#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p7m s GLU 2 N 0.00 2.56 0.39 0.03 -1.05 -1.21 -4.82 118.70 114.60 1p7m s GLU 2 Ca 0.00 -0.87 0.08 0.00 -0.15 0.00 0.00 54.97 54.02 1p7m s GLU 2 Cb 0.00 -2.53 -0.02 0.00 -0.44 0.00 0.00 34.13 31.14 1p7m s GLU 2 CO 0.00 -0.67 0.34 1.03 0.95 0.00 0.00 175.26 176.91 1p7m s ARG 3 N -4.71 2.57 0.69 -4.83 0.52 -1.26 -1.48 118.95 110.45 1p7m s ARG 3 Ca 0.57 -1.48 -0.16 0.00 -0.52 0.00 0.00 55.73 54.15 1p7m s ARG 3 Cb -0.10 -2.39 0.02 0.00 0.52 0.00 0.00 34.95 33.00 1p7m s ARG 3 CO 0.38 -0.10 1.19 0.00 0.02 0.00 0.00 175.30 176.79 1p7m h GLY 5 N 0.00 0.87 0.75 0.00 0.00 -1.98 -1.63 103.07 101.08 1p7m h GLY 5 Ca -0.48 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.50 1p7m h GLY 5 CO 0.52 0.34 -0.07 -2.67 0.00 0.00 0.00 176.54 174.65 1p7m n TRP 6 N -4.63 0.00 0.10 5.60 2.14 -1.26 -3.35 117.44 116.04 1p7m n TRP 6 Ca 0.04 0.00 -0.16 0.00 2.07 0.00 0.00 57.50 59.45 1p7m n TRP 6 Cb 0.04 -0.13 -0.14 0.00 -0.81 0.00 0.00 31.31 30.27 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 0.69 1.43 0.00 -1.67 2.07 -1.65 -2.96 116.25 114.16 1p7m h VAL 7 Ca 0.00 -3.01 0.00 0.00 0.82 0.00 0.00 66.70 64.51 1p7m h VAL 7 Cb 0.31 2.91 0.00 0.00 -1.52 0.00 0.00 31.29 32.99 1p7m h VAL 7 CO 0.00 0.88 0.00 -1.20 0.02 0.00 0.00 177.57 177.27 1p7m n SER 8 N -3.52 0.00 -1.40 0.57 7.64 -1.07 -4.49 113.62 111.35 1p7m n SER 8 Ca -0.10 -1.26 0.00 0.00 1.01 0.00 0.00 58.87 58.52 1p7m n SER 8 Cb 1.03 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.23 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 2.15 -1.12 1.43 1.13 -1.12 -5.00 117.38 114.11 1p7m n GLN 9 Ca 0.10 0.00 -0.36 0.00 -1.94 0.00 0.00 57.00 54.80 1p7m n GLN 9 Cb 0.05 0.00 0.05 0.00 0.11 0.00 0.00 30.24 30.45 1p7m n GLN 9 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 1p7m n ASP 10 N 0.00 -3.55 0.21 1.08 5.68 -1.26 -4.76 116.55 113.95 1p7m n ASP 10 Ca 0.00 0.44 0.15 0.00 -0.50 0.00 0.00 54.79 54.88 1p7m n ASP 10 Cb 0.00 -0.97 0.74 0.00 -1.14 0.00 0.00 41.12 39.75 1p7m n ASP 10 CO 0.00 0.00 0.00 1.55 -1.33 0.00 0.00 177.20 177.42 1p7m h PRO 11 N -0.63 0.00 -0.98 0.11 0.13 -1.94 -2.90 132.00 125.80 1p7m h PRO 11 Ca -0.44 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.74 1p7m h PRO 11 Cb 1.35 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.42 1p7m h PRO 11 CO 0.35 0.00 0.64 -0.07 -0.23 0.00 0.00 178.00 178.69 1p7m h LEU 12 N 0.00 1.06 -0.77 1.56 3.38 -1.95 -1.18 115.31 117.41 1p7m h LEU 12 Ca 0.00 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 1p7m h LEU 12 Cb 0.14 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1p7m h LEU 12 CO 0.00 0.72 -0.26 1.88 0.09 0.00 0.00 178.44 180.86 1p7m h TYR 13 N 1.22 0.73 -0.56 1.13 0.05 -1.75 -2.81 116.97 114.98 1p7m h TYR 13 Ca 0.40 -0.17 0.03 0.00 0.05 0.00 0.00 58.73 59.04 1p7m h TYR 13 Cb 0.04 -0.17 -0.04 0.00 1.01 0.00 0.00 36.73 37.57 1p7m h TYR 13 CO -0.00 0.84 0.33 0.82 -1.05 0.00 0.00 178.16 179.10 1p7m h ILE 14 N 0.55 1.04 0.01 -2.88 2.04 -1.37 1.36 117.51 118.26 1p7m h ILE 14 Ca 0.07 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 1p7m h ILE 14 Cb 0.74 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1p7m h ILE 14 CO 0.06 0.12 -0.00 0.00 0.00 0.00 0.00 178.15 178.32 1p7m h ALA 15 N 1.26 -0.01 -0.34 1.87 0.00 -1.38 -2.62 119.26 118.03 1p7m h ALA 15 Ca 0.23 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1p7m h ALA 15 Cb 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1p7m h ALA 15 CO -0.11 -0.33 -0.16 -0.92 0.00 0.00 0.00 179.25 177.73 1p7m h TYR 16 N -0.37 0.69 -0.80 0.00 3.20 -1.30 -2.12 116.97 116.27 1p7m h TYR 16 Ca -0.00 -0.13 -0.02 0.00 3.14 0.00 0.00 58.73 61.72 1p7m h TYR 16 Cb 0.36 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 1p7m h TYR 16 CO 0.05 0.75 0.44 1.25 -1.64 0.00 0.00 178.16 179.01 1p7m h HIS 17 N 0.56 1.10 -0.02 -3.82 2.76 0.19 -2.86 115.15 113.06 1p7m h HIS 17 Ca 0.09 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.24 1p7m h HIS 17 Cb 0.60 -0.35 0.00 0.00 1.55 0.00 0.00 27.41 29.21 1p7m h HIS 17 CO 0.03 0.77 -0.14 -0.25 -1.30 0.00 0.00 177.93 177.04 1p7m n ASP 18 N -4.41 2.21 -0.08 3.26 9.92 -1.00 -3.67 116.55 122.78 1p7m n ASP 18 Ca 0.08 -1.65 -0.08 0.00 -0.53 0.00 0.00 54.79 52.61 1p7m n ASP 18 Cb 0.09 0.12 -0.13 0.00 -0.64 0.00 0.00 41.12 40.57 1p7m n ASP 18 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 1p7m n ASN 19 N 0.54 0.86 -0.78 -2.24 2.04 -0.81 -4.83 115.26 110.04 1p7m n ASN 19 Ca 0.14 -0.00 -0.02 0.00 -0.44 0.00 0.00 54.58 54.26 1p7m n ASN 19 Cb 0.49 0.91 -0.02 0.00 -2.53 0.00 0.00 39.78 38.62 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 -2.62 0.00 -2.76 -3.83 1.02 -1.09 -4.86 120.64 106.50 1p7m n GLU 20 Ca -0.27 -0.67 -0.42 0.00 -0.02 0.00 0.00 57.16 55.77 1p7m n GLU 20 Cb 1.05 0.14 0.01 0.00 -0.02 0.00 0.00 31.44 32.62 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 0.05 2.51 -0.11 -0.32 -0.00 -1.21 -4.46 117.44 113.89 1p7m n TRP 21 Ca -0.10 -2.59 0.00 0.00 -0.00 0.00 0.00 57.50 54.81 1p7m n TRP 21 Cb 0.66 -1.30 0.00 0.00 -0.00 0.00 0.00 31.31 30.67 1p7m n TRP 21 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1p7m n GLY 22 N 0.83 0.87 0.00 5.87 0.00 -1.21 -4.97 105.19 106.58 1p7m n GLY 22 Ca 0.38 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1p7m n GLY 22 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1p7m n VAL 23 N -0.10 0.00 -3.83 1.61 0.24 -1.26 -5.00 118.33 109.98 1p7m n VAL 23 Ca 0.00 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 61.99 1p7m n VAL 23 Cb 0.04 0.00 -0.04 0.00 -1.47 0.00 0.00 33.84 32.37 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 -1.00 3.50 0.87 7.34 0.04 -1.26 -5.06 135.00 139.44 1p7m s PRO 24 Ca 0.00 -0.31 -0.12 0.00 0.04 0.00 0.00 61.00 60.61 1p7m s PRO 24 Cb 0.00 -2.97 0.12 0.00 0.04 0.00 0.00 34.50 31.68 1p7m s PRO 24 CO 0.00 0.56 1.11 -1.83 0.04 0.00 0.00 177.00 176.88 1p7m s GLU 25 N -2.56 1.45 -0.19 4.56 -1.05 -1.26 -3.94 118.70 115.71 1p7m s GLU 25 Ca 0.37 0.57 -0.11 0.00 -0.15 0.00 0.00 54.97 55.66 1p7m s GLU 25 Cb -0.13 -1.85 -0.05 0.00 -0.44 0.00 0.00 34.13 31.66 1p7m s GLU 25 CO 0.27 -2.04 0.15 0.95 0.95 0.00 0.00 175.26 175.54 1p7m s THR 26 N -3.12 5.40 0.19 1.83 -4.23 -1.26 -4.87 115.64 109.58 1p7m s THR 26 Ca 0.63 0.24 0.04 0.00 -1.18 0.00 0.00 61.69 61.42 1p7m s THR 26 Cb -0.16 -3.49 -0.03 0.00 1.34 0.00 0.00 72.50 70.16 1p7m s THR 26 CO 0.55 0.44 0.29 -0.62 -0.54 0.00 0.00 174.62 174.74 1p7m s ASP 27 N 0.36 6.20 0.41 3.99 2.15 -1.26 -4.86 116.67 123.65 1p7m s ASP 27 Ca 0.09 0.08 0.11 0.00 0.43 0.00 0.00 52.55 53.26 1p7m s ASP 27 Cb -0.11 -1.82 0.92 0.00 -0.30 0.00 0.00 42.92 41.62 1p7m s ASP 27 CO -0.01 0.00 1.97 0.28 -0.17 0.00 0.00 175.17 177.24 1p7m h SER 28 N 1.77 0.48 -0.45 -0.34 0.02 -1.94 -1.66 113.55 111.43 1p7m h SER 28 Ca -0.50 0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 60.36 1p7m h SER 28 Cb 1.21 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.64 1p7m h SER 28 CO 0.65 0.29 -0.12 0.11 -1.14 0.00 0.00 176.83 176.62 1p7m h LYS 29 N 0.54 0.87 -0.68 3.45 1.79 -2.00 -3.11 116.57 117.42 1p7m h LYS 29 Ca 0.29 -0.34 -0.06 0.00 -2.18 0.00 0.00 60.65 58.37 1p7m h LYS 29 Cb 0.45 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 31.02 1p7m h LYS 29 CO -0.09 0.98 0.20 0.87 -1.08 0.00 0.00 179.45 180.33 1p7m h LYS 30 N 0.71 1.06 -0.56 3.15 1.57 -1.69 -2.48 116.57 118.31 1p7m h LYS 30 Ca 0.11 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 1p7m h LYS 30 Cb 0.67 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.79 1p7m h LYS 30 CO 0.05 0.91 0.31 -0.07 -0.57 0.00 0.00 179.45 180.08 1p7m h LEU 31 N 1.01 0.68 0.02 2.94 3.38 -1.43 0.36 115.31 122.26 1p7m h LEU 31 Ca 0.22 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 1p7m h LEU 31 Cb 0.30 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1p7m h LEU 31 CO -0.01 0.55 -0.01 0.15 0.09 0.00 0.00 178.44 179.22 1p7m h PHE 32 N 0.78 -0.02 -0.57 1.13 3.57 -1.40 -0.92 116.94 119.51 1p7m h PHE 32 Ca 0.20 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.59 1p7m h PHE 32 Cb 0.01 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.74 1p7m h PHE 32 CO 0.00 0.33 -0.07 0.93 -2.23 0.00 0.00 178.31 177.27 1p7m h GLU 33 N -0.37 1.05 0.06 1.11 5.08 -1.31 -2.62 114.58 117.59 1p7m h GLU 33 Ca -0.00 -0.37 -0.00 0.00 -1.00 0.00 0.00 59.36 57.99 1p7m h GLU 33 Cb 0.36 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1p7m h GLU 33 CO 0.00 1.06 -0.03 1.98 -1.00 0.00 0.00 179.01 181.03 1p7m h MET 34 N 0.93 -0.08 0.00 2.33 4.05 -0.91 -2.59 114.93 118.66 1p7m h MET 34 Ca 0.15 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.56 1p7m h MET 34 Cb 0.64 0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.45 1p7m h MET 34 CO 0.04 0.07 -0.09 0.97 0.23 0.00 0.00 176.91 178.14 1p7m h ILE 35 N -0.22 0.81 -0.23 1.77 6.09 -1.14 -1.07 117.51 123.52 1p7m h ILE 35 Ca -0.01 -0.33 -0.06 0.00 -1.37 0.00 0.00 64.86 63.09 1p7m h ILE 35 Cb 0.19 1.19 -0.01 0.00 0.47 0.00 0.00 36.82 38.67 1p7m h ILE 35 CO 0.01 0.09 -0.09 0.00 -3.07 0.00 0.00 178.15 175.09 1p7m h LEU 37 N 0.19 0.56 -1.55 0.00 3.38 -1.13 -2.99 115.31 113.79 1p7m h LEU 37 Ca 0.05 -0.50 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 1p7m h LEU 37 Cb 0.58 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1p7m h LEU 37 CO 0.03 0.96 0.06 -0.33 0.09 0.00 0.00 178.44 179.25 1p7m h GLU 38 N 0.19 0.35 -0.82 1.13 4.39 -1.20 -1.62 114.58 116.99 1p7m h GLU 38 Ca 0.02 -0.05 0.08 0.00 0.34 0.00 0.00 59.36 59.76 1p7m h GLU 38 Cb 0.82 -0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 29.35 1p7m h GLU 38 CO 0.06 0.33 0.54 0.78 -1.16 0.00 0.00 179.01 179.56 1p7m h GLY 39 N 0.56 1.14 0.36 -3.84 0.00 -0.82 0.17 103.07 100.64 1p7m h GLY 39 Ca 0.09 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1p7m h GLY 39 CO -0.00 0.22 -0.11 -1.06 0.00 0.00 0.00 176.54 175.59 1p7m n GLN 40 N -4.50 1.03 0.00 4.80 1.13 -0.64 -3.60 117.38 115.60 1p7m n GLN 40 Ca 0.13 -0.48 0.16 0.00 -1.94 0.00 0.00 57.00 54.87 1p7m n GLN 40 Cb 0.27 -1.49 0.86 0.00 0.11 0.00 0.00 30.24 29.98 1p7m n GLN 40 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 1p7m n GLN 41 N -0.57 1.00 -2.17 -1.09 6.02 0.60 -4.51 117.38 116.66 1p7m n GLN 41 Ca 0.16 -0.13 -0.43 0.00 -0.01 0.00 0.00 57.00 56.59 1p7m n GLN 41 Cb 0.30 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.04 1p7m n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1p7m s ALA 42 N -2.09 3.16 0.00 -1.58 0.00 -1.24 -2.73 121.76 117.28 1p7m s ALA 42 Ca 0.43 0.27 0.00 0.00 0.00 0.00 0.00 51.96 52.67 1p7m s ALA 42 Cb 0.22 -3.89 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1p7m s ALA 42 CO 0.38 -2.15 0.00 0.41 0.00 0.00 0.00 175.76 174.40 1p7m n GLY 43 N 4.86 2.87 3.86 0.00 0.00 -1.26 -5.02 105.19 110.50 1p7m n GLY 43 Ca 0.19 -0.27 -0.28 0.00 0.00 0.00 0.00 46.02 45.66 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 4.09 0.77 0.99 1.02 -1.10 -5.08 118.68 119.36 1p7m s LEU 44 Ca 0.00 0.08 -0.13 0.00 0.02 0.00 0.00 54.13 54.10 1p7m s LEU 44 Cb 0.00 -2.71 0.06 0.00 0.02 0.00 0.00 46.19 43.56 1p7m s LEU 44 CO 0.00 0.11 1.15 -0.44 0.02 0.00 0.00 176.35 177.20 1p7m s SER 45 N -2.82 4.10 0.37 2.29 0.01 -1.26 -4.75 113.70 111.64 1p7m s SER 45 Ca 0.33 2.16 0.04 0.00 1.31 0.00 0.00 55.95 59.79 1p7m s SER 45 Cb -0.12 -2.56 0.72 0.00 0.21 0.00 0.00 66.02 64.27 1p7m s SER 45 CO 0.26 -2.31 2.01 -0.25 0.41 0.00 0.00 173.24 173.35 1p7m h TRP 46 N -0.77 0.64 -0.05 2.43 2.91 -1.98 -2.05 115.95 117.09 1p7m h TRP 46 Ca -0.46 0.00 -0.08 0.00 1.13 0.00 0.00 58.89 59.48 1p7m h TRP 46 Cb 1.27 -0.21 -0.01 0.00 -0.51 0.00 0.00 29.16 29.69 1p7m h TRP 46 CO 0.51 0.44 -0.36 0.82 -1.03 0.00 0.00 178.44 178.82 1p7m h ILE 47 N 0.68 1.27 -0.79 2.65 1.08 -2.00 -2.62 117.51 117.78 1p7m h ILE 47 Ca 0.18 -1.30 0.04 0.00 -0.39 0.00 0.00 64.86 63.39 1p7m h ILE 47 Cb -0.01 1.64 -0.05 0.00 -3.07 0.00 0.00 36.82 35.33 1p7m h ILE 47 CO -0.03 0.38 0.49 0.74 -0.69 0.00 0.00 178.15 179.04 1p7m h THR 48 N 0.08 1.08 -0.06 -0.27 2.02 -1.72 -0.95 112.91 113.10 1p7m h THR 48 Ca 0.01 -0.32 -0.13 0.00 0.77 0.00 0.00 66.41 66.73 1p7m h THR 48 Cb 0.68 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 1p7m h THR 48 CO 0.05 0.17 -0.55 1.62 0.37 0.00 0.00 175.52 177.18 1p7m h VAL 49 N 0.94 1.38 -0.29 3.16 3.04 -1.52 -2.99 116.25 119.96 1p7m h VAL 49 Ca 0.33 -1.88 0.05 0.00 -1.01 0.00 0.00 66.70 64.19 1p7m h VAL 49 Cb 0.07 1.95 -0.05 0.00 -2.01 0.00 0.00 31.29 31.25 1p7m h VAL 49 CO -0.13 0.55 -0.01 0.25 -1.01 0.00 0.00 177.57 177.22 1p7m h LEU 50 N 0.13 -0.13 -0.76 3.16 5.85 -0.82 1.75 115.31 124.49 1p7m h LEU 50 Ca -0.00 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.82 1p7m h LEU 50 Cb 1.02 0.12 -0.05 0.00 0.37 0.00 0.00 40.66 42.12 1p7m h LEU 50 CO 0.08 -0.03 0.47 0.11 -0.34 0.00 0.00 178.44 178.74 1p7m h LYS 51 N 0.08 0.89 -0.07 1.25 1.57 -1.42 0.16 116.57 119.03 1p7m h LYS 51 Ca 0.14 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.81 1p7m h LYS 51 Cb 0.19 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1p7m h LYS 51 CO -0.24 0.59 -0.23 -0.22 -0.57 0.00 0.00 179.45 178.78 1p7m h LYS 52 N 0.91 0.12 -0.66 3.15 3.64 -0.79 -2.77 116.57 120.17 1p7m h LYS 52 Ca 0.31 -0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.75 1p7m h LYS 52 Cb 0.04 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 31.78 1p7m h LYS 52 CO -0.12 0.35 0.30 -0.09 -2.27 0.00 0.00 179.45 177.61 1p7m h ARG 53 N 0.11 0.50 -0.36 1.90 2.43 0.56 1.41 114.38 120.92 1p7m h ARG 53 Ca 0.02 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.01 1p7m h ARG 53 Cb 0.47 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 1p7m h ARG 53 CO 0.03 0.33 -0.38 1.49 -1.51 0.00 0.00 179.97 179.94 1p7m h GLU 54 N 0.51 0.86 -0.08 0.20 4.57 -1.33 -2.74 114.58 116.57 1p7m h GLU 54 Ca 0.33 -0.44 -0.17 0.00 -1.18 0.00 0.00 59.36 57.89 1p7m h GLU 54 Cb 0.37 0.01 0.01 0.00 -0.16 0.00 0.00 28.75 28.98 1p7m h GLU 54 CO -0.28 1.08 -0.63 -0.97 -1.18 0.00 0.00 179.01 177.04 1p7m h ASN 55 N 0.70 0.69 -0.00 1.04 -1.24 -1.07 -2.96 115.58 112.75 1p7m h ASN 55 Ca 0.06 -0.67 -0.00 0.00 0.71 0.00 0.00 56.30 56.40 1p7m h ASN 55 Cb 0.95 -0.21 -0.00 0.00 0.73 0.00 0.00 38.32 39.79 1p7m h ASN 55 CO 0.09 1.26 0.00 0.22 -1.29 0.00 0.00 177.43 177.71 1p7m h TYR 56 N 0.18 0.00 -0.11 0.67 5.03 0.18 -1.86 116.97 121.06 1p7m h TYR 56 Ca -0.06 0.00 0.01 0.00 2.58 0.00 0.00 58.73 61.26 1p7m h TYR 56 Cb 1.28 -0.00 -0.01 0.00 1.55 0.00 0.00 36.73 39.56 1p7m h TYR 56 CO 0.11 0.04 0.07 0.07 -1.32 0.00 0.00 178.16 177.14 1p7m h ARG 57 N -0.03 0.10 -0.68 1.82 0.11 -1.58 -1.48 114.38 112.64 1p7m h ARG 57 Ca 0.00 -0.01 0.02 0.00 0.10 0.00 0.00 59.98 60.09 1p7m h ARG 57 Cb 0.04 -0.02 -0.04 0.00 1.11 0.00 0.00 29.97 31.06 1p7m h ARG 57 CO -0.00 0.07 0.44 0.00 0.10 0.00 0.00 179.97 180.58 1p7m h ALA 58 N 1.94 0.87 -0.03 0.08 0.00 -1.16 2.99 119.26 123.95 1p7m h ALA 58 Ca 0.04 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.76 1p7m h ALA 58 Cb 0.05 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.60 1p7m h ALA 58 CO -0.01 0.24 -0.60 0.00 0.00 0.00 0.00 179.25 178.89 1p7m n PHE 60 N -4.20 1.63 -0.09 0.00 3.01 -0.69 -4.59 117.46 112.52 1p7m n PHE 60 Ca -0.10 -0.58 0.23 0.00 1.01 0.00 0.00 57.45 58.02 1p7m n PHE 60 Cb 0.66 -0.39 0.44 0.00 -0.01 0.00 0.00 39.48 40.19 1p7m n PHE 60 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1p7m h HIS 61 N 3.37 0.00 -0.86 1.38 2.76 0.54 0.25 115.15 122.60 1p7m h HIS 61 Ca 0.00 0.00 0.25 0.00 -2.20 0.00 0.00 60.37 58.42 1p7m h HIS 61 Cb 1.62 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 30.55 1p7m h HIS 61 CO 0.85 0.00 0.63 1.96 -1.30 0.00 0.00 177.93 180.08 1p7m h GLN 62 N 0.00 0.00 -5.81 5.26 1.08 -1.81 -3.45 115.11 110.38 1p7m h GLN 62 Ca 0.38 0.00 -0.36 0.00 -1.45 0.00 0.00 58.65 57.22 1p7m h GLN 62 Cb 2.49 0.00 0.13 0.00 -0.05 0.00 0.00 27.48 30.05 1p7m h GLN 62 CO -0.00 0.00 -0.80 1.19 -0.95 0.00 0.00 178.83 178.27 1p7m n PHE 63 N -4.21 -2.09 -3.37 2.96 3.01 0.88 -4.97 117.46 109.67 1p7m n PHE 63 Ca 0.18 0.89 -0.26 0.00 1.01 0.00 0.00 57.45 59.27 1p7m n PHE 63 Cb 0.94 -4.78 -0.10 0.00 -0.01 0.00 0.00 39.48 35.53 1p7m n PHE 63 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1p7m s ASP 64 N -4.32 1.35 0.63 4.37 -1.08 -1.26 -4.98 116.67 111.38 1p7m s ASP 64 Ca 0.02 -2.97 0.14 0.00 -0.52 0.00 0.00 52.55 49.23 1p7m s ASP 64 Cb -0.00 -0.33 0.51 0.00 -1.46 0.00 0.00 42.92 41.63 1p7m s ASP 64 CO 0.76 -0.17 1.17 -0.65 0.52 0.00 0.00 175.17 176.80 1p7m h PRO 65 N 5.67 0.00 -0.38 4.34 0.11 -1.96 0.30 132.00 140.08 1p7m h PRO 65 Ca 0.25 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.31 1p7m h PRO 65 Cb 0.92 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.02 1p7m h PRO 65 CO 0.35 0.00 0.02 0.28 -0.21 0.00 0.00 178.00 178.44 1p7m h VAL 66 N 0.00 1.25 -0.20 3.15 2.07 -1.93 -2.62 116.25 117.97 1p7m h VAL 66 Ca 0.26 -0.95 -0.07 0.00 0.82 0.00 0.00 66.70 66.76 1p7m h VAL 66 Cb 2.48 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 33.36 1p7m h VAL 66 CO -0.00 0.32 -0.19 0.07 0.02 0.00 0.00 177.57 177.78 1p7m h LYS 67 N 0.48 0.35 -0.85 1.57 2.10 -0.83 -2.46 116.57 116.94 1p7m h LYS 67 Ca 0.11 -0.11 0.00 0.00 -2.00 0.00 0.00 60.65 58.66 1p7m h LYS 67 Cb 0.43 -0.03 -0.04 0.00 -0.90 0.00 0.00 32.23 31.68 1p7m h LYS 67 CO 0.02 0.54 0.55 0.28 -2.00 0.00 0.00 179.45 178.83 1p7m h VAL 68 N 0.32 1.22 0.00 0.07 2.07 -1.48 1.14 116.25 119.60 1p7m h VAL 68 Ca 0.06 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1p7m h VAL 68 Cb 0.53 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.29 1p7m h VAL 68 CO 0.03 0.22 0.00 0.00 0.02 0.00 0.00 177.57 177.85 1p7m h ALA 69 N 1.45 1.00 0.00 1.67 0.00 -1.10 0.67 119.26 122.95 1p7m h ALA 69 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1p7m h ALA 69 Cb -0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1p7m h ALA 69 CO -0.06 0.00 -1.49 0.00 0.00 0.00 0.00 179.25 177.70 1p7m n ALA 70 N -2.04 3.63 -2.07 0.00 0.00 0.28 -4.85 120.51 115.46 1p7m n ALA 70 Ca -0.01 -0.53 -0.43 0.00 0.00 0.00 0.00 53.44 52.46 1p7m n ALA 70 Cb 0.16 -0.79 -0.03 0.00 0.00 0.00 0.00 19.45 18.79 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 -3.28 3.69 0.57 0.00 -1.94 0.32 -4.97 119.30 113.69 1p7m s MET 71 Ca -0.00 1.64 0.04 0.00 -1.71 0.00 0.00 55.69 55.66 1p7m s MET 71 Cb 0.15 -4.08 0.07 0.00 2.01 0.00 0.00 34.83 32.97 1p7m s MET 71 CO 0.88 -1.43 0.79 -1.14 -0.01 0.00 0.00 175.02 174.11 1p7m s GLN 72 N 4.92 2.33 0.49 2.03 0.74 -1.26 -4.91 119.66 124.00 1p7m s GLN 72 Ca 0.74 -1.19 0.25 0.00 0.05 0.00 0.00 55.36 55.21 1p7m s GLN 72 Cb -0.25 -2.55 1.30 0.00 1.10 0.00 0.00 33.01 32.61 1p7m s GLN 72 CO 0.31 -0.84 1.90 0.93 -0.55 0.00 0.00 175.29 177.04 1p7m h GLU 73 N 0.08 0.17 -0.54 1.67 5.08 -1.99 0.13 114.58 119.17 1p7m h GLU 73 Ca -0.37 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.03 1p7m h GLU 73 Cb 1.28 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.45 1p7m h GLU 73 CO 0.45 0.11 0.28 1.49 -1.00 0.00 0.00 179.01 180.33 1p7m h GLU 74 N 0.17 0.51 -0.50 2.33 4.57 -1.99 0.13 114.58 119.81 1p7m h GLU 74 Ca 0.41 -0.03 -0.09 0.00 -1.18 0.00 0.00 59.36 58.47 1p7m h GLU 74 Cb 1.35 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 29.80 1p7m h GLU 74 CO -0.08 0.34 -0.06 -0.44 -1.18 0.00 0.00 179.01 177.60 1p7m h ASP 75 N 0.53 0.86 -0.36 1.04 3.32 -1.12 -2.50 116.42 118.19 1p7m h ASP 75 Ca 0.24 -0.25 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1p7m h ASP 75 Cb 0.15 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 1p7m h ASP 75 CO -0.17 0.96 0.18 0.58 -1.72 0.00 0.00 179.24 179.07 1p7m h VAL 76 N 0.80 1.15 -0.39 -1.35 2.07 -0.60 -0.53 116.25 117.41 1p7m h VAL 76 Ca 0.14 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 1p7m h VAL 76 Cb 0.56 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 1p7m h VAL 76 CO 0.03 0.16 0.18 1.05 0.02 0.00 0.00 177.57 179.01 1p7m h GLU 77 N 0.44 0.55 -0.15 1.57 4.11 -0.66 0.60 114.58 121.03 1p7m h GLU 77 Ca 0.12 -0.06 -0.01 0.00 0.07 0.00 0.00 59.36 59.48 1p7m h GLU 77 Cb 0.09 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1p7m h GLU 77 CO -0.02 0.44 0.05 -0.09 0.07 0.00 0.00 179.01 179.46 1p7m h ARG 78 N 0.55 0.24 -0.15 1.06 2.43 -0.91 -2.99 114.38 114.61 1p7m h ARG 78 Ca 0.14 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 59.12 1p7m h ARG 78 Cb 0.08 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 1p7m h ARG 78 CO -0.02 0.35 -0.52 -0.07 -1.51 0.00 0.00 179.97 178.20 1p7m h LEU 79 N 0.08 0.45 -0.92 3.80 3.38 -0.23 -2.65 115.31 119.21 1p7m h LEU 79 Ca 0.05 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1p7m h LEU 79 Cb 0.21 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1p7m h LEU 79 CO -0.00 0.89 0.51 0.58 0.09 0.00 0.00 178.44 180.50 1p7m h VAL 80 N 0.32 0.00 0.00 1.22 2.07 0.33 1.97 116.25 122.16 1p7m h VAL 80 Ca 0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.53 1p7m h VAL 80 Cb 1.02 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1p7m h VAL 80 CO 0.09 0.00 -0.67 0.00 0.02 0.00 0.00 177.57 177.01 1p7m n GLN 81 N -2.34 3.04 -2.73 1.57 6.02 -1.02 -4.37 117.38 117.55 1p7m n GLN 81 Ca -0.01 -0.02 -0.43 0.00 -0.01 0.00 0.00 57.00 56.53 1p7m n GLN 81 Cb 0.53 -1.02 -0.03 0.00 1.02 0.00 0.00 30.24 30.74 1p7m n GLN 81 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1p7m s ASP 82 N -2.18 6.54 0.00 1.08 2.15 0.67 -3.64 116.67 121.28 1p7m s ASP 82 Ca 0.02 0.22 0.00 0.00 0.43 0.00 0.00 52.55 53.22 1p7m s ASP 82 Cb 0.07 -2.49 0.00 0.00 -0.30 0.00 0.00 42.92 40.20 1p7m s ASP 82 CO 0.40 -1.15 0.00 0.00 -0.17 0.00 0.00 175.17 174.25 1p7m n ALA 83 N 7.48 0.00 -2.40 3.66 0.00 -1.26 -3.46 120.51 124.53 1p7m n ALA 83 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.51 1p7m n ALA 83 Cb 0.49 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.91 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 -1.85 0.70 3.03 0.00 0.00 -1.24 -5.01 105.19 100.81 1p7m n GLY 84 Ca 0.00 -0.69 -0.22 0.00 0.00 0.00 0.00 46.02 45.11 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 -3.07 0.00 -1.55 -0.61 -5.35 -1.22 -4.42 119.36 103.13 1p7m n ILE 85 Ca -0.00 -0.08 -0.26 0.00 -0.27 0.00 0.00 62.75 62.14 1p7m n ILE 85 Cb 0.51 -0.36 -0.06 0.00 -1.74 0.00 0.00 39.64 37.99 1p7m n ILE 85 CO 0.00 0.00 0.00 -0.38 -1.76 0.00 0.00 176.55 174.41 1p7m n ILE 86 N -4.05 -0.05 -1.67 7.28 5.41 -1.26 -4.82 119.36 120.20 1p7m n ILE 86 Ca 0.03 -0.64 -0.47 0.00 1.00 0.00 0.00 62.75 62.66 1p7m n ILE 86 Cb 0.42 -2.30 -0.05 0.00 -0.71 0.00 0.00 39.64 37.01 1p7m n ILE 86 CO 0.00 0.00 0.00 -2.11 0.00 0.00 0.00 176.55 174.44 1p7m n ARG 87 N 8.80 2.12 0.00 0.38 1.85 -1.26 -4.80 116.66 123.75 1p7m n ARG 87 Ca 0.43 0.77 0.00 0.00 -1.00 0.00 0.00 57.85 58.05 1p7m n ARG 87 Cb 0.47 -2.57 0.00 0.00 -1.05 0.00 0.00 32.46 29.30 1p7m n ARG 87 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1p7m n HIS 88 N 4.98 0.00 -0.30 2.89 8.25 -1.26 -5.00 115.22 124.77 1p7m n HIS 88 Ca 0.20 0.00 0.30 0.00 -0.26 0.00 0.00 57.72 57.96 1p7m n HIS 88 Cb 0.29 0.00 0.66 0.00 1.12 0.00 0.00 29.99 32.06 1p7m n HIS 88 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1p7m h ARG 89 N 0.00 0.14 0.37 -0.41 2.43 -1.94 0.12 114.38 115.09 1p7m h ARG 89 Ca 0.00 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.14 1p7m h ARG 89 Cb 0.00 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 1p7m h ARG 89 CO 0.00 0.09 -0.18 0.78 -1.51 0.00 0.00 179.97 179.15 1p7m h GLY 90 N 0.14 -0.52 1.02 2.80 0.00 -1.98 0.28 103.07 104.81 1p7m h GLY 90 Ca 0.56 0.19 0.00 0.00 0.00 0.00 0.00 47.33 48.08 1p7m h GLY 90 CO -0.11 -0.19 0.61 0.50 0.00 0.00 0.00 176.54 177.35 1p7m h LYS 91 N -0.54 1.30 -0.98 4.80 1.57 -1.79 -1.65 116.57 119.28 1p7m h LYS 91 Ca -0.05 -0.10 0.01 0.00 -1.87 0.00 0.00 60.65 58.64 1p7m h LYS 91 Cb 0.38 -0.28 -0.05 0.00 0.08 0.00 0.00 32.23 32.36 1p7m h LYS 91 CO 0.08 0.89 0.65 0.82 -0.57 0.00 0.00 179.45 181.32 1p7m h ILE 92 N 1.33 1.24 -0.81 1.86 2.04 -0.76 -0.43 117.51 121.98 1p7m h ILE 92 Ca 0.35 -0.45 0.11 0.00 1.00 0.00 0.00 64.86 65.87 1p7m h ILE 92 Cb -0.10 -0.19 -0.06 0.00 -0.74 0.00 0.00 36.82 35.74 1p7m h ILE 92 CO -0.07 0.24 0.53 1.56 0.00 0.00 0.00 178.15 180.41 1p7m h GLN 93 N 1.32 0.65 -0.84 2.37 1.08 0.54 0.25 115.11 120.48 1p7m h GLN 93 Ca 0.36 -0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.52 1p7m h GLN 93 Cb -0.13 -0.15 -0.04 0.00 -0.05 0.00 0.00 27.48 27.11 1p7m h GLN 93 CO -0.08 0.43 0.51 0.00 -0.95 0.00 0.00 178.83 178.74 1p7m h ALA 94 N 1.61 1.32 -0.64 3.87 0.00 -0.88 -1.93 119.26 122.61 1p7m h ALA 94 Ca 0.38 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 1p7m h ALA 94 Cb 0.56 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1p7m h ALA 94 CO -0.15 0.59 0.38 0.82 0.00 0.00 0.00 179.25 180.88 1p7m h ILE 95 N 1.15 1.19 -0.65 0.00 1.08 -0.33 -2.24 117.51 117.72 1p7m h ILE 95 Ca 0.30 -0.44 0.01 0.00 -0.39 0.00 0.00 64.86 64.35 1p7m h ILE 95 Cb -0.06 0.33 -0.03 0.00 -3.07 0.00 0.00 36.82 33.98 1p7m h ILE 95 CO -0.06 0.20 0.42 0.40 -0.69 0.00 0.00 178.15 178.42 1p7m h ILE 96 N 0.86 1.14 -0.60 -0.67 1.08 -0.87 -1.39 117.51 117.06 1p7m h ILE 96 Ca 0.23 -0.29 -0.00 0.00 -0.39 0.00 0.00 64.86 64.40 1p7m h ILE 96 Cb -0.01 0.21 -0.03 0.00 -3.07 0.00 0.00 36.82 33.92 1p7m h ILE 96 CO -0.04 0.16 0.37 1.23 -0.69 0.00 0.00 178.15 179.18 1p7m h GLY 97 N 0.85 0.85 1.42 5.37 0.00 -1.04 -1.40 103.07 109.13 1p7m h GLY 97 Ca 0.25 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.24 1p7m h GLY 97 CO -0.07 0.33 0.38 3.43 0.00 0.00 0.00 176.54 180.61 1p7m h ASN 98 N 0.82 0.67 -0.31 0.19 2.35 -0.67 -0.87 115.58 117.76 1p7m h ASN 98 Ca 0.22 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.90 1p7m h ASN 98 Cb -0.05 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.14 1p7m h ASN 98 CO -0.04 0.49 0.02 0.00 -1.65 0.00 0.00 177.43 176.25 1p7m h ALA 99 N 1.63 0.41 -0.53 -0.83 0.00 -1.02 -2.16 119.26 116.76 1p7m h ALA 99 Ca 0.21 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1p7m h ALA 99 Cb -0.09 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1p7m h ALA 99 CO -0.05 0.14 0.22 0.00 0.00 0.00 0.00 179.25 179.56 1p7m h ARG 100 N 0.33 0.76 -0.42 0.00 3.08 -1.21 -1.67 114.38 115.25 1p7m h ARG 100 Ca 0.09 -0.11 -0.06 0.00 0.07 0.00 0.00 59.98 59.97 1p7m h ARG 100 Cb 0.40 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1p7m h ARG 100 CO 0.01 0.62 0.02 0.00 -1.07 0.00 0.00 179.97 179.55 1p7m h ALA 101 N 1.49 1.25 -0.66 0.04 0.00 -0.85 -2.00 119.26 118.53 1p7m h ALA 101 Ca 0.18 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1p7m h ALA 101 Cb 0.14 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1p7m h ALA 101 CO -0.02 0.50 0.44 -0.92 0.00 0.00 0.00 179.25 179.25 1p7m h TYR 102 N 0.63 0.83 0.00 0.00 3.20 -0.67 0.29 116.97 121.26 1p7m h TYR 102 Ca 0.13 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 1p7m h TYR 102 Cb 0.37 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 38.36 1p7m h TYR 102 CO 0.02 0.52 -0.03 -0.07 -1.64 0.00 0.00 178.16 176.96 1p7m h LEU 103 N 0.89 0.00 -0.46 2.82 3.38 -1.07 -1.75 115.31 119.13 1p7m h LEU 103 Ca 0.24 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 58.11 1p7m h LEU 103 Cb -0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1p7m h LEU 103 CO -0.05 0.03 -0.11 0.06 0.09 0.00 0.00 178.44 178.46 1p7m h GLN 104 N 0.00 0.88 -0.60 1.13 -0.00 0.15 0.42 115.11 117.08 1p7m h GLN 104 Ca -0.00 -0.33 -0.09 0.00 -0.00 0.00 0.00 58.65 58.22 1p7m h GLN 104 Cb 0.07 -0.05 -0.02 0.00 -0.00 0.00 0.00 27.48 27.48 1p7m h GLN 104 CO 0.00 0.98 0.01 0.52 -0.00 0.00 0.00 178.83 180.34 1p7m h MET 105 N 0.72 1.06 -0.33 0.06 2.86 -1.03 -1.37 114.93 116.90 1p7m h MET 105 Ca 0.12 -0.33 -0.18 0.00 -2.06 0.00 0.00 59.70 57.25 1p7m h MET 105 Cb 0.65 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.21 1p7m h MET 105 CO 0.04 1.03 -0.49 0.93 1.06 0.00 0.00 176.91 179.49 1p7m h GLU 106 N 0.96 0.91 0.00 1.72 4.39 -1.29 0.23 114.58 121.49 1p7m h GLU 106 Ca 0.17 -0.54 -0.00 0.00 0.34 0.00 0.00 59.36 59.34 1p7m h GLU 106 Cb 0.55 0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1p7m h GLU 106 CO 0.03 1.18 -0.00 1.96 -1.16 0.00 0.00 179.01 181.02 1p7m h GLN 107 N 0.71 0.00 -0.00 2.33 4.20 0.09 0.89 115.11 123.33 1p7m h GLN 107 Ca 0.03 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1p7m h GLN 107 Cb 1.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.87 1p7m h GLN 107 CO 0.11 0.00 -0.68 0.09 -0.67 0.00 0.00 178.83 177.69 1p7m n ASN 108 N -3.64 0.73 -1.14 1.46 5.03 -0.54 -4.94 115.26 112.22 1p7m n ASN 108 Ca -0.03 -0.57 -0.12 0.00 0.87 0.00 0.00 54.58 54.73 1p7m n ASN 108 Cb 0.08 0.53 -0.03 0.00 -1.02 0.00 0.00 39.78 39.34 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 1.49 0.69 3.07 7.41 0.00 0.31 -4.98 105.19 113.18 1p7m n GLY 109 Ca 0.05 -0.42 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 1p7m n GLY 109 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1p7m s GLU 110 N -3.73 1.78 0.55 1.61 0.41 0.07 -4.98 118.70 114.41 1p7m s GLU 110 Ca 0.00 -1.77 -0.21 0.00 -0.41 0.00 0.00 54.97 52.59 1p7m s GLU 110 Cb 0.00 -3.30 -0.06 0.00 -1.78 0.00 0.00 34.13 28.99 1p7m s GLU 110 CO 0.00 -0.92 1.10 -2.30 -0.49 0.00 0.00 175.26 172.65 1p7m n PRO 111 N 4.40 1.25 -0.32 0.39 -0.02 -1.26 -4.53 135.00 134.91 1p7m n PRO 111 Ca -0.01 0.47 -0.02 0.00 -2.02 0.00 0.00 63.50 61.92 1p7m n PRO 111 Cb 0.42 -2.28 0.13 0.00 -0.02 0.00 0.00 33.50 31.76 1p7m n PRO 111 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 1p7m h PHE 112 N 1.01 1.18 -0.19 6.00 -1.00 -1.95 -2.67 116.94 119.32 1p7m h PHE 112 Ca -0.48 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.25 1p7m h PHE 112 Cb 1.34 -0.39 -0.01 0.00 3.61 0.00 0.00 35.95 40.50 1p7m h PHE 112 CO 0.41 0.78 -0.11 0.00 -1.61 0.00 0.00 178.31 177.78 1p7m h ALA 113 N 1.37 1.47 -0.24 2.45 0.00 -1.85 -2.92 119.26 119.54 1p7m h ALA 113 Ca 0.33 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1p7m h ALA 113 Cb -0.07 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1p7m h ALA 113 CO -0.06 0.38 0.07 -0.44 0.00 0.00 0.00 179.25 179.19 1p7m h ASP 114 N 0.28 0.36 -0.11 0.00 3.32 -1.84 -1.84 116.42 116.60 1p7m h ASP 114 Ca 0.06 -0.22 -0.13 0.00 0.02 0.00 0.00 57.03 56.75 1p7m h ASP 114 Cb 0.38 -0.10 0.01 0.00 0.22 0.00 0.00 39.33 39.84 1p7m h ASP 114 CO 0.02 0.49 -0.45 2.19 -1.72 0.00 0.00 179.24 179.76 1p7m h PHE 115 N 0.22 0.67 0.35 4.55 -0.00 -1.62 -2.61 116.94 118.50 1p7m h PHE 115 Ca 0.08 -0.29 -0.02 0.00 -0.00 0.00 0.00 57.97 57.74 1p7m h PHE 115 Cb 0.26 -0.11 0.00 0.00 -0.00 0.00 0.00 35.95 36.11 1p7m h PHE 115 CO 0.01 1.05 -0.17 -0.24 -0.00 0.00 0.00 178.31 178.96 1p7m h VAL 116 N 0.10 0.67 -0.43 0.88 3.04 -1.56 0.14 116.25 119.09 1p7m h VAL 116 Ca -0.02 -0.26 0.12 0.00 -1.01 0.00 0.00 66.70 65.53 1p7m h VAL 116 Cb 1.09 0.81 -0.02 0.00 -2.01 0.00 0.00 31.29 31.16 1p7m h VAL 116 CO 0.10 0.05 0.40 -0.50 -1.01 0.00 0.00 177.57 176.60 1p7m h TRP 117 N -0.61 0.00 0.01 3.17 4.06 -1.43 0.38 115.95 121.53 1p7m h TRP 117 Ca -0.05 0.00 -0.23 0.00 2.06 0.00 0.00 58.89 60.67 1p7m h TRP 117 Cb 0.45 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.61 1p7m h TRP 117 CO -0.02 0.00 -0.96 1.03 -3.56 0.00 0.00 178.44 174.93 1p7m h SER 118 N 0.00 0.51 -0.01 -3.49 0.87 -0.79 2.20 113.55 112.84 1p7m h SER 118 Ca 0.20 -0.42 -0.02 0.00 -1.23 0.00 0.00 61.79 60.33 1p7m h SER 118 Cb 0.99 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.79 1p7m h SER 118 CO -0.00 1.22 -0.03 -0.26 -0.53 0.00 0.00 176.83 177.23 1p7m h PHE 119 N 0.21 0.14 -0.56 2.24 -1.00 0.24 0.38 116.94 118.59 1p7m h PHE 119 Ca -0.08 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.69 1p7m h PHE 119 Cb 1.61 -0.04 0.00 0.00 3.61 0.00 0.00 35.95 41.12 1p7m h PHE 119 CO 0.06 0.18 0.00 1.55 -1.61 0.00 0.00 178.31 178.49 1p7m n VAL 120 N -4.42 2.14 -2.72 -0.55 3.14 -1.03 -4.73 118.33 110.17 1p7m n VAL 120 Ca -0.01 -1.18 -0.18 0.00 -2.96 0.00 0.00 64.34 60.00 1p7m n VAL 120 Cb 0.16 -0.13 0.02 0.00 -1.06 0.00 0.00 33.84 32.83 1p7m n VAL 120 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1p7m n ASN 121 N 0.77 -5.31 -2.37 6.55 5.15 0.12 -2.39 115.26 117.79 1p7m n ASN 121 Ca 0.25 -0.17 -0.12 0.00 -0.60 0.00 0.00 54.58 53.94 1p7m n ASN 121 Cb 0.99 -4.22 -0.01 0.00 -0.53 0.00 0.00 39.78 36.01 1p7m n ASN 121 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 1p7m n HIS 122 N -4.22 -1.36 -4.17 1.20 8.25 0.74 -4.94 115.22 110.72 1p7m n HIS 122 Ca -0.13 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.17 1p7m n HIS 122 Cb 0.62 -2.70 -0.14 0.00 1.12 0.00 0.00 29.99 28.90 1p7m n HIS 122 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1p7m s GLN 123 N -4.89 0.51 0.46 -0.41 -0.21 -1.00 -5.06 119.66 109.05 1p7m s GLN 123 Ca 0.00 -0.36 -0.22 0.00 0.02 0.00 0.00 55.36 54.80 1p7m s GLN 123 Cb 0.00 -0.45 -0.08 0.00 1.00 0.00 0.00 33.01 33.48 1p7m s GLN 123 CO 0.00 0.11 1.08 -1.25 -2.12 0.00 0.00 175.29 173.11 1p7m s PRO 124 N -0.52 3.85 -0.13 2.91 0.04 -1.26 -4.88 135.00 135.01 1p7m s PRO 124 Ca -0.01 1.53 0.03 0.00 0.04 0.00 0.00 61.00 62.59 1p7m s PRO 124 Cb -0.04 -2.29 0.01 0.00 0.04 0.00 0.00 34.50 32.21 1p7m s PRO 124 CO -0.00 -0.42 -0.23 -1.14 0.04 0.00 0.00 177.00 175.25 1p7m s GLN 125 N -2.89 3.03 -0.32 4.56 -0.44 -1.11 -5.00 119.66 117.48 1p7m s GLN 125 Ca 0.64 -0.86 -0.11 0.00 -2.50 0.00 0.00 55.36 52.53 1p7m s GLN 125 Cb -0.22 -2.39 -0.01 0.00 -1.64 0.00 0.00 33.01 28.74 1p7m s GLN 125 CO 0.26 0.04 0.18 -1.64 0.50 0.00 0.00 175.29 174.63 1p7m s MET 126 N 0.67 3.44 0.15 1.67 -1.94 -1.26 -2.08 119.30 119.95 1p7m s MET 126 Ca -0.11 -0.66 -0.15 0.00 -1.71 0.00 0.00 55.69 53.06 1p7m s MET 126 Cb -0.16 -3.64 -0.07 0.00 2.01 0.00 0.00 34.83 32.97 1p7m s MET 126 CO 0.01 -0.40 0.57 0.99 -0.01 0.00 0.00 175.02 176.18 1p7m s THR 127 N 1.66 4.82 -0.36 2.05 2.01 -1.16 -4.98 115.64 119.68 1p7m s THR 127 Ca 0.05 0.91 0.04 0.00 0.31 0.00 0.00 61.69 63.01 1p7m s THR 127 Cb -0.17 -3.76 0.54 0.00 0.01 0.00 0.00 72.50 69.12 1p7m s THR 127 CO 0.08 0.27 1.67 0.00 -0.69 0.00 0.00 174.62 175.95 1p7m n GLN 128 N 0.88 2.31 -2.12 4.92 6.02 -1.26 -4.69 117.38 123.43 1p7m n GLN 128 Ca -0.05 -2.34 -0.41 0.00 -0.01 0.00 0.00 57.00 54.18 1p7m n GLN 128 Cb 0.52 -1.94 -0.03 0.00 1.02 0.00 0.00 30.24 29.81 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 -2.52 3.57 -0.10 -1.58 0.00 -1.26 -4.90 121.76 114.97 1p7m s ALA 129 Ca 0.44 1.21 0.21 0.00 0.00 0.00 0.00 51.96 53.82 1p7m s ALA 129 Cb 0.36 -3.51 -0.24 0.00 0.00 0.00 0.00 23.12 19.72 1p7m s ALA 129 CO 0.09 -0.63 0.58 0.25 0.00 0.00 0.00 175.76 176.05 1p7m n THR 130 N 2.43 0.38 -4.32 0.00 -2.24 -1.26 -2.93 114.28 106.34 1p7m n THR 130 Ca 0.06 -0.57 -0.17 0.00 -2.27 0.00 0.00 64.05 61.10 1p7m n THR 130 Cb 0.42 -0.18 -0.10 0.00 -2.10 0.00 0.00 70.33 68.36 1p7m n THR 130 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1p7m s THR 131 N -3.32 1.35 0.35 4.28 -4.23 -1.26 -4.63 115.64 108.18 1p7m s THR 131 Ca -0.06 -2.10 0.02 0.00 -1.18 0.00 0.00 61.69 58.37 1p7m s THR 131 Cb 0.12 -2.12 0.26 0.00 1.34 0.00 0.00 72.50 72.11 1p7m s THR 131 CO 0.87 -0.53 2.01 -0.07 -0.54 0.00 0.00 174.62 176.35 1p7m h LEU 132 N 2.57 0.73 -1.20 4.79 3.38 -1.93 -1.05 115.31 122.60 1p7m h LEU 132 Ca -0.38 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.49 1p7m h LEU 132 Cb 1.21 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1p7m h LEU 132 CO 0.64 0.53 -0.40 0.77 0.09 0.00 0.00 178.44 180.07 1p7m h SER 133 N 0.87 0.00 -0.08 -0.43 4.64 -1.96 -2.05 113.55 114.53 1p7m h SER 133 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1p7m h SER 133 Cb -0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 1p7m h SER 133 CO -0.05 0.40 0.00 -0.62 -0.87 0.00 0.00 176.83 175.69 1p7m n GLU 134 N -4.02 1.27 -3.16 4.77 -0.58 -0.42 -4.84 120.64 113.67 1p7m n GLU 134 Ca -0.02 -0.41 -0.37 0.00 -0.42 0.00 0.00 57.16 55.94 1p7m n GLU 134 Cb 0.43 -1.24 -0.06 0.00 -0.57 0.00 0.00 31.44 30.00 1p7m n GLU 134 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 1p7m s ILE 135 N -1.89 4.62 0.39 -3.67 2.07 -0.77 -4.61 121.20 117.34 1p7m s ILE 135 Ca 0.21 1.25 -0.24 0.00 -1.41 0.00 0.00 60.65 60.46 1p7m s ILE 135 Cb 0.11 -3.88 -0.09 0.00 0.13 0.00 0.00 42.46 38.72 1p7m s ILE 135 CO 0.17 0.32 1.05 -2.16 -1.91 0.00 0.00 174.94 172.41 1p7m s PRO 136 N -1.71 4.19 0.00 3.50 0.04 -1.26 -4.96 135.00 134.80 1p7m s PRO 136 Ca 0.39 1.54 0.00 0.00 0.04 0.00 0.00 61.00 62.96 1p7m s PRO 136 Cb -0.18 -2.58 0.00 0.00 0.04 0.00 0.00 34.50 31.78 1p7m s PRO 136 CO 0.21 -0.12 0.47 0.25 0.04 0.00 0.00 177.00 177.84 1p7m n THR 137 N 0.01 0.05 -3.41 1.26 -2.24 -1.26 -4.90 114.28 103.79 1p7m n THR 137 Ca 0.05 -0.47 -0.20 0.00 -2.27 0.00 0.00 64.05 61.16 1p7m n THR 137 Cb 0.49 1.09 -0.10 0.00 -2.10 0.00 0.00 70.33 69.71 1p7m n THR 137 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1p7m s SER 138 N -0.05 1.86 0.15 3.42 1.04 -1.26 -4.46 113.70 114.40 1p7m s SER 138 Ca 0.00 -1.35 0.05 0.00 0.48 0.00 0.00 55.95 55.13 1p7m s SER 138 Cb 0.00 0.30 -0.04 0.00 0.10 0.00 0.00 66.02 66.39 1p7m s SER 138 CO 0.00 -0.33 0.12 0.42 0.98 0.00 0.00 173.24 174.42 1p7m s THR 139 N 1.78 4.44 0.34 2.02 -4.23 -1.26 -4.93 115.64 113.80 1p7m s THR 139 Ca 0.14 -1.05 0.07 0.00 -1.18 0.00 0.00 61.69 59.67 1p7m s THR 139 Cb -0.16 -3.24 0.31 0.00 1.34 0.00 0.00 72.50 70.75 1p7m s THR 139 CO -0.17 -0.06 1.87 1.55 -0.54 0.00 0.00 174.62 177.27 1p7m h PRO 140 N 2.60 0.74 -0.06 3.99 0.13 -1.99 0.46 132.00 137.86 1p7m h PRO 140 Ca -0.47 -0.04 -0.17 0.00 -0.87 0.00 0.00 66.00 64.44 1p7m h PRO 140 Cb 1.19 -0.17 0.01 0.00 0.13 0.00 0.00 31.00 32.17 1p7m h PRO 140 CO 0.63 0.49 -0.64 0.00 -0.23 0.00 0.00 178.00 178.26 1p7m h ALA 141 N 1.58 0.16 -0.63 -0.56 0.00 -1.95 -2.77 119.26 115.10 1p7m h ALA 141 Ca 0.44 -0.56 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1p7m h ALA 141 Cb 0.61 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1p7m h ALA 141 CO -0.20 0.45 0.26 0.77 0.00 0.00 0.00 179.25 180.52 1p7m h SER 142 N 0.13 0.86 -0.92 0.00 0.02 -1.54 -1.20 113.55 110.91 1p7m h SER 142 Ca -0.06 -0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 60.72 1p7m h SER 142 Cb 1.30 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 63.57 1p7m h SER 142 CO 0.13 0.79 0.56 0.44 -1.14 0.00 0.00 176.83 177.61 1p7m h ASP 143 N 0.88 1.10 -0.03 3.07 3.32 -0.17 -1.59 116.42 123.01 1p7m h ASP 143 Ca 0.21 -0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.10 1p7m h ASP 143 Cb 0.20 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 1p7m h ASP 143 CO -0.02 0.84 -0.28 0.00 -1.72 0.00 0.00 179.24 178.07 1p7m h ALA 144 N 1.34 1.08 -0.24 3.45 0.00 -1.14 -2.32 119.26 121.43 1p7m h ALA 144 Ca 0.33 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1p7m h ALA 144 Cb -0.06 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1p7m h ALA 144 CO -0.06 0.57 0.14 -0.07 0.00 0.00 0.00 179.25 179.82 1p7m h LEU 145 N 0.41 0.22 -0.50 0.00 3.38 -0.24 0.47 115.31 119.06 1p7m h LEU 145 Ca 0.06 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1p7m h LEU 145 Cb 0.70 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1p7m h LEU 145 CO 0.05 0.17 0.19 -1.28 0.09 0.00 0.00 178.44 177.65 1p7m h SER 146 N 0.29 0.70 -0.45 -0.43 0.87 -1.32 0.78 113.55 113.98 1p7m h SER 146 Ca 0.09 -0.18 -0.03 0.00 -1.23 0.00 0.00 61.79 60.44 1p7m h SER 146 Cb -0.00 -0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 61.76 1p7m h SER 146 CO -0.05 0.69 0.16 0.50 -0.53 0.00 0.00 176.83 177.61 1p7m h LYS 147 N 0.66 0.68 -0.13 2.24 3.64 -0.98 0.63 116.57 123.31 1p7m h LYS 147 Ca 0.16 -0.13 -0.11 0.00 -1.27 0.00 0.00 60.65 59.29 1p7m h LYS 147 Cb 0.22 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1p7m h LYS 147 CO -0.01 0.64 -0.36 0.00 -2.27 0.00 0.00 179.45 177.44 1p7m h ALA 148 N 1.01 0.22 -0.61 5.00 0.00 0.17 -2.73 119.26 122.34 1p7m h ALA 148 Ca 0.15 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 1p7m h ALA 148 Cb 0.22 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1p7m h ALA 148 CO -0.01 0.30 0.06 -0.07 0.00 0.00 0.00 179.25 179.53 1p7m h LEU 149 N 0.09 0.98 -0.98 0.00 3.38 0.69 -2.68 115.31 116.79 1p7m h LEU 149 Ca -0.01 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 1p7m h LEU 149 Cb 0.98 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.43 1p7m h LEU 149 CO 0.08 1.00 0.47 0.50 0.09 0.00 0.00 178.44 180.59 1p7m h LYS 150 N 0.95 1.19 -0.04 1.13 3.64 0.30 -1.58 116.57 122.16 1p7m h LYS 150 Ca 0.18 -0.13 -0.06 0.00 -1.27 0.00 0.00 60.65 59.37 1p7m h LYS 150 Cb 0.47 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1p7m h LYS 150 CO 0.02 0.87 -0.24 0.87 -2.27 0.00 0.00 179.45 178.69 1p7m h LYS 151 N 1.20 0.07 0.00 1.90 1.57 -1.17 -0.52 116.57 119.62 1p7m h LYS 151 Ca 0.30 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 1p7m h LYS 151 Cb 0.02 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1p7m h LYS 151 CO -0.05 0.31 0.00 0.54 -0.57 0.00 0.00 179.45 179.68 1p7m n ARG 152 N -4.22 0.64 -0.84 3.15 3.00 -0.64 -4.79 116.66 112.96 1p7m n ARG 152 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.82 1p7m n ARG 152 Cb 0.32 -1.47 0.00 0.00 0.00 0.00 0.00 32.46 31.31 1p7m n ARG 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1p7m n GLY 153 N 0.28 1.01 3.51 -0.13 0.00 -0.21 -4.50 105.19 105.14 1p7m n GLY 153 Ca 0.14 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 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 3.19 0.57 1.61 0.08 -0.92 -4.51 117.98 116.00 1p7m s PHE 154 Ca 0.00 -0.23 -0.01 0.00 0.12 0.00 0.00 56.93 56.81 1p7m s PHE 154 Cb 0.00 -2.77 0.03 0.00 -0.57 0.00 0.00 43.02 39.71 1p7m s PHE 154 CO 0.00 -0.57 0.81 0.15 -0.10 0.00 0.00 175.22 175.51 1p7m s LYS 155 N 2.05 2.56 -0.95 0.44 1.02 -1.26 -4.27 119.74 119.34 1p7m s LYS 155 Ca 0.11 -0.60 -0.07 0.00 0.02 0.00 0.00 55.97 55.43 1p7m s LYS 155 Cb -0.17 -2.42 -0.03 0.00 -0.52 0.00 0.00 37.83 34.69 1p7m s LYS 155 CO 0.12 -0.76 0.79 1.19 -0.92 0.00 0.00 175.35 175.78 1p7m n PHE 156 N -2.43 -2.48 -2.72 3.18 3.01 -1.26 -4.92 117.46 109.84 1p7m n PHE 156 Ca 0.07 0.86 -0.03 0.00 1.01 0.00 0.00 57.45 59.36 1p7m n PHE 156 Cb 0.59 -3.85 0.10 0.00 -0.01 0.00 0.00 39.48 36.32 1p7m n PHE 156 CO 0.00 0.00 0.00 1.55 1.01 0.00 0.00 176.76 179.32 1p7m n VAL 157 N -2.91 0.39 -0.20 -4.37 3.14 -1.26 -3.98 118.33 109.13 1p7m n VAL 157 Ca -0.07 -1.70 -0.12 0.00 -2.96 0.00 0.00 64.34 59.49 1p7m n VAL 157 Cb 0.58 1.06 0.11 0.00 -1.06 0.00 0.00 33.84 34.53 1p7m n VAL 157 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1p7m n GLY 158 N -1.09 -2.70 0.23 7.55 0.00 -1.26 -4.39 105.19 103.53 1p7m n GLY 158 Ca -0.08 -0.88 0.08 0.00 0.00 0.00 0.00 46.02 45.15 1p7m n GLY 158 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1p7m h THR 159 N -2.50 0.83 -0.13 2.61 1.35 -1.91 -1.92 112.91 111.25 1p7m h THR 159 Ca -0.15 -0.87 -0.14 0.00 -0.55 0.00 0.00 66.41 64.70 1p7m h THR 159 Cb 0.51 1.52 -0.01 0.00 -1.73 0.00 0.00 68.15 68.44 1p7m h THR 159 CO 0.09 0.22 -0.54 0.71 -0.25 0.00 0.00 175.52 175.75 1p7m h THR 160 N 0.00 1.35 -0.19 6.82 1.35 -1.88 -0.49 112.91 119.87 1p7m h THR 160 Ca -0.00 -1.81 -0.09 0.00 -0.55 0.00 0.00 66.41 63.96 1p7m h THR 160 Cb 0.50 1.84 -0.00 0.00 -1.73 0.00 0.00 68.15 68.76 1p7m h THR 160 CO 0.03 0.55 -0.25 0.40 -0.25 0.00 0.00 175.52 175.99 1p7m h ILE 161 N 0.28 1.34 -0.42 6.82 1.08 -1.66 -1.80 117.51 123.15 1p7m h ILE 161 Ca 0.01 -1.45 -0.07 0.00 -0.39 0.00 0.00 64.86 62.95 1p7m h ILE 161 Cb 1.03 1.84 -0.02 0.00 -3.07 0.00 0.00 36.82 36.61 1p7m h ILE 161 CO 0.09 0.44 -0.02 0.00 -0.69 0.00 0.00 178.15 177.97 1p7m h TYR 163 N 0.64 0.46 -0.17 0.00 5.03 -1.00 -2.84 116.97 119.10 1p7m h TYR 163 Ca 0.13 -0.14 -0.03 0.00 2.58 0.00 0.00 58.73 61.27 1p7m h TYR 163 Cb 0.43 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.60 1p7m h TYR 163 CO 0.02 0.76 -0.05 0.66 -1.32 0.00 0.00 178.16 178.24 1p7m h SER 164 N 0.03 0.24 -0.06 -2.11 4.64 -1.23 -2.69 113.55 112.36 1p7m h SER 164 Ca 0.03 -0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1p7m h SER 164 Cb 0.68 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1p7m h SER 164 CO 0.04 0.33 0.03 0.15 -0.87 0.00 0.00 176.83 176.50 1p7m h PHE 165 N 0.25 0.09 -0.83 4.77 3.57 -1.29 -0.02 116.94 123.48 1p7m h PHE 165 Ca 0.06 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.53 1p7m h PHE 165 Cb 0.25 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.93 1p7m h PHE 165 CO 0.00 0.18 0.42 0.52 -2.23 0.00 0.00 178.31 177.20 1p7m h MET 166 N -0.03 1.17 -0.07 1.11 2.86 -1.24 -1.89 114.93 116.85 1p7m h MET 166 Ca 0.02 -0.16 -0.23 0.00 -2.06 0.00 0.00 59.70 57.27 1p7m h MET 166 Cb 0.12 -0.22 0.02 0.00 0.06 0.00 0.00 31.60 31.58 1p7m h MET 166 CO -0.00 0.89 -0.85 1.96 1.06 0.00 0.00 176.91 179.96 1p7m h GLN 167 N 1.16 0.70 -0.10 1.72 7.50 -1.37 -2.53 115.11 122.20 1p7m h GLN 167 Ca 0.29 -0.66 -0.11 0.00 0.50 0.00 0.00 58.65 58.67 1p7m h GLN 167 Cb 0.08 0.17 0.00 0.00 0.05 0.00 0.00 27.48 27.78 1p7m h GLN 167 CO -0.04 1.26 -0.37 0.00 -1.50 0.00 0.00 178.83 178.17 1p7m h ALA 168 N 0.45 0.18 -0.08 3.87 0.00 -0.93 -3.35 119.26 119.40 1p7m h ALA 168 Ca -0.09 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 1p7m h ALA 168 Cb 1.50 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.27 1p7m h ALA 168 CO 0.17 0.26 0.01 0.00 0.00 0.00 0.00 179.25 179.69 1p7m n GLY 170 N -0.35 -0.53 0.32 0.00 0.00 -1.21 -4.04 105.19 99.38 1p7m n GLY 170 Ca -0.06 0.00 0.03 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 0.62 -7.72 0.99 3.38 -1.75 -3.43 115.31 107.40 1p7m h LEU 171 Ca 0.00 -0.02 -0.22 0.00 0.09 0.00 0.00 57.88 57.73 1p7m h LEU 171 Cb 0.00 -0.15 -0.28 0.00 0.09 0.00 0.00 40.66 40.32 1p7m h LEU 171 CO 0.00 0.45 -0.70 0.54 0.09 0.00 0.00 178.44 178.82 1p7m s VAL 172 N -5.63 0.00 -0.20 1.22 0.11 -1.02 -2.76 120.40 112.13 1p7m s VAL 172 Ca -0.09 -0.03 -0.04 0.00 -2.93 0.00 0.00 61.98 58.89 1p7m s VAL 172 Cb 0.18 -0.04 -0.02 0.00 -1.53 0.00 0.00 36.38 34.96 1p7m s VAL 172 CO 0.75 -0.02 -0.03 0.20 -3.33 0.00 0.00 175.10 172.67 1p7m s ASN 173 N -0.04 4.55 0.00 3.54 0.01 -0.88 -4.46 114.94 117.66 1p7m s ASN 173 Ca -0.01 -0.28 0.00 0.00 -0.71 0.00 0.00 52.86 51.87 1p7m s ASN 173 Cb -0.00 -1.77 0.00 0.00 0.41 0.00 0.00 41.25 39.89 1p7m s ASN 173 CO 0.00 0.05 0.00 -0.90 -1.51 0.00 0.00 177.10 174.74 1p7m n ASP 174 N 4.30 0.00 -0.14 -1.22 5.68 -1.26 -2.96 116.55 120.95 1p7m n ASP 174 Ca -0.18 0.00 -0.06 0.00 -0.50 0.00 0.00 54.79 54.06 1p7m n ASP 174 Cb 0.52 0.00 0.03 0.00 -1.14 0.00 0.00 41.12 40.52 1p7m n ASP 174 CO 0.00 0.00 0.00 0.45 -1.33 0.00 0.00 177.20 176.32 1p7m h HIS 175 N 0.00 0.41 0.00 2.11 3.86 -1.91 -3.42 115.15 116.20 1p7m h HIS 175 Ca 0.00 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 1p7m h HIS 175 Cb 0.00 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 28.35 1p7m h HIS 175 CO 0.00 0.22 0.00 1.33 0.86 0.00 0.00 177.93 180.34 1p7m n VAL 176 N -4.90 0.00 0.00 2.45 0.24 -1.26 -4.64 118.33 110.22 1p7m n VAL 176 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.32 1p7m n VAL 176 Cb 0.10 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.47 1p7m n VAL 176 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1p7m n VAL 177 N 0.00 0.00 1.86 3.34 0.31 -1.15 -4.07 118.33 118.62 1p7m n VAL 177 Ca 0.00 0.00 0.09 0.00 -0.01 0.00 0.00 64.34 64.42 1p7m n VAL 177 Cb 0.12 0.00 0.46 0.00 -0.91 0.00 0.00 33.84 33.51 1p7m n VAL 177 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1p7m n GLY 178 N 0.00 -0.77 3.74 2.92 0.00 -1.26 -4.75 105.19 105.06 1p7m n GLY 178 Ca 0.00 -0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 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 -4.02 2.74 1.00 0.00 5.04 0.13 -4.99 117.35 117.25 1p7m s TYR 182 Ca -0.04 0.80 -0.14 0.00 -2.44 0.00 0.00 57.07 55.26 1p7m s TYR 182 Cb 0.12 -4.07 0.19 0.00 0.35 0.00 0.00 41.96 38.55 1p7m s TYR 182 CO 0.43 -3.56 1.15 -1.25 -1.34 0.00 0.00 175.55 170.97 1p7m s PRO 183 N -0.61 0.42 0.00 4.97 0.04 -1.26 -4.41 135.00 134.15 1p7m s PRO 183 Ca 0.63 0.16 0.00 0.00 0.04 0.00 0.00 61.00 61.83 1p7m s PRO 183 Cb -0.48 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.29 1p7m s PRO 183 CO 0.49 -2.66 0.00 0.41 0.04 0.00 0.00 177.00 175.28 1p7m n GLY 184 N -1.93 0.57 0.00 0.56 0.00 -1.26 -4.98 105.19 98.16 1p7m n GLY 184 Ca 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.11 1p7m n GLY 184 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1p7m h ASN 185 N 0.00 0.00 -3.15 1.61 4.21 -1.95 -3.43 115.58 112.86 1p7m h ASN 185 Ca 0.00 0.00 -0.64 0.00 1.21 0.00 0.00 56.30 56.87 1p7m h ASN 185 Cb 0.00 0.00 -0.41 0.00 -1.12 0.00 0.00 38.32 36.79 1p7m h ASN 185 CO 0.00 0.03 -0.49 -1.59 -1.29 0.00 0.00 177.43 174.09 1p7m s LYS 186 N -1.05 2.61 0.00 0.81 -2.85 -1.26 -5.24 119.74 112.75 1p7m s LYS 186 Ca -0.01 -3.34 0.32 0.00 -1.00 0.00 0.00 55.97 51.94 1p7m s LYS 186 Cb 0.00 -3.52 1.85 0.00 -2.06 0.00 0.00 37.83 34.10 1p7m s LYS 186 CO 0.01 -1.28 2.19 -0.35 0.10 0.00 0.00 175.35 176.02