#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a7m s PRO 2 N 0.00 2.81 -0.59 -1.46 0.04 -1.26 -5.09 135.00 129.45 1a7m s PRO 2 Ca 0.00 -0.16 0.05 0.00 0.04 0.00 0.00 61.00 60.94 1a7m s PRO 2 Cb 0.00 -2.31 0.20 0.00 0.04 0.00 0.00 34.50 32.43 1a7m s PRO 2 CO 0.00 -0.72 0.53 1.28 0.04 0.00 0.00 177.00 178.13 1a7m n LEU 3 N -2.55 2.12 -3.31 -3.56 4.32 -1.26 -5.02 117.00 107.74 1a7m n LEU 3 Ca 0.05 -5.03 -0.26 0.00 -0.02 0.00 0.00 56.01 50.74 1a7m n LEU 3 Cb 0.58 -0.28 -0.04 0.00 -1.62 0.00 0.00 43.42 42.06 1a7m n LEU 3 CO 0.51 1.90 1.86 -0.81 -1.22 0.00 0.00 177.39 179.63 1a7m n PRO 4 N 1.78 1.15 -4.33 3.23 -0.04 -1.26 -4.85 135.00 130.68 1a7m n PRO 4 Ca 0.25 -1.28 -0.24 0.00 -0.04 0.00 0.00 63.50 62.19 1a7m n PRO 4 Cb 0.42 -2.49 -0.12 0.00 -0.04 0.00 0.00 33.50 31.27 1a7m n PRO 4 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1a7m s ILE 5 N 4.74 1.88 -0.22 0.52 1.10 -1.26 -5.13 121.20 122.82 1a7m s ILE 5 Ca 0.40 -1.78 0.00 0.00 -0.51 0.00 0.00 60.65 58.76 1a7m s ILE 5 Cb 0.10 -1.78 0.06 0.00 0.15 0.00 0.00 42.46 40.98 1a7m s ILE 5 CO 0.07 -0.17 -0.06 0.42 -2.11 0.00 0.00 174.94 173.10 1a7m s THR 6 N -1.60 1.46 -0.81 4.00 -4.23 -1.26 -5.05 115.64 108.15 1a7m s THR 6 Ca 0.13 -1.11 -0.06 0.00 -1.18 0.00 0.00 61.69 59.47 1a7m s THR 6 Cb -0.08 -1.70 -0.08 0.00 1.34 0.00 0.00 72.50 71.97 1a7m s THR 6 CO 0.06 -0.05 2.31 -0.81 -0.54 0.00 0.00 174.62 175.59 1a7m n PRO 7 N 4.71 2.12 -2.73 3.99 -0.04 -1.26 -4.43 135.00 137.36 1a7m n PRO 7 Ca -0.12 -1.37 -0.26 0.00 -0.04 0.00 0.00 63.50 61.70 1a7m n PRO 7 Cb 0.45 -2.36 -0.02 0.00 -0.04 0.00 0.00 33.50 31.53 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 3.79 2.60 -0.38 0.52 3.14 -1.26 -4.81 118.33 121.93 1a7m n VAL 8 Ca 0.45 -5.18 0.10 0.00 -2.96 0.00 0.00 64.34 56.75 1a7m n VAL 8 Cb 0.24 -1.25 0.33 0.00 -1.06 0.00 0.00 33.84 32.11 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 -0.34 4.22 -2.24 6.55 4.05 -1.26 -3.82 115.26 122.42 1a7m n ASN 9 Ca 0.34 -2.26 -0.11 0.00 0.45 0.00 0.00 54.58 53.00 1a7m n ASN 9 Cb 0.54 -0.53 0.04 0.00 1.23 0.00 0.00 39.78 41.06 1a7m n ASN 9 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1a7m n ALA 10 N 1.25 3.80 -0.33 5.20 0.00 -1.26 -4.74 120.51 124.44 1a7m n ALA 10 Ca 0.24 -3.26 0.05 0.00 0.00 0.00 0.00 53.44 50.47 1a7m n ALA 10 Cb 0.75 -0.57 0.14 0.00 0.00 0.00 0.00 19.45 19.77 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 -0.63 1.27 -1.31 0.00 -1.04 -1.25 -4.23 114.28 107.09 1a7m n THR 11 Ca 0.25 -1.22 -0.02 0.00 -2.04 0.00 0.00 64.05 61.03 1a7m n THR 11 Cb 0.89 0.33 -0.00 0.00 -1.82 0.00 0.00 70.33 69.73 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 -0.50 3.00 -1.31 0.00 0.00 -1.26 -4.56 120.51 115.88 1a7m n ALA 13 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.18 1a7m n ALA 13 Cb 0.02 0.09 0.14 0.00 0.00 0.00 0.00 19.45 19.70 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 -2.88 3.30 0.00 0.00 -6.64 -1.26 -4.65 119.36 107.24 1a7m n ILE 14 Ca 0.00 -2.43 0.00 0.00 -1.77 0.00 0.00 62.75 58.55 1a7m n ILE 14 Cb 0.00 -0.74 0.00 0.00 -1.44 0.00 0.00 39.64 37.46 1a7m n ILE 14 CO 0.00 0.00 0.00 -1.14 -1.77 0.00 0.00 176.55 173.64 1a7m n ARG 15 N -1.05 0.00 -3.29 6.28 0.63 -1.26 -5.02 116.66 112.95 1a7m n ARG 15 Ca 0.59 0.00 -0.25 0.00 -0.92 0.00 0.00 57.85 57.27 1a7m n ARG 15 Cb 1.23 0.00 -0.08 0.00 0.45 0.00 0.00 32.46 34.06 1a7m n ARG 15 CO 0.00 0.00 0.00 1.58 -2.51 0.00 0.00 177.63 176.70 1a7m n HIS 16 N 0.00 -1.01 -1.53 -0.14 -0.00 -1.26 -5.06 115.22 106.23 1a7m n HIS 16 Ca 0.00 -3.23 -0.26 0.00 -0.00 0.00 0.00 57.72 54.24 1a7m n HIS 16 Cb 0.00 0.21 -0.10 0.00 -0.00 0.00 0.00 29.99 30.10 1a7m n HIS 16 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 1a7m n PRO 17 N 2.46 0.67 -3.45 1.57 -0.04 -1.26 -4.80 135.00 130.14 1a7m n PRO 17 Ca 0.27 -1.85 -0.20 0.00 -0.04 0.00 0.00 63.50 61.68 1a7m n PRO 17 Cb 0.50 -3.57 -0.00 0.00 -0.04 0.00 0.00 33.50 30.38 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 -1.70 -0.01 0.00 0.00 8.25 -1.26 -4.75 115.22 115.76 1a7m n HIS 19 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 1a7m n HIS 19 Cb 0.58 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.69 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 0.00 1.47 0.00 -1.41 0.00 -1.26 -4.84 105.19 99.15 1a7m n GLY 20 Ca 0.00 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.16 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 0.00 0.00 0.00 1.61 3.02 -1.26 -4.99 115.26 113.64 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 0.18 -2.62 0.00 0.00 177.26 174.82 1a7m n LEU 22 N -0.98 0.00 -0.29 3.41 7.99 -1.26 -4.28 117.00 121.60 1a7m n LEU 22 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 56.01 56.08 1a7m n LEU 22 Cb 0.00 0.00 0.17 0.00 -0.11 0.00 0.00 43.42 43.48 1a7m n LEU 22 CO 0.00 0.00 0.59 1.15 -1.51 0.00 0.00 177.39 177.62 1a7m n MET 23 N 0.00 -0.07 0.00 3.23 0.00 -1.26 0.11 117.12 119.13 1a7m n MET 23 Ca 0.00 1.24 0.11 0.00 0.00 0.00 0.00 57.70 59.05 1a7m n MET 23 Cb 0.00 -1.91 0.08 0.00 0.00 0.00 0.00 33.22 31.39 1a7m n MET 23 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 175.97 176.24 1a7m n ASN 24 N -5.24 1.39 0.09 3.17 6.94 -1.26 -4.14 115.26 116.21 1a7m n ASN 24 Ca 0.16 -1.12 -0.07 0.00 -0.02 0.00 0.00 54.58 53.54 1a7m n ASN 24 Cb 0.51 0.51 -0.04 0.00 -2.36 0.00 0.00 39.78 38.40 1a7m n ASN 24 CO 0.00 0.00 0.00 -0.61 -1.03 0.00 0.00 177.26 175.62 1a7m h GLN 25 N 1.30 -0.30 0.00 -3.83 5.75 0.44 -2.86 115.11 115.61 1a7m h GLN 25 Ca 0.00 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 1a7m h GLN 25 Cb 0.61 0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.23 1a7m h GLN 25 CO 0.00 -0.09 0.03 -0.84 -2.65 0.00 0.00 178.83 175.28 1a7m h ILE 26 N -1.04 0.00 0.30 2.39 3.07 -1.36 0.14 117.51 121.01 1a7m h ILE 26 Ca -0.03 0.00 -0.01 0.00 1.55 0.00 0.00 64.86 66.36 1a7m h ILE 26 Cb 0.35 0.87 0.00 0.00 -0.27 0.00 0.00 36.82 37.77 1a7m h ILE 26 CO 0.05 0.00 -0.14 0.50 -1.05 0.00 0.00 178.15 177.51 1a7m h LYS 27 N 0.00 -0.39 -0.24 0.16 3.64 -1.69 0.18 116.57 118.23 1a7m h LYS 27 Ca 0.00 0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.34 1a7m h LYS 27 Cb 0.06 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 1a7m h LYS 27 CO 0.00 -0.07 -0.10 -0.97 -2.27 0.00 0.00 179.45 176.05 1a7m h ASN 28 N -0.77 0.50 -0.94 4.20 -1.24 -1.07 -0.02 115.58 116.23 1a7m h ASN 28 Ca -0.04 -0.40 0.10 0.00 0.71 0.00 0.00 56.30 56.67 1a7m h ASN 28 Cb 0.51 -0.14 -0.08 0.00 0.73 0.00 0.00 38.32 39.34 1a7m h ASN 28 CO 0.07 0.78 0.58 -0.61 -1.29 0.00 0.00 177.43 176.96 1a7m h GLN 29 N 0.21 0.95 0.09 6.67 4.15 -0.81 -3.09 115.11 123.28 1a7m h GLN 29 Ca 0.06 -0.06 -0.13 0.00 0.77 0.00 0.00 58.65 59.29 1a7m h GLN 29 Cb 0.59 -0.21 0.01 0.00 0.21 0.00 0.00 27.48 28.07 1a7m h GLN 29 CO 0.03 0.63 -0.61 1.25 -1.93 0.00 0.00 178.83 178.20 1a7m h LEU 30 N 0.98 0.29 -0.82 -2.39 5.85 -0.81 -3.36 115.31 115.04 1a7m h LEU 30 Ca 0.44 -0.95 0.22 0.00 0.84 0.00 0.00 57.88 58.44 1a7m h LEU 30 Cb 0.35 -0.09 -0.15 0.00 0.37 0.00 0.00 40.66 41.13 1a7m h LEU 30 CO -0.23 1.28 -0.01 0.00 -0.34 0.00 0.00 178.44 179.15 1a7m n ALA 31 N -2.70 0.40 -0.17 1.25 0.00 -0.03 0.27 120.51 119.53 1a7m n ALA 31 Ca -0.14 0.89 -0.02 0.00 0.00 0.00 0.00 53.44 54.17 1a7m n ALA 31 Cb 0.71 -0.64 0.06 0.00 0.00 0.00 0.00 19.45 19.58 1a7m n ALA 31 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1a7m h GLN 32 N 0.00 0.08 -0.14 0.00 4.15 -1.71 0.20 115.11 117.69 1a7m h GLN 32 Ca 0.49 -0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.88 1a7m h GLN 32 Cb 0.99 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.66 1a7m h GLN 32 CO -0.78 0.05 -0.01 -0.07 -1.93 0.00 0.00 178.83 176.09 1a7m h LEU 33 N 0.08 0.26 -0.80 -2.39 4.07 0.37 -0.78 115.31 116.12 1a7m h LEU 33 Ca 0.26 -0.33 0.17 0.00 0.08 0.00 0.00 57.88 58.05 1a7m h LEU 33 Cb 0.40 -0.07 -0.15 0.00 1.08 0.00 0.00 40.66 41.92 1a7m h LEU 33 CO -0.46 0.53 -0.15 -1.13 -1.08 0.00 0.00 178.44 176.14 1a7m h ASN 34 N -0.01 -0.66 0.22 -0.43 -1.24 0.23 0.68 115.58 114.36 1a7m h ASN 34 Ca 0.04 0.23 0.01 0.00 0.71 0.00 0.00 56.30 57.29 1a7m h ASN 34 Cb 0.40 0.47 -0.03 0.00 0.73 0.00 0.00 38.32 39.89 1a7m h ASN 34 CO 0.01 -0.25 -0.30 1.23 -1.29 0.00 0.00 177.43 176.83 1a7m h GLY 35 N 0.02 -0.63 1.26 1.57 0.00 -0.30 -2.22 103.07 102.77 1a7m h GLY 35 Ca 0.40 0.35 0.01 0.00 0.00 0.00 0.00 47.33 48.09 1a7m h GLY 35 CO -0.80 -0.25 0.49 1.48 0.00 0.00 0.00 176.54 177.46 1a7m h SER 36 N -0.58 0.84 -1.04 0.19 4.64 0.82 0.26 113.55 118.68 1a7m h SER 36 Ca 0.01 -0.02 0.27 0.00 -0.47 0.00 0.00 61.79 61.57 1a7m h SER 36 Cb 0.56 -0.21 -0.10 0.00 -0.31 0.00 0.00 62.40 62.35 1a7m h SER 36 CO -0.11 0.60 0.66 0.00 -0.87 0.00 0.00 176.83 177.11 1a7m h ALA 37 N 1.54 2.18 0.04 5.18 0.00 0.80 2.63 119.26 131.64 1a7m h ALA 37 Ca 0.27 0.07 -0.32 0.00 0.00 0.00 0.00 54.91 54.93 1a7m h ALA 37 Cb -0.09 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 1a7m h ALA 37 CO -0.06 -0.60 -1.84 -1.71 0.00 0.00 0.00 179.25 175.04 1a7m n ASN 38 N -4.66 1.30 -0.05 0.00 4.05 -0.24 -3.65 115.26 112.00 1a7m n ASN 38 Ca 0.26 0.33 -0.03 0.00 0.45 0.00 0.00 54.58 55.58 1a7m n ASN 38 Cb 0.87 -0.31 -0.01 0.00 1.23 0.00 0.00 39.78 41.56 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 0.67 0.00 -0.69 5.20 0.00 0.30 -3.35 119.26 121.39 1a7m h ALA 39 Ca -0.34 -0.43 0.10 0.00 0.00 0.00 0.00 54.91 54.23 1a7m h ALA 39 Cb 2.03 0.37 -0.12 0.00 0.00 0.00 0.00 17.79 20.07 1a7m h ALA 39 CO 0.08 0.37 -0.43 1.25 0.00 0.00 0.00 179.25 180.52 1a7m h LEU 40 N -0.75 -1.52 -0.50 0.00 7.12 0.41 0.30 115.31 120.37 1a7m h LEU 40 Ca 0.00 0.26 0.07 0.00 0.13 0.00 0.00 57.88 58.35 1a7m h LEU 40 Cb 0.37 0.71 -0.08 0.00 -0.53 0.00 0.00 40.66 41.14 1a7m h LEU 40 CO 0.00 -0.31 -0.21 0.33 -0.13 0.00 0.00 178.44 178.12 1a7m n PHE 41 N -5.40 -0.02 0.19 1.25 7.35 -0.71 0.22 117.46 120.32 1a7m n PHE 41 Ca 0.03 0.61 -0.07 0.00 -0.76 0.00 0.00 57.45 57.26 1a7m n PHE 41 Cb 0.35 -0.66 -0.04 0.00 0.35 0.00 0.00 39.48 39.48 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 0.00 0.00 -2.13 5.03 -0.61 0.29 117.51 120.09 1a7m h ILE 42 Ca 0.16 -0.07 0.00 0.00 -0.12 0.00 0.00 64.86 64.83 1a7m h ILE 42 Cb 0.28 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 34.07 1a7m h ILE 42 CO -0.49 0.00 0.48 -1.28 -0.68 0.00 0.00 178.15 176.18 1a7m h SER 43 N -0.55 0.00 0.00 1.72 0.87 0.91 0.60 113.55 117.10 1a7m h SER 43 Ca -0.05 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.51 1a7m h SER 43 Cb 0.37 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 1a7m h SER 43 CO 0.08 0.00 -0.21 0.00 -0.53 0.00 0.00 176.83 176.17 1a7m n TYR 44 N -2.40 0.31 0.27 2.24 9.36 0.59 -4.22 117.16 123.31 1a7m n TYR 44 Ca -0.01 0.14 0.16 0.00 3.32 0.00 0.00 57.90 61.50 1a7m n TYR 44 Cb 0.50 -0.41 0.90 0.00 -0.63 0.00 0.00 39.34 39.69 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 -0.37 0.00 -0.48 2.98 -0.00 0.11 0.96 116.97 120.17 1a7m h TYR 45 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 58.73 58.71 1a7m h TYR 45 Cb 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 36.92 1a7m h TYR 45 CO -0.09 0.00 0.23 1.79 -0.00 0.00 0.00 178.16 180.09 1a7m h THR 46 N 0.00 1.16 0.00 -0.90 1.35 -0.06 0.10 112.91 114.56 1a7m h THR 46 Ca 0.03 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 1a7m h THR 46 Cb 0.15 0.55 0.00 0.00 -1.73 0.00 0.00 68.15 67.12 1a7m h THR 46 CO -0.00 0.19 0.00 0.00 -0.25 0.00 0.00 175.52 175.46 1a7m n ALA 47 N -2.46 1.60 -0.02 6.62 0.00 0.33 -3.03 120.51 123.54 1a7m n ALA 47 Ca 0.04 -0.05 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 1a7m n ALA 47 Cb 0.12 -1.21 -0.11 0.00 0.00 0.00 0.00 19.45 18.25 1a7m n ALA 47 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1a7m h GLN 48 N 0.00 0.20 0.00 0.00 1.08 -1.06 -3.41 115.11 111.92 1a7m h GLN 48 Ca 0.00 -0.22 0.00 0.00 -1.45 0.00 0.00 58.65 56.98 1a7m h GLN 48 Cb 0.22 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.71 1a7m h GLN 48 CO 0.00 0.96 0.00 0.41 -0.95 0.00 0.00 178.83 179.25 1a7m n GLY 49 N 1.08 0.27 3.24 3.46 0.00 -1.17 -5.06 105.19 107.02 1a7m n GLY 49 Ca -0.10 -1.25 -0.14 0.00 0.00 0.00 0.00 46.02 44.54 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 0.00 1.36 -0.97 1.61 -1.05 -1.26 -3.95 118.70 114.43 1a7m s GLU 50 Ca 0.00 -1.71 -0.24 0.00 -0.15 0.00 0.00 54.97 52.88 1a7m s GLU 50 Cb 0.00 0.29 -0.04 0.00 -0.44 0.00 0.00 34.13 33.95 1a7m s GLU 50 CO 0.00 -0.47 1.87 -1.25 0.95 0.00 0.00 175.26 176.37 1a7m s PRO 51 N -3.97 2.72 0.00 -4.83 0.04 -1.26 -5.05 135.00 122.66 1a7m s PRO 51 Ca 0.39 -0.57 0.00 0.00 0.04 0.00 0.00 61.00 60.86 1a7m s PRO 51 Cb 0.05 -5.14 0.00 0.00 0.04 0.00 0.00 34.50 29.45 1a7m s PRO 51 CO 0.16 -3.28 0.00 0.34 0.04 0.00 0.00 177.00 174.26 1a7m n PHE 52 N 13.21 0.00 0.00 0.56 -0.00 -1.25 -4.19 117.46 125.79 1a7m n PHE 52 Ca 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.85 1a7m n PHE 52 Cb 0.47 0.05 0.00 0.00 -0.00 0.00 0.00 39.48 40.01 1a7m n PHE 52 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 1a7m n PRO 53 N -2.46 0.00 -0.02 -7.13 -0.04 -1.26 0.13 135.00 124.22 1a7m n PRO 53 Ca 0.00 0.19 -0.01 0.00 -0.04 0.00 0.00 63.50 63.64 1a7m n PRO 53 Cb 0.00 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 31.92 1a7m n PRO 53 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1a7m n ASN 54 N -1.19 3.81 -0.01 3.54 6.94 -1.26 -4.73 115.26 122.35 1a7m n ASN 54 Ca 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 54.58 54.57 1a7m n ASN 54 Cb 0.00 0.80 0.01 0.00 -2.36 0.00 0.00 39.78 38.23 1a7m n ASN 54 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1a7m n ASN 55 N -2.04 1.68 -0.21 0.53 3.02 0.39 -4.66 115.26 113.97 1a7m n ASN 55 Ca -0.06 -1.90 0.19 0.00 -0.03 0.00 0.00 54.58 52.78 1a7m n ASN 55 Cb 0.51 -0.02 0.54 0.00 -0.61 0.00 0.00 39.78 40.19 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 0.00 0.35 -1.85 3.41 8.10 0.81 0.38 115.31 126.51 1a7m h LEU 56 Ca 0.00 0.03 -0.03 0.00 0.11 0.00 0.00 57.88 58.00 1a7m h LEU 56 Cb 0.61 -0.03 -0.00 0.00 -0.44 0.00 0.00 40.66 40.80 1a7m h LEU 56 CO 0.00 0.15 -0.12 0.44 -4.11 0.00 0.00 178.44 174.80 1a7m h ASP 57 N 0.35 0.00 -0.01 0.17 5.19 -1.83 1.04 116.42 121.34 1a7m h ASP 57 Ca 0.43 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.84 1a7m h ASP 57 Cb 1.14 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.65 1a7m h ASP 57 CO -0.14 0.12 -0.19 1.17 -3.12 0.00 0.00 179.24 177.07 1a7m n LYS 58 N -4.15 2.19 -0.01 3.56 4.81 0.11 -4.01 118.16 120.65 1a7m n LYS 58 Ca -0.02 -0.56 -0.01 0.00 -0.87 0.00 0.00 58.31 56.85 1a7m n LYS 58 Cb 0.20 -1.05 -0.03 0.00 0.02 0.00 0.00 35.03 34.17 1a7m n LYS 58 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1a7m n LEU 59 N -0.30 0.00 -2.39 3.14 4.77 0.32 -4.82 117.00 117.72 1a7m n LEU 59 Ca 0.04 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.00 1a7m n LEU 59 Cb 0.19 0.07 0.05 0.00 -2.33 0.00 0.00 43.42 41.39 1a7m n LEU 59 CO 0.12 0.07 0.04 0.00 -1.33 0.00 0.00 177.39 176.28 1a7m n GLY 61 N -0.42 1.80 3.87 0.00 0.00 -0.71 -3.31 105.19 106.42 1a7m n GLY 61 Ca 0.12 -1.00 -0.31 0.00 0.00 0.00 0.00 46.02 44.83 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 -3.55 3.22 -0.00 1.61 0.04 -1.26 -4.78 135.00 130.27 1a7m s PRO 62 Ca 0.26 0.68 0.05 0.00 0.04 0.00 0.00 61.00 62.02 1a7m s PRO 62 Cb 0.33 -2.04 -0.07 0.00 0.04 0.00 0.00 34.50 32.76 1a7m s PRO 62 CO -0.05 -0.82 0.13 -1.71 0.04 0.00 0.00 177.00 174.59 1a7m n ASN 63 N -2.91 2.96 0.00 6.66 5.15 -1.26 -0.12 115.26 125.74 1a7m n ASN 63 Ca 0.06 -0.16 0.00 0.00 -0.60 0.00 0.00 54.58 53.89 1a7m n ASN 63 Cb 0.55 1.16 0.00 0.00 -0.53 0.00 0.00 39.78 40.96 1a7m n ASN 63 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 1a7m n VAL 64 N -1.52 0.00 -2.92 3.44 0.31 -1.26 -4.83 118.33 111.55 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 0.11 -0.26 0.00 0.00 -0.91 0.00 0.00 33.84 32.78 1a7m n VAL 64 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1a7m n THR 65 N -0.74 0.00 -0.04 2.52 -1.04 -1.26 -2.92 114.28 110.80 1a7m n THR 65 Ca 0.00 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 62.02 1a7m n THR 65 Cb 0.00 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 68.54 1a7m n THR 65 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1a7m n ASP 66 N 3.60 2.20 -4.76 8.00 5.75 -1.26 -5.04 116.55 125.04 1a7m n ASP 66 Ca 0.00 -2.01 -0.32 0.00 -0.01 0.00 0.00 54.79 52.45 1a7m n ASP 66 Cb 0.00 -0.05 0.09 0.00 -1.03 0.00 0.00 41.12 40.12 1a7m n ASP 66 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 1a7m s PHE 67 N -1.01 2.49 -0.48 2.11 -0.71 -1.15 -4.85 117.98 114.38 1a7m s PHE 67 Ca 0.05 1.58 -0.39 0.00 -1.04 0.00 0.00 56.93 57.13 1a7m s PHE 67 Cb 0.03 -3.13 -0.16 0.00 -1.21 0.00 0.00 43.02 38.55 1a7m s PHE 67 CO 0.03 -1.89 2.21 -0.35 -1.34 0.00 0.00 175.22 173.89 1a7m n PRO 68 N -3.23 0.45 -0.89 1.99 -0.04 -1.26 -4.78 135.00 127.25 1a7m n PRO 68 Ca 0.10 0.12 -0.35 0.00 -0.04 0.00 0.00 63.50 63.33 1a7m n PRO 68 Cb 0.52 -1.93 -0.05 0.00 -0.04 0.00 0.00 33.50 32.00 1a7m n PRO 68 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1a7m n PRO 69 N 7.90 1.39 -1.37 0.54 -0.04 -1.26 -4.87 135.00 137.28 1a7m n PRO 69 Ca 0.50 -1.55 -0.58 0.00 -0.04 0.00 0.00 63.50 61.82 1a7m n PRO 69 Cb 0.09 -2.68 -0.10 0.00 -0.04 0.00 0.00 33.50 30.76 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 6.60 1.38 -3.59 0.54 -0.00 -1.26 -4.87 117.46 116.26 1a7m n PHE 70 Ca 0.44 0.66 -0.29 0.00 -0.00 0.00 0.00 57.45 58.26 1a7m n PHE 70 Cb 0.31 -2.36 -0.14 0.00 -0.00 0.00 0.00 39.48 37.29 1a7m n PHE 70 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.76 175.18 1a7m s HIS 71 N 5.93 1.12 -0.83 -5.13 2.46 -1.26 -5.03 115.29 112.55 1a7m s HIS 71 Ca 1.15 -1.66 -0.13 0.00 0.47 0.00 0.00 55.06 54.89 1a7m s HIS 71 Cb -1.31 -1.29 -0.24 0.00 -0.13 0.00 0.00 32.58 29.60 1a7m s HIS 71 CO 0.63 -0.83 2.07 0.00 -2.47 0.00 0.00 174.74 174.14 1a7m n ALA 72 N 4.37 0.81 -0.89 1.58 0.00 -1.26 -4.65 120.51 120.48 1a7m n ALA 72 Ca 0.04 -1.06 -0.00 0.00 0.00 0.00 0.00 53.44 52.42 1a7m n ALA 72 Cb 0.39 -2.43 0.34 0.00 0.00 0.00 0.00 19.45 17.74 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 9.39 5.10 -0.47 0.00 3.02 -1.26 -4.86 115.26 126.18 1a7m n ASN 73 Ca 0.53 -3.05 0.00 0.00 -0.03 0.00 0.00 54.58 52.04 1a7m n ASN 73 Cb 0.27 -0.71 0.00 0.00 -0.61 0.00 0.00 39.78 38.73 1a7m n ASN 73 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1a7m n GLY 74 N 0.20 0.94 2.64 7.41 0.00 -1.26 -5.06 105.19 110.06 1a7m n GLY 74 Ca 0.34 -0.61 -0.24 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.90 -0.03 0.17 2.61 2.01 -1.26 -5.01 115.64 111.23 1a7m s THR 75 Ca 0.00 -0.01 -0.19 0.00 0.31 0.00 0.00 61.69 61.80 1a7m s THR 75 Cb 0.00 -0.48 0.11 0.00 0.01 0.00 0.00 72.50 72.13 1a7m s THR 75 CO 0.00 -0.12 1.63 -0.33 -0.69 0.00 0.00 174.62 175.11 1a7m h GLU 76 N 8.41 -0.11 -0.96 4.92 3.07 -1.99 0.40 114.58 128.32 1a7m h GLU 76 Ca -0.14 0.01 0.09 0.00 -0.50 0.00 0.00 59.36 58.82 1a7m h GLU 76 Cb 1.14 0.03 -0.07 0.00 -0.84 0.00 0.00 28.75 29.00 1a7m h GLU 76 CO 0.25 -0.07 0.60 1.57 -1.40 0.00 0.00 179.01 179.96 1a7m h LYS 77 N -0.11 0.99 -0.10 2.33 2.10 -1.97 0.18 116.57 119.99 1a7m h LYS 77 Ca 0.20 -0.06 0.00 0.00 -2.00 0.00 0.00 60.65 58.79 1a7m h LYS 77 Cb 0.43 -0.22 -0.01 0.00 -0.90 0.00 0.00 32.23 31.53 1a7m h LYS 77 CO -0.49 0.65 0.06 0.00 -2.00 0.00 0.00 179.45 177.67 1a7m h ALA 78 N 1.48 0.12 -0.27 0.07 0.00 -0.71 0.51 119.26 120.45 1a7m h ALA 78 Ca 0.45 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.41 1a7m h ALA 78 Cb 0.33 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.04 1a7m h ALA 78 CO -0.22 -0.40 -0.07 0.87 0.00 0.00 0.00 179.25 179.42 1a7m h LYS 79 N 0.12 -0.01 0.02 0.00 1.57 0.08 0.39 116.57 118.73 1a7m h LYS 79 Ca 0.04 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.57 1a7m h LYS 79 Cb -0.01 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.32 1a7m h LYS 79 CO -0.02 -0.01 -1.03 -0.07 -0.57 0.00 0.00 179.45 177.76 1a7m h LEU 80 N -0.01 0.71 0.00 2.94 4.07 -0.46 -2.43 115.31 120.14 1a7m h LEU 80 Ca 0.13 -0.59 -0.00 0.00 0.08 0.00 0.00 57.88 57.50 1a7m h LEU 80 Cb 0.21 -0.22 0.00 0.00 1.08 0.00 0.00 40.66 41.73 1a7m h LEU 80 CO -0.28 1.39 -0.00 0.58 -1.08 0.00 0.00 178.44 179.05 1a7m h VAL 81 N 0.29 1.68 -0.74 1.22 2.07 0.12 0.16 116.25 121.06 1a7m h VAL 81 Ca -0.11 -2.08 0.02 0.00 0.82 0.00 0.00 66.70 65.34 1a7m h VAL 81 Cb 1.68 3.08 -0.04 0.00 -1.52 0.00 0.00 31.29 34.49 1a7m h VAL 81 CO 0.19 0.53 0.49 -0.33 0.02 0.00 0.00 177.57 178.47 1a7m h GLU 82 N -0.90 0.93 0.77 1.57 4.39 -0.36 0.51 114.58 121.48 1a7m h GLU 82 Ca -0.00 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.61 1a7m h GLU 82 Cb 0.88 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.32 1a7m h GLU 82 CO 0.00 0.62 -0.41 1.25 -1.16 0.00 0.00 179.01 179.31 1a7m h LEU 83 N 0.96 -0.99 0.00 1.33 5.85 -1.41 0.21 115.31 121.26 1a7m h LEU 83 Ca 0.28 0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.04 1a7m h LEU 83 Cb -0.05 0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.25 1a7m h LEU 83 CO -0.07 -0.66 0.00 0.00 -0.34 0.00 0.00 178.44 177.37 1a7m n TYR 84 N -5.02 0.00 -0.32 1.25 4.19 0.56 0.13 117.16 117.95 1a7m n TYR 84 Ca -0.13 0.00 0.15 0.00 3.31 0.00 0.00 57.90 61.23 1a7m n TYR 84 Cb 0.43 -0.01 0.30 0.00 0.49 0.00 0.00 39.34 40.56 1a7m n TYR 84 CO 0.00 0.00 0.00 -2.13 0.91 0.00 0.00 176.86 175.64 1a7m n ARG 85 N -0.96 -0.07 -0.17 2.98 0.63 0.17 0.10 116.66 119.33 1a7m n ARG 85 Ca 0.00 1.40 -0.05 0.00 -0.92 0.00 0.00 57.85 58.28 1a7m n ARG 85 Cb 0.00 -2.25 0.05 0.00 0.45 0.00 0.00 32.46 30.71 1a7m n ARG 85 CO 0.00 0.00 0.00 1.98 -2.51 0.00 0.00 177.63 177.10 1a7m h MET 86 N 0.00 0.54 0.26 -0.14 4.05 0.11 0.17 114.93 119.92 1a7m h MET 86 Ca 0.59 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.96 1a7m h MET 86 Cb 1.25 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 31.93 1a7m h MET 86 CO -0.87 0.35 -0.12 0.28 0.23 0.00 0.00 176.91 176.78 1a7m h VAL 87 N 0.55 0.36 -0.89 -5.77 2.07 0.44 0.24 116.25 113.26 1a7m h VAL 87 Ca 0.22 -0.89 0.16 0.00 0.82 0.00 0.00 66.70 67.02 1a7m h VAL 87 Cb 0.10 0.62 -0.16 0.00 -1.52 0.00 0.00 31.29 30.33 1a7m h VAL 87 CO -0.14 0.10 -0.27 0.00 0.02 0.00 0.00 177.57 177.29 1a7m n ALA 88 N -2.67 0.10 -0.05 1.67 0.00 0.28 0.18 120.51 120.02 1a7m n ALA 88 Ca -0.06 0.95 -0.11 0.00 0.00 0.00 0.00 53.44 54.21 1a7m n ALA 88 Cb 0.21 -0.52 -0.10 0.00 0.00 0.00 0.00 19.45 19.05 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 -0.02 -0.15 0.00 -0.00 -0.67 -2.63 116.97 113.50 1a7m h TYR 89 Ca 0.39 -0.00 0.02 0.00 0.00 0.00 0.00 58.73 59.14 1a7m h TYR 89 Cb 0.61 0.01 -0.05 0.00 0.00 0.00 0.00 36.73 37.30 1a7m h TYR 89 CO -0.72 0.68 -0.39 1.25 -0.00 0.00 0.00 178.16 178.98 1a7m h LEU 90 N -0.95 -1.26 -0.50 0.10 7.12 0.13 -1.43 115.31 118.53 1a7m h LEU 90 Ca -0.00 0.15 0.10 0.00 0.13 0.00 0.00 57.88 58.26 1a7m h LEU 90 Cb 0.72 0.50 -0.10 0.00 -0.53 0.00 0.00 40.66 41.24 1a7m h LEU 90 CO 0.00 -0.33 -0.24 0.28 -0.13 0.00 0.00 178.44 178.03 1a7m h SER 91 N -0.38 -0.83 -0.90 1.25 0.02 0.17 0.02 113.55 112.90 1a7m h SER 91 Ca 0.03 0.19 0.22 0.00 -0.84 0.00 0.00 61.79 61.38 1a7m h SER 91 Cb 0.47 0.44 -0.17 0.00 0.14 0.00 0.00 62.40 63.28 1a7m h SER 91 CO -0.34 -0.26 -0.05 0.00 -1.14 0.00 0.00 176.83 175.04 1a7m h ALA 92 N 1.17 0.90 0.36 3.77 0.00 -0.89 0.34 119.26 124.91 1a7m h ALA 92 Ca 0.23 0.32 -0.02 0.00 0.00 0.00 0.00 54.91 55.44 1a7m h ALA 92 Cb 0.49 0.58 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1a7m h ALA 92 CO -0.58 -0.47 -0.17 0.77 0.00 0.00 0.00 179.25 178.80 1a7m h SER 93 N 0.04 -0.41 -1.22 0.00 0.02 -0.37 -1.66 113.55 109.94 1a7m h SER 93 Ca 0.50 -0.02 0.37 0.00 -0.84 0.00 0.00 61.79 61.80 1a7m h SER 93 Cb 0.92 0.11 -0.11 0.00 0.14 0.00 0.00 62.40 63.46 1a7m h SER 93 CO -0.86 -0.25 0.80 -0.07 -1.14 0.00 0.00 176.83 175.31 1a7m h LEU 94 N -0.54 0.29 0.28 5.07 4.07 0.45 -0.29 115.31 124.64 1a7m h LEU 94 Ca -0.05 0.10 -0.01 0.00 0.08 0.00 0.00 57.88 58.00 1a7m h LEU 94 Cb 0.41 0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.22 1a7m h LEU 94 CO 0.08 -0.06 -0.13 0.74 -1.08 0.00 0.00 178.44 177.99 1a7m h THR 95 N 0.19 0.20 -0.70 0.22 2.02 -0.01 -2.22 112.91 112.61 1a7m h THR 95 Ca 0.71 -0.80 0.15 0.00 0.77 0.00 0.00 66.41 67.24 1a7m h THR 95 Cb 2.18 0.34 -0.12 0.00 -1.74 0.00 0.00 68.15 68.81 1a7m h THR 95 CO -0.32 0.05 -0.05 0.78 0.37 0.00 0.00 175.52 176.35 1a7m h ASN 96 N -1.06 -0.42 0.00 4.18 2.35 -0.29 -1.62 115.58 118.71 1a7m h ASN 96 Ca -0.04 0.19 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1a7m h ASN 96 Cb 0.38 0.35 0.00 0.00 0.05 0.00 0.00 38.32 39.10 1a7m h ASN 96 CO 0.06 -0.18 0.00 -0.38 -1.65 0.00 0.00 177.43 175.28 1a7m n ILE 97 N -5.37 0.00 -0.15 2.81 5.41 -0.26 -1.61 119.36 120.20 1a7m n ILE 97 Ca 0.11 1.24 0.02 0.00 1.00 0.00 0.00 62.75 65.12 1a7m n ILE 97 Cb 0.40 -1.83 0.06 0.00 -0.71 0.00 0.00 39.64 37.56 1a7m n ILE 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.55 176.96 1a7m n THR 98 N -1.81 -0.17 -0.05 1.39 -1.04 -0.64 0.95 114.28 112.91 1a7m n THR 98 Ca 0.00 0.94 -0.10 0.00 -2.04 0.00 0.00 64.05 62.84 1a7m n THR 98 Cb 0.00 -1.29 -0.04 0.00 -1.82 0.00 0.00 70.33 67.18 1a7m n THR 98 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 1a7m h ARG 99 N 0.00 0.27 0.00 -2.82 3.08 -0.96 -0.24 114.38 113.71 1a7m h ARG 99 Ca 0.19 -0.03 -0.21 0.00 0.07 0.00 0.00 59.98 60.01 1a7m h ARG 99 Cb 0.30 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 1a7m h ARG 99 CO -0.42 0.23 -1.03 0.22 -1.07 0.00 0.00 179.97 177.90 1a7m h ASP 100 N 0.23 0.00 0.11 7.04 3.58 0.86 -3.26 116.42 124.97 1a7m h ASP 100 Ca 0.07 0.00 -0.18 0.00 0.42 0.00 0.00 57.03 57.34 1a7m h ASP 100 Cb 0.04 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.10 1a7m h ASP 100 CO -0.01 0.98 -0.85 -0.61 -2.88 0.00 0.00 179.24 175.87 1a7m h GLN 101 N 0.00 0.23 -0.04 0.28 5.75 0.60 0.41 115.11 122.34 1a7m h GLN 101 Ca -0.03 -0.39 0.01 0.00 -0.15 0.00 0.00 58.65 58.10 1a7m h GLN 101 Cb 1.77 0.14 -0.00 0.00 1.07 0.00 0.00 27.48 30.47 1a7m h GLN 101 CO 0.12 1.18 0.08 1.57 -2.65 0.00 0.00 178.83 179.14 1a7m h LYS 102 N -0.49 0.00 0.01 1.69 2.10 -1.17 -0.74 116.57 117.96 1a7m h LYS 102 Ca -0.17 0.00 -0.37 0.00 -2.00 0.00 0.00 60.65 58.12 1a7m h LYS 102 Cb 1.55 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 32.82 1a7m h LYS 102 CO 0.09 0.00 -2.32 0.28 -2.00 0.00 0.00 179.45 175.50 1a7m n VAL 103 N -3.41 1.45 0.08 0.07 0.31 -1.20 -4.49 118.33 111.14 1a7m n VAL 103 Ca -0.02 -0.78 -0.18 0.00 -0.01 0.00 0.00 64.34 63.36 1a7m n VAL 103 Cb 0.16 -0.80 -0.10 0.00 -0.91 0.00 0.00 33.84 32.20 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 0.68 -7.95 7.52 6.46 0.75 -3.45 115.31 119.32 1a7m h LEU 104 Ca -0.52 -0.60 -0.50 0.00 -0.12 0.00 0.00 57.88 56.13 1a7m h LEU 104 Cb 2.13 -0.21 -0.33 0.00 -0.73 0.00 0.00 40.66 41.52 1a7m h LEU 104 CO 0.01 1.42 -0.81 0.20 -0.62 0.00 0.00 178.44 178.64 1a7m s ASN 105 N -7.24 1.68 0.00 1.25 -0.87 -0.37 -5.00 114.94 104.38 1a7m s ASN 105 Ca -0.07 -0.28 0.07 0.00 -1.57 0.00 0.00 52.86 51.00 1a7m s ASN 105 Cb 0.07 -0.78 0.34 0.00 -0.02 0.00 0.00 41.25 40.86 1a7m s ASN 105 CO 0.90 0.02 1.04 -0.81 -2.57 0.00 0.00 177.10 175.68 1a7m n PRO 106 N 3.84 0.11 -0.14 -0.60 -0.04 -1.26 -1.50 135.00 135.41 1a7m n PRO 106 Ca -0.23 0.20 -0.28 0.00 -0.04 0.00 0.00 63.50 63.15 1a7m n PRO 106 Cb 0.52 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.38 1a7m n PRO 106 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1a7m n SER 107 N -1.26 1.92 -0.30 3.54 3.41 -1.26 -4.36 113.62 115.32 1a7m n SER 107 Ca 0.03 0.30 0.13 0.00 -0.26 0.00 0.00 58.87 59.07 1a7m n SER 107 Cb 0.05 -0.77 0.30 0.00 -0.26 0.00 0.00 64.21 63.53 1a7m n SER 107 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a7m h ALA 108 N -0.90 1.34 -0.86 7.33 0.00 -1.51 0.36 119.26 125.02 1a7m h ALA 108 Ca -0.68 0.20 0.32 0.00 0.00 0.00 0.00 54.91 54.75 1a7m h ALA 108 Cb 1.62 0.25 -0.16 0.00 0.00 0.00 0.00 17.79 19.50 1a7m h ALA 108 CO -0.39 -0.42 0.33 1.33 0.00 0.00 0.00 179.25 180.10 1a7m n VAL 109 N -5.15 -0.36 0.18 0.00 0.24 -0.71 0.14 118.33 112.66 1a7m n VAL 109 Ca 0.22 1.79 -0.11 0.00 -2.04 0.00 0.00 64.34 64.19 1a7m n VAL 109 Cb 0.67 -2.81 -0.06 0.00 -1.47 0.00 0.00 33.84 30.17 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 -0.43 -0.93 -1.34 0.87 -0.54 -2.82 113.55 108.36 1a7m h SER 110 Ca 0.67 -0.10 0.23 0.00 -1.23 0.00 0.00 61.79 61.36 1a7m h SER 110 Cb 1.68 0.11 -0.17 0.00 -0.44 0.00 0.00 62.40 63.58 1a7m h SER 110 CO -0.70 0.01 -0.08 -0.11 -0.53 0.00 0.00 176.83 175.42 1a7m n LEU 111 N -5.13 -0.19 0.04 2.23 0.00 0.36 -0.38 117.00 113.93 1a7m n LEU 111 Ca -0.08 1.59 -0.13 0.00 0.00 0.00 0.00 56.01 57.39 1a7m n LEU 111 Cb 0.26 -0.54 -0.08 0.00 0.00 0.00 0.00 43.42 43.06 1a7m n LEU 111 CO 0.23 -1.58 0.76 1.12 0.00 0.00 0.00 177.39 177.92 1a7m h HIS 112 N 0.00 -0.05 -0.97 1.96 2.07 -0.70 -1.72 115.15 115.75 1a7m h HIS 112 Ca 0.52 -0.00 0.21 0.00 -2.85 0.00 0.00 60.37 58.25 1a7m h HIS 112 Cb 0.98 0.02 -0.18 0.00 2.57 0.00 0.00 27.41 30.80 1a7m h HIS 112 CO -0.57 0.16 -0.19 0.45 -3.07 0.00 0.00 177.93 174.72 1a7m n SER 113 N -5.02 -0.30 0.22 3.10 2.88 0.49 0.91 113.62 115.90 1a7m n SER 113 Ca -0.08 1.66 -0.15 0.00 -1.33 0.00 0.00 58.87 58.97 1a7m n SER 113 Cb 0.14 -0.52 -0.07 0.00 -0.75 0.00 0.00 64.21 63.00 1a7m n SER 113 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1a7m h LYS 114 N 0.00 -0.63 -0.89 -1.46 1.63 -1.20 -2.15 116.57 111.88 1a7m h LYS 114 Ca 0.49 0.04 0.18 0.00 -0.85 0.00 0.00 60.65 60.51 1a7m h LYS 114 Cb 0.80 0.14 -0.11 0.00 -0.60 0.00 0.00 32.23 32.47 1a7m h LYS 114 CO -0.98 -0.42 0.44 -0.07 -3.45 0.00 0.00 179.45 174.97 1a7m h LEU 115 N -0.65 0.47 -0.70 5.20 3.38 0.14 0.26 115.31 123.42 1a7m h LEU 115 Ca -0.02 0.12 0.14 0.00 0.09 0.00 0.00 57.88 58.20 1a7m h LEU 115 Cb 0.57 0.06 -0.13 0.00 0.09 0.00 0.00 40.66 41.25 1a7m h LEU 115 CO -0.03 0.13 -0.18 0.78 0.09 0.00 0.00 178.44 179.23 1a7m h ASN 116 N 0.54 -0.68 0.61 -0.43 4.21 0.14 0.15 115.58 120.12 1a7m h ASN 116 Ca 0.52 0.21 -0.02 0.00 1.21 0.00 0.00 56.30 58.22 1a7m h ASN 116 Cb 0.87 0.44 -0.00 0.00 -1.12 0.00 0.00 38.32 38.51 1a7m h ASN 116 CO -0.44 -0.24 -0.37 0.00 -1.29 0.00 0.00 177.43 175.10 1a7m h ALA 117 N 1.67 -0.94 -0.69 -0.83 0.00 -0.26 0.17 119.26 118.38 1a7m h ALA 117 Ca 0.33 -0.19 0.20 0.00 0.00 0.00 0.00 54.91 55.26 1a7m h ALA 117 Cb 0.52 0.46 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 1a7m h ALA 117 CO -0.72 -1.05 0.59 1.79 0.00 0.00 0.00 179.25 179.86 1a7m h THR 118 N -0.93 0.44 0.01 0.00 1.35 -0.77 0.39 112.91 113.40 1a7m h THR 118 Ca -0.07 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.75 1a7m h THR 118 Cb 0.75 0.56 -0.00 0.00 -1.73 0.00 0.00 68.15 67.73 1a7m h THR 118 CO 0.08 0.00 -0.17 0.40 -0.25 0.00 0.00 175.52 175.57 1a7m h ILE 119 N 0.00 1.70 -0.12 6.82 2.04 -0.19 -1.49 117.51 126.26 1a7m h ILE 119 Ca 0.33 -2.35 -0.01 0.00 1.00 0.00 0.00 64.86 63.82 1a7m h ILE 119 Cb 1.51 3.29 -0.00 0.00 -0.74 0.00 0.00 36.82 40.87 1a7m h ILE 119 CO -0.00 0.60 0.02 -0.78 0.00 0.00 0.00 178.15 177.99 1a7m h ASP 120 N -0.95 0.19 -0.32 1.72 3.58 0.58 0.13 116.42 121.36 1a7m h ASP 120 Ca -0.04 -0.25 0.05 0.00 0.42 0.00 0.00 57.03 57.21 1a7m h ASP 120 Cb 1.08 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 42.06 1a7m h ASP 120 CO -0.00 0.39 0.22 1.62 -2.88 0.00 0.00 179.24 178.58 1a7m h VAL 121 N -0.01 0.96 0.03 2.25 3.04 -0.43 0.17 116.25 122.26 1a7m h VAL 121 Ca 0.04 -0.08 -0.00 0.00 -1.01 0.00 0.00 66.70 65.65 1a7m h VAL 121 Cb 0.27 0.71 0.00 0.00 -2.01 0.00 0.00 31.29 30.27 1a7m h VAL 121 CO 0.00 0.04 -0.02 -0.03 -1.01 0.00 0.00 177.57 176.56 1a7m h MET 122 N 0.23 -0.04 -0.95 4.17 1.85 -0.12 0.24 114.93 120.30 1a7m h MET 122 Ca 0.14 0.00 0.21 0.00 -0.61 0.00 0.00 59.70 59.45 1a7m h MET 122 Cb 0.28 0.01 -0.18 0.00 0.43 0.00 0.00 31.60 32.14 1a7m h MET 122 CO -0.03 0.21 -0.14 0.00 -0.40 0.00 0.00 176.91 176.55 1a7m h ARG 123 N -0.29 0.01 0.33 0.39 3.08 0.20 0.25 114.38 118.35 1a7m h ARG 123 Ca -0.00 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1a7m h ARG 123 Cb 0.27 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 1a7m h ARG 123 CO 0.01 0.01 -0.25 0.78 -1.07 0.00 0.00 179.97 179.45 1a7m h GLY 124 N 0.01 -0.88 -0.77 0.04 0.00 -0.55 0.17 103.07 101.09 1a7m h GLY 124 Ca 0.49 0.38 0.21 0.00 0.00 0.00 0.00 47.33 48.42 1a7m h GLY 124 CO -0.94 -0.30 -0.09 1.41 0.00 0.00 0.00 176.54 176.62 1a7m h LEU 125 N -0.55 -0.61 -0.34 3.11 3.38 0.14 0.45 115.31 120.88 1a7m h LEU 125 Ca -0.04 0.26 -0.18 0.00 0.09 0.00 0.00 57.88 58.01 1a7m h LEU 125 Cb 0.46 0.49 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 1a7m h LEU 125 CO 0.02 -0.29 -0.54 -0.07 0.09 0.00 0.00 178.44 177.65 1a7m h LEU 126 N 0.03 0.92 0.02 1.67 3.38 -0.74 0.24 115.31 120.83 1a7m h LEU 126 Ca 0.49 -0.49 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1a7m h LEU 126 Cb 0.87 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1a7m h LEU 126 CO -0.88 1.27 -0.01 0.28 0.09 0.00 0.00 178.44 179.20 1a7m h SER 127 N 0.64 -0.02 -0.49 -0.43 0.02 0.19 0.07 113.55 113.52 1a7m h SER 127 Ca 0.02 -0.11 0.09 0.00 -0.84 0.00 0.00 61.79 60.95 1a7m h SER 127 Cb 1.13 0.01 -0.10 0.00 0.14 0.00 0.00 62.40 63.58 1a7m h SER 127 CO 0.12 0.10 -0.32 0.78 -1.14 0.00 0.00 176.83 176.37 1a7m h ASN 128 N -0.14 -1.08 0.40 3.07 2.35 -0.11 0.43 115.58 120.49 1a7m h ASN 128 Ca -0.00 0.21 -0.02 0.00 -0.55 0.00 0.00 56.30 55.94 1a7m h ASN 128 Cb 0.14 0.53 -0.00 0.00 0.05 0.00 0.00 38.32 39.03 1a7m h ASN 128 CO 0.00 -0.30 -0.22 0.58 -1.65 0.00 0.00 177.43 175.84 1a7m h VAL 129 N -0.20 0.55 0.00 2.81 2.07 -0.01 0.34 116.25 121.82 1a7m h VAL 129 Ca 0.21 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.71 1a7m h VAL 129 Cb 0.54 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 30.85 1a7m h VAL 129 CO -0.60 0.00 -0.06 0.25 0.02 0.00 0.00 177.57 177.17 1a7m h LEU 130 N -0.58 0.00 0.17 2.57 7.12 -0.34 0.40 115.31 124.65 1a7m h LEU 130 Ca -0.05 0.00 -0.33 0.00 0.13 0.00 0.00 57.88 57.63 1a7m h LEU 130 Cb 0.46 0.00 0.01 0.00 -0.53 0.00 0.00 40.66 40.60 1a7m h LEU 130 CO 0.06 0.06 -1.64 0.00 -0.13 0.00 0.00 178.44 176.79 1a7m h ARG 132 N 0.10 -0.88 -0.69 0.00 9.65 0.36 -3.34 114.38 119.57 1a7m h ARG 132 Ca -0.30 0.06 0.09 0.00 -1.10 0.00 0.00 59.98 58.73 1a7m h ARG 132 Cb 2.08 0.20 -0.10 0.00 -1.39 0.00 0.00 29.97 30.76 1a7m h ARG 132 CO 0.18 -0.59 -0.33 1.28 2.80 0.00 0.00 179.97 183.31 1a7m n LEU 133 N -5.26 -0.57 -0.17 3.80 4.32 0.13 -1.14 117.00 118.12 1a7m n LEU 133 Ca -0.11 1.21 -0.00 0.00 -0.02 0.00 0.00 56.01 57.09 1a7m n LEU 133 Cb 0.36 -0.22 0.02 0.00 -1.62 0.00 0.00 43.42 41.96 1a7m n LEU 133 CO 0.27 -1.05 0.27 0.00 -1.22 0.00 0.00 177.39 175.66 1a7m n ASN 135 N -4.67 -0.06 -0.19 0.00 4.05 -0.29 -0.98 115.26 113.12 1a7m n ASN 135 Ca 0.05 0.46 0.00 0.00 0.45 0.00 0.00 54.58 55.54 1a7m n ASN 135 Cb 0.18 -0.16 0.00 0.00 1.23 0.00 0.00 39.78 41.04 1a7m n ASN 135 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 1a7m n LYS 136 N -4.28 0.00 -2.63 1.20 5.02 0.59 -4.90 118.16 113.15 1a7m n LYS 136 Ca 0.06 -0.62 -0.11 0.00 -2.02 0.00 0.00 58.31 55.61 1a7m n LYS 136 Cb 0.18 -0.46 0.03 0.00 -0.02 0.00 0.00 35.03 34.76 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 1.54 -2.26 2.13 4.01 0.15 -4.91 117.16 117.83 1a7m n TYR 137 Ca 0.00 -2.79 -0.40 0.00 -0.16 0.00 0.00 57.90 54.55 1a7m n TYR 137 Cb 0.57 -0.32 0.02 0.00 -0.31 0.00 0.00 39.34 39.29 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 -0.17 4.30 -0.09 -0.72 -4.01 -1.15 -4.24 116.66 110.57 1a7m n ARG 138 Ca 0.14 -4.00 -0.18 0.00 -1.04 0.00 0.00 57.85 52.77 1a7m n ARG 138 Cb 0.80 -2.40 -0.06 0.00 -3.04 0.00 0.00 32.46 27.75 1a7m n ARG 138 CO 0.00 0.00 0.00 1.55 -3.04 0.00 0.00 177.63 176.14 1a7m n VAL 139 N 0.07 1.27 0.00 8.89 3.14 -1.26 -4.83 118.33 125.61 1a7m n VAL 139 Ca 0.51 -0.13 0.00 0.00 -2.96 0.00 0.00 64.34 61.76 1a7m n VAL 139 Cb 0.27 -1.92 0.00 0.00 -1.06 0.00 0.00 33.84 31.13 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 1.75 0.55 2.68 7.55 0.00 -1.26 -4.93 105.19 111.52 1a7m n GLY 140 Ca -0.32 -0.80 -0.08 0.00 0.00 0.00 0.00 46.02 44.82 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 -0.49 0.00 1.61 1.44 -1.26 -4.92 115.22 111.59 1a7m n HIS 141 Ca 0.00 -2.40 -0.19 0.00 -2.01 0.00 0.00 57.72 53.11 1a7m n HIS 141 Cb 0.00 0.52 -0.14 0.00 0.12 0.00 0.00 29.99 30.49 1a7m n HIS 141 CO 0.00 0.00 0.00 1.55 -2.81 0.00 0.00 176.34 175.08 1a7m n VAL 142 N -0.30 1.76 -2.40 0.61 3.14 -1.26 -5.06 118.33 114.81 1a7m n VAL 142 Ca 0.04 -0.68 -0.00 0.00 -2.96 0.00 0.00 64.34 60.73 1a7m n VAL 142 Cb 0.83 -1.62 -0.00 0.00 -1.06 0.00 0.00 33.84 31.99 1a7m n VAL 142 CO 0.00 0.00 0.00 -0.90 -6.46 0.00 0.00 176.83 169.47 1a7m n ASP 143 N -3.41 -3.11 -3.04 6.55 5.75 -1.26 -4.88 116.55 113.15 1a7m n ASP 143 Ca -0.29 1.05 -0.29 0.00 -0.01 0.00 0.00 54.79 55.24 1a7m n ASP 143 Cb 1.05 -1.84 -0.03 0.00 -1.03 0.00 0.00 41.12 39.27 1a7m n ASP 143 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 1a7m n VAL 144 N 2.16 3.54 -2.81 2.12 0.24 -1.26 -4.87 118.33 117.46 1a7m n VAL 144 Ca -0.01 -5.63 -0.43 0.00 -2.04 0.00 0.00 64.34 56.22 1a7m n VAL 144 Cb 0.02 -1.42 -0.03 0.00 -1.47 0.00 0.00 33.84 30.94 1a7m n VAL 144 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1a7m s PRO 145 N -3.62 3.41 0.79 7.34 0.04 -1.26 -4.99 135.00 136.72 1a7m s PRO 145 Ca 0.47 -1.24 -0.13 0.00 0.04 0.00 0.00 61.00 60.15 1a7m s PRO 145 Cb 0.27 -4.73 0.07 0.00 0.04 0.00 0.00 34.50 30.15 1a7m s PRO 145 CO -0.14 -1.89 1.16 -1.25 0.04 0.00 0.00 177.00 174.91 1a7m s PRO 146 N 3.76 1.86 -0.07 0.56 0.04 -1.26 -5.02 135.00 134.87 1a7m s PRO 146 Ca 0.32 1.55 0.04 0.00 0.04 0.00 0.00 61.00 62.94 1a7m s PRO 146 Cb -0.08 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.64 1a7m s PRO 146 CO -0.02 -2.00 -0.18 0.14 0.04 0.00 0.00 177.00 174.98 1a7m s VAL 147 N -2.40 1.53 -0.14 -0.36 -7.23 -1.26 -5.05 120.40 105.49 1a7m s VAL 147 Ca 0.69 -0.73 -0.14 0.00 -1.81 0.00 0.00 61.98 59.98 1a7m s VAL 147 Cb -0.24 -1.34 -0.05 0.00 0.56 0.00 0.00 36.38 35.31 1a7m s VAL 147 CO 0.51 0.44 -0.28 -0.81 -0.31 0.00 0.00 175.10 174.65 1a7m n PRO 148 N 3.49 0.43 -2.53 4.82 -0.04 -1.26 -4.94 135.00 134.96 1a7m n PRO 148 Ca -0.20 0.17 -0.00 0.00 -0.04 0.00 0.00 63.50 63.42 1a7m n PRO 148 Cb 0.52 -1.24 0.00 0.00 -0.04 0.00 0.00 33.50 32.74 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 -4.11 -0.06 -2.26 3.54 2.03 -1.26 -4.80 116.55 109.64 1a7m n ASP 149 Ca -0.11 -0.01 -0.31 0.00 0.52 0.00 0.00 54.79 54.87 1a7m n ASP 149 Cb 0.42 -0.02 0.10 0.00 -0.72 0.00 0.00 41.12 40.89 1a7m n ASP 149 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 1a7m n HIS 150 N -0.53 3.12 -2.05 -0.67 8.25 -1.26 -4.65 115.22 117.42 1a7m n HIS 150 Ca -0.00 -2.73 -0.40 0.00 -0.26 0.00 0.00 57.72 54.33 1a7m n HIS 150 Cb 0.01 -1.26 -0.00 0.00 1.12 0.00 0.00 29.99 29.85 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 -0.95 7.98 -0.04 0.41 2.88 -1.26 -3.86 113.62 118.77 1a7m n SER 151 Ca 0.60 -3.20 -0.09 0.00 -1.33 0.00 0.00 58.87 54.86 1a7m n SER 151 Cb 0.88 -1.34 -0.03 0.00 -0.75 0.00 0.00 64.21 62.96 1a7m n SER 151 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1a7m n ASP 152 N 1.53 1.38 -3.91 -3.46 2.03 -1.26 -5.04 116.55 107.82 1a7m n ASP 152 Ca 0.61 0.07 -0.11 0.00 0.52 0.00 0.00 54.79 55.88 1a7m n ASP 152 Cb 0.25 -0.23 -0.12 0.00 -0.72 0.00 0.00 41.12 40.30 1a7m n ASP 152 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1a7m s LYS 153 N -2.16 0.21 0.00 -0.67 1.02 -1.25 -5.09 119.74 111.79 1a7m s LYS 153 Ca -0.12 -0.28 0.00 0.00 0.02 0.00 0.00 55.97 55.59 1a7m s LYS 153 Cb 0.04 0.08 0.00 0.00 -0.52 0.00 0.00 37.83 37.43 1a7m s LYS 153 CO 0.17 -0.04 0.00 -1.91 -0.92 0.00 0.00 175.35 172.65 1a7m n GLU 154 N 2.26 0.00 -0.34 1.68 0.00 -1.26 -2.05 120.64 120.92 1a7m n GLU 154 Ca -0.18 0.08 0.15 0.00 0.00 0.00 0.00 57.16 57.20 1a7m n GLU 154 Cb 0.57 -0.41 0.29 0.00 0.00 0.00 0.00 31.44 31.90 1a7m n GLU 154 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1a7m n VAL 155 N -1.33 -0.42 0.00 6.31 0.31 -1.26 0.49 118.33 122.43 1a7m n VAL 155 Ca 0.00 2.18 0.00 0.00 -0.01 0.00 0.00 64.34 66.51 1a7m n VAL 155 Cb 0.00 -3.18 0.00 0.00 -0.91 0.00 0.00 33.84 29.75 1a7m n VAL 155 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1a7m n PHE 156 N -5.48 0.00 -0.17 3.52 3.72 -1.26 -2.65 117.46 115.14 1a7m n PHE 156 Ca 0.23 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.65 1a7m n PHE 156 Cb 0.77 -0.50 0.04 0.00 -0.94 0.00 0.00 39.48 38.85 1a7m n PHE 156 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65 1a7m n GLN 157 N -2.33 -0.07 -0.28 -1.08 7.27 0.18 0.87 117.38 121.93 1a7m n GLN 157 Ca 0.00 0.72 0.12 0.00 0.07 0.00 0.00 57.00 57.91 1a7m n GLN 157 Cb 0.00 -1.07 0.37 0.00 2.41 0.00 0.00 30.24 31.95 1a7m n GLN 157 CO 0.00 0.00 0.00 -0.22 0.07 0.00 0.00 177.06 176.91 1a7m h LYS 158 N 0.00 0.69 0.00 3.69 1.63 -1.17 0.45 116.57 121.86 1a7m h LYS 158 Ca 0.19 -0.04 -0.30 0.00 -0.85 0.00 0.00 60.65 59.65 1a7m h LYS 158 Cb 0.31 -0.16 -0.05 0.00 -0.60 0.00 0.00 32.23 31.73 1a7m h LYS 158 CO -0.47 0.45 -2.10 1.63 -3.45 0.00 0.00 179.45 175.52 1a7m n LYS 159 N -4.58 0.47 0.11 1.90 5.02 0.19 -4.46 118.16 116.81 1a7m n LYS 159 Ca 0.18 0.13 0.11 0.00 -2.02 0.00 0.00 58.31 56.71 1a7m n LYS 159 Cb 0.48 -1.35 0.46 0.00 -0.02 0.00 0.00 35.03 34.61 1a7m n LYS 159 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 1a7m n LYS 160 N -3.25 0.16 -0.19 1.97 2.85 0.25 -4.05 118.16 115.90 1a7m n LYS 160 Ca -0.35 0.42 0.16 0.00 -1.05 0.00 0.00 58.31 57.49 1a7m n LYS 160 Cb 0.84 -1.82 0.28 0.00 -0.65 0.00 0.00 35.03 33.69 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 -2.11 0.09 -0.01 -5.58 7.94 0.16 0.10 117.00 117.59 1a7m n LEU 161 Ca 0.02 0.59 0.03 0.00 -1.11 0.00 0.00 56.01 55.54 1a7m n LEU 161 Cb 0.20 -0.29 -0.08 0.00 0.53 0.00 0.00 43.42 43.78 1a7m n LEU 161 CO 0.18 -0.64 -0.66 0.61 -1.11 0.00 0.00 177.39 175.76 1a7m n GLY 162 N -1.20 -0.46 0.18 -3.96 0.00 -1.26 -4.61 105.19 93.88 1a7m n GLY 162 Ca 0.17 -0.22 -0.11 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.24 0.00 0.07 0.00 4.15 -1.63 0.63 115.11 118.09 1a7m h GLN 164 Ca 0.04 0.00 -0.34 0.00 0.77 0.00 0.00 58.65 59.12 1a7m h GLN 164 Cb 0.29 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.94 1a7m h GLN 164 CO -0.11 0.00 -1.92 1.28 -1.93 0.00 0.00 178.83 176.15 1a7m n LEU 165 N -4.00 1.90 -0.28 -2.39 4.77 0.03 -3.42 117.00 113.62 1a7m n LEU 165 Ca 0.10 0.27 -0.04 0.00 -0.03 0.00 0.00 56.01 56.31 1a7m n LEU 165 Cb 0.69 -0.57 0.11 0.00 -2.33 0.00 0.00 43.42 41.32 1a7m n LEU 165 CO 0.32 0.67 1.11 -0.07 -1.33 0.00 0.00 177.39 178.10 1a7m h LEU 166 N 0.04 1.04 0.11 2.23 -0.00 0.85 0.87 115.31 120.45 1a7m h LEU 166 Ca -0.38 -0.12 -0.00 0.00 -0.00 0.00 0.00 57.88 57.37 1a7m h LEU 166 Cb 2.03 -0.27 -0.00 0.00 -0.00 0.00 0.00 40.66 42.42 1a7m h LEU 166 CO 0.08 0.88 -0.09 1.23 -0.00 0.00 0.00 178.44 180.53 1a7m h GLY 167 N 1.17 -0.71 -0.02 0.83 0.00 -0.96 0.51 103.07 103.89 1a7m h GLY 167 Ca 0.28 0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.92 1a7m h GLY 167 CO -0.04 -0.25 -0.06 -0.91 0.00 0.00 0.00 176.54 175.28 1a7m h THR 168 N -0.20 0.00 -0.70 4.70 1.35 -0.39 0.10 112.91 117.78 1a7m h THR 168 Ca -0.01 0.00 0.21 0.00 -0.55 0.00 0.00 66.41 66.05 1a7m h THR 168 Cb 0.17 0.00 -0.13 0.00 -1.73 0.00 0.00 68.15 66.46 1a7m h THR 168 CO -0.00 0.00 0.06 0.00 -0.25 0.00 0.00 175.52 175.33 1a7m n TYR 169 N -2.92 0.50 0.18 4.73 9.36 0.30 0.20 117.16 129.51 1a7m n TYR 169 Ca -0.01 0.84 -0.10 0.00 3.32 0.00 0.00 57.90 61.96 1a7m n TYR 169 Cb 0.04 -1.06 -0.05 0.00 -0.63 0.00 0.00 39.34 37.64 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 -0.50 -0.92 2.98 3.11 0.19 0.70 116.57 122.12 1a7m h LYS 170 Ca 0.45 0.03 0.27 0.00 -2.81 0.00 0.00 60.65 58.59 1a7m h LYS 170 Cb 0.97 0.11 -0.15 0.00 -1.00 0.00 0.00 32.23 32.16 1a7m h LYS 170 CO -0.64 -0.26 0.28 1.96 -2.81 0.00 0.00 179.45 177.98 1a7m h GLN 171 N -1.09 0.17 0.17 1.90 7.50 0.21 0.24 115.11 124.22 1a7m h GLN 171 Ca -0.05 -0.01 -0.31 0.00 0.50 0.00 0.00 58.65 58.78 1a7m h GLN 171 Cb 0.47 -0.04 0.01 0.00 0.05 0.00 0.00 27.48 27.97 1a7m h GLN 171 CO 0.09 0.12 -1.48 -0.39 -1.50 0.00 0.00 178.83 175.66 1a7m h VAL 172 N 0.18 1.10 -0.34 -0.54 -1.51 -0.58 -3.29 116.25 111.27 1a7m h VAL 172 Ca 0.61 -2.51 0.03 0.00 -1.23 0.00 0.00 66.70 63.59 1a7m h VAL 172 Cb 1.30 2.86 -0.02 0.00 -2.13 0.00 0.00 31.29 33.30 1a7m h VAL 172 CO -0.70 0.79 0.23 -0.29 -1.23 0.00 0.00 177.57 176.37 1a7m h ILE 173 N -0.07 1.02 0.00 7.19 6.09 0.13 0.65 117.51 132.53 1a7m h ILE 173 Ca -0.29 -0.12 0.00 0.00 -1.37 0.00 0.00 64.86 63.08 1a7m h ILE 173 Cb 1.95 0.63 0.00 0.00 0.47 0.00 0.00 36.82 39.88 1a7m h ILE 173 CO 0.16 0.06 0.00 -0.24 -3.07 0.00 0.00 178.15 175.06 1a7m n SER 174 N -4.49 0.00 0.00 2.19 2.88 0.75 0.29 113.62 115.25 1a7m n SER 174 Ca 0.03 -1.30 0.00 0.00 -1.33 0.00 0.00 58.87 56.28 1a7m n SER 174 Cb 0.15 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.61 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 -0.67 0.00 0.01 2.46 0.31 0.19 -4.53 118.33 116.10 1a7m n VAL 175 Ca 0.06 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.29 1a7m n VAL 175 Cb 0.03 -0.86 -0.14 0.00 -0.91 0.00 0.00 33.84 31.96 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 1.03 -0.00 2.52 -1.51 0.53 -0.68 116.25 118.13 1a7m h VAL 176 Ca 0.00 -2.82 0.00 0.00 -1.23 0.00 0.00 66.70 62.65 1a7m h VAL 176 Cb 0.97 2.55 -0.00 0.00 -2.13 0.00 0.00 31.29 32.68 1a7m h VAL 176 CO 0.00 0.65 0.01 1.62 -1.23 0.00 0.00 177.57 178.63 1a7m h VAL 177 N 0.01 0.07 0.00 7.19 3.04 -0.39 0.17 116.25 126.33 1a7m h VAL 177 Ca -0.24 0.00 -0.33 0.00 -1.01 0.00 0.00 66.70 65.12 1a7m h VAL 177 Cb 1.97 0.99 -0.06 0.00 -2.01 0.00 0.00 31.29 32.17 1a7m h VAL 177 CO 0.10 0.00 -2.29 1.67 -1.01 0.00 0.00 177.57 176.04 1a7m n GLN 178 N -3.17 0.87 -0.24 4.17 7.27 -1.18 -4.53 117.38 120.57 1a7m n GLN 178 Ca -0.03 -0.02 0.03 0.00 0.07 0.00 0.00 57.00 57.06 1a7m n GLN 178 Cb 0.08 -1.49 0.13 0.00 2.41 0.00 0.00 30.24 31.38 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 0.98 0.69 0.00 1.69 0.00 0.93 -3.51 119.26 120.04 1a7m h ALA 179 Ca -0.50 0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1a7m h ALA 179 Cb 2.13 0.42 0.00 0.00 0.00 0.00 0.00 17.79 20.34 1a7m h ALA 179 CO 0.03 -0.42 0.00 1.97 0.00 0.00 0.00 179.25 180.83