#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 3.50 0.07 3.17 2.56 0.25 -4.92 118.70 123.32 1p7m s GLU 2 Ca 0.00 -0.14 -0.36 0.00 0.00 0.00 0.00 54.97 54.47 1p7m s GLU 2 Cb 0.00 -3.14 -0.19 0.00 2.00 0.00 0.00 34.13 32.80 1p7m s GLU 2 CO 0.00 0.72 1.58 0.00 -0.56 0.00 0.00 175.26 177.00 1p7m h ARG 3 N 4.43 -1.12 0.00 4.30 2.47 -1.92 -0.73 114.38 121.81 1p7m h ARG 3 Ca -0.52 0.08 0.00 0.00 -1.26 0.00 0.00 59.98 58.28 1p7m h ARG 3 Cb 1.21 0.25 0.00 0.00 -1.65 0.00 0.00 29.97 29.79 1p7m h ARG 3 CO 0.63 -0.75 0.00 0.00 0.56 0.00 0.00 179.97 180.41 1p7m h GLY 5 N 0.00 0.00 -3.81 0.00 0.00 -1.93 -0.23 103.07 97.10 1p7m h GLY 5 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 47.33 46.94 1p7m h GLY 5 CO 0.00 0.00 0.49 1.87 0.00 0.00 0.00 176.54 178.90 1p7m n TRP 6 N -3.77 2.73 0.00 5.60 -0.00 -1.26 -4.36 117.44 116.38 1p7m n TRP 6 Ca -0.01 -1.55 0.00 0.00 -0.00 0.00 0.00 57.50 55.94 1p7m n TRP 6 Cb 0.19 -0.83 0.00 0.00 -0.00 0.00 0.00 31.31 30.68 1p7m n TRP 6 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 177.69 179.24 1p7m n VAL 7 N -0.70 0.00 1.71 5.87 3.14 -0.12 -4.77 118.33 123.46 1p7m n VAL 7 Ca 0.50 0.00 0.15 0.00 -2.96 0.00 0.00 64.34 62.04 1p7m n VAL 7 Cb 1.52 -0.05 0.85 0.00 -1.06 0.00 0.00 33.84 35.11 1p7m n VAL 7 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1p7m n SER 8 N -0.51 0.00 -0.11 6.55 7.64 -1.09 -3.36 113.62 122.74 1p7m n SER 8 Ca 0.00 -0.58 -0.07 0.00 1.01 0.00 0.00 58.87 59.23 1p7m n SER 8 Cb 0.03 -0.14 0.10 0.00 -1.01 0.00 0.00 64.21 63.19 1p7m n SER 8 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1p7m h GLN 9 N 0.00 0.83 -2.09 1.43 4.20 -1.86 -3.46 115.11 114.16 1p7m h GLN 9 Ca 0.00 -0.28 0.12 0.00 0.06 0.00 0.00 58.65 58.55 1p7m h GLN 9 Cb 0.14 -0.07 -0.17 0.00 0.30 0.00 0.00 27.48 27.68 1p7m h GLN 9 CO 0.00 0.90 0.54 0.34 -0.67 0.00 0.00 178.83 179.94 1p7m s ASP 10 N -6.69 -0.34 0.31 1.46 -1.08 -1.21 -5.17 116.67 103.95 1p7m s ASP 10 Ca -0.10 0.05 0.00 0.00 -0.52 0.00 0.00 52.55 51.98 1p7m s ASP 10 Cb 0.14 0.34 0.00 0.00 -1.46 0.00 0.00 42.92 41.94 1p7m s ASP 10 CO 0.83 -0.54 0.00 -0.81 0.52 0.00 0.00 175.17 175.17 1p7m n PRO 11 N -0.10 0.09 0.00 4.34 -0.04 -1.26 -3.78 135.00 134.24 1p7m n PRO 11 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 1p7m n PRO 11 Cb 0.61 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.07 1p7m n PRO 11 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1p7m n LEU 12 N 0.00 0.00 -0.25 1.53 4.32 -1.26 -4.27 117.00 117.07 1p7m n LEU 12 Ca 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 56.01 56.00 1p7m n LEU 12 Cb 0.00 0.00 0.24 0.00 -1.62 0.00 0.00 43.42 42.04 1p7m n LEU 12 CO 0.00 0.00 1.25 1.88 -1.22 0.00 0.00 177.39 179.30 1p7m h TYR 13 N 0.00 0.99 -0.65 -1.77 0.05 -1.89 -1.95 116.97 111.76 1p7m h TYR 13 Ca 0.00 0.02 0.08 0.00 0.05 0.00 0.00 58.73 58.89 1p7m h TYR 13 Cb 0.00 -0.33 -0.07 0.00 1.01 0.00 0.00 36.73 37.34 1p7m h TYR 13 CO 0.00 0.60 0.30 0.82 -1.05 0.00 0.00 178.16 178.83 1p7m h ILE 14 N 1.04 0.85 -0.23 -2.88 5.03 -1.78 0.90 117.51 120.44 1p7m h ILE 14 Ca 0.31 -0.18 -0.01 0.00 -0.12 0.00 0.00 64.86 64.86 1p7m h ILE 14 Cb -0.04 0.26 -0.01 0.00 -3.03 0.00 0.00 36.82 34.00 1p7m h ILE 14 CO -0.08 0.10 0.12 0.00 -0.68 0.00 0.00 178.15 177.61 1p7m h ALA 15 N 1.40 0.30 -0.41 1.87 0.00 -1.72 -2.41 119.26 118.29 1p7m h ALA 15 Ca 0.32 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 55.08 1p7m h ALA 15 Cb 0.33 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1p7m h ALA 15 CO -0.26 -0.16 -0.06 -0.92 0.00 0.00 0.00 179.25 177.85 1p7m h TYR 16 N 0.26 0.74 -0.60 0.00 3.20 -1.01 -2.13 116.97 117.43 1p7m h TYR 16 Ca 0.08 -0.11 0.02 0.00 3.14 0.00 0.00 58.73 61.86 1p7m h TYR 16 Cb 0.08 -0.20 -0.04 0.00 1.54 0.00 0.00 36.73 38.12 1p7m h TYR 16 CO -0.03 0.73 0.37 1.25 -1.64 0.00 0.00 178.16 178.84 1p7m h HIS 17 N 0.64 0.70 -0.03 -3.82 2.76 0.13 -2.86 115.15 112.67 1p7m h HIS 17 Ca 0.12 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.31 1p7m h HIS 17 Cb 0.49 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 29.22 1p7m h HIS 17 CO 0.02 0.41 -0.05 -0.25 -1.30 0.00 0.00 177.93 176.76 1p7m n ASP 18 N -4.72 2.57 -0.10 3.26 8.00 -0.98 -3.44 116.55 121.14 1p7m n ASP 18 Ca 0.05 -1.83 -0.11 0.00 0.71 0.00 0.00 54.79 53.61 1p7m n ASP 18 Cb 0.07 0.05 -0.16 0.00 -0.02 0.00 0.00 41.12 41.06 1p7m n ASP 18 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1p7m n ASN 19 N 0.95 0.13 -0.64 -2.24 2.04 -0.81 -4.80 115.26 109.90 1p7m n ASN 19 Ca 0.15 -0.01 -0.02 0.00 -0.44 0.00 0.00 54.58 54.26 1p7m n ASN 19 Cb 0.53 0.90 -0.02 0.00 -2.53 0.00 0.00 39.78 38.67 1p7m n ASN 19 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 1p7m n GLU 20 N -2.78 0.00 -3.22 -3.83 1.02 -1.09 -4.78 120.64 105.94 1p7m n GLU 20 Ca -0.34 -0.28 -0.38 0.00 -0.02 0.00 0.00 57.16 56.14 1p7m n GLU 20 Cb 1.15 0.14 -0.02 0.00 -0.02 0.00 0.00 31.44 32.69 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 0.00 3.15 0.00 -0.32 -0.00 -1.15 -4.54 117.44 114.58 1p7m n TRP 21 Ca -0.08 -3.29 0.00 0.00 -0.00 0.00 0.00 57.50 54.13 1p7m n TRP 21 Cb 0.55 -1.12 0.00 0.00 -0.00 0.00 0.00 31.31 30.74 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 1.47 0.90 0.01 5.87 0.00 -1.24 -4.87 105.19 107.33 1p7m n GLY 22 Ca 0.26 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.30 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 -1.30 0.06 -3.16 1.61 0.24 -1.26 -4.82 118.33 109.70 1p7m n VAL 23 Ca 0.00 -0.14 -0.32 0.00 -2.04 0.00 0.00 64.34 61.84 1p7m n VAL 23 Cb 0.00 0.15 -0.06 0.00 -1.47 0.00 0.00 33.84 32.47 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 -2.33 3.94 0.45 7.34 0.04 -1.26 -5.05 135.00 138.13 1p7m s PRO 24 Ca -0.02 0.58 -0.05 0.00 0.04 0.00 0.00 61.00 61.55 1p7m s PRO 24 Cb 0.03 -2.47 -0.04 0.00 0.04 0.00 0.00 34.50 32.07 1p7m s PRO 24 CO 0.22 0.17 0.75 -2.00 0.04 0.00 0.00 177.00 176.18 1p7m s GLU 25 N -3.04 3.56 -0.19 4.56 2.12 -1.26 -3.91 118.70 120.54 1p7m s GLU 25 Ca 0.53 0.16 -0.25 0.00 0.36 0.00 0.00 54.97 55.77 1p7m s GLU 25 Cb -0.10 -2.42 -0.01 0.00 0.26 0.00 0.00 34.13 31.86 1p7m s GLU 25 CO 0.19 -0.14 0.85 0.95 -0.54 0.00 0.00 175.26 176.58 1p7m s THR 26 N -2.64 4.85 0.37 -1.70 -4.23 -1.24 -4.92 115.64 106.13 1p7m s THR 26 Ca 0.47 1.66 0.08 0.00 -1.18 0.00 0.00 61.69 62.71 1p7m s THR 26 Cb -0.10 -4.15 -0.02 0.00 1.34 0.00 0.00 72.50 69.57 1p7m s THR 26 CO 0.42 -0.01 0.34 -0.62 -0.54 0.00 0.00 174.62 174.21 1p7m s ASP 27 N 1.20 5.22 0.12 3.99 -1.08 -1.26 -4.77 116.67 120.08 1p7m s ASP 27 Ca 0.38 -0.59 -0.09 0.00 -0.52 0.00 0.00 52.55 51.73 1p7m s ASP 27 Cb -0.16 -0.80 -0.12 0.00 -1.46 0.00 0.00 42.92 40.38 1p7m s ASP 27 CO 0.11 -0.49 1.31 0.28 0.52 0.00 0.00 175.17 176.89 1p7m h SER 28 N 1.13 0.76 0.01 -0.34 0.02 -1.96 -3.18 113.55 110.00 1p7m h SER 28 Ca -0.43 -0.55 -0.00 0.00 -0.84 0.00 0.00 61.79 59.97 1p7m h SER 28 Cb 1.26 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.57 1p7m h SER 28 CO 0.57 1.33 -0.01 0.11 -1.14 0.00 0.00 176.83 177.70 1p7m h LYS 29 N 0.39 -0.02 -0.76 3.45 1.79 -2.00 -3.06 116.57 116.36 1p7m h LYS 29 Ca -0.07 0.00 0.06 0.00 -2.18 0.00 0.00 60.65 58.46 1p7m h LYS 29 Cb 1.49 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 32.10 1p7m h LYS 29 CO 0.16 0.66 0.50 0.87 -1.08 0.00 0.00 179.45 180.56 1p7m h LYS 30 N -0.72 0.81 -0.31 3.15 1.79 -1.99 -1.03 116.57 118.26 1p7m h LYS 30 Ca -0.00 -0.05 -0.09 0.00 -2.18 0.00 0.00 60.65 58.33 1p7m h LYS 30 Cb 0.69 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 31.14 1p7m h LYS 30 CO 0.00 0.53 -0.19 -0.07 -1.08 0.00 0.00 179.45 178.65 1p7m h LEU 31 N 0.83 0.56 -0.18 2.94 4.07 -1.62 0.78 115.31 122.70 1p7m h LEU 31 Ca 0.32 -0.18 -0.00 0.00 0.08 0.00 0.00 57.88 58.10 1p7m h LEU 31 Cb 0.20 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 41.78 1p7m h LEU 31 CO -0.11 0.76 0.10 0.15 -1.08 0.00 0.00 178.44 178.27 1p7m h PHE 32 N 0.51 0.24 0.00 1.13 3.57 -1.08 -0.15 116.94 121.16 1p7m h PHE 32 Ca 0.08 -0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.46 1p7m h PHE 32 Cb 0.62 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.26 1p7m h PHE 32 CO 0.02 0.20 -0.56 1.05 -2.23 0.00 0.00 178.31 176.80 1p7m h GLU 33 N 0.20 0.00 0.06 1.11 4.11 -1.36 -2.93 114.58 115.78 1p7m h GLU 33 Ca 0.06 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.49 1p7m h GLU 33 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1p7m h GLU 33 CO -0.01 0.56 -0.03 1.98 0.07 0.00 0.00 179.01 181.58 1p7m h MET 34 N 0.00 -0.08 -0.41 1.06 4.05 -0.35 0.24 114.93 119.44 1p7m h MET 34 Ca -0.01 0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1p7m h MET 34 Cb 1.16 0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.96 1p7m h MET 34 CO 0.07 0.25 0.25 0.97 0.23 0.00 0.00 176.91 178.68 1p7m h ILE 35 N -0.42 1.12 0.08 1.77 6.09 -1.07 1.17 117.51 126.25 1p7m h ILE 35 Ca -0.01 -0.26 -0.00 0.00 -1.37 0.00 0.00 64.86 63.22 1p7m h ILE 35 Cb 0.37 0.53 0.00 0.00 0.47 0.00 0.00 36.82 38.20 1p7m h ILE 35 CO 0.01 0.12 -0.04 0.00 -3.07 0.00 0.00 178.15 175.18 1p7m h LEU 37 N -0.70 0.92 -1.42 0.00 3.38 -0.18 -2.62 115.31 114.68 1p7m h LEU 37 Ca -0.01 -0.30 -0.03 0.00 0.09 0.00 0.00 57.88 57.62 1p7m h LEU 37 Cb 0.56 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1p7m h LEU 37 CO 0.02 1.05 0.04 -0.08 0.09 0.00 0.00 178.44 179.55 1p7m h GLU 38 N 0.81 0.41 -0.54 1.13 4.57 0.13 -2.25 114.58 118.86 1p7m h GLU 38 Ca 0.13 -0.07 -0.03 0.00 -1.18 0.00 0.00 59.36 58.20 1p7m h GLU 38 Cb 0.67 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.17 1p7m h GLU 38 CO 0.05 0.42 0.19 0.78 -1.18 0.00 0.00 179.01 179.27 1p7m h GLY 39 N 0.68 0.84 2.00 1.92 0.00 -0.94 -2.24 103.07 105.33 1p7m h GLY 39 Ca 0.10 -0.43 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 1p7m h GLY 39 CO 0.00 0.41 -0.10 1.46 0.00 0.00 0.00 176.54 178.31 1p7m h GLN 40 N 0.77 0.00 0.00 4.80 7.50 -1.36 -2.16 115.11 124.66 1p7m h GLN 40 Ca 0.18 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.33 1p7m h GLN 40 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.72 1p7m h GLN 40 CO -0.01 0.10 0.00 0.00 -1.50 0.00 0.00 178.83 177.42 1p7m n GLN 41 N -3.92 0.22 -1.63 1.46 10.64 -0.84 -4.13 117.38 119.19 1p7m n GLN 41 Ca -0.02 0.10 -0.43 0.00 -1.83 0.00 0.00 57.00 54.82 1p7m n GLN 41 Cb 0.19 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 28.04 1p7m n GLN 41 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1p7m s ALA 42 N -2.29 2.93 0.00 2.61 0.00 -0.81 -1.17 121.76 123.03 1p7m s ALA 42 Ca 0.12 0.90 0.00 0.00 0.00 0.00 0.00 51.96 52.98 1p7m s ALA 42 Cb 0.07 -4.02 0.00 0.00 0.00 0.00 0.00 23.12 19.17 1p7m s ALA 42 CO 0.13 -2.51 0.00 0.41 0.00 0.00 0.00 175.76 173.80 1p7m n GLY 43 N 5.46 1.03 3.63 0.00 0.00 -1.26 -4.93 105.19 109.11 1p7m n GLY 43 Ca 0.27 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.97 1p7m n GLY 43 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1p7m s LEU 44 N 0.00 3.28 0.60 0.99 2.96 -0.31 -5.09 118.68 121.11 1p7m s LEU 44 Ca 0.00 -0.11 -0.19 0.00 -0.22 0.00 0.00 54.13 53.61 1p7m s LEU 44 Cb 0.00 -1.89 -0.03 0.00 0.50 0.00 0.00 46.19 44.77 1p7m s LEU 44 CO 0.00 0.27 1.23 -0.44 -1.32 0.00 0.00 176.35 176.09 1p7m s SER 45 N -1.52 5.06 0.11 3.68 0.01 -1.26 -4.47 113.70 115.31 1p7m s SER 45 Ca 0.18 2.45 -0.10 0.00 1.31 0.00 0.00 55.95 59.79 1p7m s SER 45 Cb -0.11 -2.60 -0.14 0.00 0.21 0.00 0.00 66.02 63.37 1p7m s SER 45 CO 0.09 -1.68 1.28 -0.25 0.41 0.00 0.00 173.24 173.08 1p7m h TRP 46 N 0.82 0.91 -0.58 2.43 2.91 -1.96 -2.99 115.95 117.48 1p7m h TRP 46 Ca -0.51 -0.45 0.00 0.00 1.13 0.00 0.00 58.89 59.06 1p7m h TRP 46 Cb 1.31 -0.12 -0.03 0.00 -0.51 0.00 0.00 29.16 29.81 1p7m h TRP 46 CO 0.45 1.28 0.38 0.97 -1.03 0.00 0.00 178.44 180.49 1p7m h ILE 47 N 0.39 1.15 -0.54 2.65 -0.00 -1.99 0.20 117.51 119.37 1p7m h ILE 47 Ca -0.08 -0.29 -0.00 0.00 -0.00 0.00 0.00 64.86 64.48 1p7m h ILE 47 Cb 1.54 0.30 -0.03 0.00 -0.00 0.00 0.00 36.82 38.64 1p7m h ILE 47 CO 0.17 0.15 0.32 0.74 -0.00 0.00 0.00 178.15 179.53 1p7m h THR 48 N 0.79 1.17 0.00 2.19 2.02 -1.92 -0.55 112.91 116.61 1p7m h THR 48 Ca 0.21 -0.39 -0.05 0.00 0.77 0.00 0.00 66.41 66.95 1p7m h THR 48 Cb -0.08 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 66.77 1p7m h THR 48 CO -0.04 0.17 -0.25 0.58 0.37 0.00 0.00 175.52 176.35 1p7m h VAL 49 N 0.73 0.73 0.14 3.16 2.07 -1.00 -2.91 116.25 119.16 1p7m h VAL 49 Ca 0.19 -1.07 -0.01 0.00 0.82 0.00 0.00 66.70 66.64 1p7m h VAL 49 Cb 0.00 1.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 1p7m h VAL 49 CO -0.04 0.25 -0.07 0.25 0.02 0.00 0.00 177.57 177.99 1p7m h LEU 50 N 0.00 -0.16 -0.55 2.57 6.46 0.95 1.14 115.31 125.72 1p7m h LEU 50 Ca -0.00 -0.15 0.00 0.00 -0.12 0.00 0.00 57.88 57.61 1p7m h LEU 50 Cb 0.65 0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.59 1p7m h LEU 50 CO 0.03 0.06 0.35 0.11 -0.62 0.00 0.00 178.44 178.38 1p7m h LYS 51 N -0.37 0.74 0.00 1.25 1.57 -1.39 0.18 116.57 118.54 1p7m h LYS 51 Ca -0.02 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1p7m h LYS 51 Cb 0.30 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1p7m h LYS 51 CO 0.03 0.50 0.00 1.63 -0.57 0.00 0.00 179.45 181.05 1p7m n LYS 52 N -4.68 0.02 -0.12 3.15 5.02 -1.11 -2.69 118.16 117.75 1p7m n LYS 52 Ca 0.03 0.16 -0.10 0.00 -2.02 0.00 0.00 58.31 56.39 1p7m n LYS 52 Cb 0.03 -1.53 -0.02 0.00 -0.02 0.00 0.00 35.03 33.49 1p7m n LYS 52 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 1p7m h ARG 53 N 0.00 0.56 -0.19 1.97 2.43 0.45 1.42 114.38 121.01 1p7m h ARG 53 Ca 0.00 -0.14 -0.10 0.00 -0.81 0.00 0.00 59.98 58.93 1p7m h ARG 53 Cb 0.37 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.85 1p7m h ARG 53 CO 0.00 0.61 -0.28 0.93 -1.51 0.00 0.00 179.97 179.72 1p7m h GLU 54 N 0.41 0.53 -0.37 0.20 3.07 -1.41 -2.84 114.58 114.17 1p7m h GLU 54 Ca 0.11 -0.32 -0.16 0.00 -0.50 0.00 0.00 59.36 58.49 1p7m h GLU 54 Cb 0.30 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.24 1p7m h GLU 54 CO 0.00 0.91 -0.40 -0.91 -1.40 0.00 0.00 179.01 177.21 1p7m h ASN 55 N 0.20 0.99 -0.23 1.42 2.35 -1.41 -2.87 115.58 116.02 1p7m h ASN 55 Ca 0.02 -0.46 0.02 0.00 -0.55 0.00 0.00 56.30 55.32 1p7m h ASN 55 Cb 0.86 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.93 1p7m h ASN 55 CO 0.07 1.26 0.11 0.22 -1.65 0.00 0.00 177.43 177.43 1p7m h TYR 56 N 0.75 0.20 0.00 1.19 3.20 0.19 -1.54 116.97 120.96 1p7m h TYR 56 Ca 0.06 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.89 1p7m h TYR 56 Cb 1.00 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.21 1p7m h TYR 56 CO 0.06 0.11 -0.21 0.07 -1.64 0.00 0.00 178.16 176.55 1p7m h ARG 57 N 0.23 0.00 -0.60 1.82 -0.00 -1.53 -2.38 114.38 111.93 1p7m h ARG 57 Ca 0.10 0.00 -0.04 0.00 -0.00 0.00 0.00 59.98 60.04 1p7m h ARG 57 Cb 0.03 0.00 -0.03 0.00 -0.00 0.00 0.00 29.97 29.98 1p7m h ARG 57 CO -0.07 0.21 0.23 0.00 -0.00 0.00 0.00 179.97 180.34 1p7m h ALA 58 N 1.79 0.78 -0.04 0.08 0.00 -1.06 3.11 119.26 123.91 1p7m h ALA 58 Ca -0.00 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 1p7m h ALA 58 Cb 0.45 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.01 1p7m h ALA 58 CO 0.03 0.40 -0.39 0.00 0.00 0.00 0.00 179.25 179.28 1p7m h PHE 60 N -0.18 0.42 -4.65 0.00 -1.00 -1.37 -3.46 116.94 106.69 1p7m h PHE 60 Ca -0.04 -0.30 -0.07 0.00 2.81 0.00 0.00 57.97 60.37 1p7m h PHE 60 Cb 1.07 -0.02 -0.00 0.00 3.61 0.00 0.00 35.95 40.61 1p7m h PHE 60 CO 0.14 1.23 -0.09 0.72 -1.61 0.00 0.00 178.31 178.70 1p7m n HIS 61 N -4.24 -1.83 -0.21 -0.55 8.25 1.03 -4.74 115.22 112.93 1p7m n HIS 61 Ca -0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.33 1p7m n HIS 61 Cb 0.73 -1.48 0.11 0.00 1.12 0.00 0.00 29.99 30.47 1p7m n HIS 61 CO 0.00 0.00 0.00 -0.56 0.64 0.00 0.00 176.34 176.42 1p7m h GLN 62 N 0.00 0.43 -1.67 -0.41 3.07 -1.90 -3.44 115.11 111.20 1p7m h GLN 62 Ca -0.08 -0.03 -0.05 0.00 0.09 0.00 0.00 58.65 58.58 1p7m h GLN 62 Cb 1.05 -0.10 -0.02 0.00 0.08 0.00 0.00 27.48 28.50 1p7m h GLN 62 CO 0.10 0.29 -0.05 1.19 0.09 0.00 0.00 178.83 180.44 1p7m n PHE 63 N -4.97 -0.77 -3.64 0.06 3.01 -1.26 -4.75 117.46 105.13 1p7m n PHE 63 Ca 0.09 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.50 1p7m n PHE 63 Cb 0.27 -1.26 -0.07 0.00 -0.01 0.00 0.00 39.48 38.41 1p7m n PHE 63 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1p7m s ASP 64 N -1.13 -0.33 0.21 4.37 1.01 -1.26 -5.05 116.67 114.48 1p7m s ASP 64 Ca 0.00 0.60 -0.01 0.00 0.71 0.00 0.00 52.55 53.84 1p7m s ASP 64 Cb 0.00 0.78 0.16 0.00 1.01 0.00 0.00 42.92 44.87 1p7m s ASP 64 CO 0.00 -0.10 1.53 1.55 0.21 0.00 0.00 175.17 178.36 1p7m h PRO 65 N 4.46 0.48 -0.56 8.23 0.13 -1.97 -2.96 132.00 139.81 1p7m h PRO 65 Ca -0.28 -0.30 -0.09 0.00 -0.87 0.00 0.00 66.00 64.46 1p7m h PRO 65 Cb 1.18 0.03 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 1p7m h PRO 65 CO 0.16 0.90 0.01 0.28 -0.23 0.00 0.00 178.00 179.12 1p7m h VAL 66 N 0.37 1.26 -0.32 1.56 2.07 -1.95 -1.57 116.25 117.67 1p7m h VAL 66 Ca 0.01 -1.10 -0.04 0.00 0.82 0.00 0.00 66.70 66.39 1p7m h VAL 66 Cb 1.07 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 1p7m h VAL 66 CO 0.10 0.39 0.05 0.11 0.02 0.00 0.00 177.57 178.24 1p7m h LYS 67 N 0.86 0.48 -0.38 1.57 6.56 -1.88 -2.17 116.57 121.61 1p7m h LYS 67 Ca 0.16 -0.08 -0.12 0.00 -1.06 0.00 0.00 60.65 59.55 1p7m h LYS 67 Cb 0.52 -0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 32.10 1p7m h LYS 67 CO 0.03 0.47 -0.23 0.28 -2.06 0.00 0.00 179.45 177.94 1p7m h VAL 68 N 0.47 1.28 0.00 0.50 2.07 -1.26 -1.98 116.25 117.33 1p7m h VAL 68 Ca 0.11 -1.37 0.00 0.00 0.82 0.00 0.00 66.70 66.25 1p7m h VAL 68 Cb 0.24 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 1p7m h VAL 68 CO 0.00 0.46 0.00 0.00 0.02 0.00 0.00 177.57 178.05 1p7m n ALA 69 N -2.49 1.53 1.03 1.67 0.00 -0.64 -1.00 120.51 120.60 1p7m n ALA 69 Ca -0.02 0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.64 1p7m n ALA 69 Cb 0.45 -1.35 0.28 0.00 0.00 0.00 0.00 19.45 18.82 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 -1.75 3.46 -2.53 0.00 0.00 -0.77 -4.76 120.51 114.17 1p7m n ALA 70 Ca 0.01 -0.35 -0.43 0.00 0.00 0.00 0.00 53.44 52.68 1p7m n ALA 70 Cb 0.18 -1.13 -0.02 0.00 0.00 0.00 0.00 19.45 18.48 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 -2.95 3.84 0.66 0.00 -1.94 -0.17 -5.00 119.30 113.74 1p7m s MET 71 Ca 0.12 0.93 0.04 0.00 -1.71 0.00 0.00 55.69 55.07 1p7m s MET 71 Cb 0.18 -3.87 0.11 0.00 2.01 0.00 0.00 34.83 33.25 1p7m s MET 71 CO 0.68 -1.21 0.90 -0.65 -0.01 0.00 0.00 175.02 174.73 1p7m s GLN 72 N 4.24 1.95 0.55 2.03 -0.21 -1.26 -4.92 119.66 122.03 1p7m s GLN 72 Ca 0.51 -1.33 0.26 0.00 0.02 0.00 0.00 55.36 54.82 1p7m s GLN 72 Cb -0.12 -2.47 1.45 0.00 1.00 0.00 0.00 33.01 32.87 1p7m s GLN 72 CO 0.25 -1.19 2.01 0.93 -2.12 0.00 0.00 175.29 175.17 1p7m h GLU 73 N -0.22 0.00 -0.71 2.91 5.08 -1.99 -0.05 114.58 119.59 1p7m h GLU 73 Ca -0.34 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 57.98 1p7m h GLU 73 Cb 1.28 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.49 1p7m h GLU 73 CO 0.40 0.00 0.29 1.49 -1.00 0.00 0.00 179.01 180.19 1p7m h GLU 74 N 0.00 1.06 -0.57 2.33 4.81 -1.99 -2.04 114.58 118.17 1p7m h GLU 74 Ca 0.20 -0.19 -0.08 0.00 -0.13 0.00 0.00 59.36 59.16 1p7m h GLU 74 Cb 0.87 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.06 1p7m h GLU 74 CO -0.00 0.87 0.03 -0.44 -0.73 0.00 0.00 179.01 178.74 1p7m h ASP 75 N 1.01 0.94 0.32 1.04 3.32 -1.36 -2.60 116.42 119.10 1p7m h ASP 75 Ca 0.24 -0.24 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 1p7m h ASP 75 Cb 0.20 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1p7m h ASP 75 CO -0.02 0.98 -0.41 -0.37 -1.72 0.00 0.00 179.24 177.70 1p7m h VAL 76 N 0.90 1.31 -0.60 -1.35 -1.51 -1.29 -2.17 116.25 111.53 1p7m h VAL 76 Ca 0.17 -1.48 -0.09 0.00 -1.23 0.00 0.00 66.70 64.07 1p7m h VAL 76 Cb 0.49 1.72 -0.02 0.00 -2.13 0.00 0.00 31.29 31.35 1p7m h VAL 76 CO 0.02 0.43 0.01 -0.33 -1.23 0.00 0.00 177.57 176.47 1p7m h GLU 77 N 0.11 1.05 -0.09 5.19 5.08 -0.99 -0.37 114.58 124.56 1p7m h GLU 77 Ca 0.01 -0.33 -0.22 0.00 -1.00 0.00 0.00 59.36 57.82 1p7m h GLU 77 Cb 0.78 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.94 1p7m h GLU 77 CO 0.06 1.02 -0.81 0.07 -1.00 0.00 0.00 179.01 178.35 1p7m h ARG 78 N 0.97 0.71 -0.21 2.33 0.11 -1.34 -3.19 114.38 113.76 1p7m h ARG 78 Ca 0.17 -0.64 -0.07 0.00 0.10 0.00 0.00 59.98 59.54 1p7m h ARG 78 Cb 0.54 0.15 -0.01 0.00 1.11 0.00 0.00 29.97 31.76 1p7m h ARG 78 CO 0.03 1.24 -0.18 -0.07 0.10 0.00 0.00 179.97 181.09 1p7m h LEU 79 N 0.40 0.34 -1.97 0.08 3.38 -1.30 -2.48 115.31 113.76 1p7m h LEU 79 Ca -0.07 -0.09 0.33 0.00 0.09 0.00 0.00 57.88 58.13 1p7m h LEU 79 Cb 1.45 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 42.06 1p7m h LEU 79 CO 0.16 0.55 0.82 1.62 0.09 0.00 0.00 178.44 181.68 1p7m h VAL 80 N 0.33 0.43 -0.02 1.22 3.04 -1.05 0.57 116.25 120.77 1p7m h VAL 80 Ca 0.06 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.74 1p7m h VAL 80 Cb 0.51 0.41 0.00 0.00 -2.01 0.00 0.00 31.29 30.21 1p7m h VAL 80 CO 0.03 0.00 -0.02 0.00 -1.01 0.00 0.00 177.57 176.57 1p7m n GLN 81 N -4.21 1.28 -2.61 4.17 10.64 -0.96 -4.41 117.38 121.28 1p7m n GLN 81 Ca 0.24 -1.42 -0.43 0.00 -1.83 0.00 0.00 57.00 53.57 1p7m n GLN 81 Cb 1.19 -1.31 -0.02 0.00 -0.86 0.00 0.00 30.24 29.24 1p7m n GLN 81 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1p7m s ASP 82 N -1.38 6.52 0.00 2.61 -1.08 0.20 -3.69 116.67 119.85 1p7m s ASP 82 Ca 0.18 0.24 0.00 0.00 -0.52 0.00 0.00 52.55 52.46 1p7m s ASP 82 Cb 0.13 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 39.05 1p7m s ASP 82 CO 0.21 -1.36 0.00 0.00 0.52 0.00 0.00 175.17 174.54 1p7m n ALA 83 N 8.11 0.00 -2.77 3.66 0.00 -1.26 -3.23 120.51 125.02 1p7m n ALA 83 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.41 1p7m n ALA 83 Cb 0.49 -0.14 0.02 0.00 0.00 0.00 0.00 19.45 19.82 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 -1.72 -0.00 0.00 0.00 0.00 -1.24 -4.94 105.19 97.29 1p7m n GLY 84 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 -3.98 0.00 0.00 -0.61 -5.35 -1.20 -4.87 119.36 103.35 1p7m n ILE 85 Ca -0.06 0.18 0.00 0.00 -0.27 0.00 0.00 62.75 62.60 1p7m n ILE 85 Cb 0.57 -0.38 0.00 0.00 -1.74 0.00 0.00 39.64 38.09 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 0.00 0.00 -1.33 7.28 3.06 -1.26 -5.08 119.36 122.03 1p7m n ILE 86 Ca 0.00 0.00 -0.33 0.00 -2.50 0.00 0.00 62.75 59.92 1p7m n ILE 86 Cb 0.00 0.00 0.10 0.00 0.54 0.00 0.00 39.64 40.28 1p7m n ILE 86 CO 0.00 0.00 0.00 -0.13 -2.50 0.00 0.00 176.55 173.92 1p7m s ARG 87 N -1.42 2.06 0.41 9.51 1.81 -1.26 -5.03 118.95 125.03 1p7m s ARG 87 Ca 0.00 1.59 0.08 0.00 -1.72 0.00 0.00 55.73 55.67 1p7m s ARG 87 Cb 0.00 -1.84 -0.02 0.00 -0.45 0.00 0.00 34.95 32.64 1p7m s ARG 87 CO 0.00 -1.86 0.37 -1.01 -0.68 0.00 0.00 175.30 172.12 1p7m s HIS 88 N -2.28 2.73 0.44 -0.53 3.76 -1.26 -4.87 115.29 113.28 1p7m s HIS 88 Ca 0.70 -0.47 0.16 0.00 -0.15 0.00 0.00 55.06 55.29 1p7m s HIS 88 Cb -0.25 -2.14 1.07 0.00 1.11 0.00 0.00 32.58 32.36 1p7m s HIS 88 CO 0.48 -0.10 1.95 0.00 -0.85 0.00 0.00 174.74 176.22 1p7m h ARG 89 N 1.04 0.37 0.49 1.40 3.08 -1.96 0.17 114.38 118.98 1p7m h ARG 89 Ca -0.42 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 59.59 1p7m h ARG 89 Cb 1.27 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.24 1p7m h ARG 89 CO 0.57 0.25 -0.24 0.78 -1.07 0.00 0.00 179.97 180.26 1p7m h GLY 90 N 0.39 -0.69 1.00 0.04 0.00 -1.97 -2.20 103.07 99.64 1p7m h GLY 90 Ca 0.33 0.26 -0.00 0.00 0.00 0.00 0.00 47.33 47.91 1p7m h GLY 90 CO -0.09 -0.25 0.44 1.70 0.00 0.00 0.00 176.54 178.34 1p7m h LYS 91 N -1.13 0.96 -0.37 4.80 1.63 -1.87 -2.65 116.57 117.94 1p7m h LYS 91 Ca -0.07 -0.08 0.04 0.00 -0.85 0.00 0.00 60.65 59.69 1p7m h LYS 91 Cb 0.54 -0.21 -0.04 0.00 -0.60 0.00 0.00 32.23 31.93 1p7m h LYS 91 CO 0.11 0.67 0.14 0.82 -3.45 0.00 0.00 179.45 177.74 1p7m h ILE 92 N 0.97 0.92 -0.76 2.00 2.04 -0.74 0.15 117.51 122.10 1p7m h ILE 92 Ca 0.26 -0.11 0.19 0.00 1.00 0.00 0.00 64.86 66.20 1p7m h ILE 92 Cb -0.06 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 36.57 1p7m h ILE 92 CO -0.05 0.06 0.52 0.06 0.00 0.00 0.00 178.15 178.74 1p7m h GLN 93 N 0.31 0.17 -0.32 2.37 -0.00 -1.04 0.49 115.11 117.09 1p7m h GLN 93 Ca 0.16 -0.01 -0.15 0.00 -0.00 0.00 0.00 58.65 58.66 1p7m h GLN 93 Cb 0.12 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.48 27.56 1p7m h GLN 93 CO -0.15 0.11 -0.38 0.00 -0.00 0.00 0.00 178.83 178.41 1p7m h ALA 94 N 1.64 0.71 -0.40 0.06 0.00 -0.53 -2.37 119.26 118.38 1p7m h ALA 94 Ca 0.37 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1p7m h ALA 94 Cb 1.19 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1p7m h ALA 94 CO -0.07 0.66 0.21 0.82 0.00 0.00 0.00 179.25 180.88 1p7m h ILE 95 N 0.63 1.16 -0.58 0.00 2.04 0.86 -1.90 117.51 119.72 1p7m h ILE 95 Ca 0.05 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 1p7m h ILE 95 Cb 0.94 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 1p7m h ILE 95 CO 0.09 0.17 0.30 0.40 0.00 0.00 0.00 178.15 179.11 1p7m h ILE 96 N 0.51 1.18 -0.70 -0.67 5.03 -1.21 -0.32 117.51 121.32 1p7m h ILE 96 Ca 0.14 -0.48 0.04 0.00 -0.12 0.00 0.00 64.86 64.44 1p7m h ILE 96 Cb 0.08 0.41 -0.04 0.00 -3.03 0.00 0.00 36.82 34.24 1p7m h ILE 96 CO -0.02 0.21 0.46 1.23 -0.68 0.00 0.00 178.15 179.35 1p7m h GLY 97 N 0.89 0.95 1.42 5.37 0.00 -0.82 0.11 103.07 111.00 1p7m h GLY 97 Ca 0.21 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 1p7m h GLY 97 CO -0.03 0.26 0.35 3.43 0.00 0.00 0.00 176.54 180.56 1p7m h ASN 98 N 0.81 0.68 -0.34 0.19 2.35 -0.51 -2.07 115.58 116.69 1p7m h ASN 98 Ca 0.29 -0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 56.00 1p7m h ASN 98 Cb 0.13 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.31 1p7m h ASN 98 CO -0.09 0.52 0.18 0.00 -1.65 0.00 0.00 177.43 176.39 1p7m h ALA 99 N 1.60 0.44 -0.93 -0.83 0.00 -0.61 -2.07 119.26 116.86 1p7m h ALA 99 Ca 0.21 -0.08 0.14 0.00 0.00 0.00 0.00 54.91 55.17 1p7m h ALA 99 Cb -0.04 -0.14 -0.09 0.00 0.00 0.00 0.00 17.79 17.52 1p7m h ALA 99 CO -0.04 -0.02 0.54 0.00 0.00 0.00 0.00 179.25 179.73 1p7m h ARG 100 N 0.42 0.78 -0.10 0.00 -0.00 -1.10 0.24 114.38 114.61 1p7m h ARG 100 Ca 0.12 -0.05 -0.06 0.00 -0.50 0.00 0.00 59.98 59.49 1p7m h ARG 100 Cb 0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 29.97 29.87 1p7m h ARG 100 CO -0.02 0.51 -0.21 0.00 0.00 0.00 0.00 179.97 180.26 1p7m h ALA 101 N 1.55 1.46 -0.53 0.04 0.00 -1.15 -1.17 119.26 119.46 1p7m h ALA 101 Ca 0.49 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 1p7m h ALA 101 Cb 0.60 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1p7m h ALA 101 CO -0.32 0.38 0.31 -0.92 0.00 0.00 0.00 179.25 178.71 1p7m h TYR 102 N 0.16 0.71 -0.54 0.00 3.20 0.05 0.77 116.97 121.32 1p7m h TYR 102 Ca 0.03 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 1p7m h TYR 102 Cb 0.47 -0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 1p7m h TYR 102 CO 0.01 0.50 0.27 -0.07 -1.64 0.00 0.00 178.16 177.22 1p7m h LEU 103 N 0.71 0.66 -1.22 2.82 -0.00 -0.80 -0.96 115.31 116.53 1p7m h LEU 103 Ca 0.19 -0.05 -0.06 0.00 -0.00 0.00 0.00 57.88 57.96 1p7m h LEU 103 Cb 0.00 -0.17 -0.02 0.00 -0.00 0.00 0.00 40.66 40.48 1p7m h LEU 103 CO -0.03 0.55 -0.06 1.56 -0.00 0.00 0.00 178.44 180.45 1p7m h GLN 104 N 0.75 0.46 -0.70 1.13 4.20 0.25 -1.18 115.11 120.02 1p7m h GLN 104 Ca 0.19 -0.11 -0.05 0.00 0.06 0.00 0.00 58.65 58.74 1p7m h GLN 104 Cb 0.06 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.74 1p7m h GLN 104 CO -0.03 0.54 0.24 1.98 -0.67 0.00 0.00 178.83 180.89 1p7m h MET 105 N 0.44 1.07 -0.68 1.46 4.05 0.33 -0.89 114.93 120.71 1p7m h MET 105 Ca 0.09 -0.22 -0.05 0.00 -0.28 0.00 0.00 59.70 59.24 1p7m h MET 105 Cb 0.39 -0.16 -0.03 0.00 -0.80 0.00 0.00 31.60 31.00 1p7m h MET 105 CO 0.02 0.91 0.24 1.05 0.23 0.00 0.00 176.91 179.36 1p7m h GLU 106 N 1.02 1.01 0.00 0.39 4.11 -0.92 0.48 114.58 120.67 1p7m h GLU 106 Ca 0.23 -0.19 -0.01 0.00 0.07 0.00 0.00 59.36 59.46 1p7m h GLU 106 Cb 0.27 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 1p7m h GLU 106 CO -0.01 0.85 -0.05 1.96 0.07 0.00 0.00 179.01 181.83 1p7m h GLN 107 N 0.99 0.00 0.00 1.06 4.20 -0.39 0.36 115.11 121.32 1p7m h GLN 107 Ca 0.22 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.93 1p7m h GLN 107 Cb 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1p7m h GLN 107 CO -0.01 0.05 -0.77 0.09 -0.67 0.00 0.00 178.83 177.51 1p7m n ASN 108 N -3.39 0.66 -1.29 1.46 5.03 0.12 -4.95 115.26 112.91 1p7m n ASN 108 Ca -0.02 -0.00 -0.12 0.00 0.87 0.00 0.00 54.58 55.31 1p7m n ASN 108 Cb 0.18 0.39 -0.02 0.00 -1.02 0.00 0.00 39.78 39.32 1p7m n ASN 108 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1p7m n GLY 109 N 1.35 0.18 2.92 7.41 0.00 0.13 -4.99 105.19 112.18 1p7m n GLY 109 Ca 0.03 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.35 1p7m n GLY 109 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1p7m s GLU 110 N -4.27 1.28 0.55 1.61 2.56 -1.09 -5.02 118.70 114.32 1p7m s GLU 110 Ca 0.00 -1.45 -0.18 0.00 0.00 0.00 0.00 54.97 53.34 1p7m s GLU 110 Cb 0.00 -2.70 -0.11 0.00 2.00 0.00 0.00 34.13 33.32 1p7m s GLU 110 CO 0.00 -0.89 0.28 -2.30 -0.56 0.00 0.00 175.26 171.79 1p7m n PRO 111 N 4.52 0.31 -0.15 4.30 -0.02 -1.26 -4.76 135.00 137.94 1p7m n PRO 111 Ca -0.01 0.12 -0.08 0.00 -2.02 0.00 0.00 63.50 61.51 1p7m n PRO 111 Cb 0.42 -1.44 0.01 0.00 -0.02 0.00 0.00 33.50 32.47 1p7m n PRO 111 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1p7m h PHE 112 N 0.14 0.62 0.00 6.00 3.57 -1.92 -2.40 116.94 122.94 1p7m h PHE 112 Ca -0.44 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 60.99 1p7m h PHE 112 Cb 1.42 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.95 1p7m h PHE 112 CO 0.28 0.45 -0.31 0.00 -2.23 0.00 0.00 178.31 176.50 1p7m h ALA 113 N 1.11 1.23 -0.22 2.41 0.00 -1.86 -3.09 119.26 118.84 1p7m h ALA 113 Ca 0.16 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1p7m h ALA 113 Cb 0.02 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1p7m h ALA 113 CO -0.03 0.39 -0.14 -0.44 0.00 0.00 0.00 179.25 179.03 1p7m h ASP 114 N 0.00 0.50 0.01 0.00 3.32 -1.77 -2.62 116.42 115.86 1p7m h ASP 114 Ca -0.00 -0.43 -0.16 0.00 0.02 0.00 0.00 57.03 56.46 1p7m h ASP 114 Cb 0.66 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 1p7m h ASP 114 CO 0.04 0.82 -0.53 2.19 -1.72 0.00 0.00 179.24 180.04 1p7m h PHE 115 N 0.17 0.70 0.18 4.55 -0.00 -1.53 -2.34 116.94 118.67 1p7m h PHE 115 Ca 0.04 -0.24 -0.01 0.00 -0.00 0.00 0.00 57.97 57.76 1p7m h PHE 115 Cb 0.65 -0.13 0.00 0.00 -0.00 0.00 0.00 35.95 36.47 1p7m h PHE 115 CO 0.07 0.97 -0.09 -0.39 -0.00 0.00 0.00 178.31 178.87 1p7m h VAL 116 N 0.43 0.92 -0.09 0.88 -1.51 -1.57 -1.70 116.25 113.61 1p7m h VAL 116 Ca 0.01 -0.55 0.03 0.00 -1.23 0.00 0.00 66.70 64.96 1p7m h VAL 116 Cb 1.07 1.25 -0.00 0.00 -2.13 0.00 0.00 31.29 31.47 1p7m h VAL 116 CO 0.10 0.12 0.19 -0.50 -1.23 0.00 0.00 177.57 176.25 1p7m h TRP 117 N -0.51 0.00 -0.05 5.19 4.06 -1.49 0.42 115.95 123.55 1p7m h TRP 117 Ca -0.02 0.00 -0.20 0.00 2.06 0.00 0.00 58.89 60.72 1p7m h TRP 117 Cb 0.39 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.55 1p7m h TRP 117 CO 0.01 0.00 -0.81 0.66 -3.56 0.00 0.00 178.44 174.74 1p7m h SER 118 N 0.00 0.54 0.43 -3.49 4.64 -0.75 0.84 113.55 115.76 1p7m h SER 118 Ca 0.04 -0.38 -0.08 0.00 -0.47 0.00 0.00 61.79 60.90 1p7m h SER 118 Cb 0.42 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 1p7m h SER 118 CO -0.00 1.15 -0.39 -0.26 -0.87 0.00 0.00 176.83 176.46 1p7m h PHE 119 N 0.28 0.00 -0.44 4.77 0.04 -0.37 -2.26 116.94 118.96 1p7m h PHE 119 Ca -0.05 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.72 1p7m h PHE 119 Cb 1.42 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.57 1p7m h PHE 119 CO 0.05 0.39 0.00 1.55 -0.60 0.00 0.00 178.31 179.70 1p7m n VAL 120 N -4.00 1.89 -3.58 -0.55 3.14 -1.12 -4.73 118.33 109.38 1p7m n VAL 120 Ca -0.02 -1.00 -0.25 0.00 -2.96 0.00 0.00 64.34 60.12 1p7m n VAL 120 Cb 0.43 -0.25 0.07 0.00 -1.06 0.00 0.00 33.84 33.02 1p7m n VAL 120 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1p7m n ASN 121 N 0.54 -6.14 -2.37 6.55 5.03 -0.85 -1.88 115.26 116.14 1p7m n ASN 121 Ca 0.20 -0.54 -0.01 0.00 0.87 0.00 0.00 54.58 55.10 1p7m n ASN 121 Cb 0.89 -4.85 -0.00 0.00 -1.02 0.00 0.00 39.78 34.80 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 -4.91 -1.88 -4.41 3.10 -0.00 0.29 -4.86 115.22 102.54 1p7m n HIS 122 Ca 0.00 0.00 -0.22 0.00 0.46 0.00 0.00 57.72 57.96 1p7m n HIS 122 Cb 0.56 -1.08 -0.13 0.00 -0.12 0.00 0.00 29.99 29.21 1p7m n HIS 122 CO 0.00 0.00 0.00 -0.65 0.46 0.00 0.00 176.34 176.15 1p7m s GLN 123 N -4.74 1.11 0.34 1.57 -1.52 -0.79 -5.09 119.66 110.53 1p7m s GLN 123 Ca 0.00 -0.93 -0.28 0.00 -1.95 0.00 0.00 55.36 52.19 1p7m s GLN 123 Cb 0.00 -1.21 -0.10 0.00 -0.22 0.00 0.00 33.01 31.48 1p7m s GLN 123 CO 0.00 0.30 1.29 -1.25 -0.25 0.00 0.00 175.29 175.37 1p7m s PRO 124 N -1.40 4.33 -0.18 2.91 0.04 -1.26 -4.90 135.00 134.54 1p7m s PRO 124 Ca 0.04 2.17 -0.05 0.00 0.04 0.00 0.00 61.00 63.20 1p7m s PRO 124 Cb -0.09 -3.03 -0.03 0.00 0.04 0.00 0.00 34.50 31.39 1p7m s PRO 124 CO 0.02 -0.20 0.01 -1.14 0.04 0.00 0.00 177.00 175.73 1p7m s GLN 125 N -1.83 3.74 -0.25 4.56 2.00 -0.89 -5.01 119.66 121.98 1p7m s GLN 125 Ca 0.50 -0.47 -0.10 0.00 -2.00 0.00 0.00 55.36 53.29 1p7m s GLN 125 Cb -0.39 -3.07 -0.04 0.00 0.80 0.00 0.00 33.01 30.31 1p7m s GLN 125 CO 0.51 0.17 0.14 -1.64 -0.50 0.00 0.00 175.29 173.97 1p7m s MET 126 N 0.60 3.93 -0.32 1.67 -1.94 -1.26 -0.62 119.30 121.36 1p7m s MET 126 Ca -0.00 -0.34 -0.20 0.00 -1.71 0.00 0.00 55.69 53.44 1p7m s MET 126 Cb -0.14 -3.50 -0.01 0.00 2.01 0.00 0.00 34.83 33.20 1p7m s MET 126 CO 0.02 -0.05 0.62 0.99 -0.01 0.00 0.00 175.02 176.59 1p7m s THR 127 N 1.35 4.93 -0.46 2.05 2.01 -0.53 -4.91 115.64 120.08 1p7m s THR 127 Ca 0.07 0.74 0.08 0.00 0.31 0.00 0.00 61.69 62.89 1p7m s THR 127 Cb -0.15 -4.02 0.54 0.00 0.01 0.00 0.00 72.50 68.88 1p7m s THR 127 CO 0.06 -0.20 1.39 0.00 -0.69 0.00 0.00 174.62 175.19 1p7m n GLN 128 N 5.92 3.31 -2.29 4.92 6.02 -1.26 -4.72 117.38 129.28 1p7m n GLN 128 Ca -0.01 -2.11 -0.39 0.00 -0.01 0.00 0.00 57.00 54.48 1p7m n GLN 128 Cb 0.49 -1.98 -0.02 0.00 1.02 0.00 0.00 30.24 29.75 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 -2.19 3.21 -0.11 -1.58 0.00 -1.26 -4.75 121.76 115.07 1p7m s ALA 129 Ca 0.37 0.99 0.12 0.00 0.00 0.00 0.00 51.96 53.44 1p7m s ALA 129 Cb 0.29 -3.39 -0.24 0.00 0.00 0.00 0.00 23.12 19.79 1p7m s ALA 129 CO 0.10 -0.51 0.42 2.41 0.00 0.00 0.00 175.76 178.18 1p7m n THR 130 N 0.23 1.55 -4.25 0.00 -1.04 -1.26 0.44 114.28 109.95 1p7m n THR 130 Ca 0.03 -0.80 -0.14 0.00 -2.04 0.00 0.00 64.05 61.11 1p7m n THR 130 Cb 0.46 -0.93 -0.10 0.00 -1.82 0.00 0.00 70.33 67.94 1p7m n THR 130 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1p7m s THR 131 N -2.56 0.86 0.38 12.58 -4.23 -1.26 -3.95 115.64 117.46 1p7m s THR 131 Ca -0.09 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.49 1p7m s THR 131 Cb 0.07 -2.03 0.29 0.00 1.34 0.00 0.00 72.50 72.17 1p7m s THR 131 CO 0.81 -0.57 1.98 -0.07 -0.54 0.00 0.00 174.62 176.23 1p7m h LEU 132 N 2.71 0.59 -2.39 4.79 3.38 -1.93 0.12 115.31 122.59 1p7m h LEU 132 Ca -0.37 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.60 1p7m h LEU 132 Cb 1.20 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 1p7m h LEU 132 CO 0.63 0.39 -0.01 0.28 0.09 0.00 0.00 178.44 179.82 1p7m h SER 133 N 0.68 0.00 0.24 -0.43 0.02 -2.00 1.00 113.55 113.05 1p7m h SER 133 Ca 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1p7m h SER 133 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 1p7m h SER 133 CO -0.08 0.01 -0.19 -0.62 -1.14 0.00 0.00 176.83 174.81 1p7m n GLU 134 N -3.85 0.89 -3.32 3.45 1.02 0.42 -4.81 120.64 114.44 1p7m n GLU 134 Ca -0.03 -0.48 -0.38 0.00 -0.02 0.00 0.00 57.16 56.25 1p7m n GLU 134 Cb 0.10 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 29.97 1p7m n GLU 134 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1p7m s ILE 135 N -2.44 5.17 0.41 -3.67 1.01 0.34 -4.78 121.20 117.24 1p7m s ILE 135 Ca 0.27 0.95 -0.23 0.00 0.00 0.00 0.00 60.65 61.64 1p7m s ILE 135 Cb 0.20 -3.81 -0.09 0.00 0.01 0.00 0.00 42.46 38.76 1p7m s ILE 135 CO 0.49 0.34 1.01 -2.16 0.00 0.00 0.00 174.94 174.62 1p7m s PRO 136 N 0.51 4.18 0.00 2.79 0.04 -1.26 -4.95 135.00 136.30 1p7m s PRO 136 Ca 0.26 1.36 0.19 0.00 0.04 0.00 0.00 61.00 62.85 1p7m s PRO 136 Cb -0.15 -2.41 0.53 0.00 0.04 0.00 0.00 34.50 32.50 1p7m s PRO 136 CO 0.11 -0.10 1.44 -2.37 0.04 0.00 0.00 177.00 176.11 1p7m n THR 137 N -0.28 0.95 -3.44 1.26 5.66 -1.26 -4.76 114.28 112.42 1p7m n THR 137 Ca 0.06 -0.98 -0.21 0.00 -3.05 0.00 0.00 64.05 59.87 1p7m n THR 137 Cb 0.51 0.54 -0.11 0.00 -1.55 0.00 0.00 70.33 69.72 1p7m n THR 137 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1p7m s SER 138 N -1.03 2.21 0.18 1.09 0.15 -1.26 -4.51 113.70 110.53 1p7m s SER 138 Ca 0.41 -1.03 0.07 0.00 0.70 0.00 0.00 55.95 56.09 1p7m s SER 138 Cb 0.21 0.23 -0.04 0.00 -1.71 0.00 0.00 66.02 64.72 1p7m s SER 138 CO 0.28 -0.39 0.05 0.42 1.20 0.00 0.00 173.24 174.80 1p7m s THR 139 N 2.16 3.97 0.31 6.45 -4.23 -1.26 -4.93 115.64 118.11 1p7m s THR 139 Ca 0.10 -1.33 0.06 0.00 -1.18 0.00 0.00 61.69 59.34 1p7m s THR 139 Cb -0.15 -3.02 0.30 0.00 1.34 0.00 0.00 72.50 70.98 1p7m s THR 139 CO -0.30 -0.12 1.81 1.55 -0.54 0.00 0.00 174.62 177.01 1p7m h PRO 140 N 2.56 0.78 -0.11 3.99 0.13 -1.99 0.56 132.00 137.91 1p7m h PRO 140 Ca -0.47 -0.05 -0.20 0.00 -0.87 0.00 0.00 66.00 64.41 1p7m h PRO 140 Cb 1.20 -0.18 0.01 0.00 0.13 0.00 0.00 31.00 32.17 1p7m h PRO 140 CO 0.60 0.52 -0.71 0.00 -0.23 0.00 0.00 178.00 178.17 1p7m h ALA 141 N 1.60 0.24 -0.62 -0.56 0.00 -1.95 -2.87 119.26 115.10 1p7m h ALA 141 Ca 0.54 -0.58 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1p7m h ALA 141 Cb 0.78 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1p7m h ALA 141 CO -0.31 0.57 0.07 0.66 0.00 0.00 0.00 179.25 180.23 1p7m h SER 142 N 0.36 1.00 -0.80 0.00 4.64 -1.44 -2.69 113.55 114.61 1p7m h SER 142 Ca -0.06 -0.25 -0.02 0.00 -0.47 0.00 0.00 61.79 61.00 1p7m h SER 142 Cb 1.36 -0.27 -0.04 0.00 -0.31 0.00 0.00 62.40 63.14 1p7m h SER 142 CO 0.15 1.01 0.42 -0.78 -0.87 0.00 0.00 176.83 176.76 1p7m h ASP 143 N 0.96 1.02 -0.26 4.97 3.58 0.04 -2.01 116.42 124.72 1p7m h ASP 143 Ca 0.19 -0.11 -0.04 0.00 0.42 0.00 0.00 57.03 57.49 1p7m h ASP 143 Cb 0.46 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.23 1p7m h ASP 143 CO 0.02 0.84 0.06 0.00 -2.88 0.00 0.00 179.24 177.27 1p7m h ALA 144 N 1.22 1.45 -0.18 -0.78 0.00 -1.26 -2.39 119.26 117.32 1p7m h ALA 144 Ca 0.28 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1p7m h ALA 144 Cb 0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1p7m h ALA 144 CO -0.04 0.40 0.08 -0.07 0.00 0.00 0.00 179.25 179.62 1p7m h LEU 145 N 0.51 0.24 -0.48 0.00 3.38 -1.05 0.98 115.31 118.88 1p7m h LEU 145 Ca 0.12 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1p7m h LEU 145 Cb 0.25 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1p7m h LEU 145 CO 0.00 0.31 0.29 0.28 0.09 0.00 0.00 178.44 179.41 1p7m h SER 146 N 0.16 0.58 -0.30 -0.43 0.02 -1.26 1.25 113.55 113.57 1p7m h SER 146 Ca 0.06 -0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 60.88 1p7m h SER 146 Cb 0.14 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 1p7m h SER 146 CO -0.01 0.46 -0.10 0.50 -1.14 0.00 0.00 176.83 176.55 1p7m h LYS 147 N 0.64 0.59 -0.39 3.45 3.64 -1.22 0.27 116.57 123.55 1p7m h LYS 147 Ca 0.17 -0.24 -0.11 0.00 -1.27 0.00 0.00 60.65 59.20 1p7m h LYS 147 Cb -0.01 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1p7m h LYS 147 CO -0.03 0.80 -0.19 0.00 -2.27 0.00 0.00 179.45 177.76 1p7m h ALA 148 N 0.77 0.55 -0.28 5.00 0.00 0.13 -0.98 119.26 124.45 1p7m h ALA 148 Ca 0.07 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 1p7m h ALA 148 Cb 0.60 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1p7m h ALA 148 CO 0.04 0.50 -0.11 -0.07 0.00 0.00 0.00 179.25 179.61 1p7m h LEU 149 N 0.63 0.59 -0.66 0.00 3.38 0.16 -1.30 115.31 118.11 1p7m h LEU 149 Ca 0.09 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 57.64 1p7m h LEU 149 Cb 0.75 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 1p7m h LEU 149 CO 0.06 0.85 0.33 0.50 0.09 0.00 0.00 178.44 180.26 1p7m h LYS 150 N 0.32 0.94 -0.07 1.13 3.64 -0.39 0.31 116.57 122.45 1p7m h LYS 150 Ca 0.07 -0.13 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 1p7m h LYS 150 Cb 0.61 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 1p7m h LYS 150 CO 0.04 0.74 -0.41 -0.22 -2.27 0.00 0.00 179.45 177.33 1p7m h LYS 151 N 0.91 0.15 -0.00 1.90 3.64 -1.08 -2.45 116.57 119.64 1p7m h LYS 151 Ca 0.23 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1p7m h LYS 151 Cb 0.10 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1p7m h LYS 151 CO -0.03 0.54 0.00 0.54 -2.27 0.00 0.00 179.45 178.23 1p7m n ARG 152 N -4.04 1.02 -0.41 1.90 1.74 -0.50 -4.83 116.66 111.55 1p7m n ARG 152 Ca -0.02 -0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.04 1p7m n ARG 152 Cb 0.46 -1.29 0.00 0.00 -1.02 0.00 0.00 32.46 30.61 1p7m n ARG 152 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1p7m n GLY 153 N 0.80 0.81 3.42 -0.13 0.00 -0.92 -4.62 105.19 104.54 1p7m n GLY 153 Ca 0.14 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 1p7m n GLY 153 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1p7m s PHE 154 N -2.00 3.24 0.63 1.61 0.08 0.10 -4.49 117.98 117.15 1p7m s PHE 154 Ca 0.00 -0.77 -0.01 0.00 0.12 0.00 0.00 56.93 56.27 1p7m s PHE 154 Cb 0.00 -2.48 0.07 0.00 -0.57 0.00 0.00 43.02 40.04 1p7m s PHE 154 CO 0.00 -0.60 0.88 0.15 -0.10 0.00 0.00 175.22 175.55 1p7m s LYS 155 N 1.61 2.20 -0.77 0.44 1.02 -1.26 -3.51 119.74 119.46 1p7m s LYS 155 Ca 0.03 -0.82 -0.01 0.00 0.02 0.00 0.00 55.97 55.19 1p7m s LYS 155 Cb -0.19 -2.39 -0.01 0.00 -0.52 0.00 0.00 37.83 34.73 1p7m s LYS 155 CO 0.08 -1.03 0.71 1.19 -0.92 0.00 0.00 175.35 175.37 1p7m n PHE 156 N -2.59 -2.86 -2.68 3.18 3.72 -1.26 -4.95 117.46 110.02 1p7m n PHE 156 Ca 0.10 1.09 -0.01 0.00 -0.05 0.00 0.00 57.45 58.58 1p7m n PHE 156 Cb 0.60 -4.00 0.08 0.00 -0.94 0.00 0.00 39.48 35.22 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 -1.98 0.50 -0.91 -4.37 0.24 -1.26 -4.54 118.33 106.01 1p7m n VAL 157 Ca -0.03 -1.68 -0.36 0.00 -2.04 0.00 0.00 64.34 60.23 1p7m n VAL 157 Cb 0.53 1.08 0.07 0.00 -1.47 0.00 0.00 33.84 34.05 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 -0.94 -3.19 0.31 7.63 0.00 -1.26 -4.22 105.19 103.52 1p7m n GLY 158 Ca -0.07 -0.47 0.13 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.28 0.81 -0.02 2.61 2.02 -1.94 0.18 112.91 115.28 1p7m h THR 159 Ca -0.44 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 66.59 1p7m h THR 159 Cb 1.36 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 68.66 1p7m h THR 159 CO 0.26 0.00 -0.68 0.71 0.37 0.00 0.00 175.52 176.18 1p7m h THR 160 N 0.00 1.45 -0.20 3.16 1.35 -1.85 -1.58 112.91 115.24 1p7m h THR 160 Ca 0.08 -2.24 -0.08 0.00 -0.55 0.00 0.00 66.41 63.62 1p7m h THR 160 Cb 0.35 2.19 -0.00 0.00 -1.73 0.00 0.00 68.15 68.96 1p7m h THR 160 CO -0.00 0.65 -0.19 0.40 -0.25 0.00 0.00 175.52 176.12 1p7m h ILE 161 N 0.08 1.33 -0.30 6.82 1.08 -0.93 -1.33 117.51 124.26 1p7m h ILE 161 Ca -0.01 -1.35 -0.08 0.00 -0.39 0.00 0.00 64.86 63.02 1p7m h ILE 161 Cb 1.21 1.77 -0.02 0.00 -3.07 0.00 0.00 36.82 36.71 1p7m h ILE 161 CO 0.10 0.41 -0.16 0.00 -0.69 0.00 0.00 178.15 177.80 1p7m h TYR 163 N 0.48 0.53 -0.10 0.00 5.03 -1.19 -2.45 116.97 119.26 1p7m h TYR 163 Ca 0.08 -0.18 -0.09 0.00 2.58 0.00 0.00 58.73 61.13 1p7m h TYR 163 Cb 0.56 -0.11 -0.01 0.00 1.55 0.00 0.00 36.73 38.72 1p7m h TYR 163 CO 0.02 0.85 -0.35 0.66 -1.32 0.00 0.00 178.16 178.02 1p7m h SER 164 N 0.06 0.21 -0.51 -2.11 4.64 -1.11 -2.72 113.55 112.01 1p7m h SER 164 Ca 0.02 -0.08 0.02 0.00 -0.47 0.00 0.00 61.79 61.29 1p7m h SER 164 Cb 0.79 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.78 1p7m h SER 164 CO 0.05 0.55 0.31 0.15 -0.87 0.00 0.00 176.83 177.02 1p7m h PHE 165 N 0.18 0.57 -0.53 4.77 3.57 -0.75 -0.88 116.94 123.87 1p7m h PHE 165 Ca 0.02 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.44 1p7m h PHE 165 Cb 0.70 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.24 1p7m h PHE 165 CO 0.01 0.32 -0.06 0.52 -2.23 0.00 0.00 178.31 176.88 1p7m h MET 166 N 0.61 0.94 -0.29 1.11 2.86 -1.16 0.41 114.93 119.41 1p7m h MET 166 Ca 0.21 -0.31 -0.03 0.00 -2.06 0.00 0.00 59.70 57.51 1p7m h MET 166 Cb 0.03 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 1p7m h MET 166 CO -0.10 0.97 0.08 0.37 1.06 0.00 0.00 176.91 179.29 1p7m h GLN 167 N 0.85 0.46 0.09 1.72 5.75 -1.12 -2.26 115.11 120.59 1p7m h GLN 167 Ca 0.15 -0.10 -0.27 0.00 -0.15 0.00 0.00 58.65 58.27 1p7m h GLN 167 Cb 0.59 -0.06 0.02 0.00 1.07 0.00 0.00 27.48 29.09 1p7m h GLN 167 CO 0.04 0.52 -1.16 0.00 -2.65 0.00 0.00 178.83 175.58 1p7m h ALA 168 N 0.91 0.12 -0.28 3.38 0.00 -1.10 -3.19 119.26 119.11 1p7m h ALA 168 Ca 0.09 -0.77 0.08 0.00 0.00 0.00 0.00 54.91 54.31 1p7m h ALA 168 Cb 0.26 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1p7m h ALA 168 CO -0.00 0.78 0.22 0.00 0.00 0.00 0.00 179.25 180.25 1p7m n GLY 170 N -1.54 0.65 0.28 0.00 0.00 -0.93 -3.70 105.19 99.95 1p7m n GLY 170 Ca 0.04 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.07 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 0.43 -8.16 0.99 3.38 -1.69 -3.41 115.31 106.84 1p7m h LEU 171 Ca 0.00 -0.06 -0.60 0.00 0.09 0.00 0.00 57.88 57.31 1p7m h LEU 171 Cb 0.00 -0.11 -0.33 0.00 0.09 0.00 0.00 40.66 40.31 1p7m h LEU 171 CO 0.00 0.46 -0.85 0.68 0.09 0.00 0.00 178.44 178.82 1p7m s VAL 172 N -5.08 1.60 0.32 1.22 -7.23 -1.22 -2.10 120.40 107.91 1p7m s VAL 172 Ca -0.07 -0.75 0.08 0.00 -1.81 0.00 0.00 61.98 59.42 1p7m s VAL 172 Cb 0.16 -1.41 -0.03 0.00 0.56 0.00 0.00 36.38 35.66 1p7m s VAL 172 CO 0.75 0.46 0.20 0.20 -0.31 0.00 0.00 175.10 176.40 1p7m s ASN 173 N 0.49 5.06 0.00 4.85 0.01 0.21 -4.77 114.94 120.79 1p7m s ASN 173 Ca -0.17 -0.56 0.00 0.00 -0.71 0.00 0.00 52.86 51.42 1p7m s ASN 173 Cb -0.17 -0.95 0.00 0.00 0.41 0.00 0.00 41.25 40.54 1p7m s ASN 173 CO 0.06 -0.25 0.00 0.47 -1.51 0.00 0.00 177.10 175.87 1p7m n ASP 174 N -1.23 -1.39 0.26 -1.22 8.00 -1.26 -1.45 116.55 118.26 1p7m n ASP 174 Ca -0.04 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.31 1p7m n ASP 174 Cb 0.60 -0.69 -0.09 0.00 -0.02 0.00 0.00 41.12 40.92 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 -1.23 -4.00 1.24 3.86 -1.90 -3.36 115.15 109.76 1p7m h HIS 175 Ca 0.00 0.01 -0.20 0.00 -1.16 0.00 0.00 60.37 59.02 1p7m h HIS 175 Cb 0.40 0.48 -0.19 0.00 1.06 0.00 0.00 27.41 29.16 1p7m h HIS 175 CO 0.00 -0.59 -0.71 0.14 0.86 0.00 0.00 177.93 177.63 1p7m s VAL 176 N -5.47 0.33 0.22 2.45 -7.23 -1.26 -4.65 120.40 104.79 1p7m s VAL 176 Ca -0.15 -1.22 -0.32 0.00 -1.81 0.00 0.00 61.98 58.48 1p7m s VAL 176 Cb 0.04 -0.72 -0.12 0.00 0.56 0.00 0.00 36.38 36.14 1p7m s VAL 176 CO 0.52 -0.58 1.68 -0.69 -0.31 0.00 0.00 175.10 175.72 1p7m s VAL 177 N -2.06 2.11 0.00 1.32 1.01 0.17 -1.26 120.40 121.69 1p7m s VAL 177 Ca -0.07 0.08 0.00 0.00 0.00 0.00 0.00 61.98 61.98 1p7m s VAL 177 Cb -0.06 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.27 1p7m s VAL 177 CO -0.02 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.69 1p7m n GLY 178 N 3.67 0.75 3.77 4.51 0.00 -1.26 -4.85 105.19 111.78 1p7m n GLY 178 Ca 0.14 -0.03 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.91 2.92 0.00 0.00 6.14 0.68 -4.63 117.35 119.56 1p7m s TYR 182 Ca 0.50 -3.02 0.00 0.00 0.64 0.00 0.00 57.07 55.19 1p7m s TYR 182 Cb 0.41 -2.45 0.00 0.00 0.42 0.00 0.00 41.96 40.33 1p7m s TYR 182 CO 0.04 -0.69 0.00 -0.35 0.64 0.00 0.00 175.55 175.20 1p7m n PRO 183 N 2.79 0.00 0.00 4.97 -0.04 -1.26 -4.67 135.00 136.79 1p7m n PRO 183 Ca 0.12 0.35 0.00 0.00 -0.04 0.00 0.00 63.50 63.93 1p7m n PRO 183 Cb 0.35 -0.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.97 1p7m n PRO 183 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1p7m n GLY 184 N 1.98 0.72 0.00 0.55 0.00 -1.26 -2.91 105.19 104.26 1p7m n GLY 184 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1p7m n GLY 184 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1p7m n ASN 185 N 1.48 2.45 -4.75 1.61 6.94 -1.26 -5.06 115.26 116.67 1p7m n ASN 185 Ca 0.00 0.00 -0.37 0.00 -0.02 0.00 0.00 54.58 54.19 1p7m n ASN 185 Cb 0.00 0.48 0.04 0.00 -2.36 0.00 0.00 39.78 37.94 1p7m n ASN 185 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1p7m s LYS 186 N -1.00 2.98 0.00 -3.83 -0.14 -1.15 -5.30 119.74 111.30 1p7m s LYS 186 Ca 0.00 1.94 0.00 0.00 -1.36 0.00 0.00 55.97 56.55 1p7m s LYS 186 Cb 0.00 -2.00 0.00 0.00 -1.68 0.00 0.00 37.83 34.15 1p7m s LYS 186 CO 0.00 -1.23 0.43 -0.35 -0.76 0.00 0.00 175.35 173.44