.51 122.26 1a7m h ILE 26 Ca 0.00 -0.08 -0.04 0.00 1.55 0.00 0.00 64.86 66.29 1a7m h ILE 26 Cb 0.30 0.35 0.01 0.00 -0.27 0.00 0.00 36.82 37.21 1a7m h ILE 26 CO 0.00 0.04 -0.41 0.50 -1.05 0.00 0.00 178.15 177.23 1a7m h LYS 27 N 0.22 -1.10 0.00 0.16 3.64 -1.58 0.24 116.57 118.14 1a7m h LYS 27 Ca 0.47 0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 59.92 1a7m h LYS 27 Cb 1.49 0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 33.56 1a7m h LYS 27 CO -0.12 -0.73 -0.04 -0.91 -2.27 0.00 0.00 179.45 175.38 1a7m h ASN 28 N -1.20 0.00 0.00 4.20 4.21 -0.30 -2.77 115.58 119.71 1a7m h ASN 28 Ca -0.12 0.00 -0.08 0.00 1.21 0.00 0.00 56.30 57.31 1a7m h ASN 28 Cb 0.88 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.07 1a7m h ASN 28 CO 0.19 0.04 -0.46 1.56 -1.29 0.00 0.00 177.43 177.47 1a7m h GLN 29 N 0.00 0.00 -0.62 0.81 4.20 -0.39 -3.35 115.11 115.76 1a7m h GLN 29 Ca -0.00 0.00 0.13 0.00 0.06 0.00 0.00 58.65 58.84 1a7m h GLN 29 Cb 0.10 0.00 -0.12 0.00 0.30 0.00 0.00 27.48 27.77 1a7m h GLN 29 CO 0.01 0.84 -0.13 -0.11 -0.67 0.00 0.00 178.83 178.76 1a7m n LEU 30 N -4.57 -0.20 -0.24 1.46 -0.00 0.81 0.15 117.00 114.41 1a7m n LEU 30 Ca -0.16 1.07 -0.00 0.00 -0.00 0.00 0.00 56.01 56.91 1a7m n LEU 30 Cb 0.49 -0.33 0.07 0.00 -0.00 0.00 0.00 43.42 43.64 1a7m n LEU 30 CO 0.24 -1.03 0.70 0.00 -0.00 0.00 0.00 177.39 177.30 1a7m h ALA 31 N 1.24 0.37 -0.01 1.96 0.00 -1.63 0.95 119.26 122.15 1a7m h ALA 31 Ca 0.31 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.48 1a7m h ALA 31 Cb 0.50 0.60 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1a7m h ALA 31 CO -0.63 -0.47 0.29 1.96 0.00 0.00 0.00 179.25 180.40 1a7m h GLN 32 N -0.03 0.00 0.02 0.00 4.20 0.12 0.20 115.11 119.62 1a7m h GLN 32 Ca 0.32 0.00 -0.39 0.00 0.06 0.00 0.00 58.65 58.65 1a7m h GLN 32 Cb 0.53 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.25 1a7m h GLN 32 CO -0.73 0.00 -2.39 1.28 -0.67 0.00 0.00 178.83 176.32 1a7m n LEU 33 N -2.93 2.83 -0.21 1.46 4.77 0.28 -3.89 117.00 119.32 1a7m n LEU 33 Ca -0.02 -0.04 -0.07 0.00 -0.03 0.00 0.00 56.01 55.85 1a7m n LEU 33 Cb 0.34 -0.94 -0.02 0.00 -2.33 0.00 0.00 43.42 40.47 1a7m n LEU 33 CO 0.14 0.89 0.58 -1.13 -1.33 0.00 0.00 177.39 176.55 1a7m h ASN 34 N -0.08 -1.42 -0.92 -1.43 -0.00 0.28 0.94 115.58 112.96 1a7m h ASN 34 Ca -0.56 0.24 0.24 0.00 -0.00 0.00 0.00 56.30 56.22 1a7m h ASN 34 Cb 1.89 0.66 -0.13 0.00 -0.00 0.00 0.00 38.32 40.74 1a7m h ASN 34 CO -0.09 -0.33 0.42 1.23 -0.00 0.00 0.00 177.43 178.66 1a7m h GLY 35 N -0.21 1.62 2.00 1.57 0.00 -1.32 0.12 103.07 106.85 1a7m h GLY 35 Ca 0.20 -0.18 -0.16 0.00 0.00 0.00 0.00 47.33 47.19 1a7m h GLY 35 CO -0.69 -0.30 -0.76 1.48 0.00 0.00 0.00 176.54 176.27 1a7m h SER 36 N 0.39 0.00 -0.99 0.19 4.64 0.45 0.14 113.55 118.36 1a7m h SER 36 Ca 0.59 0.00 0.18 0.00 -0.47 0.00 0.00 61.79 62.09 1a7m h SER 36 Cb 1.16 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.15 1a7m h SER 36 CO -0.55 0.76 0.62 0.00 -0.87 0.00 0.00 176.83 176.79 1a7m h ALA 37 N 1.24 1.71 0.00 5.18 0.00 0.29 1.43 119.26 129.10 1a7m h ALA 37 Ca -0.01 0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.76 1a7m h ALA 37 Cb 1.54 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 1a7m h ALA 37 CO 0.10 -0.05 -1.20 -1.71 0.00 0.00 0.00 179.25 176.39 1a7m n ASN 38 N -4.71 1.86 0.30 0.00 4.05 -1.07 -3.78 115.26 111.92 1a7m n ASN 38 Ca 0.22 0.45 -0.13 0.00 0.45 0.00 0.00 54.58 55.57 1a7m n ASN 38 Cb 0.55 -0.94 -0.07 0.00 1.23 0.00 0.00 39.78 40.55 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 -0.61 -0.81 0.61 5.20 0.00 -0.05 -2.41 119.26 121.20 1a7m h ALA 39 Ca -0.31 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.39 1a7m h ALA 39 Cb 1.19 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 1a7m h ALA 39 CO -0.19 -0.77 -0.48 1.25 0.00 0.00 0.00 179.25 179.06 1a7m h LEU 40 N -1.18 -1.28 -0.79 0.00 7.12 0.17 0.17 115.31 119.53 1a7m h LEU 40 Ca -0.08 0.09 0.09 0.00 0.13 0.00 0.00 57.88 58.11 1a7m h LEU 40 Cb 0.65 0.40 -0.11 0.00 -0.53 0.00 0.00 40.66 41.07 1a7m h LEU 40 CO 0.14 -0.69 -0.39 0.33 -0.13 0.00 0.00 178.44 177.70 1a7m n PHE 41 N -5.58 -0.18 0.33 1.25 7.35 -0.42 0.23 117.46 120.44 1a7m n PHE 41 Ca -0.13 0.98 -0.17 0.00 -0.76 0.00 0.00 57.45 57.37 1a7m n PHE 41 Cb 0.47 -0.67 -0.09 0.00 0.35 0.00 0.00 39.48 39.55 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 0.36 0.00 -2.13 5.03 -0.99 0.38 117.51 120.16 1a7m h ILE 42 Ca 0.19 -0.13 0.00 0.00 -0.12 0.00 0.00 64.86 64.81 1a7m h ILE 42 Cb 0.39 0.41 0.00 0.00 -3.03 0.00 0.00 36.82 34.59 1a7m h ILE 42 CO -0.76 0.02 0.00 -0.24 -0.68 0.00 0.00 178.15 176.49 1a7m n SER 43 N -5.42 0.31 -0.03 1.72 2.88 0.57 0.15 113.62 113.81 1a7m n SER 43 Ca -0.13 0.63 -0.02 0.00 -1.33 0.00 0.00 58.87 58.02 1a7m n SER 43 Cb 0.35 -0.67 -0.01 0.00 -0.75 0.00 0.00 64.21 63.13 1a7m n SER 43 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1a7m n TYR 44 N -1.89 0.28 -0.32 0.66 9.36 0.62 -4.19 117.16 121.66 1a7m n TYR 44 Ca 0.00 0.12 0.12 0.00 3.32 0.00 0.00 57.90 61.46 1a7m n TYR 44 Cb 0.06 -0.39 0.33 0.00 -0.63 0.00 0.00 39.34 38.71 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 -0.35 0.97 -0.59 2.98 -0.00 -0.07 0.18 116.97 120.09 1a7m h TYR 45 Ca 0.00 0.03 0.11 0.00 0.00 0.00 0.00 58.73 58.87 1a7m h TYR 45 Cb 0.21 -0.30 -0.03 0.00 0.00 0.00 0.00 36.73 36.60 1a7m h TYR 45 CO -0.09 0.30 0.40 1.79 -0.00 0.00 0.00 178.16 180.56 1a7m h THR 46 N 0.77 0.86 0.00 -0.90 1.35 -0.46 -0.87 112.91 113.66 1a7m h THR 46 Ca 0.51 -0.11 -0.14 0.00 -0.55 0.00 0.00 66.41 66.12 1a7m h THR 46 Cb 0.78 0.50 -0.02 0.00 -1.73 0.00 0.00 68.15 67.67 1a7m h THR 46 CO -0.28 0.06 -0.68 0.00 -0.25 0.00 0.00 175.52 174.37 1a7m h ALA 47 N 1.71 0.76 -0.77 6.62 0.00 -0.81 -3.32 119.26 123.46 1a7m h ALA 47 Ca 0.28 -0.62 0.18 0.00 0.00 0.00 0.00 54.91 54.75 1a7m h ALA 47 Cb 0.64 -0.11 -0.12 0.00 0.00 0.00 0.00 17.79 18.20 1a7m h ALA 47 CO -0.07 0.85 0.12 1.96 0.00 0.00 0.00 179.25 182.11 1a7m h GLN 48 N 0.00 0.19 0.00 0.00 7.50 -1.11 -3.47 115.11 118.22 1a7m h GLN 48 Ca -0.01 -0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.13 1a7m h GLN 48 Cb 1.29 -0.04 0.00 0.00 0.05 0.00 0.00 27.48 28.78 1a7m h GLN 48 CO 0.09 0.12 0.00 0.41 -1.50 0.00 0.00 178.83 177.95 1a7m n GLY 49 N -1.38 2.79 3.94 3.46 0.00 -1.25 -5.02 105.19 107.74 1a7m n GLY 49 Ca 0.15 -1.97 -0.26 0.00 0.00 0.00 0.00 46.02 43.94 1a7m n GLY 49 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1a7m s GLU 50 N -2.87 1.71 -1.15 1.61 4.04 -1.26 -4.00 118.70 116.78 1a7m s GLU 50 Ca 0.00 -0.44 -0.24 0.00 0.04 0.00 0.00 54.97 54.34 1a7m s GLU 50 Cb 0.00 -2.11 -0.11 0.00 0.02 0.00 0.00 34.13 31.92 1a7m s GLU 50 CO 0.00 -1.58 1.98 -1.25 -1.84 0.00 0.00 175.26 172.57 1a7m s PRO 51 N -5.40 2.22 0.00 -4.83 0.04 -1.26 -5.04 135.00 120.73 1a7m s PRO 51 Ca 0.65 -0.96 0.00 0.00 0.04 0.00 0.00 61.00 60.73 1a7m s PRO 51 Cb -0.08 -5.18 0.00 0.00 0.04 0.00 0.00 34.50 29.28 1a7m s PRO 51 CO 0.47 -4.27 0.00 1.19 0.04 0.00 0.00 177.00 174.43 1a7m n PHE 52 N 15.49 0.00 0.14 0.56 3.01 -1.26 -4.25 117.46 131.15 1a7m n PHE 52 Ca 0.44 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.94 1a7m n PHE 52 Cb 0.47 0.11 0.21 0.00 -0.01 0.00 0.00 39.48 40.25 1a7m n PHE 52 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1a7m n PRO 53 N -2.34 0.06 -0.01 -1.08 -0.04 -1.26 0.97 135.00 131.30 1a7m n PRO 53 Ca 0.00 0.48 0.00 0.00 -0.04 0.00 0.00 63.50 63.94 1a7m n PRO 53 Cb 0.00 -2.09 -0.02 0.00 -0.04 0.00 0.00 33.50 31.35 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 -1.83 4.37 -0.04 3.54 5.15 -1.26 -4.75 115.26 120.45 1a7m n ASN 54 Ca -0.01 0.00 0.02 0.00 -0.60 0.00 0.00 54.58 53.99 1a7m n ASN 54 Cb 0.43 0.88 0.03 0.00 -0.53 0.00 0.00 39.78 40.59 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 -1.81 2.09 0.15 1.20 3.02 0.16 -4.59 115.26 115.49 1a7m n ASN 55 Ca -0.02 -2.17 0.16 0.00 -0.03 0.00 0.00 54.58 52.52 1a7m n ASN 55 Cb 0.29 -0.08 0.74 0.00 -0.61 0.00 0.00 39.78 40.13 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 0.07 0.00 -1.03 3.41 8.10 0.37 0.86 115.31 127.09 1a7m h LEU 56 Ca 0.00 0.00 0.12 0.00 0.11 0.00 0.00 57.88 58.11 1a7m h LEU 56 Cb 0.59 0.00 -0.08 0.00 -0.44 0.00 0.00 40.66 40.73 1a7m h LEU 56 CO 0.00 0.00 0.63 -0.78 -4.11 0.00 0.00 178.44 174.18 1a7m h ASP 57 N 0.00 0.91 0.00 0.17 1.82 -1.81 1.58 116.42 119.09 1a7m h ASP 57 Ca 0.12 0.05 -0.14 0.00 -0.39 0.00 0.00 57.03 56.66 1a7m h ASP 57 Cb 0.54 -0.14 -0.03 0.00 0.68 0.00 0.00 39.33 40.39 1a7m h ASP 57 CO -0.00 0.48 -2.01 0.29 -1.61 0.00 0.00 179.24 176.39 1a7m n LYS 58 N -4.61 0.83 -0.00 0.28 4.76 -0.16 -3.45 118.16 115.81 1a7m n LYS 58 Ca 0.19 -0.10 0.11 0.00 -2.87 0.00 0.00 58.31 55.64 1a7m n LYS 58 Cb 0.36 -1.45 -0.13 0.00 -1.84 0.00 0.00 35.03 31.97 1a7m n LYS 58 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1a7m n LEU 59 N -2.38 0.44 -2.74 -0.35 4.32 0.12 -4.62 117.00 111.80 1a7m n LEU 59 Ca -0.15 -0.18 -0.05 0.00 -0.02 0.00 0.00 56.01 55.62 1a7m n LEU 59 Cb 0.75 -0.01 0.04 0.00 -1.62 0.00 0.00 43.42 42.58 1a7m n LEU 59 CO 0.39 0.09 -0.05 0.00 -1.22 0.00 0.00 177.39 176.60 1a7m n GLY 61 N -0.33 1.17 1.54 0.00 0.00 -0.80 -3.75 105.19 103.02 1a7m n GLY 61 Ca 0.08 -0.37 -0.14 0.00 0.00 0.00 0.00 46.02 45.59 1a7m n GLY 61 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1a7m n PRO 62 N -0.37 -2.53 0.00 1.61 -0.04 -1.26 -4.79 135.00 127.62 1a7m n PRO 62 Ca -0.14 -0.75 0.00 0.00 -0.04 0.00 0.00 63.50 62.58 1a7m n PRO 62 Cb 0.85 -0.80 0.00 0.00 -0.04 0.00 0.00 33.50 33.52 1a7m n PRO 62 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1a7m n ASN 63 N -4.04 0.00 0.00 3.54 6.94 -1.26 -3.64 115.26 116.80 1a7m n ASN 63 Ca 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.63 1a7m n ASN 63 Cb 0.27 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.69 1a7m n ASN 63 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 1a7m n VAL 64 N -2.36 0.01 -0.27 3.53 0.31 -1.26 -4.82 118.33 113.48 1a7m n VAL 64 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1a7m n VAL 64 Cb 0.00 -0.98 0.00 0.00 -0.91 0.00 0.00 33.84 31.95 1a7m n VAL 64 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1a7m n THR 65 N -2.51 0.00 -0.97 2.52 5.66 -1.26 -0.66 114.28 117.06 1a7m n THR 65 Ca 0.00 0.00 -0.01 0.00 -3.05 0.00 0.00 64.05 60.99 1a7m n THR 65 Cb 0.00 0.00 0.34 0.00 -1.55 0.00 0.00 70.33 69.12 1a7m n THR 65 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1a7m n ASP 66 N 1.35 5.19 -4.84 1.09 -0.08 -1.26 -4.86 116.55 113.13 1a7m n ASP 66 Ca 0.00 -3.11 -0.34 0.00 -1.51 0.00 0.00 54.79 49.83 1a7m n ASP 66 Cb 0.00 -0.73 -0.06 0.00 2.34 0.00 0.00 41.12 42.67 1a7m n ASP 66 CO 0.00 0.00 0.00 0.12 0.12 0.00 0.00 177.20 177.44 1a7m s PHE 67 N -2.89 3.45 0.14 -0.67 5.36 0.17 -5.09 117.98 118.45 1a7m s PHE 67 Ca 0.55 0.34 -0.30 0.00 -0.96 0.00 0.00 56.93 56.56 1a7m s PHE 67 Cb 0.43 -1.83 -0.07 0.00 -0.34 0.00 0.00 43.02 41.22 1a7m s PHE 67 CO 0.14 0.63 0.94 -1.25 -1.46 0.00 0.00 175.22 174.22 1a7m s PRO 68 N -1.57 4.72 0.62 10.12 0.04 -1.26 -4.74 135.00 142.93 1a7m s PRO 68 Ca 0.22 1.43 -0.14 0.00 0.04 0.00 0.00 61.00 62.55 1a7m s PRO 68 Cb -0.12 -3.35 -0.03 0.00 0.04 0.00 0.00 34.50 31.04 1a7m s PRO 68 CO 0.12 0.30 1.05 -1.25 0.04 0.00 0.00 177.00 177.26 1a7m s PRO 69 N -0.33 3.29 -0.22 0.56 0.04 -1.26 -4.94 135.00 132.14 1a7m s PRO 69 Ca 0.45 1.05 -0.01 0.00 0.04 0.00 0.00 61.00 62.52 1a7m s PRO 69 Cb -0.24 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.28 1a7m s PRO 69 CO 0.30 -0.82 -0.10 0.12 0.04 0.00 0.00 177.00 176.54 1a7m s PHE 70 N -2.74 2.95 -0.58 0.56 2.19 -1.26 -5.03 117.98 114.07 1a7m s PHE 70 Ca 0.60 -1.40 0.06 0.00 0.33 0.00 0.00 56.93 56.52 1a7m s PHE 70 Cb -0.14 -2.03 0.23 0.00 -1.31 0.00 0.00 43.02 39.77 1a7m s PHE 70 CO 0.44 -0.70 0.62 -2.39 1.83 0.00 0.00 175.22 175.01 1a7m n HIS 71 N 4.69 2.30 -0.59 10.12 1.44 -1.26 -5.03 115.22 126.89 1a7m n HIS 71 Ca -0.18 -3.98 -0.07 0.00 -2.01 0.00 0.00 57.72 51.47 1a7m n HIS 71 Cb 0.49 -0.46 -0.08 0.00 0.12 0.00 0.00 29.99 30.07 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 1.35 0.42 -2.25 1.59 0.00 -1.26 -4.65 120.51 115.72 1a7m n ALA 72 Ca 0.26 -0.36 -0.39 0.00 0.00 0.00 0.00 53.44 52.94 1a7m n ALA 72 Cb 0.43 -0.84 0.02 0.00 0.00 0.00 0.00 19.45 19.06 1a7m n ALA 72 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1a7m n ASN 73 N 2.23 7.43 -2.94 0.00 4.13 -1.26 -4.78 115.26 120.07 1a7m n ASN 73 Ca 0.23 -3.63 -0.14 0.00 1.68 0.00 0.00 54.58 52.72 1a7m n ASN 73 Cb 0.09 -1.17 -0.03 0.00 -1.54 0.00 0.00 39.78 37.13 1a7m n ASN 73 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1a7m n GLY 74 N 0.10 -0.09 3.14 7.41 0.00 -1.26 -4.87 105.19 109.62 1a7m n GLY 74 Ca 0.51 0.05 -0.33 0.00 0.00 0.00 0.00 46.02 46.25 1a7m n GLY 74 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1a7m s THR 75 N -2.79 2.50 0.08 2.61 -4.23 -1.26 -5.00 115.64 107.56 1a7m s THR 75 Ca 0.14 -1.22 -0.18 0.00 -1.18 0.00 0.00 61.69 59.25 1a7m s THR 75 Cb -0.08 -2.30 -0.05 0.00 1.34 0.00 0.00 72.50 71.41 1a7m s THR 75 CO 0.38 0.18 1.30 -0.33 -0.54 0.00 0.00 174.62 175.61 1a7m h GLU 76 N 7.92 -0.10 -0.27 3.99 5.08 -1.96 0.24 114.58 129.48 1a7m h GLU 76 Ca -0.30 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.09 1a7m h GLU 76 Cb 1.09 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.33 1a7m h GLU 76 CO 0.55 -0.07 0.09 0.87 -1.00 0.00 0.00 179.01 179.45 1a7m h LYS 77 N -0.11 0.21 0.03 2.33 6.56 -1.99 -1.67 116.57 121.93 1a7m h LYS 77 Ca 0.07 -0.01 0.03 0.00 -1.06 0.00 0.00 60.65 59.67 1a7m h LYS 77 Cb 0.28 -0.05 -0.05 0.00 -0.57 0.00 0.00 32.23 31.85 1a7m h LYS 77 CO -0.43 0.14 -0.30 0.00 -2.06 0.00 0.00 179.45 176.80 1a7m h ALA 78 N 1.17 -0.44 -0.70 3.86 0.00 -1.55 0.38 119.26 121.98 1a7m h ALA 78 Ca 0.12 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.13 1a7m h ALA 78 Cb 0.09 0.51 -0.13 0.00 0.00 0.00 0.00 17.79 18.27 1a7m h ALA 78 CO -0.13 -0.81 -0.34 0.87 0.00 0.00 0.00 179.25 178.84 1a7m h LYS 79 N -0.46 -0.11 -0.32 0.00 1.57 -0.20 0.47 116.57 117.52 1a7m h LYS 79 Ca 0.05 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1a7m h LYS 79 Cb 0.53 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 1a7m h LYS 79 CO -0.23 -0.07 0.19 -0.07 -0.57 0.00 0.00 179.45 178.70 1a7m h LEU 80 N -0.11 0.39 0.14 2.94 4.07 -0.39 -0.78 115.31 121.57 1a7m h LEU 80 Ca 0.27 -0.06 0.01 0.00 0.08 0.00 0.00 57.88 58.18 1a7m h LEU 80 Cb 0.56 -0.10 -0.02 0.00 1.08 0.00 0.00 40.66 42.19 1a7m h LEU 80 CO -0.76 0.33 -0.16 0.58 -1.08 0.00 0.00 178.44 177.35 1a7m h VAL 81 N 0.42 0.63 -0.11 1.22 2.07 0.24 0.16 116.25 120.88 1a7m h VAL 81 Ca 0.12 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.68 1a7m h VAL 81 Cb 0.01 0.63 -0.05 0.00 -1.52 0.00 0.00 31.29 30.37 1a7m h VAL 81 CO -0.02 0.00 -0.21 -0.33 0.02 0.00 0.00 177.57 177.02 1a7m h GLU 82 N -0.35 -0.27 0.00 1.57 5.08 -0.14 -0.76 114.58 119.71 1a7m h GLU 82 Ca 0.01 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1a7m h GLU 82 Cb 0.34 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1a7m h GLU 82 CO -0.06 -0.18 0.00 -0.11 -1.00 0.00 0.00 179.01 177.66 1a7m n LEU 83 N -5.35 0.00 -0.07 1.33 7.94 -0.31 -1.70 117.00 118.85 1a7m n LEU 83 Ca -0.03 0.89 -0.02 0.00 -1.11 0.00 0.00 56.01 55.75 1a7m n LEU 83 Cb 0.26 -0.39 -0.02 0.00 0.53 0.00 0.00 43.42 43.80 1a7m n LEU 83 CO 0.20 -0.39 0.21 0.00 -1.11 0.00 0.00 177.39 176.30 1a7m n TYR 84 N -2.02 -0.07 0.12 1.96 4.19 0.55 0.71 117.16 122.60 1a7m n TYR 84 Ca 0.00 0.19 -0.16 0.00 3.31 0.00 0.00 57.90 61.25 1a7m n TYR 84 Cb 0.00 -0.33 -0.09 0.00 0.49 0.00 0.00 39.34 39.41 1a7m n TYR 84 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1a7m h ARG 85 N 0.00 -0.69 -1.00 2.98 3.08 -1.13 1.42 114.38 119.03 1a7m h ARG 85 Ca 0.02 0.05 0.23 0.00 0.07 0.00 0.00 59.98 60.36 1a7m h ARG 85 Cb 0.06 0.16 -0.12 0.00 0.08 0.00 0.00 29.97 30.15 1a7m h ARG 85 CO -0.15 -0.46 0.59 0.52 -1.07 0.00 0.00 179.97 179.41 1a7m h MET 86 N -0.72 0.60 0.00 0.04 2.86 0.76 0.33 114.93 118.80 1a7m h MET 86 Ca 0.01 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1a7m h MET 86 Cb 0.73 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.26 1a7m h MET 86 CO -0.27 0.40 -0.89 1.55 1.06 0.00 0.00 176.91 178.76 1a7m n VAL 87 N -4.87 0.44 0.01 -2.22 3.14 0.22 -2.12 118.33 112.93 1a7m n VAL 87 Ca 0.26 -0.40 -0.02 0.00 -2.96 0.00 0.00 64.34 61.23 1a7m n VAL 87 Cb 0.71 -0.16 -0.01 0.00 -1.06 0.00 0.00 33.84 33.32 1a7m n VAL 87 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1a7m h ALA 88 N 2.28 -0.12 -0.96 1.55 0.00 0.55 0.42 119.26 122.98 1a7m h ALA 88 Ca 0.00 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1a7m h ALA 88 Cb 0.86 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.63 1a7m h ALA 88 CO 0.00 -0.12 0.61 0.10 0.00 0.00 0.00 179.25 179.85 1a7m h TYR 89 N -0.80 1.14 0.16 0.00 -0.00 -0.86 -1.63 116.97 114.97 1a7m h TYR 89 Ca -0.01 0.03 -0.01 0.00 -0.00 0.00 0.00 58.73 58.74 1a7m h TYR 89 Cb 0.08 -0.37 0.00 0.00 -0.00 0.00 0.00 36.73 36.44 1a7m h TYR 89 CO 0.01 0.59 -0.07 1.25 -0.00 0.00 0.00 178.16 179.93 1a7m h LEU 90 N 1.12 -0.18 -0.97 0.10 6.46 -1.50 -0.66 115.31 119.68 1a7m h LEU 90 Ca 0.41 -0.14 0.22 0.00 -0.12 0.00 0.00 57.88 58.25 1a7m h LEU 90 Cb 0.15 0.05 -0.18 0.00 -0.73 0.00 0.00 40.66 39.94 1a7m h LEU 90 CO -0.17 0.04 -0.15 0.28 -0.62 0.00 0.00 178.44 177.82 1a7m h SER 91 N -0.39 -0.76 0.75 1.25 0.02 0.80 0.50 113.55 115.71 1a7m h SER 91 Ca -0.02 0.29 -0.03 0.00 -0.84 0.00 0.00 61.79 61.18 1a7m h SER 91 Cb 0.31 0.56 -0.00 0.00 0.14 0.00 0.00 62.40 63.41 1a7m h SER 91 CO 0.04 -0.33 -0.47 0.00 -1.14 0.00 0.00 176.83 174.92 1a7m h ALA 92 N 1.97 -1.25 -0.54 3.77 0.00 -1.10 -0.08 119.26 122.03 1a7m h ALA 92 Ca 0.51 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 55.23 1a7m h ALA 92 Cb 0.88 0.59 -0.06 0.00 0.00 0.00 0.00 17.79 19.20 1a7m h ALA 92 CO -0.97 -1.21 -0.32 0.43 0.00 0.00 0.00 179.25 177.18 1a7m n SER 93 N -5.41 -0.57 -0.13 0.00 7.64 0.15 0.00 113.62 115.30 1a7m n SER 93 Ca -0.14 1.23 -0.04 0.00 1.01 0.00 0.00 58.87 60.93 1a7m n SER 93 Cb 0.48 -0.26 0.03 0.00 -1.01 0.00 0.00 64.21 63.45 1a7m n SER 93 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 1a7m h LEU 94 N 0.00 -0.27 -0.48 -3.43 4.07 -0.82 -1.29 115.31 113.09 1a7m h LEU 94 Ca 0.09 0.11 0.10 0.00 0.08 0.00 0.00 57.88 58.26 1a7m h LEU 94 Cb 0.22 0.21 -0.10 0.00 1.08 0.00 0.00 40.66 42.08 1a7m h LEU 94 CO -0.50 -0.09 -0.18 0.74 -1.08 0.00 0.00 178.44 177.32 1a7m h THR 95 N 0.06 0.41 -0.28 0.22 2.02 0.15 0.30 112.91 115.80 1a7m h THR 95 Ca 0.21 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.43 1a7m h THR 95 Cb 0.31 0.41 -0.07 0.00 -1.74 0.00 0.00 68.15 67.06 1a7m h THR 95 CO -0.39 0.00 -0.53 0.78 0.37 0.00 0.00 175.52 175.75 1a7m h ASN 96 N -0.07 -1.74 -0.54 4.18 4.21 -0.05 -1.08 115.58 120.50 1a7m h ASN 96 Ca 0.23 0.22 0.11 0.00 1.21 0.00 0.00 56.30 58.07 1a7m h ASN 96 Cb 0.43 0.70 -0.11 0.00 -1.12 0.00 0.00 38.32 38.22 1a7m h ASN 96 CO -0.54 -0.44 -0.18 0.40 -1.29 0.00 0.00 177.43 175.39 1a7m h ILE 97 N -0.48 0.39 -0.98 2.81 5.03 -0.91 0.23 117.51 123.60 1a7m h ILE 97 Ca 0.06 0.00 0.13 0.00 -0.12 0.00 0.00 64.86 64.93 1a7m h ILE 97 Cb 0.64 0.39 -0.14 0.00 -3.03 0.00 0.00 36.82 34.67 1a7m h ILE 97 CO -0.52 0.00 -0.45 0.41 -0.68 0.00 0.00 178.15 176.91 1a7m n THR 98 N -5.40 -0.57 0.27 -0.27 -1.04 0.96 0.18 114.28 108.40 1a7m n THR 98 Ca 0.05 2.32 -0.11 0.00 -2.04 0.00 0.00 64.05 64.28 1a7m n THR 98 Cb 0.31 -3.00 -0.05 0.00 -1.82 0.00 0.00 70.33 65.77 1a7m n THR 98 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 1a7m h ARG 99 N 0.00 -0.67 -0.83 -2.82 2.43 -0.58 0.46 114.38 112.37 1a7m h ARG 99 Ca 0.27 0.05 0.16 0.00 -0.81 0.00 0.00 59.98 59.65 1a7m h ARG 99 Cb 0.52 0.15 -0.15 0.00 -0.42 0.00 0.00 29.97 30.07 1a7m h ARG 99 CO -0.95 -0.45 -0.24 -0.25 -1.51 0.00 0.00 179.97 176.57 1a7m n ASP 100 N -4.12 -0.36 0.04 -3.80 9.92 -0.24 -0.33 116.55 117.67 1a7m n ASP 100 Ca -0.09 1.43 -0.20 0.00 -0.53 0.00 0.00 54.79 55.41 1a7m n ASP 100 Cb 0.27 -0.41 -0.11 0.00 -0.64 0.00 0.00 41.12 40.23 1a7m n ASP 100 CO 0.00 0.00 0.00 1.56 0.13 0.00 0.00 177.20 178.89 1a7m h GLN 101 N 0.00 0.56 -0.34 -1.24 7.50 -0.30 1.27 115.11 122.55 1a7m h GLN 101 Ca 0.37 -0.64 0.10 0.00 0.50 0.00 0.00 58.65 58.99 1a7m h GLN 101 Cb 0.58 0.19 -0.01 0.00 0.05 0.00 0.00 27.48 28.29 1a7m h GLN 101 CO -0.85 1.25 0.43 -0.22 -1.50 0.00 0.00 178.83 177.94 1a7m h LYS 102 N 0.14 0.00 0.00 1.46 3.11 0.29 0.69 116.57 122.27 1a7m h LYS 102 Ca -0.12 0.00 -0.21 0.00 -2.81 0.00 0.00 60.65 57.51 1a7m h LYS 102 Cb 1.58 0.00 -0.04 0.00 -1.00 0.00 0.00 32.23 32.77 1a7m h LYS 102 CO 0.17 0.00 -1.86 0.28 -2.81 0.00 0.00 179.45 175.23 1a7m n VAL 103 N -3.56 0.78 -0.07 2.00 0.31 -0.03 -4.60 118.33 113.17 1a7m n VAL 103 Ca 0.06 -0.52 -0.14 0.00 -0.01 0.00 0.00 64.34 63.72 1a7m n VAL 103 Cb 0.59 -0.55 -0.05 0.00 -0.91 0.00 0.00 33.84 32.91 1a7m n VAL 103 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1a7m h LEU 104 N 0.00 0.77 -7.64 7.52 5.85 0.39 -3.46 115.31 118.73 1a7m h LEU 104 Ca -0.31 -0.53 -0.23 0.00 0.84 0.00 0.00 57.88 57.66 1a7m h LEU 104 Cb 1.66 -0.22 -0.28 0.00 0.37 0.00 0.00 40.66 42.19 1a7m h LEU 104 CO 0.02 1.15 -0.66 0.21 -0.34 0.00 0.00 178.44 178.82 1a7m s ASN 105 N -6.67 -0.05 0.43 1.25 2.47 -0.47 -4.98 114.94 106.93 1a7m s ASN 105 Ca -0.12 0.12 0.16 0.00 0.42 0.00 0.00 52.86 53.44 1a7m s ASN 105 Cb 0.08 0.10 0.90 0.00 -1.45 0.00 0.00 41.25 40.88 1a7m s ASN 105 CO 0.84 -0.04 1.43 1.55 -3.72 0.00 0.00 177.10 177.16 1a7m h PRO 106 N 6.27 0.00 0.00 0.43 0.13 -1.89 0.52 132.00 137.45 1a7m h PRO 106 Ca -0.28 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.53 1a7m h PRO 106 Cb 1.19 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.26 1a7m h PRO 106 CO 0.47 0.00 -2.23 0.43 -0.23 0.00 0.00 178.00 176.44 1a7m n SER 107 N -2.28 1.99 -0.22 1.44 7.64 -1.26 -4.38 113.62 116.55 1a7m n SER 107 Ca -0.01 -0.09 0.00 0.00 1.01 0.00 0.00 58.87 59.78 1a7m n SER 107 Cb 0.38 -0.08 0.12 0.00 -1.01 0.00 0.00 64.21 63.62 1a7m n SER 107 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1a7m h ALA 108 N 0.17 0.87 -1.16 -0.43 0.00 -0.36 0.26 119.26 118.61 1a7m h ALA 108 Ca -0.48 0.07 0.43 0.00 0.00 0.00 0.00 54.91 54.93 1a7m h ALA 108 Cb 1.82 -0.00 -0.15 0.00 0.00 0.00 0.00 17.79 19.46 1a7m h ALA 108 CO -0.05 -0.12 0.70 1.33 0.00 0.00 0.00 179.25 181.11 1a7m n VAL 109 N -4.92 -0.31 -0.05 0.00 0.24 0.41 0.20 118.33 113.90 1a7m n VAL 109 Ca 0.10 1.81 -0.13 0.00 -2.04 0.00 0.00 64.34 64.08 1a7m n VAL 109 Cb 0.27 -2.95 -0.11 0.00 -1.47 0.00 0.00 33.84 29.57 1a7m n VAL 109 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 1a7m h SER 110 N 0.00 -0.01 -0.89 -1.34 0.87 -0.74 -2.75 113.55 108.68 1a7m h SER 110 Ca 0.83 -0.80 0.22 0.00 -1.23 0.00 0.00 61.79 60.81 1a7m h SER 110 Cb 2.47 0.00 -0.13 0.00 -0.44 0.00 0.00 62.40 64.30 1a7m h SER 110 CO -0.57 0.83 0.37 0.17 -0.53 0.00 0.00 176.83 177.11 1a7m h LEU 111 N -0.90 0.28 -0.36 2.23 8.10 0.01 0.52 115.31 125.18 1a7m h LEU 111 Ca -0.00 0.16 0.04 0.00 0.11 0.00 0.00 57.88 58.18 1a7m h LEU 111 Cb 0.81 0.15 -0.04 0.00 -0.44 0.00 0.00 40.66 41.15 1a7m h LEU 111 CO 0.00 -0.03 0.15 1.12 -4.11 0.00 0.00 178.44 175.58 1a7m h HIS 112 N 0.37 0.28 -0.91 0.17 2.07 -1.20 -0.76 115.15 115.16 1a7m h HIS 112 Ca 0.56 0.02 0.21 0.00 -2.85 0.00 0.00 60.37 58.31 1a7m h HIS 112 Cb 1.07 -0.07 -0.17 0.00 2.57 0.00 0.00 27.41 30.81 1a7m h HIS 112 CO -0.16 0.13 -0.07 1.03 -3.07 0.00 0.00 177.93 175.79 1a7m h SER 113 N 0.32 -0.58 0.07 3.10 0.87 0.35 0.64 113.55 118.31 1a7m h SER 113 Ca 0.16 0.26 0.01 0.00 -1.23 0.00 0.00 61.79 60.99 1a7m h SER 113 Cb 0.11 0.48 -0.01 0.00 -0.44 0.00 0.00 62.40 62.54 1a7m h SER 113 CO -0.14 -0.29 -0.10 0.11 -0.53 0.00 0.00 176.83 175.88 1a7m h LYS 114 N 0.03 -0.19 -0.58 2.24 1.79 -0.86 -2.20 116.57 116.79 1a7m h LYS 114 Ca 0.49 0.01 0.12 0.00 -2.18 0.00 0.00 60.65 59.09 1a7m h LYS 114 Cb 0.90 0.04 -0.11 0.00 -1.58 0.00 0.00 32.23 31.48 1a7m h LYS 114 CO -0.87 -0.13 -0.16 -0.07 -1.08 0.00 0.00 179.45 177.14 1a7m h LEU 115 N -0.20 -0.60 -0.80 2.94 3.38 0.84 0.83 115.31 121.70 1a7m h LEU 115 Ca 0.01 0.18 0.14 0.00 0.09 0.00 0.00 57.88 58.30 1a7m h LEU 115 Cb 0.21 0.38 -0.14 0.00 0.09 0.00 0.00 40.66 41.20 1a7m h LEU 115 CO -0.05 -0.21 -0.32 0.78 0.09 0.00 0.00 178.44 178.74 1a7m h ASN 116 N -0.02 -1.14 0.25 -0.43 4.21 -0.03 0.33 115.58 118.75 1a7m h ASN 116 Ca 0.28 0.26 0.00 0.00 1.21 0.00 0.00 56.30 58.05 1a7m h ASN 116 Cb 0.44 0.62 -0.02 0.00 -1.12 0.00 0.00 38.32 38.24 1a7m h ASN 116 CO -0.61 -0.29 -0.25 0.00 -1.29 0.00 0.00 177.43 174.99 1a7m h ALA 117 N 1.37 -0.52 -0.82 -0.83 0.00 -0.60 0.11 119.26 117.97 1a7m h ALA 117 Ca 0.32 -0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.26 1a7m h ALA 117 Cb 0.58 0.36 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 1a7m h ALA 117 CO -0.84 -0.82 0.53 1.79 0.00 0.00 0.00 179.25 179.92 1a7m h THR 118 N -0.53 0.93 0.49 0.00 1.35 -0.30 0.16 112.91 115.00 1a7m h THR 118 Ca -0.00 -0.25 -0.02 0.00 -0.55 0.00 0.00 66.41 65.58 1a7m h THR 118 Cb 0.50 0.14 0.00 0.00 -1.73 0.00 0.00 68.15 67.06 1a7m h THR 118 CO -0.06 0.13 -0.23 0.40 -0.25 0.00 0.00 175.52 175.51 1a7m h ILE 119 N 0.73 0.00 -0.88 6.82 2.04 0.12 0.39 117.51 126.73 1a7m h ILE 119 Ca 0.38 -0.48 0.09 0.00 1.00 0.00 0.00 64.86 65.86 1a7m h ILE 119 Cb 0.50 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.51 1a7m h ILE 119 CO -0.15 0.00 0.53 -0.78 0.00 0.00 0.00 178.15 177.74 1a7m h ASP 120 N -1.14 0.78 -0.18 1.72 1.82 -0.63 0.18 116.42 118.98 1a7m h ASP 120 Ca -0.07 0.04 -0.21 0.00 -0.39 0.00 0.00 57.03 56.40 1a7m h ASP 120 Cb 0.50 -0.12 0.01 0.00 0.68 0.00 0.00 39.33 40.40 1a7m h ASP 120 CO 0.11 0.45 -0.70 1.62 -1.61 0.00 0.00 179.24 179.12 1a7m h VAL 121 N 0.89 1.28 -0.27 2.25 3.04 -0.74 -2.45 116.25 120.25 1a7m h VAL 121 Ca 0.42 -1.89 -0.08 0.00 -1.01 0.00 0.00 66.70 64.14 1a7m h VAL 121 Cb 0.34 1.86 -0.01 0.00 -2.01 0.00 0.00 31.29 31.47 1a7m h VAL 121 CO -0.23 0.60 -0.13 0.24 -1.01 0.00 0.00 177.57 177.05 1a7m h MET 122 N 0.58 0.56 -0.54 4.17 2.86 0.71 0.20 114.93 123.47 1a7m h MET 122 Ca -0.03 -0.24 0.11 0.00 -2.06 0.00 0.00 59.70 57.48 1a7m h MET 122 Cb 1.32 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.93 1a7m h MET 122 CO 0.15 0.80 0.37 0.07 1.06 0.00 0.00 176.91 179.36 1a7m h ARG 123 N 0.29 0.25 -0.01 1.72 -0.00 -0.72 0.79 114.38 116.70 1a7m h ARG 123 Ca 0.06 -0.02 -0.00 0.00 -0.00 0.00 0.00 59.98 60.02 1a7m h ARG 123 Cb 0.64 -0.06 -0.00 0.00 -0.00 0.00 0.00 29.97 30.55 1a7m h ARG 123 CO 0.04 0.17 0.01 0.78 -0.00 0.00 0.00 179.97 180.96 1a7m h GLY 124 N 0.26 0.01 0.44 0.08 0.00 -0.58 0.24 103.07 103.52 1a7m h GLY 124 Ca 0.25 -0.01 0.01 0.00 0.00 0.00 0.00 47.33 47.58 1a7m h GLY 124 CO -0.05 0.01 -0.40 1.41 0.00 0.00 0.00 176.54 177.50 1a7m h LEU 125 N -0.04 -1.14 -0.84 3.11 4.07 0.34 -0.10 115.31 120.70 1a7m h LEU 125 Ca 0.00 0.11 0.20 0.00 0.08 0.00 0.00 57.88 58.27 1a7m h LEU 125 Cb 0.06 0.41 -0.12 0.00 1.08 0.00 0.00 40.66 42.09 1a7m h LEU 125 CO -0.00 -0.51 0.31 -0.07 -1.08 0.00 0.00 178.44 177.08 1a7m h LEU 126 N -0.73 0.20 0.29 1.67 4.07 -0.23 0.70 115.31 121.28 1a7m h LEU 126 Ca -0.00 0.15 -0.00 0.00 0.08 0.00 0.00 57.88 58.11 1a7m h LEU 126 Cb 0.70 0.16 -0.03 0.00 1.08 0.00 0.00 40.66 42.57 1a7m h LEU 126 CO -0.15 -0.02 -0.48 -1.28 -1.08 0.00 0.00 178.44 175.43 1a7m h SER 127 N 0.35 -1.38 -0.73 -0.43 0.87 0.30 0.72 113.55 113.26 1a7m h SER 127 Ca 0.51 0.13 0.16 0.00 -1.23 0.00 0.00 61.79 61.36 1a7m h SER 127 Cb 0.93 0.48 -0.13 0.00 -0.44 0.00 0.00 62.40 63.25 1a7m h SER 127 CO -0.53 -0.57 0.01 0.78 -0.53 0.00 0.00 176.83 175.99 1a7m h ASN 128 N -0.81 -0.33 0.31 6.23 2.35 0.12 1.26 115.58 124.71 1a7m h ASN 128 Ca -0.03 0.19 -0.02 0.00 -0.55 0.00 0.00 56.30 55.89 1a7m h ASN 128 Cb 0.75 0.33 0.00 0.00 0.05 0.00 0.00 38.32 39.46 1a7m h ASN 128 CO -0.16 -0.17 -0.15 0.58 -1.65 0.00 0.00 177.43 175.88 1a7m h VAL 129 N 0.11 0.00 0.00 2.81 2.07 0.17 0.37 116.25 121.78 1a7m h VAL 129 Ca 0.40 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.89 1a7m h VAL 129 Cb 0.69 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 1a7m h VAL 129 CO -0.64 0.00 0.07 0.18 0.02 0.00 0.00 177.57 177.20 1a7m n LEU 130 N -3.20 0.11 0.02 2.57 7.99 0.24 0.15 117.00 124.88 1a7m n LEU 130 Ca -0.05 0.50 -0.02 0.00 -0.01 0.00 0.00 56.01 56.43 1a7m n LEU 130 Cb 0.17 -0.51 -0.10 0.00 -0.11 0.00 0.00 43.42 42.88 1a7m n LEU 130 CO 0.13 -0.54 -0.35 0.00 -1.51 0.00 0.00 177.39 175.12 1a7m h ARG 132 N 0.00 0.00 -3.47 0.00 9.65 0.57 -3.37 114.38 117.76 1a7m h ARG 132 Ca -0.19 0.00 -0.18 0.00 -1.10 0.00 0.00 59.98 58.51 1a7m h ARG 132 Cb 1.68 0.00 -0.25 0.00 -1.39 0.00 0.00 29.97 30.01 1a7m h ARG 132 CO 0.05 0.00 -0.55 -0.48 2.80 0.00 0.00 179.97 181.79 1a7m s LEU 133 N -8.30 1.55 0.00 3.80 -0.00 0.28 -4.99 118.68 111.01 1a7m s LEU 133 Ca -0.08 0.09 0.00 0.00 -0.00 0.00 0.00 54.13 54.14 1a7m s LEU 133 Cb 0.01 0.50 0.00 0.00 -0.00 0.00 0.00 46.19 46.70 1a7m s LEU 133 CO 0.12 -0.15 0.00 0.00 -0.00 0.00 0.00 176.35 176.31 1a7m n ASN 135 N 0.00 0.00 -0.63 0.00 2.85 -1.26 -4.46 115.26 111.76 1a7m n ASN 135 Ca 0.00 0.00 0.05 0.00 -0.11 0.00 0.00 54.58 54.52 1a7m n ASN 135 Cb 0.00 -0.31 0.20 0.00 1.24 0.00 0.00 39.78 40.91 1a7m n ASN 135 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 1a7m n LYS 136 N -2.14 1.61 -2.17 1.20 5.02 -1.26 -4.93 118.16 115.49 1a7m n LYS 136 Ca 0.00 -3.20 0.00 0.00 -2.02 0.00 0.00 58.31 53.09 1a7m n LYS 136 Cb 0.00 -1.64 0.00 0.00 -0.02 0.00 0.00 35.03 33.37 1a7m n LYS 136 CO 0.00 0.00 0.00 2.48 -0.52 0.00 0.00 177.40 179.36 1a7m n TYR 137 N -1.15 -1.73 0.10 2.13 4.11 -1.26 -4.39 117.16 114.97 1a7m n TYR 137 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 58.11 1a7m n TYR 137 Cb 0.74 -0.92 0.00 0.00 -0.00 0.00 0.00 39.34 39.16 1a7m n TYR 137 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.86 174.73 1a7m n ARG 138 N -2.14 0.00 -0.38 -3.48 0.63 -1.26 -4.79 116.66 105.24 1a7m n ARG 138 Ca 0.00 0.00 -0.08 0.00 -0.92 0.00 0.00 57.85 56.85 1a7m n ARG 138 Cb 0.40 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.25 1a7m n ARG 138 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1a7m n VAL 139 N -3.17 -0.59 0.00 5.15 0.31 -1.26 -4.83 118.33 113.94 1a7m n VAL 139 Ca 0.00 2.20 0.00 0.00 -0.01 0.00 0.00 64.34 66.53 1a7m n VAL 139 Cb 0.00 -2.76 0.00 0.00 -0.91 0.00 0.00 33.84 30.17 1a7m n VAL 139 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1a7m n GLY 140 N -1.28 0.35 0.00 2.92 0.00 -1.26 -4.94 105.19 100.98 1a7m n GLY 140 Ca 0.04 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1a7m n GLY 140 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1a7m n HIS 141 N 0.00 0.00 -0.03 1.61 8.25 0.16 -4.54 115.22 120.67 1a7m n HIS 141 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.31 1a7m n HIS 141 Cb 0.00 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 30.99 1a7m n HIS 141 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 1a7m h VAL 142 N 0.00 1.59 -1.72 1.59 3.04 -1.79 -3.38 116.25 115.58 1a7m h VAL 142 Ca 0.00 -2.02 0.00 0.00 -1.01 0.00 0.00 66.70 63.67 1a7m h VAL 142 Cb 0.00 2.89 0.00 0.00 -2.01 0.00 0.00 31.29 32.17 1a7m h VAL 142 CO 0.00 0.55 -0.41 0.47 -1.01 0.00 0.00 177.57 177.17 1a7m n ASP 143 N -4.52 -4.94 -3.34 3.17 8.00 -1.26 -4.84 116.55 108.82 1a7m n ASP 143 Ca -0.10 0.57 -0.26 0.00 0.71 0.00 0.00 54.79 55.71 1a7m n ASP 143 Cb 0.50 -1.58 -0.08 0.00 -0.02 0.00 0.00 41.12 39.94 1a7m n ASP 143 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1a7m n VAL 144 N -0.35 0.54 -1.66 2.53 0.24 -1.26 -5.03 118.33 113.34 1a7m n VAL 144 Ca 0.00 -4.46 -0.44 0.00 -2.04 0.00 0.00 64.34 57.40 1a7m n VAL 144 Cb 0.00 -2.00 -0.01 0.00 -1.47 0.00 0.00 33.84 30.36 1a7m n VAL 144 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1a7m n PRO 145 N 1.36 1.90 -3.31 7.34 -0.04 -1.26 -5.02 135.00 135.97 1a7m n PRO 145 Ca 0.25 0.67 -0.27 0.00 -0.04 0.00 0.00 63.50 64.10 1a7m n PRO 145 Cb 0.47 -2.21 -0.02 0.00 -0.04 0.00 0.00 33.50 31.70 1a7m n PRO 145 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1a7m s PRO 146 N -1.52 3.59 -0.50 0.54 0.04 -1.26 -4.91 135.00 130.97 1a7m s PRO 146 Ca 0.59 -0.08 0.06 0.00 0.04 0.00 0.00 61.00 61.61 1a7m s PRO 146 Cb -0.62 -2.64 0.21 0.00 0.04 0.00 0.00 34.50 31.49 1a7m s PRO 146 CO 0.59 0.18 0.49 1.33 0.04 0.00 0.00 177.00 179.63 1a7m n VAL 147 N -1.22 0.10 -3.32 -0.36 0.24 -1.26 -5.09 118.33 107.42 1a7m n VAL 147 Ca -0.02 -4.18 -0.46 0.00 -2.04 0.00 0.00 64.34 57.64 1a7m n VAL 147 Cb 0.54 -1.92 -0.01 0.00 -1.47 0.00 0.00 33.84 30.98 1a7m n VAL 147 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1a7m s PRO 148 N -1.02 3.93 -0.03 7.34 0.04 -1.26 -4.99 135.00 139.01 1a7m s PRO 148 Ca 0.33 -2.85 -0.03 0.00 0.04 0.00 0.00 61.00 58.49 1a7m s PRO 148 Cb 0.08 -4.52 0.01 0.00 0.04 0.00 0.00 34.50 30.10 1a7m s PRO 148 CO -0.14 -1.29 0.09 0.34 0.04 0.00 0.00 177.00 176.04 1a7m s ASP 149 N 1.77 -0.08 -0.14 6.66 -1.08 -1.26 -5.01 116.67 117.53 1a7m s ASP 149 Ca 0.26 0.16 0.24 0.00 -0.52 0.00 0.00 52.55 52.68 1a7m s ASP 149 Cb -0.10 0.18 0.46 0.00 -1.46 0.00 0.00 42.92 42.01 1a7m s ASP 149 CO -0.08 -0.04 1.14 0.00 0.52 0.00 0.00 175.17 176.71 1a7m n HIS 150 N 2.98 0.61 0.47 -5.34 1.44 -1.26 -4.92 115.22 109.19 1a7m n HIS 150 Ca -0.13 -1.35 0.06 0.00 -2.01 0.00 0.00 57.72 54.29 1a7m n HIS 150 Cb 0.59 -0.16 0.20 0.00 0.12 0.00 0.00 29.99 30.75 1a7m n HIS 150 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 1a7m n SER 151 N -0.10 2.63 0.08 4.39 3.41 -1.26 -4.26 113.62 118.51 1a7m n SER 151 Ca 0.06 -2.13 -0.23 0.00 -0.26 0.00 0.00 58.87 56.32 1a7m n SER 151 Cb 0.96 -0.36 -0.15 0.00 -0.26 0.00 0.00 64.21 64.40 1a7m n SER 151 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 1a7m h ASP 152 N 2.45 0.62 -4.36 4.04 3.58 -2.03 -3.46 116.42 117.27 1a7m h ASP 152 Ca 0.00 -0.92 -0.62 0.00 0.42 0.00 0.00 57.03 55.91 1a7m h ASP 152 Cb 0.76 -0.20 -0.27 0.00 1.72 0.00 0.00 39.33 41.33 1a7m h ASP 152 CO 0.07 1.62 -0.86 -0.54 -2.88 0.00 0.00 179.24 176.65 1a7m s LYS 153 N -2.52 1.62 0.00 0.28 -0.14 -1.26 -5.07 119.74 112.64 1a7m s LYS 153 Ca -0.13 -0.91 0.00 0.00 -1.36 0.00 0.00 55.97 53.56 1a7m s LYS 153 Cb 0.03 -1.68 0.00 0.00 -1.68 0.00 0.00 37.83 34.50 1a7m s LYS 153 CO 0.87 0.44 0.00 0.39 -0.76 0.00 0.00 175.35 176.29 1a7m n GLU 154 N 2.10 0.00 -0.36 1.68 1.02 -1.26 -2.49 120.64 121.34 1a7m n GLU 154 Ca -0.16 0.00 0.31 0.00 -0.02 0.00 0.00 57.16 57.29 1a7m n GLU 154 Cb 0.53 0.00 0.57 0.00 -0.02 0.00 0.00 31.44 32.52 1a7m n GLU 154 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 1a7m h VAL 155 N 0.00 0.12 -0.35 2.62 -1.51 -1.99 0.74 116.25 115.88 1a7m h VAL 155 Ca 0.00 -0.04 0.07 0.00 -1.23 0.00 0.00 66.70 65.50 1a7m h VAL 155 Cb 0.00 -0.01 -0.09 0.00 -2.13 0.00 0.00 31.29 29.06 1a7m h VAL 155 CO 0.00 0.02 -0.39 -0.26 -1.23 0.00 0.00 177.57 175.71 1a7m h PHE 156 N 0.12 -1.11 0.00 5.19 0.04 -1.99 0.24 116.94 119.42 1a7m h PHE 156 Ca 0.81 0.06 -0.06 0.00 2.80 0.00 0.00 57.97 61.58 1a7m h PHE 156 Cb 2.17 0.54 -0.01 0.00 2.20 0.00 0.00 35.95 40.85 1a7m h PHE 156 CO -0.01 -0.43 -0.31 1.96 -0.60 0.00 0.00 178.31 178.93 1a7m h GLN 157 N -0.33 0.00 -0.56 1.51 7.50 0.81 1.01 115.11 125.05 1a7m h GLN 157 Ca 0.14 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.29 1a7m h GLN 157 Cb 0.58 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.11 1a7m h GLN 157 CO -0.53 0.31 0.00 1.63 -1.50 0.00 0.00 178.83 178.74 1a7m n LYS 158 N -3.64 1.45 0.03 1.46 5.02 0.75 -0.76 118.16 122.47 1a7m n LYS 158 Ca -0.01 -0.46 0.00 0.00 -2.02 0.00 0.00 58.31 55.82 1a7m n LYS 158 Cb 0.43 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 34.06 1a7m n LYS 158 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1a7m n LYS 159 N -0.02 0.00 -0.03 1.97 4.01 -0.59 -4.82 118.16 118.68 1a7m n LYS 159 Ca 0.04 0.00 0.12 0.00 -0.51 0.00 0.00 58.31 57.96 1a7m n LYS 159 Cb 0.26 -0.19 0.53 0.00 -0.51 0.00 0.00 35.03 35.11 1a7m n LYS 159 CO 0.00 0.00 0.00 0.36 -1.11 0.00 0.00 177.40 176.65 1a7m n LYS 160 N -2.89 1.52 -0.29 1.97 -0.00 0.34 -4.31 118.16 114.50 1a7m n LYS 160 Ca 0.00 -0.77 0.24 0.00 -0.00 0.00 0.00 58.31 57.79 1a7m n LYS 160 Cb 0.15 -1.43 0.45 0.00 -0.00 0.00 0.00 35.03 34.20 1a7m n LYS 160 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1a7m n LEU 161 N -0.04 0.19 -0.15 -5.58 7.94 0.06 0.45 117.00 119.87 1a7m n LEU 161 Ca 0.18 1.49 0.07 0.00 -1.11 0.00 0.00 56.01 56.64 1a7m n LEU 161 Cb 0.28 -0.68 0.11 0.00 0.53 0.00 0.00 43.42 43.66 1a7m n LEU 161 CO 0.15 -1.63 0.56 0.61 -1.11 0.00 0.00 177.39 175.97 1a7m n GLY 162 N -1.29 4.13 0.13 -3.96 0.00 -1.26 -4.56 105.19 98.37 1a7m n GLY 162 Ca 0.30 -0.75 -0.23 0.00 0.00 0.00 0.00 46.02 45.34 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 -0.52 0.72 0.47 0.00 4.15 -1.33 0.15 115.11 118.74 1a7m h GLN 164 Ca -0.54 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 58.83 1a7m h GLN 164 Cb 1.71 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 29.22 1a7m h GLN 164 CO -0.19 0.47 -0.40 -0.07 -1.93 0.00 0.00 178.83 176.71 1a7m h LEU 165 N 0.74 -1.08 -0.25 -2.39 -0.00 -1.77 -0.25 115.31 110.30 1a7m h LEU 165 Ca 0.32 0.08 0.06 0.00 -0.00 0.00 0.00 57.88 58.34 1a7m h LEU 165 Cb 0.19 0.35 -0.06 0.00 -0.00 0.00 0.00 40.66 41.15 1a7m h LEU 165 CO -0.18 -0.57 -0.11 -0.07 -0.00 0.00 0.00 178.44 177.51 1a7m h LEU 166 N -0.87 -0.37 -1.44 1.67 -0.00 0.52 0.37 115.31 115.19 1a7m h LEU 166 Ca -0.05 0.09 0.34 0.00 -0.00 0.00 0.00 57.88 58.27 1a7m h LEU 166 Cb 0.75 0.21 -0.10 0.00 -0.00 0.00 0.00 40.66 41.52 1a7m h LEU 166 CO -0.03 -0.14 0.77 1.23 -0.00 0.00 0.00 178.44 180.27 1a7m h GLY 167 N -0.07 1.14 0.13 0.83 0.00 -0.15 0.20 103.07 105.15 1a7m h GLY 167 Ca 0.13 -0.15 -0.00 0.00 0.00 0.00 0.00 47.33 47.31 1a7m h GLY 167 CO -0.30 -0.23 -0.02 -0.91 0.00 0.00 0.00 176.54 175.08 1a7m h THR 168 N 0.23 1.09 -0.85 4.70 1.35 0.75 -3.34 112.91 116.84 1a7m h THR 168 Ca 0.69 -1.63 0.10 0.00 -0.55 0.00 0.00 66.41 65.02 1a7m h THR 168 Cb 2.03 1.99 -0.13 0.00 -1.73 0.00 0.00 68.15 70.31 1a7m h THR 168 CO -0.32 0.34 -0.49 0.22 -0.25 0.00 0.00 175.52 175.02 1a7m h TYR 169 N -0.93 -1.50 -0.50 4.73 3.20 0.12 0.81 116.97 122.90 1a7m h TYR 169 Ca -0.01 0.11 0.15 0.00 3.14 0.00 0.00 58.73 62.12 1a7m h TYR 169 Cb 0.61 0.77 -0.02 0.00 1.54 0.00 0.00 36.73 39.63 1a7m h TYR 169 CO 0.15 -0.40 0.48 1.57 -1.64 0.00 0.00 178.16 178.32 1a7m h LYS 170 N -0.09 0.00 0.12 1.82 2.10 -0.82 0.68 116.57 120.38 1a7m h LYS 170 Ca 0.21 0.00 -0.34 0.00 -2.00 0.00 0.00 60.65 58.52 1a7m h LYS 170 Cb 0.52 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.83 1a7m h LYS 170 CO -0.86 0.00 -1.79 1.96 -2.00 0.00 0.00 179.45 176.76 1a7m h GLN 171 N 0.00 0.25 0.09 0.07 4.20 0.42 -2.02 115.11 118.11 1a7m h GLN 171 Ca 0.24 -0.43 -0.00 0.00 0.06 0.00 0.00 58.65 58.52 1a7m h GLN 171 Cb 1.19 0.16 0.00 0.00 0.30 0.00 0.00 27.48 29.13 1a7m h GLN 171 CO -0.00 1.10 -0.04 -0.39 -0.67 0.00 0.00 178.83 178.83 1a7m h VAL 172 N 0.07 1.16 -0.38 -0.54 -1.51 0.39 -2.86 116.25 112.58 1a7m h VAL 172 Ca -0.34 -1.23 0.08 0.00 -1.23 0.00 0.00 66.70 63.98 1a7m h VAL 172 Cb 2.04 1.91 -0.08 0.00 -2.13 0.00 0.00 31.29 33.03 1a7m h VAL 172 CO 0.12 0.29 -0.16 0.40 -1.23 0.00 0.00 177.57 176.99 1a7m h ILE 173 N -0.71 0.49 0.00 7.19 1.08 0.15 1.11 117.51 126.83 1a7m h ILE 173 Ca -0.01 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.46 1a7m h ILE 173 Cb 0.56 0.49 0.00 0.00 -3.07 0.00 0.00 36.82 34.80 1a7m h ILE 173 CO 0.02 0.00 0.00 -0.24 -0.69 0.00 0.00 178.15 177.24 1a7m n SER 174 N -5.35 0.00 -0.03 1.72 2.88 -0.76 0.25 113.62 112.34 1a7m n SER 174 Ca 0.02 -0.42 -0.03 0.00 -1.33 0.00 0.00 58.87 57.11 1a7m n SER 174 Cb 0.26 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.67 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 -0.96 0.38 -0.03 2.46 0.31 0.21 -4.43 118.33 116.27 1a7m n VAL 175 Ca 0.09 -0.24 -0.10 0.00 -0.01 0.00 0.00 64.34 64.07 1a7m n VAL 175 Cb 0.04 -0.80 -0.14 0.00 -0.91 0.00 0.00 33.84 32.03 1a7m n VAL 175 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1a7m n VAL 176 N -2.20 1.60 0.25 2.52 0.24 0.32 -3.04 118.33 118.03 1a7m n VAL 176 Ca -0.09 -0.79 0.08 0.00 -2.04 0.00 0.00 64.34 61.50 1a7m n VAL 176 Cb 0.67 -1.04 0.63 0.00 -1.47 0.00 0.00 33.84 32.63 1a7m n VAL 176 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 1a7m h VAL 177 N 0.01 1.00 -0.56 3.34 3.04 -0.41 0.27 116.25 122.94 1a7m h VAL 177 Ca -0.34 -0.13 -0.31 0.00 -1.01 0.00 0.00 66.70 64.90 1a7m h VAL 177 Cb 2.04 1.07 -0.19 0.00 -2.01 0.00 0.00 31.29 32.21 1a7m h VAL 177 CO 0.07 0.04 0.07 0.00 -1.01 0.00 0.00 177.57 176.74 1a7m n GLN 178 N -4.45 2.11 -0.07 4.17 6.02 -1.24 -4.61 117.38 119.30 1a7m n GLN 178 Ca -0.03 -3.25 -0.15 0.00 -0.01 0.00 0.00 57.00 53.56 1a7m n GLN 178 Cb 0.12 -1.96 -0.05 0.00 1.02 0.00 0.00 30.24 29.37 1a7m n GLN 178 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1a7m n ALA 179 N -1.09 1.92 0.21 -1.58 0.00 0.96 -4.98 120.51 115.95 1a7m n ALA 179 Ca 0.42 -0.61 0.02 0.00 0.00 0.00 0.00 53.44 53.27 1a7m n ALA 179 Cb 1.13 0.26 0.02 0.00 0.00 0.00 0.00 19.45 20.86 1a7m n ALA 179 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47