#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p7m s GLU 2 N 0.00 2.69 0.16 3.17 -6.30 -1.26 -4.98 118.70 112.17 1p7m s GLU 2 Ca 0.00 -0.63 -0.16 0.00 -2.50 0.00 0.00 54.97 51.69 1p7m s GLU 2 Cb 0.00 -2.58 0.05 0.00 0.00 0.00 0.00 34.13 31.59 1p7m s GLU 2 CO 0.00 0.63 1.79 0.00 0.02 0.00 0.00 175.26 177.71 1p7m h ARG 3 N 4.75 0.46 -1.49 4.30 3.08 -1.94 -3.24 114.38 120.29 1p7m h ARG 3 Ca -0.49 -0.03 0.10 0.00 0.07 0.00 0.00 59.98 59.63 1p7m h ARG 3 Cb 1.17 -0.10 -0.25 0.00 0.08 0.00 0.00 29.97 30.87 1p7m h ARG 3 CO 0.54 0.30 0.59 0.00 -1.07 0.00 0.00 179.97 180.33 1p7m h GLY 5 N 2.95 1.35 -0.50 0.00 0.00 -1.99 -1.20 103.07 103.68 1p7m h GLY 5 Ca -0.20 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.79 1p7m h GLY 5 CO 0.24 0.15 -0.16 -2.67 0.00 0.00 0.00 176.54 174.09 1p7m n TRP 6 N -4.71 0.00 0.07 5.60 2.14 -1.26 -4.11 117.44 115.17 1p7m n TRP 6 Ca 0.14 0.00 -0.21 0.00 2.07 0.00 0.00 57.50 59.50 1p7m n TRP 6 Cb 0.28 -0.04 -0.13 0.00 -0.81 0.00 0.00 31.31 30.60 1p7m n TRP 6 CO 0.00 0.00 0.00 0.28 2.07 0.00 0.00 177.69 180.04 1p7m h VAL 7 N 2.29 1.36 0.00 -1.67 2.07 -1.55 -3.07 116.25 115.68 1p7m h VAL 7 Ca 0.00 -2.43 0.00 0.00 0.82 0.00 0.00 66.70 65.09 1p7m h VAL 7 Cb 0.61 2.84 0.00 0.00 -1.52 0.00 0.00 31.29 33.22 1p7m h VAL 7 CO 0.00 0.72 0.00 -1.20 0.02 0.00 0.00 177.57 177.11 1p7m n SER 8 N -3.94 0.00 -0.04 0.57 7.64 -1.13 -3.82 113.62 112.89 1p7m n SER 8 Ca -0.14 -1.52 -0.00 0.00 1.01 0.00 0.00 58.87 58.22 1p7m n SER 8 Cb 0.90 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 64.10 1p7m n SER 8 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 1p7m h GLN 9 N 0.00 -0.02 -4.48 1.43 4.15 -1.70 -3.48 115.11 111.01 1p7m h GLN 9 Ca 0.00 0.00 -0.21 0.00 0.77 0.00 0.00 58.65 59.22 1p7m h GLN 9 Cb 0.00 0.00 -0.17 0.00 0.21 0.00 0.00 27.48 27.53 1p7m h GLN 9 CO 0.00 -0.01 -0.70 -0.51 -1.93 0.00 0.00 178.83 175.68 1p7m s ASP 10 N -5.41 0.86 0.39 -0.69 1.01 -1.25 -5.04 116.67 106.54 1p7m s ASP 10 Ca -0.00 -0.87 0.13 0.00 0.71 0.00 0.00 52.55 52.52 1p7m s ASP 10 Cb 0.00 0.11 0.81 0.00 1.01 0.00 0.00 42.92 44.84 1p7m s ASP 10 CO 0.01 -0.43 1.88 1.55 0.21 0.00 0.00 175.17 178.40 1p7m h PRO 11 N 3.47 0.04 -0.62 8.23 0.13 -1.93 -2.85 132.00 138.47 1p7m h PRO 11 Ca -0.35 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.74 1p7m h PRO 11 Cb 1.17 -0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 1p7m h PRO 11 CO 0.58 0.32 0.24 -0.07 -0.23 0.00 0.00 178.00 178.84 1p7m h LEU 12 N 0.03 0.82 -0.77 1.56 3.38 -1.96 -2.26 115.31 116.11 1p7m h LEU 12 Ca 0.00 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 1p7m h LEU 12 Cb 0.52 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 1p7m h LEU 12 CO 0.04 0.74 0.25 1.88 0.09 0.00 0.00 178.44 181.44 1p7m h TYR 13 N 0.88 1.21 -0.67 1.13 0.05 -1.80 -2.65 116.97 115.12 1p7m h TYR 13 Ca 0.21 -0.12 0.09 0.00 0.05 0.00 0.00 58.73 58.96 1p7m h TYR 13 Cb 0.18 -0.35 -0.07 0.00 1.01 0.00 0.00 36.73 37.50 1p7m h TYR 13 CO 0.01 0.94 0.32 0.82 -1.05 0.00 0.00 178.16 179.21 1p7m h ILE 14 N 1.13 0.84 -0.13 -2.88 2.04 -1.44 1.10 117.51 118.16 1p7m h ILE 14 Ca 0.25 -0.19 -0.02 0.00 1.00 0.00 0.00 64.86 65.90 1p7m h ILE 14 Cb 0.29 0.24 -0.00 0.00 -0.74 0.00 0.00 36.82 36.61 1p7m h ILE 14 CO -0.01 0.10 0.01 0.00 0.00 0.00 0.00 178.15 178.25 1p7m h ALA 15 N 1.41 0.18 -0.81 1.87 0.00 -1.40 0.69 119.26 121.20 1p7m h ALA 15 Ca 0.33 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1p7m h ALA 15 Cb 0.35 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 1p7m h ALA 15 CO -0.27 -0.14 0.41 -0.92 0.00 0.00 0.00 179.25 178.33 1p7m h TYR 16 N -0.03 1.15 -0.26 0.00 3.20 -1.05 -1.74 116.97 118.24 1p7m h TYR 16 Ca 0.04 -0.05 -0.19 0.00 3.14 0.00 0.00 58.73 61.68 1p7m h TYR 16 Cb 0.35 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.26 1p7m h TYR 16 CO 0.03 0.82 -0.57 1.25 -1.64 0.00 0.00 178.16 178.05 1p7m h HIS 17 N 1.14 1.03 0.00 -3.82 2.76 0.14 -3.12 115.15 113.28 1p7m h HIS 17 Ca 0.28 -0.37 0.00 0.00 -2.20 0.00 0.00 60.37 58.08 1p7m h HIS 17 Cb 0.09 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 28.86 1p7m h HIS 17 CO 0.01 1.19 0.00 -0.25 -1.30 0.00 0.00 177.93 177.58 1p7m n ASP 18 N -3.99 0.00 0.00 3.26 8.00 0.24 -4.25 116.55 119.81 1p7m n ASP 18 Ca -0.04 -0.08 0.00 0.00 0.71 0.00 0.00 54.79 55.37 1p7m n ASP 18 Cb 0.64 -0.29 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 1p7m n ASP 18 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1p7m n ASN 19 N -1.29 0.00 0.00 -2.24 3.02 -0.68 -4.96 115.26 109.11 1p7m n ASN 19 Ca 0.13 0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.98 1p7m n ASN 19 Cb 0.23 -0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1p7m n ASN 19 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1p7m n GLU 20 N -1.17 0.00 0.00 3.52 1.02 -1.26 -5.03 120.64 117.72 1p7m n GLU 20 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1p7m n GLU 20 Cb 0.00 -0.33 0.00 0.00 -0.02 0.00 0.00 31.44 31.09 1p7m n GLU 20 CO 0.00 0.00 0.00 1.87 1.18 0.00 0.00 177.13 180.18 1p7m n TRP 21 N -1.60 0.00 0.00 -0.32 -0.00 -1.26 -0.93 117.44 113.33 1p7m n TRP 21 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 1p7m n TRP 21 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.31 1p7m n TRP 21 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1p7m n GLY 22 N 0.00 0.79 0.00 5.87 0.00 -1.26 -4.97 105.19 105.62 1p7m n GLY 22 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1p7m n GLY 22 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1p7m n VAL 23 N 0.00 0.40 -2.57 1.61 0.24 -0.11 -4.73 118.33 113.17 1p7m n VAL 23 Ca 0.00 -0.70 -0.36 0.00 -2.04 0.00 0.00 64.34 61.25 1p7m n VAL 23 Cb 0.00 0.80 -0.04 0.00 -1.47 0.00 0.00 33.84 33.13 1p7m n VAL 23 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1p7m s PRO 24 N -0.40 4.10 0.53 7.34 0.04 -1.26 -5.01 135.00 140.34 1p7m s PRO 24 Ca 0.00 1.44 -0.02 0.00 0.04 0.00 0.00 61.00 62.46 1p7m s PRO 24 Cb 0.00 -2.41 0.01 0.00 0.04 0.00 0.00 34.50 32.14 1p7m s PRO 24 CO 0.00 -0.19 0.79 -1.83 0.04 0.00 0.00 177.00 175.81 1p7m s GLU 25 N -2.71 2.82 -0.43 4.56 -1.05 -1.25 -3.82 118.70 116.82 1p7m s GLU 25 Ca 0.60 -0.41 -0.16 0.00 -0.15 0.00 0.00 54.97 54.86 1p7m s GLU 25 Cb -0.20 -2.43 0.03 0.00 -0.44 0.00 0.00 34.13 31.10 1p7m s GLU 25 CO 0.24 -0.58 0.35 0.95 0.95 0.00 0.00 175.26 177.18 1p7m s THR 26 N -2.78 5.22 0.58 1.83 -4.23 -1.26 -4.86 115.64 110.12 1p7m s THR 26 Ca 0.53 -0.69 -0.03 0.00 -1.18 0.00 0.00 61.69 60.32 1p7m s THR 26 Cb -0.10 -4.00 0.02 0.00 1.34 0.00 0.00 72.50 69.76 1p7m s THR 26 CO 0.41 -0.40 0.85 -1.81 -0.54 0.00 0.00 174.62 173.12 1p7m s ASP 27 N 1.93 5.39 0.15 3.99 1.01 -1.26 -4.68 116.67 123.19 1p7m s ASP 27 Ca 0.06 0.38 -0.07 0.00 0.71 0.00 0.00 52.55 53.64 1p7m s ASP 27 Cb -0.20 -1.32 -0.03 0.00 1.01 0.00 0.00 42.92 42.38 1p7m s ASP 27 CO 0.10 -1.13 1.39 0.28 0.21 0.00 0.00 175.17 176.02 1p7m h SER 28 N -0.09 0.71 -0.06 0.27 0.02 -1.95 -3.30 113.55 109.15 1p7m h SER 28 Ca -0.44 -0.45 -0.21 0.00 -0.84 0.00 0.00 61.79 59.84 1p7m h SER 28 Cb 1.28 -0.21 0.01 0.00 0.14 0.00 0.00 62.40 63.63 1p7m h SER 28 CO 0.58 1.21 -0.79 0.11 -1.14 0.00 0.00 176.83 176.80 1p7m h LYS 29 N 0.42 0.64 -0.72 3.45 1.57 -2.00 -3.30 116.57 116.63 1p7m h LYS 29 Ca -0.03 -0.61 0.01 0.00 -1.87 0.00 0.00 60.65 58.15 1p7m h LYS 29 Cb 1.32 0.15 -0.04 0.00 0.08 0.00 0.00 32.23 33.75 1p7m h LYS 29 CO 0.14 1.22 0.47 0.87 -0.57 0.00 0.00 179.45 181.58 1p7m h LYS 30 N 0.28 0.92 -0.84 3.15 1.57 -1.97 -1.66 116.57 118.01 1p7m h LYS 30 Ca -0.08 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.67 1p7m h LYS 30 Cb 1.45 -0.21 -0.04 0.00 0.08 0.00 0.00 32.23 33.51 1p7m h LYS 30 CO 0.16 0.61 0.55 -0.07 -0.57 0.00 0.00 179.45 180.13 1p7m h LEU 31 N 0.94 0.92 -0.35 2.94 3.38 -1.64 0.73 115.31 122.24 1p7m h LEU 31 Ca 0.27 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.21 1p7m h LEU 31 Cb -0.06 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1p7m h LEU 31 CO -0.06 0.65 0.16 0.15 0.09 0.00 0.00 178.44 179.42 1p7m h PHE 32 N 1.08 0.51 -0.28 1.13 3.57 -1.41 0.60 116.94 122.14 1p7m h PHE 32 Ca 0.32 -0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.62 1p7m h PHE 32 Cb -0.04 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 38.54 1p7m h PHE 32 CO -0.00 0.45 -0.50 0.93 -2.23 0.00 0.00 178.31 176.96 1p7m h GLU 33 N 0.42 0.83 -0.11 1.11 5.08 -1.15 -2.34 114.58 118.41 1p7m h GLU 33 Ca 0.12 -0.52 -0.01 0.00 -1.00 0.00 0.00 59.36 57.94 1p7m h GLU 33 Cb 0.14 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 1p7m h GLU 33 CO -0.01 1.16 0.03 1.98 -1.00 0.00 0.00 179.01 181.16 1p7m h MET 34 N 0.60 0.18 0.00 2.33 4.05 0.71 -1.24 114.93 121.57 1p7m h MET 34 Ca 0.02 -0.04 -0.04 0.00 -0.28 0.00 0.00 59.70 59.35 1p7m h MET 34 Cb 1.11 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.88 1p7m h MET 34 CO 0.11 0.35 -0.21 0.97 0.23 0.00 0.00 176.91 178.37 1p7m h ILE 35 N -0.03 1.15 -0.04 1.77 6.09 0.18 0.58 117.51 127.21 1p7m h ILE 35 Ca 0.03 -0.72 -0.02 0.00 -1.37 0.00 0.00 64.86 62.78 1p7m h ILE 35 Cb 0.26 1.39 -0.00 0.00 0.47 0.00 0.00 36.82 38.93 1p7m h ILE 35 CO 0.00 0.21 -0.06 0.00 -3.07 0.00 0.00 178.15 175.23 1p7m h LEU 37 N -0.39 1.00 -1.08 0.00 4.07 -0.93 -2.86 115.31 115.11 1p7m h LEU 37 Ca 0.00 -0.40 -0.03 0.00 0.08 0.00 0.00 57.88 57.54 1p7m h LEU 37 Cb 0.60 -0.28 -0.03 0.00 1.08 0.00 0.00 40.66 42.03 1p7m h LEU 37 CO 0.01 1.20 0.33 -0.08 -1.08 0.00 0.00 178.44 178.82 1p7m h GLU 38 N 0.82 0.98 -0.71 1.13 4.57 0.16 -1.80 114.58 119.73 1p7m h GLU 38 Ca 0.09 -0.13 0.02 0.00 -1.18 0.00 0.00 59.36 58.16 1p7m h GLU 38 Cb 0.85 -0.18 -0.04 0.00 -0.16 0.00 0.00 28.75 29.22 1p7m h GLU 38 CO 0.08 0.76 0.47 0.78 -1.18 0.00 0.00 179.01 179.91 1p7m h GLY 39 N 1.04 0.99 2.00 1.92 0.00 -0.84 -0.17 103.07 108.01 1p7m h GLY 39 Ca 0.24 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 47.19 1p7m h GLY 39 CO -0.03 0.34 -0.09 1.46 0.00 0.00 0.00 176.54 178.21 1p7m h GLN 40 N 0.92 0.00 0.00 4.80 4.20 -1.23 -2.06 115.11 121.74 1p7m h GLN 40 Ca 0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.98 1p7m h GLN 40 Cb -0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.74 1p7m h GLN 40 CO -0.07 0.09 0.00 0.00 -0.67 0.00 0.00 178.83 178.19 1p7m n GLN 41 N -3.58 0.33 -1.60 1.46 -0.00 -0.08 -4.24 117.38 109.67 1p7m n GLN 41 Ca -0.02 0.08 -0.44 0.00 -0.00 0.00 0.00 57.00 56.62 1p7m n GLN 41 Cb 0.22 -1.50 -0.04 0.00 -0.00 0.00 0.00 30.24 28.92 1p7m n GLN 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1p7m n ALA 42 N -1.16 1.59 0.00 2.61 0.00 -0.78 -1.03 120.51 121.74 1p7m n ALA 42 Ca 0.09 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1p7m n ALA 42 Cb 0.09 -2.80 0.00 0.00 0.00 0.00 0.00 19.45 16.74 1p7m n ALA 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p7m n GLY 43 N 5.54 1.62 3.84 0.00 0.00 -1.26 -4.94 105.19 109.99 1p7m n GLY 43 Ca 0.29 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.05 1p7m n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p7m s LEU 44 N 0.00 3.97 0.61 0.99 2.01 -0.20 -5.09 118.68 120.96 1p7m s LEU 44 Ca 0.00 -0.04 -0.16 0.00 0.01 0.00 0.00 54.13 53.94 1p7m s LEU 44 Cb 0.00 -2.57 -0.03 0.00 0.01 0.00 0.00 46.19 43.61 1p7m s LEU 44 CO 0.00 0.06 1.09 -0.44 1.01 0.00 0.00 176.35 178.08 1p7m s SER 45 N -3.15 5.51 0.17 2.29 0.01 -1.26 -4.59 113.70 112.68 1p7m s SER 45 Ca 0.32 1.97 -0.12 0.00 1.31 0.00 0.00 55.95 59.43 1p7m s SER 45 Cb -0.10 -2.55 0.05 0.00 0.21 0.00 0.00 66.02 63.63 1p7m s SER 45 CO 0.25 -1.36 1.67 -0.25 0.41 0.00 0.00 173.24 173.96 1p7m h TRP 46 N 0.46 0.97 -0.60 2.43 2.91 -1.96 -2.52 115.95 117.64 1p7m h TRP 46 Ca -0.48 -0.12 0.15 0.00 1.13 0.00 0.00 58.89 59.58 1p7m h TRP 46 Cb 1.24 -0.27 -0.03 0.00 -0.51 0.00 0.00 29.16 29.59 1p7m h TRP 46 CO 0.55 0.84 0.42 0.82 -1.03 0.00 0.00 178.44 180.04 1p7m h ILE 47 N 0.82 0.75 -0.93 2.65 1.08 -2.01 0.15 117.51 120.02 1p7m h ILE 47 Ca 0.18 -0.04 0.05 0.00 -0.39 0.00 0.00 64.86 64.65 1p7m h ILE 47 Cb 0.37 0.62 -0.06 0.00 -3.07 0.00 0.00 36.82 34.68 1p7m h ILE 47 CO 0.00 0.02 0.60 0.74 -0.69 0.00 0.00 178.15 178.83 1p7m h THR 48 N 0.12 1.12 0.00 -0.27 2.02 -1.83 -0.58 112.91 113.50 1p7m h THR 48 Ca 0.29 -0.39 -0.09 0.00 0.77 0.00 0.00 66.41 66.99 1p7m h THR 48 Cb 0.96 -0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1p7m h THR 48 CO -0.04 0.21 -0.44 -0.37 0.37 0.00 0.00 175.52 175.26 1p7m h VAL 49 N 1.13 1.12 0.30 3.16 -1.51 -1.06 -2.52 116.25 116.86 1p7m h VAL 49 Ca 0.38 -1.60 -0.01 0.00 -1.23 0.00 0.00 66.70 64.24 1p7m h VAL 49 Cb 0.07 1.91 0.00 0.00 -2.13 0.00 0.00 31.29 31.14 1p7m h VAL 49 CO -0.14 0.43 -0.14 0.25 -1.23 0.00 0.00 177.57 176.73 1p7m h LEU 50 N 0.00 -0.34 -0.51 4.19 5.85 -0.91 1.57 115.31 125.16 1p7m h LEU 50 Ca -0.00 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1p7m h LEU 50 Cb 0.88 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 1p7m h LEU 50 CO 0.06 -0.11 0.29 0.11 -0.34 0.00 0.00 178.44 178.45 1p7m h LYS 51 N -0.55 0.71 0.00 1.25 1.57 -1.47 -0.09 116.57 117.98 1p7m h LYS 51 Ca -0.04 -0.08 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 1p7m h LYS 51 Cb 0.41 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 1p7m h LYS 51 CO 0.07 0.54 -0.19 0.87 -0.57 0.00 0.00 179.45 180.17 1p7m h LYS 52 N 0.68 0.00 -0.72 3.15 1.79 -1.27 -2.27 116.57 117.94 1p7m h LYS 52 Ca 0.18 0.00 0.10 0.00 -2.18 0.00 0.00 60.65 58.76 1p7m h LYS 52 Cb 0.03 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 30.60 1p7m h LYS 52 CO -0.03 0.19 0.35 -0.09 -1.08 0.00 0.00 179.45 178.78 1p7m h ARG 53 N 0.00 0.55 -0.24 3.15 2.43 0.43 1.10 114.38 121.80 1p7m h ARG 53 Ca -0.00 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 58.98 1p7m h ARG 53 Cb 0.43 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 1p7m h ARG 53 CO 0.02 0.37 -0.48 0.93 -1.51 0.00 0.00 179.97 179.30 1p7m h GLU 54 N 0.57 0.65 0.07 0.20 5.08 -1.30 -2.77 114.58 117.09 1p7m h GLU 54 Ca 0.37 -0.37 -0.14 0.00 -1.00 0.00 0.00 59.36 58.22 1p7m h GLU 54 Cb 0.43 0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.72 1p7m h GLU 54 CO -0.30 0.99 -0.57 -2.95 -1.00 0.00 0.00 179.01 175.18 1p7m h ASN 55 N 0.51 0.38 -0.40 1.42 -1.07 -0.91 -2.72 115.58 112.81 1p7m h ASN 55 Ca 0.03 -0.89 0.02 0.00 0.07 0.00 0.00 56.30 55.53 1p7m h ASN 55 Cb 1.03 -0.12 -0.03 0.00 -2.07 0.00 0.00 38.32 37.13 1p7m h ASN 55 CO 0.10 1.23 0.23 0.22 0.07 0.00 0.00 177.43 179.28 1p7m h TYR 56 N -0.41 0.43 0.00 4.14 5.03 0.11 -1.16 116.97 125.11 1p7m h TYR 56 Ca -0.09 0.01 -0.07 0.00 2.58 0.00 0.00 58.73 61.17 1p7m h TYR 56 Cb 1.38 -0.13 -0.01 0.00 1.55 0.00 0.00 36.73 39.52 1p7m h TYR 56 CO 0.19 0.24 -0.31 0.07 -1.32 0.00 0.00 178.16 177.04 1p7m h ARG 57 N 0.46 0.00 -0.29 1.82 -0.00 -1.60 -2.58 114.38 112.18 1p7m h ARG 57 Ca 0.16 0.00 -0.10 0.00 -0.00 0.00 0.00 59.98 60.04 1p7m h ARG 57 Cb 0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 29.98 1p7m h ARG 57 CO -0.08 0.31 -0.21 0.00 -0.00 0.00 0.00 179.97 179.99 1p7m h ALA 58 N 1.69 0.42 -0.18 0.08 0.00 -0.92 0.64 119.26 120.98 1p7m h ALA 58 Ca -0.00 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.47 1p7m h ALA 58 Cb 0.57 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1p7m h ALA 58 CO 0.04 0.37 -0.16 0.00 0.00 0.00 0.00 179.25 179.50 1p7m h PHE 60 N 0.10 0.23 0.00 0.00 -1.00 -1.52 -3.45 116.94 111.30 1p7m h PHE 60 Ca 0.03 -0.16 0.00 0.00 2.81 0.00 0.00 57.97 60.65 1p7m h PHE 60 Cb 0.69 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 40.24 1p7m h PHE 60 CO 0.08 1.09 0.00 0.72 -1.61 0.00 0.00 178.31 178.59 1p7m n HIS 61 N -4.43 0.00 -0.18 -0.55 8.25 0.22 -4.67 115.22 113.87 1p7m n HIS 61 Ca -0.11 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.28 1p7m n HIS 61 Cb 0.60 -1.01 0.09 0.00 1.12 0.00 0.00 29.99 30.78 1p7m n HIS 61 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1p7m h GLN 62 N 0.00 0.98 0.00 -0.41 1.08 -1.88 -3.44 115.11 111.43 1p7m h GLN 62 Ca 0.00 -0.27 0.00 0.00 -1.45 0.00 0.00 58.65 56.93 1p7m h GLN 62 Cb 0.22 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.54 1p7m h GLN 62 CO 0.00 0.94 0.00 1.19 -0.95 0.00 0.00 178.83 180.01 1p7m n PHE 63 N -4.20 0.00 -3.82 2.96 3.01 -1.26 -4.80 117.46 109.34 1p7m n PHE 63 Ca 0.03 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.19 1p7m n PHE 63 Cb 0.31 -1.21 -0.15 0.00 -0.01 0.00 0.00 39.48 38.42 1p7m n PHE 63 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1p7m s ASP 64 N -1.23 4.23 0.63 4.37 2.15 -1.26 -4.98 116.67 120.58 1p7m s ASP 64 Ca 0.00 -1.87 0.23 0.00 0.43 0.00 0.00 52.55 51.34 1p7m s ASP 64 Cb 0.00 -1.11 1.06 0.00 -0.30 0.00 0.00 42.92 42.57 1p7m s ASP 64 CO 0.00 -0.39 1.56 -0.65 -0.17 0.00 0.00 175.17 175.51 1p7m h PRO 65 N 7.85 0.00 -0.29 4.34 0.11 -1.99 0.43 132.00 142.44 1p7m h PRO 65 Ca -0.10 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.99 1p7m h PRO 65 Cb 1.01 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 1p7m h PRO 65 CO 0.49 0.00 0.10 0.28 -0.21 0.00 0.00 178.00 178.66 1p7m h VAL 66 N 0.00 1.19 -0.20 3.15 2.07 -1.93 -2.18 116.25 118.35 1p7m h VAL 66 Ca 0.19 -0.62 -0.07 0.00 0.82 0.00 0.00 66.70 67.03 1p7m h VAL 66 Cb 1.70 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 32.50 1p7m h VAL 66 CO -0.00 0.21 -0.19 0.11 0.02 0.00 0.00 177.57 177.72 1p7m h LYS 67 N 0.32 0.34 -0.78 1.57 6.56 -1.29 -2.46 116.57 120.83 1p7m h LYS 67 Ca 0.10 -0.10 -0.01 0.00 -1.06 0.00 0.00 60.65 59.57 1p7m h LYS 67 Cb 0.23 -0.03 -0.04 0.00 -0.57 0.00 0.00 32.23 31.81 1p7m h LYS 67 CO -0.00 0.53 0.45 0.28 -2.06 0.00 0.00 179.45 178.64 1p7m h VAL 68 N 0.32 1.22 0.00 0.50 2.07 -1.35 0.29 116.25 119.29 1p7m h VAL 68 Ca 0.06 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.06 1p7m h VAL 68 Cb 0.52 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1p7m h VAL 68 CO 0.03 0.24 0.00 0.00 0.02 0.00 0.00 177.57 177.86 1p7m n ALA 69 N -2.42 1.58 1.02 1.67 0.00 -0.87 -1.09 120.51 120.40 1p7m n ALA 69 Ca 0.08 0.11 0.12 0.00 0.00 0.00 0.00 53.44 53.75 1p7m n ALA 69 Cb 0.08 -1.39 0.22 0.00 0.00 0.00 0.00 19.45 18.36 1p7m n ALA 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p7m n ALA 70 N -1.79 3.63 -2.60 0.00 0.00 0.95 -4.76 120.51 115.94 1p7m n ALA 70 Ca 0.02 -0.38 -0.43 0.00 0.00 0.00 0.00 53.44 52.65 1p7m n ALA 70 Cb 0.21 -1.08 -0.03 0.00 0.00 0.00 0.00 19.45 18.54 1p7m n ALA 70 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1p7m s MET 71 N -2.96 3.81 0.44 0.00 -1.94 -0.25 -5.02 119.30 113.38 1p7m s MET 71 Ca 0.12 0.61 0.03 0.00 -1.71 0.00 0.00 55.69 54.74 1p7m s MET 71 Cb 0.17 -3.84 0.08 0.00 2.01 0.00 0.00 34.83 33.26 1p7m s MET 71 CO 0.70 -1.11 0.61 0.94 -0.01 0.00 0.00 175.02 176.15 1p7m n GLN 72 N 7.17 0.40 -0.02 2.03 -0.06 -1.26 -4.85 117.38 120.79 1p7m n GLN 72 Ca 0.09 -1.94 0.10 0.00 -2.00 0.00 0.00 57.00 53.25 1p7m n GLN 72 Cb 0.48 -0.32 0.51 0.00 -4.06 0.00 0.00 30.24 26.85 1p7m n GLN 72 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 1p7m h GLU 73 N 0.00 0.37 -0.22 3.69 5.08 -1.96 0.77 114.58 122.31 1p7m h GLU 73 Ca -0.20 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.07 1p7m h GLU 73 Cb 0.83 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 1p7m h GLU 73 CO 0.25 0.24 -0.13 1.05 -1.00 0.00 0.00 179.01 179.42 1p7m h GLU 74 N 0.38 0.35 -0.48 2.33 4.11 -2.00 -2.63 114.58 116.64 1p7m h GLU 74 Ca 0.21 -0.09 -0.13 0.00 0.07 0.00 0.00 59.36 59.42 1p7m h GLU 74 Cb 0.35 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1p7m h GLU 74 CO -0.05 0.49 -0.22 -0.44 0.07 0.00 0.00 179.01 178.86 1p7m h ASP 75 N 0.33 1.03 0.00 3.06 3.32 -1.20 -2.82 116.42 120.14 1p7m h ASP 75 Ca 0.06 -0.40 -0.08 0.00 0.02 0.00 0.00 57.03 56.64 1p7m h ASP 75 Cb 0.44 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1p7m h ASP 75 CO 0.03 1.19 -0.23 -0.37 -1.72 0.00 0.00 179.24 178.14 1p7m h VAL 76 N 0.86 1.25 -0.50 -1.35 -1.51 -1.15 -2.26 116.25 111.59 1p7m h VAL 76 Ca 0.11 -1.17 -0.05 0.00 -1.23 0.00 0.00 66.70 64.35 1p7m h VAL 76 Cb 0.80 1.35 -0.02 0.00 -2.13 0.00 0.00 31.29 31.28 1p7m h VAL 76 CO 0.07 0.37 0.09 -0.33 -1.23 0.00 0.00 177.57 176.53 1p7m h GLU 77 N 0.35 0.77 -0.27 5.19 5.08 -1.31 -0.61 114.58 123.78 1p7m h GLU 77 Ca 0.06 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1p7m h GLU 77 Cb 0.60 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 1p7m h GLU 77 CO 0.04 0.72 0.14 -0.09 -1.00 0.00 0.00 179.01 178.83 1p7m h ARG 78 N 0.74 0.37 -0.13 2.33 2.43 -1.17 -2.87 114.38 116.08 1p7m h ARG 78 Ca 0.16 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.16 1p7m h ARG 78 Cb 0.32 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1p7m h ARG 78 CO 0.00 0.34 -0.46 -0.07 -1.51 0.00 0.00 179.97 178.27 1p7m h LEU 79 N 0.31 0.35 -1.28 3.80 3.38 -1.22 -2.62 115.31 118.04 1p7m h LEU 79 Ca 0.09 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1p7m h LEU 79 Cb 0.08 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1p7m h LEU 79 CO -0.01 0.77 0.49 0.58 0.09 0.00 0.00 178.44 180.35 1p7m h VAL 80 N 0.27 0.00 0.00 1.22 2.07 -0.88 0.62 116.25 119.55 1p7m h VAL 80 Ca 0.02 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1p7m h VAL 80 Cb 0.92 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1p7m h VAL 80 CO 0.08 0.00 -0.71 0.00 0.02 0.00 0.00 177.57 176.95 1p7m n GLN 81 N -2.61 2.98 -2.65 1.57 6.02 -1.02 -4.45 117.38 117.23 1p7m n GLN 81 Ca -0.01 -0.03 -0.43 0.00 -0.01 0.00 0.00 57.00 56.52 1p7m n GLN 81 Cb 0.52 -0.96 -0.03 0.00 1.02 0.00 0.00 30.24 30.79 1p7m n GLN 81 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1p7m s ASP 82 N -2.11 6.56 0.00 1.08 2.15 0.22 -3.58 116.67 120.98 1p7m s ASP 82 Ca 0.01 0.29 0.00 0.00 0.43 0.00 0.00 52.55 53.28 1p7m s ASP 82 Cb 0.05 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.14 1p7m s ASP 82 CO 0.30 -1.26 0.00 0.00 -0.17 0.00 0.00 175.17 174.03 1p7m n ALA 83 N 7.82 0.00 -2.66 3.66 0.00 -1.26 -3.57 120.51 124.50 1p7m n ALA 83 Ca 0.10 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.45 1p7m n ALA 83 Cb 0.49 -0.03 0.02 0.00 0.00 0.00 0.00 19.45 19.93 1p7m n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p7m n GLY 84 N -1.87 0.24 0.88 0.00 0.00 -1.23 -5.00 105.19 98.20 1p7m n GLY 84 Ca 0.00 -0.39 -0.05 0.00 0.00 0.00 0.00 46.02 45.59 1p7m n GLY 84 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1p7m n ILE 85 N -3.68 0.00 -1.55 -0.61 -5.35 -1.23 -4.51 119.36 102.43 1p7m n ILE 85 Ca -0.03 0.00 -0.22 0.00 -0.27 0.00 0.00 62.75 62.22 1p7m n ILE 85 Cb 0.54 -0.15 -0.06 0.00 -1.74 0.00 0.00 39.64 38.23 1p7m n ILE 85 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1p7m n ILE 86 N -3.10 -0.03 -1.63 7.28 3.06 -1.26 -4.87 119.36 118.81 1p7m n ILE 86 Ca 0.02 -0.61 -0.44 0.00 -2.50 0.00 0.00 62.75 59.22 1p7m n ILE 86 Cb 0.09 -2.26 -0.01 0.00 0.54 0.00 0.00 39.64 38.00 1p7m n ILE 86 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 1p7m n ARG 87 N 8.83 1.66 0.00 9.51 1.74 -1.26 -4.85 116.66 132.29 1p7m n ARG 87 Ca 0.44 0.58 0.00 0.00 -0.77 0.00 0.00 57.85 58.10 1p7m n ARG 87 Cb 0.47 -2.04 0.00 0.00 -1.02 0.00 0.00 32.46 29.86 1p7m n ARG 87 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1p7m n HIS 88 N 0.34 0.00 -0.33 -1.55 8.25 -1.26 -5.03 115.22 115.63 1p7m n HIS 88 Ca 0.08 0.00 0.19 0.00 -0.26 0.00 0.00 57.72 57.72 1p7m n HIS 88 Cb 0.33 0.00 0.42 0.00 1.12 0.00 0.00 29.99 31.87 1p7m n HIS 88 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1p7m h ARG 89 N 0.00 0.53 0.72 -0.41 0.11 -1.91 0.17 114.38 113.58 1p7m h ARG 89 Ca 0.00 -0.03 -0.04 0.00 0.10 0.00 0.00 59.98 60.01 1p7m h ARG 89 Cb 0.00 -0.12 0.01 0.00 1.11 0.00 0.00 29.97 30.97 1p7m h ARG 89 CO 0.00 0.35 -0.35 0.78 0.10 0.00 0.00 179.97 180.85 1p7m h GLY 90 N 0.54 -1.01 1.01 0.08 0.00 -2.00 -1.32 103.07 100.38 1p7m h GLY 90 Ca 0.61 0.37 -0.00 0.00 0.00 0.00 0.00 47.33 48.31 1p7m h GLY 90 CO -0.38 -0.37 0.50 1.70 0.00 0.00 0.00 176.54 177.99 1p7m h LYS 91 N -1.20 1.11 -0.78 4.80 3.64 -1.81 -2.39 116.57 119.94 1p7m h LYS 91 Ca -0.10 -0.10 0.03 0.00 -1.27 0.00 0.00 60.65 59.21 1p7m h LYS 91 Cb 0.76 -0.23 -0.05 0.00 -0.41 0.00 0.00 32.23 32.30 1p7m h LYS 91 CO 0.16 0.78 0.50 0.82 -2.27 0.00 0.00 179.45 179.44 1p7m h ILE 92 N 1.12 1.13 -0.45 2.00 2.04 -0.68 -0.25 117.51 122.42 1p7m h ILE 92 Ca 0.29 -0.34 0.06 0.00 1.00 0.00 0.00 64.86 65.88 1p7m h ILE 92 Cb -0.05 0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 36.07 1p7m h ILE 92 CO -0.06 0.18 0.30 0.06 0.00 0.00 0.00 178.15 178.63 1p7m h GLN 93 N 0.98 0.35 -0.45 2.37 -0.00 -0.72 0.12 115.11 117.75 1p7m h GLN 93 Ca 0.31 -0.02 -0.06 0.00 -0.00 0.00 0.00 58.65 58.88 1p7m h GLN 93 Cb -0.01 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.48 27.37 1p7m h GLN 93 CO -0.10 0.23 0.04 0.00 -0.00 0.00 0.00 178.83 178.99 1p7m h ALA 94 N 1.76 1.22 -0.85 0.06 0.00 -0.82 -2.25 119.26 118.37 1p7m h ALA 94 Ca 0.19 -0.23 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1p7m h ALA 94 Cb 0.32 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 1p7m h ALA 94 CO -0.05 0.52 0.53 0.82 0.00 0.00 0.00 179.25 181.08 1p7m h ILE 95 N 0.68 1.05 -0.97 0.00 1.08 -0.43 -0.60 117.51 118.32 1p7m h ILE 95 Ca 0.14 -0.33 0.02 0.00 -0.39 0.00 0.00 64.86 64.30 1p7m h ILE 95 Cb 0.37 -0.01 -0.05 0.00 -3.07 0.00 0.00 36.82 34.06 1p7m h ILE 95 CO 0.01 0.18 0.64 0.40 -0.69 0.00 0.00 178.15 178.69 1p7m h ILE 96 N 0.97 1.23 -0.79 -0.67 1.08 -1.25 -0.53 117.51 117.54 1p7m h ILE 96 Ca 0.37 -0.44 0.05 0.00 -0.39 0.00 0.00 64.86 64.45 1p7m h ILE 96 Cb 0.16 -0.18 -0.05 0.00 -3.07 0.00 0.00 36.82 33.68 1p7m h ILE 96 CO -0.17 0.24 0.52 1.23 -0.69 0.00 0.00 178.15 179.28 1p7m h GLY 97 N 1.29 1.10 1.08 5.37 0.00 -0.96 0.06 103.07 111.01 1p7m h GLY 97 Ca 0.36 -0.36 0.04 0.00 0.00 0.00 0.00 47.33 47.37 1p7m h GLY 97 CO -0.09 0.29 0.52 3.43 0.00 0.00 0.00 176.54 180.69 1p7m h ASN 98 N 0.91 0.83 -0.43 0.19 -0.26 -0.56 -1.87 115.58 114.39 1p7m h ASN 98 Ca 0.33 -0.01 -0.02 0.00 -0.56 0.00 0.00 56.30 56.04 1p7m h ASN 98 Cb 0.15 -0.19 -0.02 0.00 -1.06 0.00 0.00 38.32 37.20 1p7m h ASN 98 CO -0.11 0.57 0.19 0.00 -1.06 0.00 0.00 177.43 177.02 1p7m h ALA 99 N 1.54 0.55 -0.76 -0.83 0.00 -0.78 -0.33 119.26 118.65 1p7m h ALA 99 Ca 0.32 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.17 1p7m h ALA 99 Cb 0.07 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 1p7m h ALA 99 CO -0.10 0.13 0.44 0.00 0.00 0.00 0.00 179.25 179.73 1p7m h ARG 100 N 0.55 0.78 -0.00 0.00 -0.00 -1.14 0.14 114.38 114.71 1p7m h ARG 100 Ca 0.14 -0.05 -0.06 0.00 -0.50 0.00 0.00 59.98 59.52 1p7m h ARG 100 Cb 0.15 -0.18 -0.01 0.00 0.00 0.00 0.00 29.97 29.94 1p7m h ARG 100 CO -0.02 0.52 -0.29 0.00 0.00 0.00 0.00 179.97 180.18 1p7m h ALA 101 N 1.38 1.52 -0.62 0.04 0.00 -0.90 -0.58 119.26 120.11 1p7m h ALA 101 Ca 0.34 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1p7m h ALA 101 Cb 0.20 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1p7m h ALA 101 CO -0.19 0.36 0.31 -0.92 0.00 0.00 0.00 179.25 178.81 1p7m h TYR 102 N 0.00 0.88 -0.08 0.00 3.20 0.10 -0.86 116.97 120.22 1p7m h TYR 102 Ca -0.00 -0.04 -0.10 0.00 3.14 0.00 0.00 58.73 61.73 1p7m h TYR 102 Cb 0.51 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 1p7m h TYR 102 CO 0.00 0.66 -0.40 -0.07 -1.64 0.00 0.00 178.16 176.71 1p7m h LEU 103 N 0.84 0.17 -0.95 2.82 4.07 -0.52 -2.75 115.31 118.99 1p7m h LEU 103 Ca 0.21 -0.07 0.00 0.00 0.08 0.00 0.00 57.88 58.11 1p7m h LEU 103 Cb 0.10 -0.05 -0.05 0.00 1.08 0.00 0.00 40.66 41.74 1p7m h LEU 103 CO -0.03 0.55 0.61 1.56 -1.08 0.00 0.00 178.44 180.05 1p7m h GLN 104 N 0.14 1.26 -0.25 1.13 1.08 0.29 0.59 115.11 119.35 1p7m h GLN 104 Ca 0.01 -0.09 -0.19 0.00 -1.45 0.00 0.00 58.65 56.93 1p7m h GLN 104 Cb 0.77 -0.28 0.00 0.00 -0.05 0.00 0.00 27.48 27.92 1p7m h GLN 104 CO 0.06 0.85 -0.60 0.52 -0.95 0.00 0.00 178.83 178.71 1p7m h MET 105 N 1.29 0.81 -0.49 1.46 2.86 -1.24 -0.96 114.93 118.66 1p7m h MET 105 Ca 0.34 -0.54 -0.08 0.00 -2.06 0.00 0.00 59.70 57.36 1p7m h MET 105 Cb -0.12 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.60 1p7m h MET 105 CO -0.07 1.17 -0.02 0.93 1.06 0.00 0.00 176.91 179.98 1p7m h GLU 106 N 0.61 0.88 0.00 1.72 5.08 -1.13 0.65 114.58 122.40 1p7m h GLU 106 Ca 0.00 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.06 1p7m h GLU 106 Cb 1.20 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.37 1p7m h GLU 106 CO 0.13 0.93 -0.04 1.96 -1.00 0.00 0.00 179.01 180.99 1p7m h GLN 107 N 0.74 0.00 0.00 2.33 4.20 0.25 0.12 115.11 122.75 1p7m h GLN 107 Ca 0.14 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 1p7m h GLN 107 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1p7m h GLN 107 CO 0.03 0.04 -0.71 -1.71 -0.67 0.00 0.00 178.83 175.81 1p7m n ASN 108 N -3.24 0.64 -1.21 1.46 2.85 -0.17 -4.94 115.26 110.65 1p7m n ASN 108 Ca -0.01 -0.39 -0.12 0.00 -0.11 0.00 0.00 54.58 53.95 1p7m n ASN 108 Cb 0.22 0.51 -0.02 0.00 1.24 0.00 0.00 39.78 41.73 1p7m n ASN 108 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1p7m n GLY 109 N 1.47 0.36 3.05 8.20 0.00 0.21 -4.98 105.19 113.50 1p7m n GLY 109 Ca 0.04 -0.41 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 1p7m n GLY 109 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1p7m s GLU 110 N -4.06 1.70 0.48 1.61 2.02 -0.26 -5.00 118.70 115.20 1p7m s GLU 110 Ca 0.00 -1.79 -0.23 0.00 0.02 0.00 0.00 54.97 52.97 1p7m s GLU 110 Cb 0.00 -3.25 -0.08 0.00 0.10 0.00 0.00 34.13 30.90 1p7m s GLU 110 CO 0.00 -0.91 1.17 -2.30 0.02 0.00 0.00 175.26 173.24 1p7m n PRO 111 N 4.35 1.55 -0.22 0.39 -0.02 -1.26 -4.59 135.00 135.20 1p7m n PRO 111 Ca 0.00 0.56 -0.06 0.00 -2.02 0.00 0.00 63.50 61.98 1p7m n PRO 111 Cb 0.42 -2.31 0.04 0.00 -0.02 0.00 0.00 33.50 31.63 1p7m n PRO 111 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 1p7m h PHE 112 N 1.51 0.83 -0.22 6.00 -1.00 -1.91 -2.57 116.94 119.57 1p7m h PHE 112 Ca -0.48 -0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.24 1p7m h PHE 112 Cb 1.32 -0.27 -0.01 0.00 3.61 0.00 0.00 35.95 40.59 1p7m h PHE 112 CO 0.44 0.56 -0.14 0.00 -1.61 0.00 0.00 178.31 177.56 1p7m h ALA 113 N 1.20 1.35 -0.14 2.45 0.00 -1.82 -3.05 119.26 119.25 1p7m h ALA 113 Ca 0.23 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1p7m h ALA 113 Cb -0.03 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1p7m h ALA 113 CO -0.04 0.44 0.08 0.22 0.00 0.00 0.00 179.25 179.95 1p7m h ASP 114 N 0.34 0.17 -0.18 0.00 3.58 -1.79 -1.64 116.42 116.90 1p7m h ASP 114 Ca 0.07 -0.07 -0.08 0.00 0.42 0.00 0.00 57.03 57.36 1p7m h ASP 114 Cb 0.46 -0.04 -0.00 0.00 1.72 0.00 0.00 39.33 41.47 1p7m h ASP 114 CO 0.03 0.19 -0.21 2.19 -2.88 0.00 0.00 179.24 178.56 1p7m h PHE 115 N 0.13 0.55 0.00 0.28 -0.00 -1.54 -2.47 116.94 113.89 1p7m h PHE 115 Ca 0.05 -0.17 0.00 0.00 -0.00 0.00 0.00 57.97 57.85 1p7m h PHE 115 Cb 0.06 -0.11 -0.00 0.00 -0.00 0.00 0.00 35.95 35.89 1p7m h PHE 115 CO -0.05 0.84 -0.01 -0.24 -0.00 0.00 0.00 178.31 178.86 1p7m h VAL 116 N 0.10 0.98 -0.22 0.88 3.04 -1.54 0.22 116.25 119.71 1p7m h VAL 116 Ca 0.02 0.00 0.07 0.00 -1.01 0.00 0.00 66.70 65.78 1p7m h VAL 116 Cb 0.76 0.98 -0.01 0.00 -2.01 0.00 0.00 31.29 31.01 1p7m h VAL 116 CO 0.05 0.00 0.30 -0.50 -1.01 0.00 0.00 177.57 176.41 1p7m h TRP 117 N -0.01 0.00 -0.30 3.17 -0.00 -1.33 0.61 115.95 118.10 1p7m h TRP 117 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 58.89 58.72 1p7m h TRP 117 Cb 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 29.17 1p7m h TRP 117 CO -0.08 0.00 -0.48 0.66 -0.00 0.00 0.00 178.44 178.53 1p7m h SER 118 N 0.00 0.89 0.04 -3.49 4.64 -0.09 2.76 113.55 118.30 1p7m h SER 118 Ca 0.11 -0.44 -0.06 0.00 -0.47 0.00 0.00 61.79 60.92 1p7m h SER 118 Cb 0.70 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 1p7m h SER 118 CO -0.00 1.22 -0.17 -0.26 -0.87 0.00 0.00 176.83 176.75 1p7m h PHE 119 N 0.64 0.26 -0.53 4.77 0.04 -0.42 -1.44 116.94 120.26 1p7m h PHE 119 Ca 0.03 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1p7m h PHE 119 Cb 1.06 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 39.14 1p7m h PHE 119 CO 0.06 0.41 0.00 1.33 -0.60 0.00 0.00 178.31 179.51 1p7m n VAL 120 N -4.24 1.98 -3.69 -0.55 0.24 -1.15 -4.88 118.33 106.04 1p7m n VAL 120 Ca -0.01 -1.11 -0.25 0.00 -2.04 0.00 0.00 64.34 60.93 1p7m n VAL 120 Cb 0.30 -0.13 0.06 0.00 -1.47 0.00 0.00 33.84 32.60 1p7m n VAL 120 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1p7m n ASN 121 N 0.74 -5.50 -2.18 -1.34 5.03 -0.54 -1.43 115.26 110.03 1p7m n ASN 121 Ca 0.23 -0.63 -0.03 0.00 0.87 0.00 0.00 54.58 55.02 1p7m n ASN 121 Cb 0.93 -4.66 -0.00 0.00 -1.02 0.00 0.00 39.78 35.03 1p7m n ASN 121 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.26 177.00 1p7m n HIS 122 N -4.84 -1.62 -4.26 3.10 -0.00 0.92 -4.88 115.22 103.63 1p7m n HIS 122 Ca -0.01 0.00 -0.22 0.00 -0.00 0.00 0.00 57.72 57.49 1p7m n HIS 122 Cb 0.56 -1.46 -0.12 0.00 -0.00 0.00 0.00 29.99 28.97 1p7m n HIS 122 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 1p7m s GLN 123 N -4.42 1.03 0.54 1.57 -1.52 -0.52 -5.09 119.66 111.27 1p7m s GLN 123 Ca 0.00 -1.08 -0.21 0.00 -1.95 0.00 0.00 55.36 52.12 1p7m s GLN 123 Cb 0.00 -1.21 -0.05 0.00 -0.22 0.00 0.00 33.01 31.53 1p7m s GLN 123 CO 0.00 0.28 1.23 -1.25 -0.25 0.00 0.00 175.29 175.30 1p7m s PRO 124 N -1.81 3.25 -0.04 2.91 0.04 -1.26 -4.86 135.00 133.23 1p7m s PRO 124 Ca 0.04 1.92 0.06 0.00 0.04 0.00 0.00 61.00 63.05 1p7m s PRO 124 Cb -0.10 -2.16 -0.02 0.00 0.04 0.00 0.00 34.50 32.26 1p7m s PRO 124 CO 0.03 -1.00 -0.21 -1.14 0.04 0.00 0.00 177.00 174.73 1p7m s GLN 125 N -3.03 2.34 -0.26 4.56 -0.44 -0.77 -5.02 119.66 117.04 1p7m s GLN 125 Ca 0.72 -0.82 -0.11 0.00 -2.50 0.00 0.00 55.36 52.65 1p7m s GLN 125 Cb -0.32 -2.21 -0.05 0.00 -1.64 0.00 0.00 33.01 28.79 1p7m s GLN 125 CO 0.37 0.57 0.17 -1.64 0.50 0.00 0.00 175.29 175.26 1p7m s MET 126 N -0.61 3.98 -0.28 1.67 -1.94 -1.26 0.03 119.30 120.89 1p7m s MET 126 Ca 0.09 -0.31 -0.25 0.00 -1.71 0.00 0.00 55.69 53.52 1p7m s MET 126 Cb -0.11 -3.59 0.00 0.00 2.01 0.00 0.00 34.83 33.14 1p7m s MET 126 CO 0.00 -0.08 0.85 0.99 -0.01 0.00 0.00 175.02 176.77 1p7m s THR 127 N 1.45 4.77 -0.72 2.05 2.01 0.40 -4.90 115.64 120.70 1p7m s THR 127 Ca 0.07 1.41 0.06 0.00 0.31 0.00 0.00 61.69 63.54 1p7m s THR 127 Cb -0.15 -4.18 0.32 0.00 0.01 0.00 0.00 72.50 68.51 1p7m s THR 127 CO 0.08 -0.22 1.00 0.00 -0.69 0.00 0.00 174.62 174.79 1p7m n GLN 128 N 6.23 2.53 -2.52 4.92 6.02 -1.26 -4.47 117.38 128.84 1p7m n GLN 128 Ca 0.06 -1.24 -0.42 0.00 -0.01 0.00 0.00 57.00 55.39 1p7m n GLN 128 Cb 0.48 -1.80 -0.03 0.00 1.02 0.00 0.00 30.24 29.91 1p7m n GLN 128 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1p7m s ALA 129 N -1.69 3.33 -0.05 -1.58 0.00 -1.26 -4.90 121.76 115.61 1p7m s ALA 129 Ca 0.21 0.73 0.20 0.00 0.00 0.00 0.00 51.96 53.11 1p7m s ALA 129 Cb 0.16 -3.42 -0.31 0.00 0.00 0.00 0.00 23.12 19.55 1p7m s ALA 129 CO 0.06 -0.41 0.41 0.25 0.00 0.00 0.00 175.76 176.07 1p7m n THR 130 N 4.00 0.17 -4.28 0.00 -2.24 -1.26 -1.74 114.28 108.94 1p7m n THR 130 Ca 0.08 -0.52 -0.15 0.00 -2.27 0.00 0.00 64.05 61.19 1p7m n THR 130 Cb 0.48 -0.04 -0.10 0.00 -2.10 0.00 0.00 70.33 68.56 1p7m n THR 130 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1p7m s THR 131 N -3.32 1.07 0.33 4.28 -4.23 -1.26 -4.71 115.64 107.80 1p7m s THR 131 Ca -0.08 -2.04 0.02 0.00 -1.18 0.00 0.00 61.69 58.40 1p7m s THR 131 Cb 0.12 -2.09 0.27 0.00 1.34 0.00 0.00 72.50 72.15 1p7m s THR 131 CO 0.86 -0.54 1.96 -0.07 -0.54 0.00 0.00 174.62 176.29 1p7m h LEU 132 N 2.64 0.81 0.00 4.79 3.38 -1.94 0.51 115.31 125.51 1p7m h LEU 132 Ca -0.37 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1p7m h LEU 132 Cb 1.21 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1p7m h LEU 132 CO 0.64 0.56 0.00 -1.20 0.09 0.00 0.00 178.44 178.53 1p7m n SER 133 N -4.45 0.00 -1.39 -0.43 7.64 -1.26 -2.07 113.62 111.66 1p7m n SER 133 Ca 0.10 -0.39 0.10 0.00 1.01 0.00 0.00 58.87 59.69 1p7m n SER 133 Cb 0.12 -0.16 0.32 0.00 -1.01 0.00 0.00 64.21 63.48 1p7m n SER 133 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1p7m n GLU 134 N -1.16 3.23 -3.43 1.43 4.07 0.18 -4.84 120.64 120.11 1p7m n GLU 134 Ca 0.15 -2.73 -0.44 0.00 -0.06 0.00 0.00 57.16 54.09 1p7m n GLU 134 Cb 0.15 -1.70 -0.09 0.00 -0.06 0.00 0.00 31.44 29.74 1p7m n GLU 134 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 1p7m s ILE 135 N -1.45 5.17 0.32 6.31 -1.09 -0.88 -4.31 121.20 125.27 1p7m s ILE 135 Ca 0.48 -0.94 -0.29 0.00 -2.23 0.00 0.00 60.65 57.67 1p7m s ILE 135 Cb 0.28 -4.02 -0.12 0.00 -1.58 0.00 0.00 42.46 37.03 1p7m s ILE 135 CO 0.27 -0.47 1.45 -2.65 -1.23 0.00 0.00 174.94 172.31 1p7m n PRO 136 N 5.17 2.42 -0.13 2.79 -0.02 -1.26 -4.90 135.00 139.07 1p7m n PRO 136 Ca -0.12 0.85 0.10 0.00 -2.02 0.00 0.00 63.50 62.31 1p7m n PRO 136 Cb 0.45 -2.54 0.16 0.00 -0.02 0.00 0.00 33.50 31.54 1p7m n PRO 136 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1p7m n THR 137 N 1.15 0.41 -3.38 3.45 -2.24 -1.26 -4.72 114.28 107.68 1p7m n THR 137 Ca 0.06 -0.70 -0.25 0.00 -2.27 0.00 0.00 64.05 60.89 1p7m n THR 137 Cb 0.36 1.04 -0.10 0.00 -2.10 0.00 0.00 70.33 69.53 1p7m n THR 137 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1p7m s SER 138 N -1.37 1.86 0.09 3.42 0.01 -1.26 -4.47 113.70 111.99 1p7m s SER 138 Ca 0.30 -2.40 0.02 0.00 1.31 0.00 0.00 55.95 55.18 1p7m s SER 138 Cb 0.18 -0.14 -0.04 0.00 0.21 0.00 0.00 66.02 66.23 1p7m s SER 138 CO 0.26 -0.24 0.17 0.42 0.41 0.00 0.00 173.24 174.27 1p7m s THR 139 N 0.74 5.01 0.40 1.44 -4.23 -1.26 -4.89 115.64 112.83 1p7m s THR 139 Ca 0.24 -0.64 0.14 0.00 -1.18 0.00 0.00 61.69 60.25 1p7m s THR 139 Cb -0.10 -3.47 0.36 0.00 1.34 0.00 0.00 72.50 70.62 1p7m s THR 139 CO -0.08 0.06 1.86 1.55 -0.54 0.00 0.00 174.62 177.48 1p7m h PRO 140 N 2.90 0.49 -0.11 3.99 0.13 -2.00 0.76 132.00 138.16 1p7m h PRO 140 Ca -0.46 -0.03 -0.16 0.00 -0.87 0.00 0.00 66.00 64.48 1p7m h PRO 140 Cb 1.17 -0.11 0.01 0.00 0.13 0.00 0.00 31.00 32.20 1p7m h PRO 140 CO 0.70 0.32 -0.55 0.00 -0.23 0.00 0.00 178.00 178.24 1p7m h ALA 141 N 1.62 0.21 -0.40 -0.56 0.00 -1.94 -0.55 119.26 117.64 1p7m h ALA 141 Ca 0.46 -0.52 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 1p7m h ALA 141 Cb 1.00 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1p7m h ALA 141 CO -0.19 0.43 0.00 0.77 0.00 0.00 0.00 179.25 180.26 1p7m h SER 142 N 0.17 0.69 -0.38 0.00 0.02 -1.34 0.16 113.55 112.86 1p7m h SER 142 Ca -0.04 -0.31 -0.09 0.00 -0.84 0.00 0.00 61.79 60.52 1p7m h SER 142 Cb 1.19 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.53 1p7m h SER 142 CO 0.11 0.83 -0.08 -0.78 -1.14 0.00 0.00 176.83 175.77 1p7m h ASP 143 N 0.53 0.80 0.49 3.07 3.58 0.42 -2.05 116.42 123.26 1p7m h ASP 143 Ca 0.11 -0.23 -0.13 0.00 0.42 0.00 0.00 57.03 57.20 1p7m h ASP 143 Cb 0.47 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 41.29 1p7m h ASP 143 CO 0.02 0.91 -0.60 0.00 -2.88 0.00 0.00 179.24 176.69 1p7m h ALA 144 N 1.17 0.95 -0.22 -0.78 0.00 -0.87 -2.80 119.26 116.71 1p7m h ALA 144 Ca 0.13 -0.54 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 1p7m h ALA 144 Cb 0.56 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1p7m h ALA 144 CO 0.03 0.74 0.03 1.25 0.00 0.00 0.00 179.25 181.30 1p7m h LEU 145 N 0.08 0.36 -0.85 0.00 5.85 -0.14 -1.64 115.31 118.97 1p7m h LEU 145 Ca -0.01 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 1p7m h LEU 145 Cb 1.08 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.97 1p7m h LEU 145 CO 0.08 0.54 0.48 0.28 -0.34 0.00 0.00 178.44 179.49 1p7m h SER 146 N 0.17 1.04 -0.60 1.25 0.02 -1.33 -0.62 113.55 113.47 1p7m h SER 146 Ca 0.07 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 1p7m h SER 146 Cb 0.34 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.59 1p7m h SER 146 CO 0.01 0.82 0.35 0.50 -1.14 0.00 0.00 176.83 177.37 1p7m h LYS 147 N 1.17 0.82 -0.15 3.45 3.64 -1.28 0.99 116.57 125.21 1p7m h LYS 147 Ca 0.30 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 59.56 1p7m h LYS 147 Cb -0.00 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.65 1p7m h LYS 147 CO -0.05 0.61 -0.04 0.00 -2.27 0.00 0.00 179.45 177.70 1p7m h ALA 148 N 1.17 0.21 -0.42 5.00 0.00 -0.85 -1.40 119.26 122.96 1p7m h ALA 148 Ca 0.21 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 1p7m h ALA 148 Cb 0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1p7m h ALA 148 CO -0.04 -0.03 -0.19 -0.07 0.00 0.00 0.00 179.25 178.92 1p7m h LEU 149 N -0.01 0.83 -0.91 0.00 3.38 -0.92 -0.83 115.31 116.85 1p7m h LEU 149 Ca 0.04 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 1p7m h LEU 149 Cb 0.47 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 1p7m h LEU 149 CO 0.02 1.00 0.50 0.50 0.09 0.00 0.00 178.44 180.55 1p7m h LYS 150 N 0.72 1.27 0.00 1.13 3.64 0.11 0.26 116.57 123.71 1p7m h LYS 150 Ca 0.11 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1p7m h LYS 150 Cb 0.70 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1p7m h LYS 150 CO 0.05 0.92 0.00 0.87 -2.27 0.00 0.00 179.45 179.03 1p7m h LYS 151 N 1.27 0.00 -0.05 1.90 1.57 -0.99 -2.98 116.57 117.29 1p7m h LYS 151 Ca 0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 1p7m h LYS 151 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1p7m h LYS 151 CO -0.05 0.00 0.00 -2.13 -0.57 0.00 0.00 179.45 176.70 1p7m n ARG 152 N -2.35 1.22 -1.22 3.15 3.00 -0.34 -4.83 116.66 115.30 1p7m n ARG 152 Ca 0.05 -0.34 0.00 0.00 -0.00 0.00 0.00 57.85 57.57 1p7m n ARG 152 Cb 0.43 -1.32 0.00 0.00 0.00 0.00 0.00 32.46 31.57 1p7m n ARG 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1p7m n GLY 153 N 0.90 0.57 3.49 5.14 0.00 -1.13 -4.51 105.19 109.64 1p7m n GLY 153 Ca 0.15 -0.82 -0.41 0.00 0.00 0.00 0.00 46.02 44.93 1p7m n GLY 153 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1p7m s PHE 154 N -2.00 3.23 0.60 1.61 2.19 -0.04 -4.54 117.98 119.03 1p7m s PHE 154 Ca 0.00 -0.44 0.01 0.00 0.33 0.00 0.00 56.93 56.84 1p7m s PHE 154 Cb 0.00 -2.51 0.07 0.00 -1.31 0.00 0.00 43.02 39.26 1p7m s PHE 154 CO 0.00 -0.48 0.84 0.15 1.83 0.00 0.00 175.22 177.56 1p7m s LYS 155 N 1.69 2.27 -1.03 10.12 1.02 -1.26 -4.05 119.74 128.49 1p7m s LYS 155 Ca 0.05 -0.95 -0.08 0.00 0.02 0.00 0.00 55.97 55.01 1p7m s LYS 155 Cb -0.18 -2.46 -0.05 0.00 -0.52 0.00 0.00 37.83 34.62 1p7m s LYS 155 CO 0.10 -0.94 0.87 1.19 -0.92 0.00 0.00 175.35 175.64 1p7m n PHE 156 N -2.48 -2.42 -2.83 3.18 3.72 -1.26 -4.94 117.46 110.43 1p7m n PHE 156 Ca 0.11 0.82 -0.00 0.00 -0.05 0.00 0.00 57.45 58.32 1p7m n PHE 156 Cb 0.60 -3.98 0.05 0.00 -0.94 0.00 0.00 39.48 35.21 1p7m n PHE 156 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 1p7m n VAL 157 N -3.23 1.21 -0.91 -4.37 0.24 -1.26 -4.35 118.33 105.65 1p7m n VAL 157 Ca -0.07 -2.83 -0.35 0.00 -2.04 0.00 0.00 64.34 59.05 1p7m n VAL 157 Cb 0.60 1.29 0.07 0.00 -1.47 0.00 0.00 33.84 34.34 1p7m n VAL 157 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1p7m n GLY 158 N -0.63 -3.45 0.37 7.63 0.00 -1.26 -4.28 105.19 103.57 1p7m n GLY 158 Ca 0.06 -0.66 0.18 0.00 0.00 0.00 0.00 46.02 45.60 1p7m n GLY 158 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1p7m h THR 159 N -1.26 0.78 -0.04 2.61 2.02 -1.93 0.44 112.91 115.53 1p7m h THR 159 Ca -0.44 -0.05 -0.14 0.00 0.77 0.00 0.00 66.41 66.55 1p7m h THR 159 Cb 1.32 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 68.34 1p7m h THR 159 CO 0.27 0.03 -0.63 0.71 0.37 0.00 0.00 175.52 176.27 1p7m h THR 160 N 0.14 1.41 -0.30 3.16 1.35 -1.85 -1.64 112.91 115.18 1p7m h THR 160 Ca 0.27 -2.07 -0.05 0.00 -0.55 0.00 0.00 66.41 64.02 1p7m h THR 160 Cb 0.88 2.08 -0.01 0.00 -1.73 0.00 0.00 68.15 69.36 1p7m h THR 160 CO -0.04 0.60 -0.01 0.40 -0.25 0.00 0.00 175.52 176.23 1p7m h ILE 161 N 0.12 1.26 -0.46 6.82 1.08 -0.39 0.35 117.51 126.28 1p7m h ILE 161 Ca -0.01 -0.96 -0.09 0.00 -0.39 0.00 0.00 64.86 63.41 1p7m h ILE 161 Cb 1.13 1.29 -0.02 0.00 -3.07 0.00 0.00 36.82 36.15 1p7m h ILE 161 CO 0.09 0.31 -0.07 0.00 -0.69 0.00 0.00 178.15 177.79 1p7m h TYR 163 N 0.71 0.37 -0.28 0.00 3.20 -1.17 -2.85 116.97 116.94 1p7m h TYR 163 Ca 0.12 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 1p7m h TYR 163 Cb 0.60 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 1p7m h TYR 163 CO 0.05 0.64 0.07 0.77 -1.64 0.00 0.00 178.16 178.05 1p7m h SER 164 N -0.02 0.36 -0.26 -2.11 0.02 -0.27 -2.60 113.55 108.67 1p7m h SER 164 Ca 0.03 -0.04 0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1p7m h SER 164 Cb 0.55 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 1p7m h SER 164 CO 0.02 0.37 0.15 0.15 -1.14 0.00 0.00 176.83 176.38 1p7m h PHE 165 N 0.39 0.27 0.00 3.45 3.57 -0.89 -2.36 116.94 121.38 1p7m h PHE 165 Ca 0.09 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 1p7m h PHE 165 Cb 0.16 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 1p7m h PHE 165 CO 0.00 0.16 -0.29 0.00 -2.23 0.00 0.00 178.31 175.95 1p7m h MET 166 N 0.30 0.00 -1.01 1.11 -0.00 -1.26 -0.86 114.93 113.21 1p7m h MET 166 Ca 0.10 0.00 0.06 0.00 -0.00 0.00 0.00 59.70 59.87 1p7m h MET 166 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 31.60 31.54 1p7m h MET 166 CO -0.05 0.29 0.65 1.96 -0.00 0.00 0.00 176.91 179.77 1p7m h GLN 167 N 0.00 1.15 0.01 -0.10 1.08 -1.20 -2.93 115.11 113.12 1p7m h GLN 167 Ca -0.00 -0.07 -0.36 0.00 -1.45 0.00 0.00 58.65 56.77 1p7m h GLN 167 Cb 0.55 -0.26 -0.06 0.00 -0.05 0.00 0.00 27.48 27.66 1p7m h GLN 167 CO 0.04 0.76 -2.24 0.00 -0.95 0.00 0.00 178.83 176.44 1p7m n ALA 168 N -2.36 1.43 0.08 3.87 0.00 -1.12 -4.22 120.51 118.19 1p7m n ALA 168 Ca 0.15 -1.10 0.20 0.00 0.00 0.00 0.00 53.44 52.69 1p7m n ALA 168 Cb 0.18 -0.34 0.74 0.00 0.00 0.00 0.00 19.45 20.03 1p7m n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p7m n GLY 170 N -1.54 0.78 0.23 0.00 0.00 -1.11 -3.90 105.19 99.65 1p7m n GLY 170 Ca 0.07 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.14 1p7m n GLY 170 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1p7m h LEU 171 N 0.00 0.08 -8.30 0.99 3.38 -1.78 -3.42 115.31 106.26 1p7m h LEU 171 Ca 0.00 -0.01 -0.57 0.00 0.09 0.00 0.00 57.88 57.39 1p7m h LEU 171 Cb 0.00 -0.02 -0.30 0.00 0.09 0.00 0.00 40.66 40.43 1p7m h LEU 171 CO 0.00 0.22 -0.84 0.68 0.09 0.00 0.00 178.44 178.59 1p7m s VAL 172 N -4.74 1.46 0.32 1.22 -7.23 -1.25 -1.85 120.40 108.33 1p7m s VAL 172 Ca -0.05 -0.76 0.07 0.00 -1.81 0.00 0.00 61.98 59.43 1p7m s VAL 172 Cb 0.16 -1.23 -0.02 0.00 0.56 0.00 0.00 36.38 35.85 1p7m s VAL 172 CO 0.70 0.42 0.33 0.20 -0.31 0.00 0.00 175.10 176.44 1p7m s ASN 173 N -0.22 5.54 0.00 4.85 0.02 0.10 -4.88 114.94 120.34 1p7m s ASN 173 Ca 0.02 -0.36 0.00 0.00 -1.02 0.00 0.00 52.86 51.50 1p7m s ASN 173 Cb -0.09 -1.13 0.00 0.00 0.02 0.00 0.00 41.25 40.05 1p7m s ASN 173 CO 0.01 -0.32 0.00 0.47 0.02 0.00 0.00 177.10 177.27 1p7m n ASP 174 N -1.42 -1.04 -0.25 -1.22 8.00 -1.26 -0.45 116.55 118.90 1p7m n ASP 174 Ca -0.02 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.52 1p7m n ASP 174 Cb 0.59 -0.52 0.17 0.00 -0.02 0.00 0.00 41.12 41.34 1p7m n ASP 174 CO 0.00 0.00 0.00 0.45 -0.39 0.00 0.00 177.20 177.26 1p7m h HIS 175 N 0.00 0.46 -0.03 1.24 3.86 -1.90 -3.35 115.15 115.43 1p7m h HIS 175 Ca 0.00 0.04 -0.16 0.00 -1.16 0.00 0.00 60.37 59.08 1p7m h HIS 175 Cb 0.00 -0.09 -0.17 0.00 1.06 0.00 0.00 27.41 28.20 1p7m h HIS 175 CO 0.00 0.05 -0.36 1.33 0.86 0.00 0.00 177.93 179.81 1p7m n VAL 176 N -5.02 0.09 -2.85 2.45 0.24 -1.26 -4.91 118.33 107.08 1p7m n VAL 176 Ca 0.13 -0.87 0.00 0.00 -2.04 0.00 0.00 64.34 61.56 1p7m n VAL 176 Cb 0.40 0.89 0.00 0.00 -1.47 0.00 0.00 33.84 33.66 1p7m n VAL 176 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1p7m n VAL 177 N -1.01 -1.49 0.00 3.34 0.31 -0.71 -4.05 118.33 114.72 1p7m n VAL 177 Ca -0.18 0.30 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 1p7m n VAL 177 Cb 0.83 -2.53 0.00 0.00 -0.91 0.00 0.00 33.84 31.24 1p7m n VAL 177 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1p7m n GLY 178 N 1.59 0.65 3.70 2.92 0.00 -1.26 -4.74 105.19 108.06 1p7m n GLY 178 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 1p7m n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p7m s TYR 182 N -3.24 2.68 -0.04 0.00 6.14 1.07 -4.93 117.35 119.03 1p7m s TYR 182 Ca 0.05 0.85 -0.30 0.00 0.64 0.00 0.00 57.07 58.31 1p7m s TYR 182 Cb 0.09 -4.08 -0.04 0.00 0.42 0.00 0.00 41.96 38.35 1p7m s TYR 182 CO 0.37 -3.54 1.25 -1.25 0.64 0.00 0.00 175.55 173.02 1p7m s PRO 183 N -0.92 4.33 -0.05 4.97 0.04 -1.26 -4.89 135.00 137.22 1p7m s PRO 183 Ca 0.61 1.75 0.16 0.00 0.04 0.00 0.00 61.00 63.56 1p7m s PRO 183 Cb -0.48 -3.56 0.56 0.00 0.04 0.00 0.00 34.50 31.05 1p7m s PRO 183 CO 0.52 -0.48 1.45 0.41 0.04 0.00 0.00 177.00 178.94 1p7m n GLY 184 N 3.44 2.01 2.38 0.56 0.00 -1.26 -4.88 105.19 107.43 1p7m n GLY 184 Ca 0.12 -0.67 -0.18 0.00 0.00 0.00 0.00 46.02 45.29 1p7m n GLY 184 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1p7m n ASN 185 N 1.05 -4.87 -4.79 1.61 5.03 -1.26 -4.94 115.26 107.08 1p7m n ASN 185 Ca 0.20 0.29 -0.30 0.00 0.87 0.00 0.00 54.58 55.64 1p7m n ASN 185 Cb 0.63 -4.26 -0.06 0.00 -1.02 0.00 0.00 39.78 35.07 1p7m n ASN 185 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.26 173.84 1p7m s LYS 186 N -4.11 2.95 0.00 3.52 0.00 -1.26 -5.36 119.74 115.48 1p7m s LYS 186 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 55.97 55.30 1p7m s LYS 186 Cb 0.00 -2.76 0.00 0.00 0.00 0.00 0.00 37.83 35.07 1p7m s LYS 186 CO 0.00 0.57 0.02 -2.30 0.00 0.00 0.00 175.35 173.63