#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 3.29 0.36 0.03 2.56 -1.15 -4.82 118.70 118.97 1p7m s GLU 2 Ca 0.00 -0.31 0.01 0.00 0.00 0.00 0.00 54.97 54.67 1p7m s GLU 2 Cb 0.00 -3.03 -0.03 0.00 2.00 0.00 0.00 34.13 33.07 1p7m s GLU 2 CO 0.00 0.71 0.57 1.03 -0.56 0.00 0.00 175.26 177.00 1p7m s ARG 3 N -1.45 3.40 0.45 4.30 0.52 -1.26 -1.79 118.95 123.13 1p7m s ARG 3 Ca 0.20 -0.38 -0.23 0.00 -0.52 0.00 0.00 55.73 54.80 1p7m s ARG 3 Cb -0.12 -2.65 -0.10 0.00 0.52 0.00 0.00 34.95 32.60 1p7m s ARG 3 CO 0.10 0.08 0.99 0.00 0.02 0.00 0.00 175.30 176.49 1p7m h GLY 5 N 1.36 1.20 0.58 0.00 0.00 -2.00 -1.29 103.07 102.92 1p7m h GLY 5 Ca -0.45 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.45 1p7m h GLY 5 CO 0.56 0.40 -0.02 -2.67 0.00 0.00 0.00 176.54 174.80 1p7m n TRP 6 N -4.53 0.00 0.04 5.60 2.14 -1.26 -3.57 117.44 115.86 1p7m n TRP 6 Ca 0.10 0.00 -0.22 0.00 2.07 0.00 0.00 57.50 59.44 1p7m n TRP 6 Cb 0.05 -0.04 -0.14 0.00 -0.81 0.00 0.00 31.31 30.36 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 0.78 1.06 0.00 -1.67 2.07 -1.55 -3.23 116.25 113.71 1p7m h VAL 7 Ca 0.00 -2.46 0.00 0.00 0.82 0.00 0.00 66.70 65.06 1p7m h VAL 7 Cb 0.22 2.80 0.00 0.00 -1.52 0.00 0.00 31.29 32.78 1p7m h VAL 7 CO 0.00 0.76 0.00 -1.20 0.02 0.00 0.00 177.57 177.15 1p7m n SER 8 N -3.82 0.00 0.00 0.57 7.64 -1.10 -4.51 113.62 112.39 1p7m n SER 8 Ca -0.23 -1.41 0.00 0.00 1.01 0.00 0.00 58.87 58.24 1p7m n SER 8 Cb 0.96 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.16 1p7m n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p7m n GLN 9 N -0.75 0.00 -2.24 1.43 6.02 -1.22 -4.99 117.38 115.64 1p7m n GLN 9 Ca 0.11 0.00 -0.39 0.00 -0.01 0.00 0.00 57.00 56.71 1p7m n GLN 9 Cb 0.05 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.29 1p7m n GLN 9 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1p7m s ASP 10 N -1.00 6.48 0.45 1.08 2.15 -1.25 -4.92 116.67 119.67 1p7m s ASP 10 Ca 0.00 2.42 0.18 0.00 0.43 0.00 0.00 52.55 55.59 1p7m s ASP 10 Cb 0.00 -2.62 1.08 0.00 -0.30 0.00 0.00 42.92 41.08 1p7m s ASP 10 CO 0.00 -0.71 1.98 1.55 -0.17 0.00 0.00 175.17 177.82 1p7m h PRO 11 N 2.68 0.00 -0.49 4.34 0.13 -1.90 -2.88 132.00 133.87 1p7m h PRO 11 Ca -0.49 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.60 1p7m h PRO 11 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.34 1p7m h PRO 11 CO 0.63 0.20 0.13 -0.07 -0.23 0.00 0.00 178.00 178.66 1p7m h LEU 12 N 0.00 0.69 -0.84 1.56 3.38 -1.94 -2.90 115.31 115.26 1p7m h LEU 12 Ca -0.00 -0.11 0.09 0.00 0.09 0.00 0.00 57.88 57.95 1p7m h LEU 12 Cb 0.40 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.90 1p7m h LEU 12 CO 0.03 0.67 0.49 1.88 0.09 0.00 0.00 178.44 181.60 1p7m h TYR 13 N 0.72 0.90 -0.95 1.13 0.05 -1.75 -1.36 116.97 115.71 1p7m h TYR 13 Ca 0.16 0.03 0.13 0.00 0.05 0.00 0.00 58.73 59.10 1p7m h TYR 13 Cb 0.25 -0.28 -0.09 0.00 1.01 0.00 0.00 36.73 37.63 1p7m h TYR 13 CO 0.01 0.38 0.57 0.82 -1.05 0.00 0.00 178.16 178.89 1p7m h ILE 14 N 0.83 0.86 0.02 -2.88 5.03 -1.67 0.96 117.51 120.66 1p7m h ILE 14 Ca 0.40 -0.30 -0.00 0.00 -0.12 0.00 0.00 64.86 64.84 1p7m h ILE 14 Cb 0.35 -0.09 0.00 0.00 -3.03 0.00 0.00 36.82 34.05 1p7m h ILE 14 CO -0.24 0.16 -0.01 0.00 -0.68 0.00 0.00 178.15 177.38 1p7m h ALA 15 N 1.54 -0.03 -0.58 1.87 0.00 -1.37 0.70 119.26 121.39 1p7m h ALA 15 Ca 0.49 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 55.14 1p7m h ALA 15 Cb 0.55 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1p7m h ALA 15 CO -0.29 -0.36 -0.05 -0.92 0.00 0.00 0.00 179.25 177.62 1p7m h TYR 16 N -0.34 1.15 0.02 0.00 3.20 -1.05 -2.38 116.97 117.57 1p7m h TYR 16 Ca -0.00 -0.22 -0.00 0.00 3.14 0.00 0.00 58.73 61.65 1p7m h TYR 16 Cb 0.32 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.30 1p7m h TYR 16 CO 0.03 1.04 -0.01 1.25 -1.64 0.00 0.00 178.16 178.83 1p7m h HIS 17 N 0.95 -0.02 0.00 -3.82 2.76 0.99 -2.92 115.15 113.08 1p7m h HIS 17 Ca 0.16 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 1p7m h HIS 17 Cb 0.61 0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.58 1p7m h HIS 17 CO 0.04 0.44 0.00 -0.25 -1.30 0.00 0.00 177.93 176.86 1p7m n ASP 18 N -4.88 0.00 -0.06 3.26 8.00 0.23 -2.99 116.55 120.11 1p7m n ASP 18 Ca -0.08 -0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.26 1p7m n ASP 18 Cb 0.24 -0.30 -0.14 0.00 -0.02 0.00 0.00 41.12 40.90 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 -1.30 1.33 -2.51 -2.24 5.03 -0.90 -4.88 115.26 109.80 1p7m n ASN 19 Ca 0.10 0.12 -0.03 0.00 0.87 0.00 0.00 54.58 55.64 1p7m n ASN 19 Cb 0.19 -0.15 0.01 0.00 -1.02 0.00 0.00 39.78 38.80 1p7m n ASN 19 CO 0.00 0.00 0.00 -1.84 -1.83 0.00 0.00 177.26 173.59 1p7m n GLU 20 N -3.16 0.34 -1.02 3.52 0.28 -1.11 -4.96 120.64 114.52 1p7m n GLU 20 Ca -0.32 -0.77 -0.36 0.00 -0.16 0.00 0.00 57.16 55.55 1p7m n GLU 20 Cb 1.06 0.01 -0.04 0.00 1.43 0.00 0.00 31.44 33.90 1p7m n GLU 20 CO 0.00 0.00 0.00 1.87 -0.16 0.00 0.00 177.13 178.84 1p7m n TRP 21 N -0.51 1.73 -3.32 -1.84 -0.00 -1.16 -4.11 117.44 108.22 1p7m n TRP 21 Ca -0.20 -1.87 -0.16 0.00 -0.00 0.00 0.00 57.50 55.27 1p7m n TRP 21 Cb 0.66 -1.70 0.08 0.00 -0.00 0.00 0.00 31.31 30.35 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 4.27 -0.55 0.17 5.87 0.00 -0.82 -4.71 105.19 109.43 1p7m n GLY 22 Ca 0.48 0.21 -0.12 0.00 0.00 0.00 0.00 46.02 46.59 1p7m n GLY 22 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1p7m n VAL 23 N -3.78 0.86 -3.69 1.61 0.31 -1.26 -4.18 118.33 108.20 1p7m n VAL 23 Ca -0.22 -0.30 -0.31 0.00 -0.01 0.00 0.00 64.34 63.50 1p7m n VAL 23 Cb 0.65 -1.18 -0.04 0.00 -0.91 0.00 0.00 33.84 32.35 1p7m n VAL 23 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1p7m s PRO 24 N -2.30 3.59 0.36 5.55 0.04 -1.26 -4.99 135.00 136.00 1p7m s PRO 24 Ca -0.20 -0.14 -0.27 0.00 0.04 0.00 0.00 61.00 60.42 1p7m s PRO 24 Cb 0.06 -2.86 -0.09 0.00 0.04 0.00 0.00 34.50 31.65 1p7m s PRO 24 CO 0.33 0.47 1.25 -2.00 0.04 0.00 0.00 177.00 177.08 1p7m s GLU 25 N -2.73 4.22 0.02 4.56 2.12 -1.26 -4.51 118.70 121.12 1p7m s GLU 25 Ca 0.40 2.07 -0.02 0.00 0.36 0.00 0.00 54.97 57.78 1p7m s GLU 25 Cb -0.12 -2.91 -0.04 0.00 0.26 0.00 0.00 34.13 31.32 1p7m s GLU 25 CO 0.25 -0.25 0.20 0.95 -0.54 0.00 0.00 175.26 175.87 1p7m s THR 26 N -1.24 5.41 0.75 -1.70 -4.23 -1.26 -5.08 115.64 108.30 1p7m s THR 26 Ca 0.52 -0.24 -0.11 0.00 -1.18 0.00 0.00 61.69 60.68 1p7m s THR 26 Cb -0.36 -3.58 0.05 0.00 1.34 0.00 0.00 72.50 69.95 1p7m s THR 26 CO 0.47 0.24 1.12 -1.81 -0.54 0.00 0.00 174.62 174.10 1p7m s ASP 27 N -2.19 4.90 0.38 3.99 1.01 -1.26 -4.88 116.67 118.64 1p7m s ASP 27 Ca 0.31 0.86 0.05 0.00 0.71 0.00 0.00 52.55 54.48 1p7m s ASP 27 Cb -0.13 -1.49 0.76 0.00 1.01 0.00 0.00 42.92 43.07 1p7m s ASP 27 CO 0.23 -1.65 2.04 0.28 0.21 0.00 0.00 175.17 176.28 1p7m h SER 28 N -0.83 0.58 -0.55 0.27 0.02 -1.96 -2.84 113.55 108.24 1p7m h SER 28 Ca -0.45 -0.01 -0.11 0.00 -0.84 0.00 0.00 61.79 60.37 1p7m h SER 28 Cb 1.30 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.68 1p7m h SER 28 CO 0.64 0.42 -0.10 0.11 -1.14 0.00 0.00 176.83 176.76 1p7m h LYS 29 N 0.69 1.05 -0.91 3.45 1.57 -2.00 -3.14 116.57 117.28 1p7m h LYS 29 Ca 0.19 -0.39 0.03 0.00 -1.87 0.00 0.00 60.65 58.62 1p7m h LYS 29 Cb -0.06 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.13 1p7m h LYS 29 CO -0.04 1.08 0.60 0.87 -0.57 0.00 0.00 179.45 181.39 1p7m h LYS 30 N 0.93 1.13 -0.74 3.15 1.57 -1.87 -1.61 116.57 119.13 1p7m h LYS 30 Ca 0.14 -0.07 0.04 0.00 -1.87 0.00 0.00 60.65 58.90 1p7m h LYS 30 Cb 0.68 -0.25 -0.04 0.00 0.08 0.00 0.00 32.23 32.69 1p7m h LYS 30 CO 0.05 0.75 0.49 -0.07 -0.57 0.00 0.00 179.45 180.09 1p7m h LEU 31 N 1.16 0.76 -0.15 2.94 4.07 -1.60 0.13 115.31 122.62 1p7m h LEU 31 Ca 0.36 -0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.30 1p7m h LEU 31 Cb -0.02 -0.17 -0.01 0.00 1.08 0.00 0.00 40.66 41.54 1p7m h LEU 31 CO -0.10 0.52 0.06 0.15 -1.08 0.00 0.00 178.44 177.99 1p7m h PHE 32 N 0.88 0.23 -0.04 1.13 3.57 -1.37 0.66 116.94 122.01 1p7m h PHE 32 Ca 0.30 -0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.67 1p7m h PHE 32 Cb 0.09 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 1p7m h PHE 32 CO -0.00 0.31 -0.48 1.05 -2.23 0.00 0.00 178.31 176.95 1p7m h GLU 33 N 0.09 0.09 -0.05 1.11 4.11 -1.28 -2.86 114.58 115.78 1p7m h GLU 33 Ca 0.05 -0.05 -0.02 0.00 0.07 0.00 0.00 59.36 59.41 1p7m h GLU 33 Cb 0.17 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 1p7m h GLU 33 CO -0.00 0.56 -0.06 1.98 0.07 0.00 0.00 179.01 181.55 1p7m h MET 34 N 0.07 0.13 0.00 1.06 4.05 -0.41 -2.63 114.93 117.20 1p7m h MET 34 Ca 0.00 -0.07 -0.01 0.00 -0.28 0.00 0.00 59.70 59.33 1p7m h MET 34 Cb 0.88 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.68 1p7m h MET 34 CO 0.07 0.61 -0.06 0.97 0.23 0.00 0.00 176.91 178.72 1p7m h ILE 35 N -0.33 0.90 0.06 1.77 6.09 -0.86 0.71 117.51 125.86 1p7m h ILE 35 Ca 0.01 -0.22 -0.00 0.00 -1.37 0.00 0.00 64.86 63.27 1p7m h ILE 35 Cb 0.59 1.12 0.00 0.00 0.47 0.00 0.00 36.82 39.00 1p7m h ILE 35 CO 0.01 0.06 -0.03 0.00 -3.07 0.00 0.00 178.15 175.12 1p7m h LEU 37 N -0.61 0.75 -1.18 0.00 3.38 -1.10 -2.94 115.31 113.61 1p7m h LEU 37 Ca -0.01 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.56 1p7m h LEU 37 Cb 0.53 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 1p7m h LEU 37 CO 0.01 1.12 0.32 -0.08 0.09 0.00 0.00 178.44 179.91 1p7m h GLU 38 N 0.53 0.89 -0.49 1.13 4.57 0.41 -1.74 114.58 119.88 1p7m h GLU 38 Ca 0.02 -0.11 -0.01 0.00 -1.18 0.00 0.00 59.36 58.08 1p7m h GLU 38 Cb 1.07 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 29.46 1p7m h GLU 38 CO 0.10 0.68 0.24 0.78 -1.18 0.00 0.00 179.01 179.64 1p7m h GLY 39 N 0.97 0.73 1.86 1.92 0.00 -0.94 -2.17 103.07 105.43 1p7m h GLY 39 Ca 0.22 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.21 1p7m h GLY 39 CO -0.03 0.31 -0.02 1.46 0.00 0.00 0.00 176.54 178.26 1p7m h GLN 40 N 0.68 0.18 0.00 4.80 4.20 -1.26 -2.40 115.11 121.32 1p7m h GLN 40 Ca 0.17 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1p7m h GLN 40 Cb 0.06 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.81 1p7m h GLN 40 CO -0.02 0.23 0.00 0.00 -0.67 0.00 0.00 178.83 178.36 1p7m n GLN 41 N -4.40 0.06 -2.01 1.46 10.64 -0.82 -4.32 117.38 118.00 1p7m n GLN 41 Ca -0.01 0.00 -0.42 0.00 -1.83 0.00 0.00 57.00 54.74 1p7m n GLN 41 Cb 0.17 -1.15 -0.03 0.00 -0.86 0.00 0.00 30.24 28.37 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 -2.00 3.64 0.00 2.61 0.00 -0.90 -2.99 121.76 122.11 1p7m s ALA 42 Ca 0.01 1.05 0.00 0.00 0.00 0.00 0.00 51.96 53.02 1p7m s ALA 42 Cb 0.00 -3.70 0.00 0.00 0.00 0.00 0.00 23.12 19.43 1p7m s ALA 42 CO 0.01 -1.17 0.00 0.41 0.00 0.00 0.00 175.76 175.00 1p7m n GLY 43 N 3.98 0.61 3.92 0.00 0.00 -1.26 -4.87 105.19 107.57 1p7m n GLY 43 Ca 0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.91 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 4.11 0.65 0.99 1.43 -1.16 -5.08 118.68 119.62 1p7m s LEU 44 Ca 0.00 0.53 -0.14 0.00 -1.03 0.00 0.00 54.13 53.49 1p7m s LEU 44 Cb 0.00 -3.34 -0.01 0.00 0.03 0.00 0.00 46.19 42.87 1p7m s LEU 44 CO 0.00 -0.17 1.07 -0.44 0.23 0.00 0.00 176.35 177.04 1p7m s SER 45 N -3.39 5.43 0.46 2.29 0.01 -1.26 -4.54 113.70 112.70 1p7m s SER 45 Ca 0.41 1.80 0.11 0.00 1.31 0.00 0.00 55.95 59.58 1p7m s SER 45 Cb -0.10 -2.53 1.03 0.00 0.21 0.00 0.00 66.02 64.63 1p7m s SER 45 CO 0.31 -1.41 2.09 -0.25 0.41 0.00 0.00 173.24 174.40 1p7m h TRP 46 N -0.08 0.31 -0.28 2.43 2.91 -1.95 -1.70 115.95 117.58 1p7m h TRP 46 Ca -0.46 0.01 -0.12 0.00 1.13 0.00 0.00 58.89 59.45 1p7m h TRP 46 Cb 1.22 -0.10 -0.01 0.00 -0.51 0.00 0.00 29.16 29.76 1p7m h TRP 46 CO 0.59 0.19 -0.32 0.82 -1.03 0.00 0.00 178.44 178.69 1p7m h ILE 47 N 0.33 1.28 -0.81 2.65 1.08 -2.00 -2.32 117.51 117.72 1p7m h ILE 47 Ca 0.10 -1.42 0.06 0.00 -0.39 0.00 0.00 64.86 63.20 1p7m h ILE 47 Cb -0.01 1.41 -0.05 0.00 -3.07 0.00 0.00 36.82 35.10 1p7m h ILE 47 CO -0.02 0.46 0.53 0.74 -0.69 0.00 0.00 178.15 179.16 1p7m h THR 48 N 0.50 1.05 -0.40 -0.27 2.02 -1.67 0.25 112.91 114.39 1p7m h THR 48 Ca 0.06 -0.30 -0.10 0.00 0.77 0.00 0.00 66.41 66.84 1p7m h THR 48 Cb 0.79 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.27 1p7m h THR 48 CO 0.06 0.16 -0.14 0.58 0.37 0.00 0.00 175.52 176.55 1p7m h VAL 49 N 0.89 1.26 -0.24 3.16 2.07 -1.34 -2.30 116.25 119.75 1p7m h VAL 49 Ca 0.35 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.67 1p7m h VAL 49 Cb 0.22 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 1p7m h VAL 49 CO -0.12 0.40 0.16 0.25 0.02 0.00 0.00 177.57 178.28 1p7m h LEU 50 N 0.66 0.27 -0.03 2.57 6.46 -0.58 2.05 115.31 126.72 1p7m h LEU 50 Ca 0.11 -0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 57.86 1p7m h LEU 50 Cb 0.61 -0.07 -0.00 0.00 -0.73 0.00 0.00 40.66 40.47 1p7m h LEU 50 CO 0.04 0.20 0.01 0.11 -0.62 0.00 0.00 178.44 178.18 1p7m h LYS 51 N 0.32 0.04 0.00 1.25 1.57 -1.38 -1.64 116.57 116.74 1p7m h LYS 51 Ca 0.09 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 1p7m h LYS 51 Cb -0.04 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1p7m h LYS 51 CO -0.02 0.15 -0.18 0.87 -0.57 0.00 0.00 179.45 179.70 1p7m h LYS 52 N -0.08 0.00 -0.82 3.15 1.57 -1.10 -2.18 116.57 117.11 1p7m h LYS 52 Ca 0.01 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.88 1p7m h LYS 52 Cb 0.12 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.36 1p7m h LYS 52 CO -0.00 0.18 0.46 -0.09 -0.57 0.00 0.00 179.45 179.43 1p7m h ARG 53 N 0.00 0.75 -0.37 3.15 2.43 0.43 1.20 114.38 121.97 1p7m h ARG 53 Ca -0.00 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 58.98 1p7m h ARG 53 Cb 0.42 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 1p7m h ARG 53 CO 0.02 0.50 -0.32 1.49 -1.51 0.00 0.00 179.97 180.15 1p7m h GLU 54 N 0.78 0.88 -0.36 0.20 4.81 -1.23 -2.32 114.58 117.34 1p7m h GLU 54 Ca 0.39 -0.45 -0.06 0.00 -0.13 0.00 0.00 59.36 59.12 1p7m h GLU 54 Cb 0.37 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 1p7m h GLU 54 CO -0.25 1.09 -0.01 -0.91 -0.73 0.00 0.00 179.01 178.20 1p7m h ASN 55 N 0.68 0.53 -0.88 1.04 -0.26 -0.87 -1.55 115.58 114.27 1p7m h ASN 55 Ca 0.06 -0.11 -0.01 0.00 -0.56 0.00 0.00 56.30 55.69 1p7m h ASN 55 Cb 0.91 -0.14 -0.04 0.00 -1.06 0.00 0.00 38.32 37.99 1p7m h ASN 55 CO 0.08 0.61 0.52 0.22 -1.06 0.00 0.00 177.43 177.81 1p7m h TYR 56 N 0.54 1.16 -0.66 1.19 3.20 0.17 -0.90 116.97 121.67 1p7m h TYR 56 Ca 0.11 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.99 1p7m h TYR 56 Cb 0.37 -0.38 -0.03 0.00 1.54 0.00 0.00 36.73 38.22 1p7m h TYR 56 CO 0.01 0.78 0.44 0.00 -1.64 0.00 0.00 178.16 177.75 1p7m h ARG 57 N 1.21 0.84 -0.79 1.82 3.08 -0.74 -0.96 114.38 118.84 1p7m h ARG 57 Ca 0.31 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.29 1p7m h ARG 57 Cb -0.04 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 29.78 1p7m h ARG 57 CO -0.06 0.56 0.42 0.00 -1.07 0.00 0.00 179.97 179.81 1p7m h ALA 58 N 1.60 1.24 -0.03 0.04 0.00 -0.96 3.41 119.26 124.56 1p7m h ALA 58 Ca 0.25 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 1p7m h ALA 58 Cb -0.05 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 17.43 1p7m h ALA 58 CO -0.06 0.60 -0.48 0.00 0.00 0.00 0.00 179.25 179.32 1p7m n PHE 60 N -4.30 0.00 0.00 0.00 3.72 -0.47 -4.97 117.46 111.44 1p7m n PHE 60 Ca -0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.30 1p7m n PHE 60 Cb 0.60 -0.41 0.00 0.00 -0.94 0.00 0.00 39.48 38.73 1p7m n PHE 60 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 1p7m n HIS 61 N -2.95 0.00 0.10 1.38 -0.00 1.13 -3.86 115.22 111.02 1p7m n HIS 61 Ca -0.20 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.49 1p7m n HIS 61 Cb 0.70 0.00 0.15 0.00 -0.00 0.00 0.00 29.99 30.84 1p7m n HIS 61 CO 0.00 0.00 0.00 1.96 -0.00 0.00 0.00 176.34 178.30 1p7m h GLN 62 N 0.00 0.16 -4.00 1.57 4.20 -1.93 -3.46 115.11 111.66 1p7m h GLN 62 Ca 0.00 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.60 1p7m h GLN 62 Cb 0.00 0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.79 1p7m h GLN 62 CO 0.00 0.70 0.00 1.97 -0.67 0.00 0.00 178.83 180.83 1p7m n PHE 63 N -3.88 -1.63 -2.91 2.96 1.16 -1.25 -4.84 117.46 107.07 1p7m n PHE 63 Ca -0.02 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.16 1p7m n PHE 63 Cb 0.60 -0.94 -0.06 0.00 -1.61 0.00 0.00 39.48 37.47 1p7m n PHE 63 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1p7m s ASP 64 N -1.63 7.42 0.20 5.98 1.11 -1.26 -4.87 116.67 123.62 1p7m s ASP 64 Ca 0.00 1.68 -0.13 0.00 0.18 0.00 0.00 52.55 54.28 1p7m s ASP 64 Cb 0.00 -2.52 0.23 0.00 1.07 0.00 0.00 42.92 41.69 1p7m s ASP 64 CO 0.00 0.13 1.66 -0.65 1.18 0.00 0.00 175.17 177.49 1p7m h PRO 65 N 4.69 0.07 -0.36 8.23 0.11 -1.96 -1.25 132.00 141.53 1p7m h PRO 65 Ca -0.46 -0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.55 1p7m h PRO 65 Cb 1.21 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 1p7m h PRO 65 CO 0.68 0.05 -0.18 0.28 -0.21 0.00 0.00 178.00 178.62 1p7m h VAL 66 N 0.07 1.26 -0.23 3.15 2.07 -1.93 -2.58 116.25 118.07 1p7m h VAL 66 Ca 0.28 -1.22 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 1p7m h VAL 66 Cb 0.44 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 1p7m h VAL 66 CO -0.51 0.41 0.09 0.11 0.02 0.00 0.00 177.57 177.69 1p7m h LYS 67 N 0.60 0.35 -0.18 1.57 6.56 -1.64 -2.24 116.57 121.58 1p7m h LYS 67 Ca 0.09 -0.07 -0.10 0.00 -1.06 0.00 0.00 60.65 59.52 1p7m h LYS 67 Cb 0.64 -0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 32.23 1p7m h LYS 67 CO 0.04 0.41 -0.30 -0.39 -2.06 0.00 0.00 179.45 177.15 1p7m h VAL 68 N 0.22 1.27 0.00 0.50 -1.51 -1.36 -0.82 116.25 114.55 1p7m h VAL 68 Ca 0.08 -1.32 -0.00 0.00 -1.23 0.00 0.00 66.70 64.23 1p7m h VAL 68 Cb 0.20 1.47 -0.00 0.00 -2.13 0.00 0.00 31.29 30.83 1p7m h VAL 68 CO -0.01 0.41 -0.01 0.00 -1.23 0.00 0.00 177.57 176.73 1p7m h ALA 69 N 1.37 1.04 -0.00 5.19 0.00 -1.18 0.26 119.26 125.95 1p7m h ALA 69 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1p7m h ALA 69 Cb 0.70 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1p7m h ALA 69 CO 0.05 0.01 -0.59 0.00 0.00 0.00 0.00 179.25 178.72 1p7m n ALA 70 N -2.11 3.80 -2.65 0.00 0.00 -0.36 -4.78 120.51 114.41 1p7m n ALA 70 Ca -0.02 -0.43 -0.42 0.00 0.00 0.00 0.00 53.44 52.56 1p7m n ALA 70 Cb 0.15 -1.02 -0.03 0.00 0.00 0.00 0.00 19.45 18.55 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 -2.91 4.20 0.60 0.00 -1.94 0.92 -5.03 119.30 115.14 1p7m s MET 71 Ca 0.12 1.10 0.03 0.00 -1.71 0.00 0.00 55.69 55.23 1p7m s MET 71 Cb 0.17 -3.65 0.07 0.00 2.01 0.00 0.00 34.83 33.43 1p7m s MET 71 CO 0.71 -0.59 0.83 -0.65 -0.01 0.00 0.00 175.02 175.31 1p7m s GLN 72 N 3.04 2.25 0.53 2.03 -0.21 -1.26 -4.88 119.66 121.17 1p7m s GLN 72 Ca 0.39 -1.07 0.27 0.00 0.02 0.00 0.00 55.36 54.97 1p7m s GLN 72 Cb -0.15 -2.49 1.43 0.00 1.00 0.00 0.00 33.01 32.80 1p7m s GLN 72 CO 0.07 -0.93 1.96 0.93 -2.12 0.00 0.00 175.29 175.21 1p7m h GLU 73 N -0.05 0.00 -0.15 2.91 5.08 -1.98 0.90 114.58 121.30 1p7m h GLU 73 Ca -0.38 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.98 1p7m h GLU 73 Cb 1.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.53 1p7m h GLU 73 CO 0.46 0.00 0.09 0.93 -1.00 0.00 0.00 179.01 179.48 1p7m h GLU 74 N 0.00 0.20 -0.74 2.33 5.08 -2.00 -0.29 114.58 119.16 1p7m h GLU 74 Ca 0.30 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.62 1p7m h GLU 74 Cb 1.21 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.39 1p7m h GLU 74 CO -0.00 0.18 0.37 -0.44 -1.00 0.00 0.00 179.01 178.12 1p7m h ASP 75 N 0.16 0.96 -0.81 1.42 3.32 -1.22 -2.32 116.42 117.92 1p7m h ASP 75 Ca 0.05 -0.12 0.07 0.00 0.02 0.00 0.00 57.03 57.05 1p7m h ASP 75 Cb 0.03 -0.24 -0.06 0.00 0.22 0.00 0.00 39.33 39.28 1p7m h ASP 75 CO -0.01 0.81 0.49 0.58 -1.72 0.00 0.00 179.24 179.39 1p7m h VAL 76 N 1.03 1.00 -0.94 -1.35 2.07 -0.63 -0.76 116.25 116.67 1p7m h VAL 76 Ca 0.26 -0.30 0.05 0.00 0.82 0.00 0.00 66.70 67.52 1p7m h VAL 76 Cb 0.09 0.05 -0.06 0.00 -1.52 0.00 0.00 31.29 29.86 1p7m h VAL 76 CO -0.03 0.16 0.61 -0.33 0.02 0.00 0.00 177.57 178.00 1p7m h GLU 77 N 0.87 1.11 -0.87 1.57 5.08 -0.51 -0.39 114.58 121.44 1p7m h GLU 77 Ca 0.36 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.64 1p7m h GLU 77 Cb 0.21 -0.25 -0.04 0.00 0.50 0.00 0.00 28.75 29.17 1p7m h GLU 77 CO -0.19 0.73 0.47 -0.09 -1.00 0.00 0.00 179.01 178.93 1p7m h ARG 78 N 1.14 1.23 -0.22 2.33 2.43 -0.99 -2.32 114.38 117.99 1p7m h ARG 78 Ca 0.39 -0.15 -0.07 0.00 -0.81 0.00 0.00 59.98 59.34 1p7m h ARG 78 Cb 0.08 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.38 1p7m h ARG 78 CO -0.13 0.91 -0.16 -0.07 -1.51 0.00 0.00 179.97 179.01 1p7m h LEU 79 N 1.22 0.35 -1.33 3.80 3.38 -0.52 0.14 115.31 122.35 1p7m h LEU 79 Ca 0.31 -0.09 0.19 0.00 0.09 0.00 0.00 57.88 58.38 1p7m h LEU 79 Cb 0.05 -0.09 -0.08 0.00 0.09 0.00 0.00 40.66 40.62 1p7m h LEU 79 CO -0.05 0.53 0.60 0.58 0.09 0.00 0.00 178.44 180.20 1p7m h VAL 80 N 0.34 0.72 -0.01 1.22 2.07 -0.73 -0.64 116.25 119.21 1p7m h VAL 80 Ca 0.06 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.39 1p7m h VAL 80 Cb 0.48 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1p7m h VAL 80 CO 0.03 0.10 -0.20 0.00 0.02 0.00 0.00 177.57 177.52 1p7m n GLN 81 N -4.58 1.55 -2.50 1.57 10.64 -0.87 -4.38 117.38 118.80 1p7m n GLN 81 Ca 0.20 -1.04 -0.42 0.00 -1.83 0.00 0.00 57.00 53.91 1p7m n GLN 81 Cb 0.62 -1.27 -0.02 0.00 -0.86 0.00 0.00 30.24 28.71 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 -1.64 6.36 0.00 2.61 2.15 0.43 -3.70 116.67 122.88 1p7m s ASP 82 Ca 0.15 0.28 0.00 0.00 0.43 0.00 0.00 52.55 53.41 1p7m s ASP 82 Cb 0.13 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.20 1p7m s ASP 82 CO 0.32 -1.52 0.00 0.00 -0.17 0.00 0.00 175.17 173.80 1p7m n ALA 83 N 8.75 0.00 -2.65 3.66 0.00 -1.26 -3.23 120.51 125.78 1p7m n ALA 83 Ca 0.11 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.45 1p7m n ALA 83 Cb 0.49 -0.01 0.02 0.00 0.00 0.00 0.00 19.45 19.95 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 -1.39 0.19 0.00 0.00 0.00 -1.24 -4.96 105.19 97.79 1p7m n GLY 84 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.74 0.00 0.00 -0.61 -5.35 -1.20 -4.86 119.36 103.60 1p7m n ILE 85 Ca -0.04 0.14 0.00 0.00 -0.27 0.00 0.00 62.75 62.58 1p7m n ILE 85 Cb 0.55 -0.37 0.00 0.00 -1.74 0.00 0.00 39.64 38.08 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 -1.79 7.28 3.06 -1.26 -5.12 119.36 121.53 1p7m n ILE 86 Ca 0.00 0.00 -0.32 0.00 -2.50 0.00 0.00 62.75 59.93 1p7m n ILE 86 Cb 0.00 0.00 0.04 0.00 0.54 0.00 0.00 39.64 40.22 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 -0.89 2.95 0.54 9.51 1.81 -1.26 -5.06 118.95 126.55 1p7m s ARG 87 Ca 0.00 1.25 0.05 0.00 -1.72 0.00 0.00 55.73 55.30 1p7m s ARG 87 Cb 0.00 -1.98 0.04 0.00 -0.45 0.00 0.00 34.95 32.56 1p7m s ARG 87 CO 0.00 -1.11 0.36 -1.01 -0.68 0.00 0.00 175.30 172.86 1p7m s HIS 88 N -2.53 1.62 0.21 -0.53 3.76 -1.26 -4.79 115.29 111.77 1p7m s HIS 88 Ca 0.64 -0.87 -0.09 0.00 -0.15 0.00 0.00 55.06 54.60 1p7m s HIS 88 Cb -0.18 -1.87 0.25 0.00 1.11 0.00 0.00 32.58 31.89 1p7m s HIS 88 CO 0.43 -0.41 1.81 0.07 -0.85 0.00 0.00 174.74 175.79 1p7m h ARG 89 N 0.80 0.69 0.48 1.40 0.11 -1.97 0.19 114.38 116.08 1p7m h ARG 89 Ca -0.37 -0.04 -0.01 0.00 0.10 0.00 0.00 59.98 59.65 1p7m h ARG 89 Cb 1.31 -0.16 -0.02 0.00 1.11 0.00 0.00 29.97 32.21 1p7m h ARG 89 CO 0.59 0.46 -0.41 0.78 0.10 0.00 0.00 179.97 181.48 1p7m h GLY 90 N 0.71 -1.03 0.98 0.08 0.00 -1.99 0.18 103.07 102.00 1p7m h GLY 90 Ca 0.31 0.47 -0.03 0.00 0.00 0.00 0.00 47.33 48.08 1p7m h GLY 90 CO -0.18 -0.35 0.20 1.70 0.00 0.00 0.00 176.54 177.91 1p7m h LYS 91 N -0.89 0.81 0.06 4.80 3.11 -1.90 -2.75 116.57 119.80 1p7m h LYS 91 Ca -0.05 -0.15 0.01 0.00 -2.81 0.00 0.00 60.65 57.65 1p7m h LYS 91 Cb 0.77 -0.13 -0.02 0.00 -1.00 0.00 0.00 32.23 31.85 1p7m h LYS 91 CO -0.02 0.72 -0.13 0.82 -2.81 0.00 0.00 179.45 178.03 1p7m h ILE 92 N 0.73 0.70 -0.93 2.00 1.08 -0.40 -0.11 117.51 120.58 1p7m h ILE 92 Ca 0.18 0.00 0.25 0.00 -0.39 0.00 0.00 64.86 64.89 1p7m h ILE 92 Cb 0.22 0.70 -0.06 0.00 -3.07 0.00 0.00 36.82 34.62 1p7m h ILE 92 CO -0.01 0.00 0.64 1.56 -0.69 0.00 0.00 178.15 179.65 1p7m h GLN 93 N -0.24 0.19 -0.59 2.37 4.20 -0.51 0.63 115.11 121.17 1p7m h GLN 93 Ca 0.02 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.67 1p7m h GLN 93 Cb 0.27 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 1p7m h GLN 93 CO -0.08 0.13 0.16 0.00 -0.67 0.00 0.00 178.83 178.37 1p7m h ALA 94 N 1.57 0.77 -0.51 3.87 0.00 -0.74 -0.08 119.26 124.16 1p7m h ALA 94 Ca 0.47 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 55.10 1p7m h ALA 94 Cb 1.52 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 1p7m h ALA 94 CO -0.11 0.46 0.05 0.82 0.00 0.00 0.00 179.25 180.47 1p7m h ILE 95 N 0.84 1.26 -0.58 0.00 2.04 0.76 -0.17 117.51 121.65 1p7m h ILE 95 Ca 0.19 -1.00 0.01 0.00 1.00 0.00 0.00 64.86 65.05 1p7m h ILE 95 Cb 0.32 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 1p7m h ILE 95 CO -0.00 0.36 0.38 0.40 0.00 0.00 0.00 178.15 179.29 1p7m h ILE 96 N 0.73 1.15 -0.49 -0.67 1.08 -0.79 -1.31 117.51 117.20 1p7m h ILE 96 Ca 0.15 -0.27 -0.03 0.00 -0.39 0.00 0.00 64.86 64.32 1p7m h ILE 96 Cb 0.45 0.29 -0.02 0.00 -3.07 0.00 0.00 36.82 34.47 1p7m h ILE 96 CO 0.02 0.14 0.19 1.23 -0.69 0.00 0.00 178.15 179.04 1p7m h GLY 97 N 0.79 0.76 0.94 5.37 0.00 -0.66 -1.70 103.07 108.57 1p7m h GLY 97 Ca 0.21 -0.38 0.06 0.00 0.00 0.00 0.00 47.33 47.23 1p7m h GLY 97 CO -0.05 0.36 0.55 3.43 0.00 0.00 0.00 176.54 180.83 1p7m h ASN 98 N 0.70 0.83 -0.19 0.19 -0.26 0.15 -0.08 115.58 116.93 1p7m h ASN 98 Ca 0.17 0.00 -0.03 0.00 -0.56 0.00 0.00 56.30 55.89 1p7m h ASN 98 Cb 0.15 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.23 1p7m h ASN 98 CO -0.02 0.54 0.02 0.00 -1.06 0.00 0.00 177.43 176.92 1p7m h ALA 99 N 1.54 0.25 -0.89 -0.83 0.00 -1.02 0.73 119.26 119.04 1p7m h ALA 99 Ca 0.36 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 55.17 1p7m h ALA 99 Cb 0.19 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.85 1p7m h ALA 99 CO -0.13 -0.06 0.57 0.00 0.00 0.00 0.00 179.25 179.63 1p7m h ARG 100 N 0.10 0.91 -0.03 0.00 2.47 -1.15 0.49 114.38 117.15 1p7m h ARG 100 Ca 0.06 -0.05 -0.07 0.00 -1.26 0.00 0.00 59.98 58.65 1p7m h ARG 100 Cb 0.34 -0.20 -0.01 0.00 -1.65 0.00 0.00 29.97 28.44 1p7m h ARG 100 CO 0.01 0.60 -0.33 0.00 0.56 0.00 0.00 179.97 180.81 1p7m h ALA 101 N 1.54 1.39 -0.42 0.04 0.00 -0.44 -0.25 119.26 121.12 1p7m h ALA 101 Ca 0.40 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1p7m h ALA 101 Cb 0.31 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1p7m h ALA 101 CO -0.16 0.45 0.08 -0.92 0.00 0.00 0.00 179.25 178.70 1p7m h TYR 102 N 0.06 0.72 -0.05 0.00 3.20 0.23 -1.34 116.97 119.78 1p7m h TYR 102 Ca 0.01 -0.09 -0.04 0.00 3.14 0.00 0.00 58.73 61.74 1p7m h TYR 102 Cb 0.61 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 1p7m h TYR 102 CO 0.00 0.69 -0.16 -0.07 -1.64 0.00 0.00 178.16 176.99 1p7m h LEU 103 N 0.54 0.08 -1.14 2.82 3.38 -0.31 -1.84 115.31 118.84 1p7m h LEU 103 Ca 0.13 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1p7m h LEU 103 Cb 0.35 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1p7m h LEU 103 CO 0.01 0.24 0.30 1.56 0.09 0.00 0.00 178.44 180.64 1p7m h GLN 104 N 0.08 0.90 -0.54 1.13 4.20 0.08 0.27 115.11 121.23 1p7m h GLN 104 Ca 0.02 -0.12 -0.09 0.00 0.06 0.00 0.00 58.65 58.51 1p7m h GLN 104 Cb 0.33 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 1p7m h GLN 104 CO 0.02 0.70 -0.03 0.52 -0.67 0.00 0.00 178.83 179.37 1p7m h MET 105 N 0.89 0.94 -0.35 1.46 2.86 -0.95 -2.04 114.93 117.75 1p7m h MET 105 Ca 0.22 -0.30 -0.16 0.00 -2.06 0.00 0.00 59.70 57.40 1p7m h MET 105 Cb 0.10 -0.09 -0.00 0.00 0.06 0.00 0.00 31.60 31.67 1p7m h MET 105 CO -0.03 0.95 -0.41 1.49 1.06 0.00 0.00 176.91 179.97 1p7m h GLU 106 N 0.86 0.90 0.00 1.72 4.81 -1.08 -0.66 114.58 121.14 1p7m h GLU 106 Ca 0.15 -0.50 -0.00 0.00 -0.13 0.00 0.00 59.36 58.88 1p7m h GLU 106 Cb 0.55 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.96 1p7m h GLU 106 CO 0.03 1.15 -0.02 1.96 -0.73 0.00 0.00 179.01 181.40 1p7m h GLN 107 N 0.71 0.00 -0.01 1.92 4.20 -0.23 0.75 115.11 122.46 1p7m h GLN 107 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1p7m h GLN 107 Cb 1.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.79 1p7m h GLN 107 CO 0.10 0.02 -0.37 0.09 -0.67 0.00 0.00 178.83 178.00 1p7m n ASN 108 N -3.60 1.05 -1.24 1.46 5.03 -0.77 -4.92 115.26 112.27 1p7m n ASN 108 Ca -0.03 -0.85 -0.12 0.00 0.87 0.00 0.00 54.58 54.45 1p7m n ASN 108 Cb 0.11 0.24 -0.02 0.00 -1.02 0.00 0.00 39.78 39.09 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 1.39 0.41 3.10 7.41 0.00 0.26 -4.99 105.19 112.76 1p7m n GLY 109 Ca 0.10 -0.40 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 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 -4.03 2.19 0.47 1.61 2.12 -0.36 -5.00 118.70 115.70 1p7m s GLU 110 Ca 0.00 -1.41 -0.22 0.00 0.36 0.00 0.00 54.97 53.69 1p7m s GLU 110 Cb 0.00 -3.05 -0.09 0.00 0.26 0.00 0.00 34.13 31.25 1p7m s GLU 110 CO 0.00 -0.66 0.94 -2.30 -0.54 0.00 0.00 175.26 172.71 1p7m n PRO 111 N 4.47 1.16 -0.10 4.30 -0.02 -1.26 -4.41 135.00 139.14 1p7m n PRO 111 Ca -0.11 0.42 -0.08 0.00 -2.02 0.00 0.00 63.50 61.71 1p7m n PRO 111 Cb 0.42 -2.03 -0.00 0.00 -0.02 0.00 0.00 33.50 31.87 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 1.18 0.38 0.00 6.00 3.57 -1.93 -1.44 116.94 124.70 1p7m h PHE 112 Ca -0.45 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.02 1p7m h PHE 112 Cb 1.35 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.96 1p7m h PHE 112 CO 0.41 0.22 -0.18 0.00 -2.23 0.00 0.00 178.31 176.54 1p7m h ALA 113 N 1.15 1.39 -0.19 2.41 0.00 -1.83 -3.05 119.26 119.14 1p7m h ALA 113 Ca 0.13 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1p7m h ALA 113 Cb -0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1p7m h ALA 113 CO -0.06 0.22 0.10 0.22 0.00 0.00 0.00 179.25 179.73 1p7m h ASP 114 N 0.00 0.24 -0.17 0.00 3.58 -1.60 -1.34 116.42 117.12 1p7m h ASP 114 Ca -0.00 -0.09 -0.12 0.00 0.42 0.00 0.00 57.03 57.23 1p7m h ASP 114 Cb 0.39 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.39 1p7m h ASP 114 CO 0.02 0.26 -0.37 2.19 -2.88 0.00 0.00 179.24 178.46 1p7m h PHE 115 N 0.19 0.71 0.34 0.28 -5.15 -1.48 -2.26 116.94 109.57 1p7m h PHE 115 Ca 0.07 -0.26 -0.02 0.00 -0.20 0.00 0.00 57.97 57.56 1p7m h PHE 115 Cb 0.08 -0.13 0.00 0.00 0.22 0.00 0.00 35.95 36.13 1p7m h PHE 115 CO -0.04 1.01 -0.16 -0.24 -2.00 0.00 0.00 178.31 176.88 1p7m h VAL 116 N 0.21 0.67 -0.17 0.88 3.04 -1.55 -1.73 116.25 117.60 1p7m h VAL 116 Ca 0.00 -0.45 0.05 0.00 -1.01 0.00 0.00 66.70 65.29 1p7m h VAL 116 Cb 0.98 0.90 -0.01 0.00 -2.01 0.00 0.00 31.29 31.15 1p7m h VAL 116 CO 0.08 0.09 0.28 -0.50 -1.01 0.00 0.00 177.57 176.51 1p7m h TRP 117 N -0.71 0.00 -0.40 3.17 4.06 -1.34 -0.29 115.95 120.44 1p7m h TRP 117 Ca -0.05 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 60.84 1p7m h TRP 117 Cb 0.49 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.64 1p7m h TRP 117 CO 0.01 0.00 0.01 1.03 -3.56 0.00 0.00 178.44 175.93 1p7m h SER 118 N 0.00 0.68 0.30 -3.49 0.87 -0.68 1.39 113.55 112.61 1p7m h SER 118 Ca 0.08 -0.30 -0.06 0.00 -1.23 0.00 0.00 61.79 60.28 1p7m h SER 118 Cb 0.64 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 1p7m h SER 118 CO -0.00 0.81 -0.27 -0.26 -0.53 0.00 0.00 176.83 176.58 1p7m h PHE 119 N 0.53 0.00 -0.26 2.24 0.04 -0.83 -0.49 116.94 118.18 1p7m h PHE 119 Ca 0.12 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.89 1p7m h PHE 119 Cb 0.45 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.60 1p7m h PHE 119 CO 0.03 0.27 0.00 0.28 -0.60 0.00 0.00 178.31 178.30 1p7m n VAL 120 N -4.15 0.34 -2.83 -0.55 0.31 -0.98 -4.86 118.33 105.61 1p7m n VAL 120 Ca -0.02 -0.34 -0.17 0.00 -0.01 0.00 0.00 64.34 63.80 1p7m n VAL 120 Cb 0.33 0.17 0.03 0.00 -0.91 0.00 0.00 33.84 33.46 1p7m n VAL 120 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1p7m n ASN 121 N 0.25 -5.00 -3.46 4.52 4.05 -0.19 -2.55 115.26 112.88 1p7m n ASN 121 Ca 0.09 -0.22 -0.22 0.00 0.45 0.00 0.00 54.58 54.68 1p7m n ASN 121 Cb 0.22 -3.85 -0.03 0.00 1.23 0.00 0.00 39.78 37.35 1p7m n ASN 121 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 1p7m n HIS 122 N -4.20 -1.65 -3.81 1.20 8.25 0.47 -4.90 115.22 110.58 1p7m n HIS 122 Ca -0.09 0.40 -0.12 0.00 -0.26 0.00 0.00 57.72 57.65 1p7m n HIS 122 Cb 0.59 -2.10 -0.10 0.00 1.12 0.00 0.00 29.99 29.50 1p7m n HIS 122 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 1p7m s GLN 123 N -6.08 0.50 0.38 -0.41 -2.07 -1.06 -5.08 119.66 105.86 1p7m s GLN 123 Ca 0.41 -0.14 -0.27 0.00 -1.82 0.00 0.00 55.36 53.54 1p7m s GLN 123 Cb -0.23 0.22 -0.09 0.00 -1.09 0.00 0.00 33.01 31.82 1p7m s GLN 123 CO 0.50 -0.12 1.29 -1.25 -1.32 0.00 0.00 175.29 174.39 1p7m s PRO 124 N -0.99 4.09 -0.12 9.60 0.04 -1.26 -4.89 135.00 141.47 1p7m s PRO 124 Ca -0.11 2.14 -0.00 0.00 0.04 0.00 0.00 61.00 63.07 1p7m s PRO 124 Cb -0.05 -2.84 -0.02 0.00 0.04 0.00 0.00 34.50 31.63 1p7m s PRO 124 CO 0.02 -0.39 -0.11 -1.14 0.04 0.00 0.00 177.00 175.42 1p7m s GLN 125 N -2.12 3.27 -0.14 4.56 -0.44 -0.18 -4.98 119.66 119.64 1p7m s GLN 125 Ca 0.55 -0.65 -0.20 0.00 -2.50 0.00 0.00 55.36 52.55 1p7m s GLN 125 Cb -0.38 -2.64 -0.03 0.00 -1.64 0.00 0.00 33.01 28.32 1p7m s GLN 125 CO 0.49 0.31 0.59 1.41 0.50 0.00 0.00 175.29 178.59 1p7m s MET 126 N 0.12 4.31 -0.16 1.67 -2.45 -1.26 -1.58 119.30 119.94 1p7m s MET 126 Ca -0.05 0.62 -0.13 0.00 -1.25 0.00 0.00 55.69 54.87 1p7m s MET 126 Cb -0.15 -3.50 -0.05 0.00 1.25 0.00 0.00 34.83 32.39 1p7m s MET 126 CO 0.04 -0.02 0.28 0.99 1.05 0.00 0.00 175.02 177.36 1p7m s THR 127 N 1.18 5.32 -0.34 10.11 2.01 -1.14 -4.95 115.64 127.82 1p7m s THR 127 Ca 0.30 0.51 0.04 0.00 0.31 0.00 0.00 61.69 62.85 1p7m s THR 127 Cb -0.16 -3.62 0.43 0.00 0.01 0.00 0.00 72.50 69.16 1p7m s THR 127 CO 0.12 0.39 1.47 0.00 -0.69 0.00 0.00 174.62 175.92 1p7m n GLN 128 N 3.57 2.18 -2.00 4.92 6.02 -1.26 -4.49 117.38 126.31 1p7m n GLN 128 Ca -0.12 -1.82 -0.40 0.00 -0.01 0.00 0.00 57.00 54.65 1p7m n GLN 128 Cb 0.52 -1.77 -0.00 0.00 1.02 0.00 0.00 30.24 30.00 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 -1.99 3.27 -0.13 -1.58 0.00 -1.26 -4.87 121.76 115.20 1p7m s ALA 129 Ca 0.34 1.29 0.05 0.00 0.00 0.00 0.00 51.96 53.64 1p7m s ALA 129 Cb 0.28 -3.51 -0.11 0.00 0.00 0.00 0.00 23.12 19.77 1p7m s ALA 129 CO 0.07 -0.90 -0.05 0.25 0.00 0.00 0.00 175.76 175.13 1p7m n THR 130 N 0.08 0.79 -4.41 0.00 -2.24 -1.26 -2.08 114.28 105.17 1p7m n THR 130 Ca 0.04 -0.39 -0.21 0.00 -2.27 0.00 0.00 64.05 61.23 1p7m n THR 130 Cb 0.43 -0.87 -0.10 0.00 -2.10 0.00 0.00 70.33 67.69 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 -2.28 1.82 0.36 4.28 -4.23 -1.26 -4.79 115.64 109.54 1p7m s THR 131 Ca -0.13 -2.20 0.05 0.00 -1.18 0.00 0.00 61.69 58.24 1p7m s THR 131 Cb 0.04 -2.29 0.29 0.00 1.34 0.00 0.00 72.50 71.88 1p7m s THR 131 CO 0.39 -0.42 1.96 -0.07 -0.54 0.00 0.00 174.62 175.94 1p7m h LEU 132 N 2.37 0.67 0.00 4.79 3.38 -1.96 0.55 115.31 125.12 1p7m h LEU 132 Ca -0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1p7m h LEU 132 Cb 1.23 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1p7m h LEU 132 CO 0.64 0.44 0.00 -1.20 0.09 0.00 0.00 178.44 178.41 1p7m n SER 133 N -4.48 0.00 -1.12 -0.43 7.64 -1.26 -2.35 113.62 111.63 1p7m n SER 133 Ca 0.10 -0.98 0.10 0.00 1.01 0.00 0.00 58.87 59.11 1p7m n SER 133 Cb 0.21 0.00 0.25 0.00 -1.01 0.00 0.00 64.21 63.66 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 -0.99 2.62 -3.36 1.43 4.07 0.19 -4.90 120.64 119.70 1p7m n GLU 134 Ca 0.23 -2.38 -0.38 0.00 -0.06 0.00 0.00 57.16 54.56 1p7m n GLU 134 Cb 0.10 -1.48 -0.07 0.00 -0.06 0.00 0.00 31.44 29.94 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 -1.11 5.19 0.30 6.31 -1.09 -0.99 -4.57 121.20 125.24 1p7m s ILE 135 Ca 0.39 0.78 -0.29 0.00 -2.23 0.00 0.00 60.65 59.30 1p7m s ILE 135 Cb 0.21 -3.76 -0.10 0.00 -1.58 0.00 0.00 42.46 37.24 1p7m s ILE 135 CO 0.28 0.25 1.20 -2.16 -1.23 0.00 0.00 174.94 173.29 1p7m s PRO 136 N 1.23 4.51 0.00 2.79 0.04 -1.26 -4.93 135.00 137.38 1p7m s PRO 136 Ca 0.21 1.99 0.10 0.00 0.04 0.00 0.00 61.00 63.34 1p7m s PRO 136 Cb -0.15 -3.14 0.18 0.00 0.04 0.00 0.00 34.50 31.43 1p7m s PRO 136 CO 0.08 0.02 1.02 -2.37 0.04 0.00 0.00 177.00 175.79 1p7m n THR 137 N 1.09 0.50 -3.33 1.26 5.66 -1.26 -4.80 114.28 113.40 1p7m n THR 137 Ca -0.00 -0.75 -0.20 0.00 -3.05 0.00 0.00 64.05 60.04 1p7m n THR 137 Cb 0.43 0.85 -0.08 0.00 -1.55 0.00 0.00 70.33 69.98 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 -0.91 1.33 0.30 1.09 0.15 -1.26 -4.24 113.70 110.15 1p7m s SER 138 Ca 0.16 -2.06 0.08 0.00 0.70 0.00 0.00 55.95 54.83 1p7m s SER 138 Cb 0.10 0.27 -0.03 0.00 -1.71 0.00 0.00 66.02 64.64 1p7m s SER 138 CO 0.13 -0.23 0.22 0.42 1.20 0.00 0.00 173.24 174.98 1p7m s THR 139 N 0.99 3.81 0.27 6.45 -4.23 -1.26 -4.89 115.64 116.78 1p7m s THR 139 Ca 0.22 -1.46 -0.00 0.00 -1.18 0.00 0.00 61.69 59.27 1p7m s THR 139 Cb -0.11 -3.22 0.26 0.00 1.34 0.00 0.00 72.50 70.77 1p7m s THR 139 CO -0.06 -0.26 1.81 -0.65 -0.54 0.00 0.00 174.62 174.92 1p7m h PRO 140 N 1.42 0.82 -0.29 3.99 0.11 -2.00 0.64 132.00 136.69 1p7m h PRO 140 Ca -0.46 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.49 1p7m h PRO 140 Cb 1.25 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1p7m h PRO 140 CO 0.60 0.54 -0.25 0.00 -0.21 0.00 0.00 178.00 178.69 1p7m h ALA 141 N 1.53 0.42 -0.39 -0.75 0.00 -1.95 -0.31 119.26 117.82 1p7m h ALA 141 Ca 0.47 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1p7m h ALA 141 Cb 0.53 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1p7m h ALA 141 CO -0.29 0.40 0.11 0.77 0.00 0.00 0.00 179.25 180.24 1p7m h SER 142 N 0.42 0.58 -0.41 0.00 0.02 -1.58 0.34 113.55 112.92 1p7m h SER 142 Ca 0.05 -0.22 -0.09 0.00 -0.84 0.00 0.00 61.79 60.70 1p7m h SER 142 Cb 0.81 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.17 1p7m h SER 142 CO 0.06 0.65 -0.05 -0.78 -1.14 0.00 0.00 176.83 175.57 1p7m h ASP 143 N 0.48 0.82 0.50 3.07 3.58 0.30 -1.17 116.42 123.99 1p7m h ASP 143 Ca 0.12 -0.22 -0.15 0.00 0.42 0.00 0.00 57.03 57.19 1p7m h ASP 143 Cb 0.28 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.10 1p7m h ASP 143 CO -0.00 0.91 -0.68 0.00 -2.88 0.00 0.00 179.24 176.59 1p7m h ALA 144 N 1.17 0.79 -0.12 -0.78 0.00 -0.79 -2.75 119.26 116.78 1p7m h ALA 144 Ca 0.14 -0.60 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 1p7m h ALA 144 Cb 0.53 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1p7m h ALA 144 CO 0.03 0.80 0.01 1.25 0.00 0.00 0.00 179.25 181.34 1p7m h LEU 145 N 0.11 0.20 -0.81 0.00 5.85 0.22 0.33 115.31 121.21 1p7m h LEU 145 Ca -0.01 -0.28 0.05 0.00 0.84 0.00 0.00 57.88 58.48 1p7m h LEU 145 Cb 1.21 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 42.13 1p7m h LEU 145 CO 0.10 0.43 0.50 0.28 -0.34 0.00 0.00 178.44 179.40 1p7m h SER 146 N -0.04 0.78 -0.54 1.25 0.02 -1.21 0.34 113.55 114.17 1p7m h SER 146 Ca 0.04 0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 60.94 1p7m h SER 146 Cb 0.32 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 1p7m h SER 146 CO 0.00 0.51 0.10 0.50 -1.14 0.00 0.00 176.83 176.81 1p7m h LYS 147 N 0.92 0.88 -0.11 3.45 3.64 -1.17 0.24 116.57 124.41 1p7m h LYS 147 Ca 0.35 -0.23 -0.03 0.00 -1.27 0.00 0.00 60.65 59.48 1p7m h LYS 147 Cb 0.14 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.85 1p7m h LYS 147 CO -0.16 0.85 -0.03 0.00 -2.27 0.00 0.00 179.45 177.84 1p7m h ALA 148 N 0.99 0.16 -0.77 5.00 0.00 0.72 -2.12 119.26 123.24 1p7m h ALA 148 Ca 0.16 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1p7m h ALA 148 Cb 0.38 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1p7m h ALA 148 CO 0.01 -0.11 0.29 -0.07 0.00 0.00 0.00 179.25 179.37 1p7m h LEU 149 N -0.10 1.08 -1.08 0.00 -0.00 -0.28 -2.29 115.31 112.65 1p7m h LEU 149 Ca 0.03 -0.18 0.00 0.00 -0.00 0.00 0.00 57.88 57.73 1p7m h LEU 149 Cb 0.44 -0.28 -0.04 0.00 -0.00 0.00 0.00 40.66 40.77 1p7m h LEU 149 CO 0.01 0.97 0.58 0.50 -0.00 0.00 0.00 178.44 180.51 1p7m h LYS 150 N 1.13 1.20 -0.16 1.13 3.64 -0.40 0.65 116.57 123.76 1p7m h LYS 150 Ca 0.25 -0.08 -0.16 0.00 -1.27 0.00 0.00 60.65 59.39 1p7m h LYS 150 Cb 0.24 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1p7m h LYS 150 CO -0.02 0.81 -0.57 0.87 -2.27 0.00 0.00 179.45 178.28 1p7m h LYS 151 N 1.23 0.51 0.00 1.90 1.57 -0.98 -2.69 116.57 118.11 1p7m h LYS 151 Ca 0.33 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1p7m h LYS 151 Cb -0.11 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1p7m h LYS 151 CO -0.07 0.94 0.00 0.54 -0.57 0.00 0.00 179.45 180.29 1p7m n ARG 152 N -3.94 0.39 -0.37 3.15 1.74 -0.90 -4.76 116.66 111.97 1p7m n ARG 152 Ca -0.03 0.05 0.00 0.00 -0.77 0.00 0.00 57.85 57.10 1p7m n ARG 152 Cb 0.61 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.55 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 -0.04 0.78 3.52 -0.13 0.00 -1.01 -4.58 105.19 103.73 1p7m n GLY 153 Ca 0.10 -0.32 -0.43 0.00 0.00 0.00 0.00 46.02 45.38 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 3.12 0.55 1.61 0.40 0.18 -4.48 117.98 117.36 1p7m s PHE 154 Ca 0.00 -0.07 0.06 0.00 -0.60 0.00 0.00 56.93 56.32 1p7m s PHE 154 Cb 0.00 -3.13 0.06 0.00 0.51 0.00 0.00 43.02 40.46 1p7m s PHE 154 CO 0.00 -0.74 0.75 0.15 0.70 0.00 0.00 175.22 176.08 1p7m s LYS 155 N 2.54 2.41 -0.92 0.44 1.02 -1.26 -3.73 119.74 120.24 1p7m s LYS 155 Ca 0.19 -1.26 -0.05 0.00 0.02 0.00 0.00 55.97 54.87 1p7m s LYS 155 Cb -0.15 -2.60 -0.05 0.00 -0.52 0.00 0.00 37.83 34.50 1p7m s LYS 155 CO 0.16 -0.75 0.81 1.19 -0.92 0.00 0.00 175.35 175.85 1p7m n PHE 156 N -2.24 -2.33 -2.71 3.18 3.72 -1.26 -4.96 117.46 110.86 1p7m n PHE 156 Ca 0.12 0.83 -0.05 0.00 -0.05 0.00 0.00 57.45 58.29 1p7m n PHE 156 Cb 0.60 -3.98 0.04 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 -2.87 1.40 -0.87 -4.37 0.24 -1.26 -4.49 118.33 106.10 1p7m n VAL 157 Ca -0.05 -3.14 -0.32 0.00 -2.04 0.00 0.00 64.34 58.79 1p7m n VAL 157 Cb 0.59 0.86 0.03 0.00 -1.47 0.00 0.00 33.84 33.86 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 -0.53 -3.99 0.31 7.63 0.00 -1.26 -4.05 105.19 103.30 1p7m n GLY 158 Ca 0.12 -0.66 0.13 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.87 0.89 0.06 2.61 2.02 -1.95 0.33 112.91 115.99 1p7m h THR 159 Ca -0.38 -0.00 -0.24 0.00 0.77 0.00 0.00 66.41 66.56 1p7m h THR 159 Cb 1.14 0.89 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 1p7m h THR 159 CO 0.20 0.00 -1.06 0.74 0.37 0.00 0.00 175.52 175.77 1p7m h THR 160 N 0.00 1.46 -0.33 3.16 2.02 -1.85 -2.85 112.91 114.52 1p7m h THR 160 Ca 0.11 -2.75 -0.13 0.00 0.77 0.00 0.00 66.41 64.40 1p7m h THR 160 Cb 0.42 2.66 -0.01 0.00 -1.74 0.00 0.00 68.15 69.48 1p7m h THR 160 CO -0.00 0.81 -0.34 0.40 0.37 0.00 0.00 175.52 176.76 1p7m h ILE 161 N 0.14 1.28 -0.15 3.11 2.04 -1.27 0.12 117.51 122.79 1p7m h ILE 161 Ca -0.10 -1.49 -0.03 0.00 1.00 0.00 0.00 64.86 64.24 1p7m h ILE 161 Cb 1.74 1.39 -0.00 0.00 -0.74 0.00 0.00 36.82 39.20 1p7m h ILE 161 CO 0.18 0.49 -0.03 0.00 0.00 0.00 0.00 178.15 178.78 1p7m h TYR 163 N -0.00 0.91 -0.78 0.00 3.20 -1.45 -2.85 116.97 116.00 1p7m h TYR 163 Ca 0.04 -0.19 0.03 0.00 3.14 0.00 0.00 58.73 61.75 1p7m h TYR 163 Cb 0.46 -0.22 -0.05 0.00 1.54 0.00 0.00 36.73 38.45 1p7m h TYR 163 CO 0.05 0.92 0.50 0.77 -1.64 0.00 0.00 178.16 178.76 1p7m h SER 164 N 0.64 0.82 -0.84 -2.11 0.02 -0.70 -1.65 113.55 109.73 1p7m h SER 164 Ca 0.11 -0.00 0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1p7m h SER 164 Cb 0.62 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.93 1p7m h SER 164 CO 0.04 0.57 0.56 0.15 -1.14 0.00 0.00 176.83 177.01 1p7m h PHE 165 N 0.97 1.05 -0.48 3.45 3.57 -1.13 -2.30 116.94 122.06 1p7m h PHE 165 Ca 0.31 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.79 1p7m h PHE 165 Cb 0.00 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 38.36 1p7m h PHE 165 CO -0.03 0.65 0.11 0.52 -2.23 0.00 0.00 178.31 177.34 1p7m h MET 166 N 1.12 0.73 -0.63 1.11 2.86 -1.08 0.89 114.93 119.94 1p7m h MET 166 Ca 0.31 -0.14 0.04 0.00 -2.06 0.00 0.00 59.70 57.86 1p7m h MET 166 Cb -0.10 -0.12 -0.05 0.00 0.06 0.00 0.00 31.60 31.40 1p7m h MET 166 CO -0.07 0.67 0.36 1.96 1.06 0.00 0.00 176.91 180.88 1p7m h GLN 167 N 0.71 0.67 0.00 1.72 4.20 -1.18 -2.42 115.11 118.80 1p7m h GLN 167 Ca 0.16 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1p7m h GLN 167 Cb 0.27 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.90 1p7m h GLN 167 CO -0.00 0.44 -0.88 0.00 -0.67 0.00 0.00 178.83 177.72 1p7m h ALA 168 N 1.31 0.51 0.00 3.87 0.00 -1.56 -3.20 119.26 120.19 1p7m h ALA 168 Ca 0.27 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 1p7m h ALA 168 Cb 0.11 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1p7m h ALA 168 CO -0.15 0.00 -0.10 0.00 0.00 0.00 0.00 179.25 179.00 1p7m n GLY 170 N -0.92 0.43 0.32 0.00 0.00 -1.16 -3.98 105.19 99.89 1p7m n GLY 170 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 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 0.82 -8.09 0.99 3.38 -1.83 -3.43 115.31 107.14 1p7m h LEU 171 Ca 0.00 -0.10 -0.45 0.00 0.09 0.00 0.00 57.88 57.41 1p7m h LEU 171 Cb 0.00 -0.21 -0.30 0.00 0.09 0.00 0.00 40.66 40.24 1p7m h LEU 171 CO 0.00 0.73 -0.80 0.68 0.09 0.00 0.00 178.44 179.14 1p7m s VAL 172 N -5.43 0.94 -0.05 1.22 -7.23 -1.25 -1.01 120.40 107.59 1p7m s VAL 172 Ca -0.10 -0.48 0.06 0.00 -1.81 0.00 0.00 61.98 59.64 1p7m s VAL 172 Cb 0.16 -0.80 -0.01 0.00 0.56 0.00 0.00 36.38 36.29 1p7m s VAL 172 CO 0.80 0.27 -0.23 0.20 -0.31 0.00 0.00 175.10 175.83 1p7m s ASN 173 N -0.10 2.81 0.00 4.85 0.01 -0.62 -4.79 114.94 117.10 1p7m s ASN 173 Ca 0.01 -0.46 0.00 0.00 -0.71 0.00 0.00 52.86 51.70 1p7m s ASN 173 Cb -0.06 -0.71 0.00 0.00 0.41 0.00 0.00 41.25 40.89 1p7m s ASN 173 CO 0.00 0.23 0.00 -0.67 -1.51 0.00 0.00 177.10 175.15 1p7m n ASP 174 N 2.93 0.00 0.00 -1.22 -0.08 -1.26 -2.90 116.55 114.01 1p7m n ASP 174 Ca -0.17 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.11 1p7m n ASP 174 Cb 0.52 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.98 1p7m n ASP 174 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 1p7m n HIS 175 N 0.00 0.00 -2.70 -0.67 8.25 -1.26 -0.89 115.22 117.95 1p7m n HIS 175 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.42 1p7m n HIS 175 Cb 0.00 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.15 1p7m n HIS 175 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1p7m n VAL 176 N 0.00 1.48 -1.68 1.59 0.24 -1.26 -4.81 118.33 113.89 1p7m n VAL 176 Ca 0.00 -3.14 0.00 0.00 -2.04 0.00 0.00 64.34 59.16 1p7m n VAL 176 Cb 0.00 0.89 0.00 0.00 -1.47 0.00 0.00 33.84 33.26 1p7m n VAL 176 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 1p7m n VAL 177 N -0.62 0.00 -2.27 3.34 3.14 -0.07 -4.36 118.33 117.49 1p7m n VAL 177 Ca 0.13 0.00 -0.04 0.00 -2.96 0.00 0.00 64.34 61.47 1p7m n VAL 177 Cb 0.83 0.00 0.02 0.00 -1.06 0.00 0.00 33.84 33.63 1p7m n VAL 177 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1p7m n GLY 178 N -0.28 0.99 3.73 7.55 0.00 -1.26 -5.00 105.19 110.92 1p7m n GLY 178 Ca 0.00 -0.07 -0.37 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 -3.95 3.73 0.12 0.00 5.04 0.13 -4.99 117.35 117.44 1p7m s TYR 182 Ca -0.04 1.72 -0.31 0.00 -2.44 0.00 0.00 57.07 56.00 1p7m s TYR 182 Cb 0.13 -3.15 -0.08 0.00 0.35 0.00 0.00 41.96 39.21 1p7m s TYR 182 CO 0.79 -0.13 1.43 -1.25 -1.34 0.00 0.00 175.55 175.04 1p7m s PRO 183 N -0.30 4.30 0.00 4.97 0.04 -1.26 -4.57 135.00 138.18 1p7m s PRO 183 Ca 0.47 2.13 0.07 0.00 0.04 0.00 0.00 61.00 63.71 1p7m s PRO 183 Cb -0.26 -3.25 0.39 0.00 0.04 0.00 0.00 34.50 31.42 1p7m s PRO 183 CO 0.32 -0.48 0.92 0.41 0.04 0.00 0.00 177.00 178.21 1p7m n GLY 184 N 3.56 -0.60 2.47 0.56 0.00 -1.26 -4.77 105.19 105.15 1p7m n GLY 184 Ca 0.12 -0.04 -0.20 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.67 -5.49 -3.55 1.61 3.02 -1.26 -3.20 115.26 105.72 1p7m n ASN 185 Ca 0.05 0.25 -0.24 0.00 -0.03 0.00 0.00 54.58 54.61 1p7m n ASN 185 Cb 0.02 -4.72 0.01 0.00 -0.61 0.00 0.00 39.78 34.49 1p7m n ASN 185 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1p7m n LYS 186 N -2.66 -1.68 0.00 3.52 4.01 -1.26 -5.35 118.16 114.74 1p7m n LYS 186 Ca -0.22 1.14 0.06 0.00 -0.51 0.00 0.00 58.31 58.78 1p7m n LYS 186 Cb 0.67 -2.97 0.36 0.00 -0.51 0.00 0.00 35.03 32.57 1p7m n LYS 186 CO 0.00 0.00 0.00 -2.30 -1.11 0.00 0.00 177.40 173.99