#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 3.47 0.73 2.12 2.12 -1.26 -4.90 118.70 120.98 1p7m s GLU 2 Ca 0.00 -0.34 -0.04 0.00 0.36 0.00 0.00 54.97 54.95 1p7m s GLU 2 Cb 0.00 -3.04 0.12 0.00 0.26 0.00 0.00 34.13 31.47 1p7m s GLU 2 CO 0.00 0.61 1.02 1.03 -0.54 0.00 0.00 175.26 177.38 1p7m s ARG 3 N -2.32 1.71 0.54 4.30 0.52 -1.26 -1.19 118.95 121.26 1p7m s ARG 3 Ca 0.33 -0.84 -0.17 0.00 -0.52 0.00 0.00 55.73 54.53 1p7m s ARG 3 Cb -0.13 -2.26 -0.06 0.00 0.52 0.00 0.00 34.95 33.03 1p7m s ARG 3 CO 0.24 -1.47 1.04 0.00 0.02 0.00 0.00 175.30 175.14 1p7m h GLY 5 N 0.90 1.60 0.22 0.00 0.00 -1.99 0.53 103.07 104.33 1p7m h GLY 5 Ca -0.48 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.49 1p7m h GLY 5 CO 0.58 0.06 -0.17 -2.67 0.00 0.00 0.00 176.54 174.35 1p7m n TRP 6 N -4.72 0.00 0.06 5.60 2.14 -1.26 -3.87 117.44 115.39 1p7m n TRP 6 Ca 0.19 0.00 -0.21 0.00 2.07 0.00 0.00 57.50 59.55 1p7m n TRP 6 Cb 0.42 -0.10 -0.12 0.00 -0.81 0.00 0.00 31.31 30.70 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 1.32 1.29 0.00 -1.67 2.07 -1.25 -2.95 116.25 115.06 1p7m h VAL 7 Ca 0.00 -2.34 0.00 0.00 0.82 0.00 0.00 66.70 65.18 1p7m h VAL 7 Cb 0.47 2.56 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 1p7m h VAL 7 CO 0.00 0.72 0.00 -1.20 0.02 0.00 0.00 177.57 177.11 1p7m n SER 8 N -3.85 0.00 -0.21 0.57 7.64 -1.14 -3.49 113.62 113.14 1p7m n SER 8 Ca -0.12 -0.72 -0.08 0.00 1.01 0.00 0.00 58.87 58.95 1p7m n SER 8 Cb 0.92 -0.05 0.03 0.00 -1.01 0.00 0.00 64.21 64.10 1p7m n SER 8 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 1p7m h GLN 9 N 0.00 0.94 0.00 1.43 4.15 -1.65 -3.48 115.11 116.50 1p7m h GLN 9 Ca 0.00 -0.22 0.00 0.00 0.77 0.00 0.00 58.65 59.20 1p7m h GLN 9 Cb 0.04 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.60 1p7m h GLN 9 CO 0.00 0.86 0.00 -0.25 -1.93 0.00 0.00 178.83 177.51 1p7m n ASP 10 N -4.37 0.00 -2.96 -0.69 8.00 -1.23 -5.15 116.55 110.16 1p7m n ASP 10 Ca 0.03 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.53 1p7m n ASP 10 Cb 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 1p7m n ASP 10 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1p7m n PRO 11 N -0.33 0.77 0.00 -0.24 -0.02 -1.26 -3.38 135.00 130.53 1p7m n PRO 11 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1p7m n PRO 11 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 1p7m n PRO 11 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1p7m n LEU 12 N 0.00 0.00 -0.31 2.45 4.77 -1.26 -4.27 117.00 118.37 1p7m n LEU 12 Ca 0.00 0.00 -0.05 0.00 -0.03 0.00 0.00 56.01 55.93 1p7m n LEU 12 Cb 0.00 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.17 1p7m n LEU 12 CO 0.00 0.00 1.11 1.88 -1.33 0.00 0.00 177.39 179.05 1p7m h TYR 13 N 0.00 1.23 -0.64 -1.77 0.05 -1.89 -2.37 116.97 111.58 1p7m h TYR 13 Ca 0.00 -0.07 0.06 0.00 0.05 0.00 0.00 58.73 58.77 1p7m h TYR 13 Cb 0.00 -0.38 -0.05 0.00 1.01 0.00 0.00 36.73 37.31 1p7m h TYR 13 CO 0.00 0.90 0.35 0.82 -1.05 0.00 0.00 178.16 179.18 1p7m h ILE 14 N 1.21 0.97 0.02 -2.88 5.03 -1.76 1.04 117.51 121.14 1p7m h ILE 14 Ca 0.29 -0.23 -0.00 0.00 -0.12 0.00 0.00 64.86 64.80 1p7m h ILE 14 Cb 0.13 0.25 0.00 0.00 -3.03 0.00 0.00 36.82 34.18 1p7m h ILE 14 CO -0.03 0.12 -0.01 0.00 -0.68 0.00 0.00 178.15 177.55 1p7m h ALA 15 N 1.33 -0.02 -0.65 1.87 0.00 -1.83 0.59 119.26 120.54 1p7m h ALA 15 Ca 0.29 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1p7m h ALA 15 Cb 0.17 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1p7m h ALA 15 CO -0.17 -0.36 0.33 -0.92 0.00 0.00 0.00 179.25 178.13 1p7m h TYR 16 N -0.33 0.92 -0.33 0.00 3.20 -1.08 -0.83 116.97 118.53 1p7m h TYR 16 Ca -0.00 -0.04 -0.13 0.00 3.14 0.00 0.00 58.73 61.70 1p7m h TYR 16 Cb 0.32 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 1p7m h TYR 16 CO 0.03 0.68 -0.32 1.25 -1.64 0.00 0.00 178.16 178.16 1p7m h HIS 17 N 0.90 0.96 0.00 -3.82 2.76 0.12 -2.81 115.15 113.25 1p7m h HIS 17 Ca 0.23 -0.29 0.00 0.00 -2.20 0.00 0.00 60.37 58.11 1p7m h HIS 17 Cb 0.08 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 28.84 1p7m h HIS 17 CO -0.00 1.07 0.00 -0.25 -1.30 0.00 0.00 177.93 177.44 1p7m n ASP 18 N -4.19 0.00 0.00 3.26 8.00 0.20 -4.00 116.55 119.83 1p7m n ASP 18 Ca -0.03 0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.55 1p7m n ASP 18 Cb 0.50 -0.33 0.00 0.00 -0.02 0.00 0.00 41.12 41.26 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 -1.33 0.00 0.04 -2.24 3.02 -0.34 -4.98 115.26 109.43 1p7m n ASN 19 Ca 0.09 0.36 0.00 0.00 -0.03 0.00 0.00 54.58 55.00 1p7m n ASN 19 Cb 0.20 -0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 1p7m n ASN 19 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1p7m n GLU 20 N -0.96 0.00 -2.50 3.52 1.02 -1.25 -5.06 120.64 115.41 1p7m n GLU 20 Ca 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.07 1p7m n GLU 20 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 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 -2.68 -0.51 0.00 -0.32 -0.00 -1.26 -3.99 117.44 108.68 1p7m n TRP 21 Ca 0.00 0.21 0.00 0.00 -0.00 0.00 0.00 57.50 57.71 1p7m n TRP 21 Cb 0.00 -0.57 0.00 0.00 -0.00 0.00 0.00 31.31 30.74 1p7m n TRP 21 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1p7m n GLY 22 N -0.58 0.93 0.00 5.87 0.00 -1.25 -4.92 105.19 105.24 1p7m n GLY 22 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1p7m n GLY 22 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1p7m n VAL 23 N 0.00 0.00 -3.14 1.61 0.24 -1.26 -4.86 118.33 110.92 1p7m n VAL 23 Ca 0.00 0.00 -0.32 0.00 -2.04 0.00 0.00 64.34 61.98 1p7m n VAL 23 Cb 0.00 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.32 1p7m n VAL 23 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1p7m s PRO 24 N -0.60 3.90 0.47 7.34 0.04 -1.26 -5.02 135.00 139.87 1p7m s PRO 24 Ca 0.00 0.52 -0.19 0.00 0.04 0.00 0.00 61.00 61.37 1p7m s PRO 24 Cb 0.00 -2.47 -0.10 0.00 0.04 0.00 0.00 34.50 31.97 1p7m s PRO 24 CO 0.00 0.15 0.96 -2.00 0.04 0.00 0.00 177.00 176.15 1p7m s GLU 25 N -3.15 4.10 -0.06 4.56 2.12 -1.26 -4.13 118.70 120.88 1p7m s GLU 25 Ca 0.52 1.04 -0.13 0.00 0.36 0.00 0.00 54.97 56.75 1p7m s GLU 25 Cb -0.10 -2.16 -0.05 0.00 0.26 0.00 0.00 34.13 32.07 1p7m s GLU 25 CO 0.21 -0.14 0.34 0.95 -0.54 0.00 0.00 175.26 176.09 1p7m s THR 26 N -2.38 5.18 0.23 -1.70 -4.23 -1.26 -5.00 115.64 106.47 1p7m s THR 26 Ca 0.60 0.68 0.02 0.00 -1.18 0.00 0.00 61.69 61.81 1p7m s THR 26 Cb -0.09 -3.64 -0.03 0.00 1.34 0.00 0.00 72.50 70.07 1p7m s THR 26 CO 0.21 0.54 0.39 -0.62 -0.54 0.00 0.00 174.62 174.61 1p7m s ASP 27 N -0.73 6.34 0.39 3.99 2.15 -1.26 -4.91 116.67 122.64 1p7m s ASP 27 Ca 0.21 0.24 0.11 0.00 0.43 0.00 0.00 52.55 53.55 1p7m s ASP 27 Cb -0.15 -1.94 0.91 0.00 -0.30 0.00 0.00 42.92 41.44 1p7m s ASP 27 CO 0.10 -0.08 1.92 0.28 -0.17 0.00 0.00 175.17 177.22 1p7m h SER 28 N 1.49 0.52 -0.11 -0.34 0.02 -1.97 -1.11 113.55 112.06 1p7m h SER 28 Ca -0.50 0.02 -0.14 0.00 -0.84 0.00 0.00 61.79 60.34 1p7m h SER 28 Cb 1.21 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 63.66 1p7m h SER 28 CO 0.64 0.29 -0.39 0.11 -1.14 0.00 0.00 176.83 176.34 1p7m h LYS 29 N 0.57 0.63 -0.66 3.45 1.57 -2.01 -3.20 116.57 116.92 1p7m h LYS 29 Ca 0.37 -0.32 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 1p7m h LYS 29 Cb 0.64 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.92 1p7m h LYS 29 CO -0.13 0.92 0.22 0.87 -0.57 0.00 0.00 179.45 180.75 1p7m h LYS 30 N 0.52 1.01 -0.94 3.15 1.57 -1.58 -2.69 116.57 117.61 1p7m h LYS 30 Ca 0.05 -0.21 0.07 0.00 -1.87 0.00 0.00 60.65 58.69 1p7m h LYS 30 Cb 0.91 -0.15 -0.06 0.00 0.08 0.00 0.00 32.23 33.00 1p7m h LYS 30 CO 0.08 0.87 0.61 -0.07 -0.57 0.00 0.00 179.45 180.37 1p7m h LEU 31 N 0.94 0.93 0.18 2.94 4.07 -1.52 0.78 115.31 123.64 1p7m h LEU 31 Ca 0.21 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.18 1p7m h LEU 31 Cb 0.27 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 41.83 1p7m h LEU 31 CO -0.01 0.59 -0.09 0.15 -1.08 0.00 0.00 178.44 178.00 1p7m h PHE 32 N 1.05 -0.22 -0.46 1.13 3.57 -1.54 0.75 116.94 121.22 1p7m h PHE 32 Ca 0.41 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.79 1p7m h PHE 32 Cb 0.23 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.02 1p7m h PHE 32 CO -0.00 0.10 -0.16 0.93 -2.23 0.00 0.00 178.31 176.95 1p7m h GLU 33 N -0.56 0.89 -0.08 1.11 5.08 -1.24 0.16 114.58 119.94 1p7m h GLU 33 Ca -0.02 -0.34 -0.04 0.00 -1.00 0.00 0.00 59.36 57.96 1p7m h GLU 33 Cb 0.42 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1p7m h GLU 33 CO 0.04 0.98 -0.09 1.98 -1.00 0.00 0.00 179.01 180.92 1p7m h MET 34 N 0.79 0.20 -0.11 2.33 4.05 0.63 -1.16 114.93 121.66 1p7m h MET 34 Ca 0.12 -0.11 -0.08 0.00 -0.28 0.00 0.00 59.70 59.35 1p7m h MET 34 Cb 0.69 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.49 1p7m h MET 34 CO 0.05 0.65 -0.29 0.97 0.23 0.00 0.00 176.91 178.52 1p7m h ILE 35 N -0.25 1.25 -0.16 1.77 6.09 0.56 0.11 117.51 126.88 1p7m h ILE 35 Ca 0.01 -1.19 -0.07 0.00 -1.37 0.00 0.00 64.86 62.25 1p7m h ILE 35 Cb 0.62 1.50 -0.00 0.00 0.47 0.00 0.00 36.82 39.41 1p7m h ILE 35 CO 0.02 0.36 -0.15 0.00 -3.07 0.00 0.00 178.15 175.31 1p7m h LEU 37 N 0.04 0.87 -1.07 0.00 3.38 -1.00 -2.79 115.31 114.74 1p7m h LEU 37 Ca 0.03 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.64 1p7m h LEU 37 Cb 0.68 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1p7m h LEU 37 CO 0.04 1.03 -0.02 -0.33 0.09 0.00 0.00 178.44 179.24 1p7m h GLU 38 N 0.77 0.63 -0.82 1.13 4.39 -0.72 -2.56 114.58 117.41 1p7m h GLU 38 Ca 0.12 -0.16 0.15 0.00 0.34 0.00 0.00 59.36 59.81 1p7m h GLU 38 Cb 0.69 -0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 29.20 1p7m h GLU 38 CO 0.05 0.67 0.54 0.78 -1.16 0.00 0.00 179.01 179.89 1p7m h GLY 39 N 0.92 0.89 1.66 -3.84 0.00 -0.95 0.04 103.07 101.77 1p7m h GLY 39 Ca 0.12 -0.22 -0.04 0.00 0.00 0.00 0.00 47.33 47.19 1p7m h GLY 39 CO 0.02 0.06 -0.01 1.46 0.00 0.00 0.00 176.54 178.07 1p7m h GLN 40 N 0.50 0.43 -0.37 4.80 4.20 -1.51 -2.64 115.11 120.53 1p7m h GLN 40 Ca 0.41 -0.08 0.11 0.00 0.06 0.00 0.00 58.65 59.14 1p7m h GLN 40 Cb 0.85 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.54 1p7m h GLN 40 CO -0.15 0.47 0.90 1.96 -0.67 0.00 0.00 178.83 181.34 1p7m h GLN 41 N 0.42 0.00 -6.06 1.46 1.08 -1.08 -3.29 115.11 107.64 1p7m h GLN 41 Ca 0.09 0.00 -0.63 0.00 -1.45 0.00 0.00 58.65 56.66 1p7m h GLN 41 Cb 0.29 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.72 1p7m h GLN 41 CO 0.01 0.00 1.36 0.00 -0.95 0.00 0.00 178.83 179.25 1p7m n ALA 42 N -1.89 1.26 0.00 3.87 0.00 -1.00 -0.61 120.51 122.14 1p7m n ALA 42 Ca 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1p7m n ALA 42 Cb 1.02 -2.66 0.00 0.00 0.00 0.00 0.00 19.45 17.82 1p7m n ALA 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p7m n GLY 43 N 5.74 2.25 3.93 0.00 0.00 -1.26 -4.94 105.19 110.91 1p7m n GLY 43 Ca 0.33 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.15 1p7m n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p7m s LEU 44 N 0.00 3.83 0.04 0.99 2.01 0.22 -5.11 118.68 120.66 1p7m s LEU 44 Ca 0.00 -0.31 -0.02 0.00 0.01 0.00 0.00 54.13 53.82 1p7m s LEU 44 Cb 0.00 -2.53 -0.04 0.00 0.01 0.00 0.00 46.19 43.62 1p7m s LEU 44 CO 0.00 -0.39 0.22 -0.44 1.01 0.00 0.00 176.35 176.75 1p7m s SER 45 N -4.09 6.38 0.28 2.29 0.01 -1.26 -4.49 113.70 112.82 1p7m s SER 45 Ca 0.43 0.34 -0.00 0.00 1.31 0.00 0.00 55.95 58.03 1p7m s SER 45 Cb -0.08 -1.99 0.49 0.00 0.21 0.00 0.00 66.02 64.65 1p7m s SER 45 CO 0.29 0.20 1.86 -0.25 0.41 0.00 0.00 173.24 175.75 1p7m h TRP 46 N 3.37 1.17 -0.89 2.43 2.91 -1.96 -0.69 115.95 122.30 1p7m h TRP 46 Ca -0.47 0.03 0.06 0.00 1.13 0.00 0.00 58.89 59.64 1p7m h TRP 46 Cb 1.17 -0.38 -0.06 0.00 -0.51 0.00 0.00 29.16 29.39 1p7m h TRP 46 CO 0.64 0.53 0.58 0.97 -1.03 0.00 0.00 178.44 180.13 1p7m h ILE 47 N 1.08 1.09 -0.73 2.65 -0.00 -1.99 0.30 117.51 119.90 1p7m h ILE 47 Ca 0.47 -0.36 -0.07 0.00 -0.00 0.00 0.00 64.86 64.91 1p7m h ILE 47 Cb 0.35 -0.05 -0.03 0.00 -0.00 0.00 0.00 36.82 37.09 1p7m h ILE 47 CO -0.23 0.19 0.19 0.74 -0.00 0.00 0.00 178.15 179.05 1p7m h THR 48 N 1.04 1.26 -0.37 2.19 2.02 -1.54 -2.04 112.91 115.48 1p7m h THR 48 Ca 0.38 -0.96 -0.08 0.00 0.77 0.00 0.00 66.41 66.52 1p7m h THR 48 Cb 0.15 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.04 1p7m h THR 48 CO -0.13 0.37 -0.10 0.58 0.37 0.00 0.00 175.52 176.60 1p7m h VAL 49 N 1.10 1.24 -0.17 3.16 2.07 -0.43 -2.17 116.25 121.05 1p7m h VAL 49 Ca 0.23 -1.08 0.04 0.00 0.82 0.00 0.00 66.70 66.71 1p7m h VAL 49 Cb 0.35 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 1p7m h VAL 49 CO -0.00 0.36 -0.07 0.25 0.02 0.00 0.00 177.57 178.13 1p7m h LEU 50 N 0.58 -0.24 -0.09 2.57 6.46 0.22 2.13 115.31 126.94 1p7m h LEU 50 Ca 0.11 0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.92 1p7m h LEU 50 Cb 0.53 0.14 -0.00 0.00 -0.73 0.00 0.00 40.66 40.59 1p7m h LEU 50 CO 0.03 -0.09 0.03 0.11 -0.62 0.00 0.00 178.44 177.90 1p7m h LYS 51 N -0.04 0.14 0.00 1.25 1.57 -1.32 -1.60 116.57 116.57 1p7m h LYS 51 Ca 0.09 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 1p7m h LYS 51 Cb 0.18 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 1p7m h LYS 51 CO -0.20 0.28 -0.10 0.87 -0.57 0.00 0.00 179.45 179.72 1p7m h LYS 52 N -0.02 0.00 -0.60 3.15 1.79 -0.93 -1.91 116.57 118.05 1p7m h LYS 52 Ca 0.03 0.00 0.09 0.00 -2.18 0.00 0.00 60.65 58.60 1p7m h LYS 52 Cb 0.19 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.77 1p7m h LYS 52 CO -0.00 0.10 0.21 -0.09 -1.08 0.00 0.00 179.45 178.60 1p7m h ARG 53 N 0.00 0.38 -0.54 3.15 2.43 0.45 1.25 114.38 121.49 1p7m h ARG 53 Ca -0.00 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.05 1p7m h ARG 53 Cb 0.24 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.69 1p7m h ARG 53 CO 0.01 0.25 -0.02 0.93 -1.51 0.00 0.00 179.97 179.63 1p7m h GLU 54 N 0.39 0.97 -0.27 0.20 4.39 -1.24 -2.87 114.58 116.14 1p7m h GLU 54 Ca 0.30 -0.32 -0.13 0.00 0.34 0.00 0.00 59.36 59.56 1p7m h GLU 54 Cb 0.38 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1p7m h GLU 54 CO -0.31 0.99 -0.37 -0.91 -1.16 0.00 0.00 179.01 177.24 1p7m h ASN 55 N 0.85 0.63 -0.21 1.42 2.35 -0.91 -2.67 115.58 117.03 1p7m h ASN 55 Ca 0.15 -0.27 0.02 0.00 -0.55 0.00 0.00 56.30 55.65 1p7m h ASN 55 Cb 0.56 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.73 1p7m h ASN 55 CO 0.03 0.94 0.08 0.22 -1.65 0.00 0.00 177.43 177.05 1p7m h TYR 56 N 0.50 0.14 0.00 1.19 3.20 0.17 -0.25 116.97 121.92 1p7m h TYR 56 Ca 0.05 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.86 1p7m h TYR 56 Cb 0.87 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.10 1p7m h TYR 56 CO 0.04 0.07 -0.33 0.07 -1.64 0.00 0.00 178.16 176.36 1p7m h ARG 57 N 0.18 0.00 -0.26 1.82 0.11 -1.51 -2.26 114.38 112.46 1p7m h ARG 57 Ca 0.09 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 60.02 1p7m h ARG 57 Cb 0.05 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.12 1p7m h ARG 57 CO -0.09 0.33 -0.44 0.00 0.10 0.00 0.00 179.97 179.88 1p7m h ALA 58 N 1.67 0.75 0.02 0.08 0.00 -0.93 1.01 119.26 121.85 1p7m h ALA 58 Ca -0.00 -0.46 -0.12 0.00 0.00 0.00 0.00 54.91 54.33 1p7m h ALA 58 Cb 0.72 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.42 1p7m h ALA 58 CO 0.04 0.66 -0.46 0.00 0.00 0.00 0.00 179.25 179.50 1p7m h PHE 60 N -0.34 0.21 0.00 0.00 -1.00 -1.46 -3.46 116.94 110.88 1p7m h PHE 60 Ca -0.06 -0.15 0.00 0.00 2.81 0.00 0.00 57.97 60.57 1p7m h PHE 60 Cb 1.22 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 40.77 1p7m h PHE 60 CO 0.17 1.31 0.00 1.58 -1.61 0.00 0.00 178.31 179.77 1p7m n HIS 61 N -4.30 0.00 0.07 -0.55 -0.00 0.35 -4.65 115.22 106.13 1p7m n HIS 61 Ca -0.20 0.00 -0.05 0.00 0.46 0.00 0.00 57.72 57.93 1p7m n HIS 61 Cb 0.70 -1.17 -0.09 0.00 -0.12 0.00 0.00 29.99 29.31 1p7m n HIS 61 CO 0.00 0.00 0.00 1.96 0.46 0.00 0.00 176.34 178.76 1p7m h GLN 62 N 0.00 0.00 0.00 1.57 4.20 -1.89 -3.46 115.11 115.53 1p7m h GLN 62 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1p7m h GLN 62 Cb 0.35 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.13 1p7m h GLN 62 CO 0.00 0.85 0.00 1.97 -0.67 0.00 0.00 178.83 180.98 1p7m n PHE 63 N -3.29 0.00 -4.96 2.96 -1.74 -1.26 -4.83 117.46 104.34 1p7m n PHE 63 Ca -0.01 0.00 -0.28 0.00 -0.56 0.00 0.00 57.45 56.60 1p7m n PHE 63 Cb 0.91 -0.78 -0.16 0.00 1.52 0.00 0.00 39.48 40.97 1p7m n PHE 63 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1p7m s ASP 64 N -0.41 2.42 0.24 5.98 1.11 -1.26 -5.02 116.67 119.73 1p7m s ASP 64 Ca 0.00 -0.40 0.25 0.00 0.18 0.00 0.00 52.55 52.59 1p7m s ASP 64 Cb 0.00 -0.64 0.85 0.00 1.07 0.00 0.00 42.92 44.20 1p7m s ASP 64 CO 0.00 0.19 1.76 1.55 1.18 0.00 0.00 175.17 179.84 1p7m h PRO 65 N 6.16 0.00 -0.09 8.23 0.13 -1.94 -3.17 132.00 141.32 1p7m h PRO 65 Ca -0.33 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.71 1p7m h PRO 65 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1p7m h PRO 65 CO 0.48 0.00 -0.31 0.28 -0.23 0.00 0.00 178.00 178.21 1p7m h VAL 66 N 0.00 1.41 -0.16 1.56 2.07 -1.95 -2.67 116.25 116.51 1p7m h VAL 66 Ca 0.00 -1.67 -0.14 0.00 0.82 0.00 0.00 66.70 65.71 1p7m h VAL 66 Cb 0.64 2.24 -0.01 0.00 -1.52 0.00 0.00 31.29 32.64 1p7m h VAL 66 CO 0.00 0.49 -0.49 0.11 0.02 0.00 0.00 177.57 177.70 1p7m h LYS 67 N -0.10 0.42 -0.80 1.57 1.57 -1.96 -3.02 116.57 114.26 1p7m h LYS 67 Ca -0.01 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.52 1p7m h LYS 67 Cb 0.94 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.23 1p7m h LYS 67 CO 0.07 0.82 0.46 0.28 -0.57 0.00 0.00 179.45 180.50 1p7m h VAL 68 N 0.33 1.23 0.00 0.50 2.07 -1.54 0.23 116.25 119.08 1p7m h VAL 68 Ca 0.02 -0.54 0.00 0.00 0.82 0.00 0.00 66.70 66.99 1p7m h VAL 68 Cb 0.98 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1p7m h VAL 68 CO 0.09 0.25 0.00 0.00 0.02 0.00 0.00 177.57 177.93 1p7m h ALA 69 N 1.24 1.00 -0.01 1.67 0.00 -1.34 0.32 119.26 122.14 1p7m h ALA 69 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1p7m h ALA 69 Cb -0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1p7m h ALA 69 CO -0.05 0.00 -0.19 0.00 0.00 0.00 0.00 179.25 179.01 1p7m n ALA 70 N -1.93 2.94 -2.60 0.00 0.00 0.74 -4.80 120.51 114.87 1p7m n ALA 70 Ca -0.01 -0.47 -0.42 0.00 0.00 0.00 0.00 53.44 52.54 1p7m n ALA 70 Cb 0.14 -1.07 -0.04 0.00 0.00 0.00 0.00 19.45 18.47 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 -2.31 3.80 0.54 0.00 -1.94 0.11 -5.03 119.30 114.47 1p7m s MET 71 Ca 0.28 0.47 0.03 0.00 -1.71 0.00 0.00 55.69 54.76 1p7m s MET 71 Cb 0.20 -3.81 0.10 0.00 2.01 0.00 0.00 34.83 33.33 1p7m s MET 71 CO 0.45 -0.92 0.74 1.04 -0.01 0.00 0.00 175.02 176.32 1p7m n GLN 72 N 6.65 0.31 0.11 2.03 6.02 -1.26 -4.93 117.38 126.31 1p7m n GLN 72 Ca 0.06 -2.34 0.11 0.00 -0.01 0.00 0.00 57.00 54.82 1p7m n GLN 72 Cb 0.48 -0.39 0.60 0.00 1.02 0.00 0.00 30.24 31.95 1p7m n GLN 72 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1p7m h GLU 73 N 0.00 0.14 -0.23 -1.09 5.08 -1.99 -1.96 114.58 114.53 1p7m h GLU 73 Ca -0.25 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.14 1p7m h GLU 73 Cb 1.00 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 30.18 1p7m h GLU 73 CO 0.30 0.10 0.01 1.49 -1.00 0.00 0.00 179.01 179.90 1p7m h GLU 74 N 0.15 0.08 -0.80 2.33 4.81 -2.00 0.46 114.58 119.61 1p7m h GLU 74 Ca 0.12 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 1p7m h GLU 74 Cb 0.31 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.63 1p7m h GLU 74 CO -0.02 0.05 0.41 -0.44 -0.73 0.00 0.00 179.01 178.28 1p7m h ASP 75 N 0.08 1.02 -0.83 1.04 3.32 -1.73 -2.03 116.42 117.29 1p7m h ASP 75 Ca 0.11 -0.10 0.04 0.00 0.02 0.00 0.00 57.03 57.09 1p7m h ASP 75 Cb 0.13 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.37 1p7m h ASP 75 CO -0.18 0.84 0.53 0.58 -1.72 0.00 0.00 179.24 179.29 1p7m h VAL 76 N 1.13 1.12 -0.33 -1.35 2.07 -0.82 -0.59 116.25 117.48 1p7m h VAL 76 Ca 0.28 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.45 1p7m h VAL 76 Cb 0.08 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 29.84 1p7m h VAL 76 CO -0.04 0.19 0.19 1.05 0.02 0.00 0.00 177.57 178.98 1p7m h GLU 77 N 1.02 0.44 -0.12 1.57 -0.00 -0.23 -0.15 114.58 117.11 1p7m h GLU 77 Ca 0.33 -0.03 -0.05 0.00 -0.00 0.00 0.00 59.36 59.61 1p7m h GLU 77 Cb 0.03 -0.09 -0.00 0.00 -0.00 0.00 0.00 28.75 28.68 1p7m h GLU 77 CO -0.12 0.31 -0.11 0.00 -0.00 0.00 0.00 179.01 179.09 1p7m h ARG 78 N 0.45 0.29 -0.08 1.06 3.08 -0.89 -3.27 114.38 115.02 1p7m h ARG 78 Ca 0.12 -0.15 -0.13 0.00 0.07 0.00 0.00 59.98 59.89 1p7m h ARG 78 Cb -0.01 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1p7m h ARG 78 CO -0.02 0.69 -0.53 -0.07 -1.07 0.00 0.00 179.97 178.96 1p7m h LEU 79 N -0.09 0.24 -1.83 3.04 3.38 -0.92 -2.87 115.31 116.26 1p7m h LEU 79 Ca 0.02 -0.13 0.22 0.00 0.09 0.00 0.00 57.88 58.08 1p7m h LEU 79 Cb 0.63 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 1p7m h LEU 79 CO 0.03 0.73 0.69 0.58 0.09 0.00 0.00 178.44 180.56 1p7m h VAL 80 N 0.17 0.34 -0.00 1.22 2.07 -1.08 0.19 116.25 119.16 1p7m h VAL 80 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1p7m h VAL 80 Cb 1.00 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 1p7m h VAL 80 CO 0.08 0.00 -0.50 0.00 0.02 0.00 0.00 177.57 177.18 1p7m n GLN 81 N -3.80 3.14 -2.28 1.57 10.64 -1.16 -4.33 117.38 121.16 1p7m n GLN 81 Ca 0.15 -0.08 -0.43 0.00 -1.83 0.00 0.00 57.00 54.81 1p7m n GLN 81 Cb 0.96 -1.04 -0.02 0.00 -0.86 0.00 0.00 30.24 29.27 1p7m n GLN 81 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1p7m s ASP 82 N -1.99 6.31 0.00 2.61 1.01 0.66 -2.87 116.67 122.39 1p7m s ASP 82 Ca 0.05 1.02 0.00 0.00 0.71 0.00 0.00 52.55 54.33 1p7m s ASP 82 Cb 0.09 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.48 1p7m s ASP 82 CO 0.44 -1.42 0.00 0.00 0.21 0.00 0.00 175.17 174.40 1p7m n ALA 83 N 8.87 0.00 -2.62 5.23 0.00 -1.26 -3.33 120.51 127.40 1p7m n ALA 83 Ca 0.18 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.58 1p7m n ALA 83 Cb 0.47 -0.07 0.01 0.00 0.00 0.00 0.00 19.45 19.86 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 -1.80 0.66 0.00 0.00 0.00 -1.14 -5.03 105.19 97.88 1p7m n GLY 84 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.47 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 -3.03 0.00 -1.80 -0.61 -5.35 -1.21 -4.56 119.36 102.80 1p7m n ILE 85 Ca -0.00 0.00 -0.34 0.00 -0.27 0.00 0.00 62.75 62.14 1p7m n ILE 85 Cb 0.51 0.00 -0.04 0.00 -1.74 0.00 0.00 39.64 38.38 1p7m n ILE 85 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 1p7m s ILE 86 N -0.54 3.19 0.21 7.28 1.01 -1.26 -4.89 121.20 126.20 1p7m s ILE 86 Ca 0.00 0.05 -0.32 0.00 0.00 0.00 0.00 60.65 60.37 1p7m s ILE 86 Cb 0.00 -3.49 -0.13 0.00 0.01 0.00 0.00 42.46 38.85 1p7m s ILE 86 CO 0.00 -0.47 1.50 0.54 0.00 0.00 0.00 174.94 176.51 1p7m n ARG 87 N 9.05 2.15 0.00 2.79 1.74 -1.26 -4.85 116.66 126.28 1p7m n ARG 87 Ca 0.31 0.77 0.00 0.00 -0.77 0.00 0.00 57.85 58.16 1p7m n ARG 87 Cb 0.52 -2.49 0.00 0.00 -1.02 0.00 0.00 32.46 29.47 1p7m n ARG 87 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1p7m n HIS 88 N 2.57 0.00 -0.21 -1.55 8.25 -1.26 -5.00 115.22 118.02 1p7m n HIS 88 Ca 0.14 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.73 1p7m n HIS 88 Cb 0.31 0.00 0.44 0.00 1.12 0.00 0.00 29.99 31.86 1p7m n HIS 88 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1p7m h ARG 89 N 0.00 0.55 0.45 -0.41 3.08 -1.93 0.15 114.38 116.26 1p7m h ARG 89 Ca 0.00 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 1p7m h ARG 89 Cb 0.00 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.93 1p7m h ARG 89 CO 0.00 0.36 -0.21 0.78 -1.07 0.00 0.00 179.97 179.83 1p7m h GLY 90 N 0.56 -0.63 0.97 0.04 0.00 -1.99 0.19 103.07 102.22 1p7m h GLY 90 Ca 0.40 0.23 -0.04 0.00 0.00 0.00 0.00 47.33 47.92 1p7m h GLY 90 CO -0.15 -0.23 0.16 1.70 0.00 0.00 0.00 176.54 178.01 1p7m h LYS 91 N -0.61 0.75 -0.53 4.80 1.63 -1.69 -2.45 116.57 118.47 1p7m h LYS 91 Ca -0.06 -0.16 0.03 0.00 -0.85 0.00 0.00 60.65 59.61 1p7m h LYS 91 Cb 0.47 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 31.95 1p7m h LYS 91 CO 0.10 0.70 0.30 0.82 -3.45 0.00 0.00 179.45 177.93 1p7m h ILE 92 N 0.65 1.03 -0.52 2.00 2.04 -0.56 -0.34 117.51 121.80 1p7m h ILE 92 Ca 0.16 -0.21 0.06 0.00 1.00 0.00 0.00 64.86 65.88 1p7m h ILE 92 Cb 0.26 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 1p7m h ILE 92 CO -0.01 0.11 0.35 1.56 0.00 0.00 0.00 178.15 180.16 1p7m h GLN 93 N 0.60 0.44 -0.83 2.37 4.20 -0.34 0.70 115.11 122.24 1p7m h GLN 93 Ca 0.22 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.91 1p7m h GLN 93 Cb 0.06 -0.10 -0.04 0.00 0.30 0.00 0.00 27.48 27.70 1p7m h GLN 93 CO -0.12 0.29 0.54 0.00 -0.67 0.00 0.00 178.83 178.88 1p7m h ALA 94 N 1.72 1.39 -0.38 3.87 0.00 -0.59 -1.38 119.26 123.90 1p7m h ALA 94 Ca 0.23 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1p7m h ALA 94 Cb 0.33 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1p7m h ALA 94 CO -0.06 0.56 -0.03 0.82 0.00 0.00 0.00 179.25 180.54 1p7m h ILE 95 N 1.13 1.27 -0.42 0.00 2.04 -0.57 -1.22 117.51 119.74 1p7m h ILE 95 Ca 0.30 -1.05 0.03 0.00 1.00 0.00 0.00 64.86 65.14 1p7m h ILE 95 Cb -0.12 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 1p7m h ILE 95 CO -0.06 0.35 0.22 0.40 0.00 0.00 0.00 178.15 179.06 1p7m h ILE 96 N 0.50 1.00 -0.78 -0.67 5.03 -0.83 -0.92 117.51 120.84 1p7m h ILE 96 Ca 0.10 -0.15 -0.01 0.00 -0.12 0.00 0.00 64.86 64.68 1p7m h ILE 96 Cb 0.51 0.51 -0.04 0.00 -3.03 0.00 0.00 36.82 34.77 1p7m h ILE 96 CO 0.02 0.08 0.45 1.23 -0.68 0.00 0.00 178.15 179.26 1p7m h GLY 97 N 0.45 1.15 1.18 5.37 0.00 -1.12 -1.55 103.07 108.54 1p7m h GLY 97 Ca 0.17 -0.49 0.03 0.00 0.00 0.00 0.00 47.33 47.04 1p7m h GLY 97 CO -0.10 0.47 0.49 3.43 0.00 0.00 0.00 176.54 180.83 1p7m h ASN 98 N 1.08 0.79 -0.31 0.19 2.35 0.06 -2.01 115.58 117.74 1p7m h ASN 98 Ca 0.28 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.99 1p7m h ASN 98 Cb -0.01 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.16 1p7m h ASN 98 CO -0.05 0.55 0.10 0.00 -1.65 0.00 0.00 177.43 176.38 1p7m h ALA 99 N 1.56 0.40 -0.87 -0.83 0.00 -0.48 -2.37 119.26 116.67 1p7m h ALA 99 Ca 0.29 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 55.11 1p7m h ALA 99 Cb 0.02 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 1p7m h ALA 99 CO -0.08 0.03 0.57 -0.09 0.00 0.00 0.00 179.25 179.68 1p7m h ARG 100 N 0.34 0.98 -0.44 0.00 9.65 -1.16 -0.40 114.38 123.35 1p7m h ARG 100 Ca 0.10 -0.06 -0.03 0.00 -1.10 0.00 0.00 59.98 58.89 1p7m h ARG 100 Cb 0.23 -0.22 -0.02 0.00 -1.39 0.00 0.00 29.97 28.57 1p7m h ARG 100 CO -0.00 0.65 0.13 0.00 2.80 0.00 0.00 179.97 183.54 1p7m h ALA 101 N 1.52 1.40 -0.53 2.80 0.00 -0.94 -1.77 119.26 121.73 1p7m h ALA 101 Ca 0.37 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1p7m h ALA 101 Cb 0.15 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1p7m h ALA 101 CO -0.13 0.44 0.31 -0.92 0.00 0.00 0.00 179.25 178.95 1p7m h TYR 102 N 0.63 0.72 0.00 0.00 3.20 -0.59 0.26 116.97 121.19 1p7m h TYR 102 Ca 0.15 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.99 1p7m h TYR 102 Cb 0.21 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.24 1p7m h TYR 102 CO 0.01 0.51 -0.10 -0.07 -1.64 0.00 0.00 178.16 176.88 1p7m h LEU 103 N 0.72 0.00 -0.59 2.82 -0.00 -0.98 -2.30 115.31 114.97 1p7m h LEU 103 Ca 0.19 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 58.02 1p7m h LEU 103 Cb 0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.66 1p7m h LEU 103 CO -0.03 0.10 0.18 0.06 -0.00 0.00 0.00 178.44 178.74 1p7m h GLN 104 N 0.00 0.93 -0.44 1.13 3.07 -0.12 0.19 115.11 119.86 1p7m h GLN 104 Ca -0.00 -0.21 -0.14 0.00 0.09 0.00 0.00 58.65 58.39 1p7m h GLN 104 Cb 0.24 -0.13 -0.01 0.00 0.08 0.00 0.00 27.48 27.66 1p7m h GLN 104 CO 0.01 0.84 -0.27 0.52 0.09 0.00 0.00 178.83 180.02 1p7m h MET 105 N 0.85 0.94 -0.49 0.06 2.86 -1.22 -1.76 114.93 116.18 1p7m h MET 105 Ca 0.19 -0.43 -0.10 0.00 -2.06 0.00 0.00 59.70 57.30 1p7m h MET 105 Cb 0.30 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 1p7m h MET 105 CO -0.00 1.09 -0.09 0.93 1.06 0.00 0.00 176.91 179.90 1p7m h GLU 106 N 0.80 0.92 0.00 1.72 5.08 -1.23 0.27 114.58 122.14 1p7m h GLU 106 Ca 0.09 -0.34 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1p7m h GLU 106 Cb 0.85 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.04 1p7m h GLU 106 CO 0.07 0.99 0.00 1.96 -1.00 0.00 0.00 179.01 181.04 1p7m h GLN 107 N 0.77 0.00 -0.00 2.33 4.20 -0.52 0.50 115.11 122.40 1p7m h GLN 107 Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1p7m h GLN 107 Cb 0.64 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.42 1p7m h GLN 107 CO 0.04 0.00 -0.59 -1.71 -0.67 0.00 0.00 178.83 175.90 1p7m n ASN 108 N -3.01 0.69 -0.87 1.46 5.15 -0.13 -4.94 115.26 113.61 1p7m n ASN 108 Ca -0.01 -0.50 -0.09 0.00 -0.60 0.00 0.00 54.58 53.38 1p7m n ASN 108 Cb 0.17 0.42 -0.02 0.00 -0.53 0.00 0.00 39.78 39.82 1p7m n ASN 108 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1p7m n GLY 109 N 1.49 0.51 3.10 8.20 0.00 0.18 -4.99 105.19 113.68 1p7m n GLY 109 Ca 0.06 -0.57 -0.34 0.00 0.00 0.00 0.00 46.02 45.17 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 -3.64 1.97 0.57 1.61 2.56 0.10 -4.99 118.70 116.88 1p7m s GLU 110 Ca 0.00 -1.70 -0.19 0.00 0.00 0.00 0.00 54.97 53.08 1p7m s GLU 110 Cb 0.00 -3.38 -0.07 0.00 2.00 0.00 0.00 34.13 32.69 1p7m s GLU 110 CO 0.00 -0.93 0.85 -2.30 -0.56 0.00 0.00 175.26 172.32 1p7m n PRO 111 N 4.51 0.84 -0.10 4.30 -0.02 -1.26 -4.39 135.00 138.88 1p7m n PRO 111 Ca -0.03 0.32 -0.12 0.00 -2.02 0.00 0.00 63.50 61.65 1p7m n PRO 111 Cb 0.42 -2.02 -0.04 0.00 -0.02 0.00 0.00 33.50 31.84 1p7m n PRO 111 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1p7m h PHE 112 N 0.55 0.76 0.00 6.00 3.57 -1.95 -3.06 116.94 122.81 1p7m h PHE 112 Ca -0.47 -0.20 -0.07 0.00 3.53 0.00 0.00 57.97 60.76 1p7m h PHE 112 Cb 1.37 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.93 1p7m h PHE 112 CO 0.36 0.90 -0.31 0.00 -2.23 0.00 0.00 178.31 177.03 1p7m h ALA 113 N 0.75 1.15 -0.20 2.41 0.00 -1.85 -2.99 119.26 118.52 1p7m h ALA 113 Ca 0.06 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.72 1p7m h ALA 113 Cb 0.72 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1p7m h ALA 113 CO 0.05 0.39 0.03 0.22 0.00 0.00 0.00 179.25 179.94 1p7m h ASP 114 N 0.00 -0.02 0.30 0.00 3.58 -1.90 0.14 116.42 118.52 1p7m h ASP 114 Ca -0.00 0.04 -0.23 0.00 0.42 0.00 0.00 57.03 57.25 1p7m h ASP 114 Cb 0.71 0.05 0.01 0.00 1.72 0.00 0.00 39.33 41.82 1p7m h ASP 114 CO 0.04 0.02 -0.96 2.19 -2.88 0.00 0.00 179.24 177.64 1p7m h PHE 115 N 0.10 0.67 0.40 0.28 -0.00 -1.65 -2.55 116.94 114.19 1p7m h PHE 115 Ca 0.09 -0.37 -0.02 0.00 -0.00 0.00 0.00 57.97 57.68 1p7m h PHE 115 Cb 0.10 -0.07 0.00 0.00 -0.00 0.00 0.00 35.95 35.98 1p7m h PHE 115 CO -0.16 1.19 -0.19 0.28 -0.00 0.00 0.00 178.31 179.43 1p7m h VAL 116 N 0.25 0.58 -0.03 0.88 2.07 -1.35 -1.90 116.25 116.74 1p7m h VAL 116 Ca -0.09 -0.39 0.01 0.00 0.82 0.00 0.00 66.70 67.05 1p7m h VAL 116 Cb 1.60 0.76 -0.00 0.00 -1.52 0.00 0.00 31.29 32.14 1p7m h VAL 116 CO 0.17 0.07 0.09 -0.50 0.02 0.00 0.00 177.57 177.43 1p7m h TRP 117 N -0.77 0.00 -0.04 1.57 4.06 -0.82 0.43 115.95 120.38 1p7m h TRP 117 Ca -0.05 0.00 -0.16 0.00 2.06 0.00 0.00 58.89 60.73 1p7m h TRP 117 Cb 0.53 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.67 1p7m h TRP 117 CO 0.00 0.00 -0.71 0.66 -3.56 0.00 0.00 178.44 174.83 1p7m h SER 118 N 0.00 0.25 0.43 -3.49 4.64 -0.91 1.54 113.55 116.01 1p7m h SER 118 Ca 0.01 -0.16 -0.10 0.00 -0.47 0.00 0.00 61.79 61.07 1p7m h SER 118 Cb 0.20 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.21 1p7m h SER 118 CO -0.00 0.87 -0.48 -0.26 -0.87 0.00 0.00 176.83 176.10 1p7m h PHE 119 N 0.14 0.06 -0.48 4.77 0.04 -0.43 -2.41 116.94 118.63 1p7m h PHE 119 Ca -0.02 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.73 1p7m h PHE 119 Cb 1.26 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.40 1p7m h PHE 119 CO 0.02 0.52 0.00 1.33 -0.60 0.00 0.00 178.31 179.58 1p7m n VAL 120 N -3.97 2.12 -3.45 -0.55 0.24 -1.16 -4.83 118.33 106.73 1p7m n VAL 120 Ca -0.02 -1.11 -0.20 0.00 -2.04 0.00 0.00 64.34 60.97 1p7m n VAL 120 Cb 0.50 -0.26 0.07 0.00 -1.47 0.00 0.00 33.84 32.68 1p7m n VAL 120 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1p7m n ASN 121 N 0.57 -5.18 -2.39 -1.34 3.02 -0.91 -2.43 115.26 106.61 1p7m n ASN 121 Ca 0.22 -0.50 -0.02 0.00 -0.03 0.00 0.00 54.58 54.25 1p7m n ASN 121 Cb 0.98 -4.62 -0.00 0.00 -0.61 0.00 0.00 39.78 35.53 1p7m n ASN 121 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 1p7m n HIS 122 N -4.58 -1.84 -3.85 3.10 -0.00 0.52 -4.86 115.22 103.71 1p7m n HIS 122 Ca -0.05 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.02 1p7m n HIS 122 Cb 0.57 -1.28 -0.10 0.00 -0.12 0.00 0.00 29.99 29.06 1p7m n HIS 122 CO 0.00 0.00 0.00 1.14 0.46 0.00 0.00 176.34 177.94 1p7m s GLN 123 N -4.81 0.43 0.37 1.57 -2.07 -1.02 -5.08 119.66 109.06 1p7m s GLN 123 Ca 0.00 -0.24 -0.28 0.00 -1.82 0.00 0.00 55.36 53.01 1p7m s GLN 123 Cb 0.00 0.18 -0.11 0.00 -1.09 0.00 0.00 33.01 31.99 1p7m s GLN 123 CO 0.00 -0.10 1.50 -0.35 -1.32 0.00 0.00 175.29 175.02 1p7m n PRO 124 N 1.79 2.66 -4.36 9.60 -0.04 -1.26 -4.86 135.00 138.53 1p7m n PRO 124 Ca -0.20 0.94 -0.31 0.00 -0.04 0.00 0.00 63.50 63.89 1p7m n PRO 124 Cb 0.56 -2.67 -0.10 0.00 -0.04 0.00 0.00 33.50 31.25 1p7m n PRO 124 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1p7m s GLN 125 N -1.88 2.24 -0.20 0.54 -0.44 -1.08 -4.95 119.66 113.89 1p7m s GLN 125 Ca 0.55 -0.93 -0.15 0.00 -2.50 0.00 0.00 55.36 52.32 1p7m s GLN 125 Cb -0.48 -2.34 -0.04 0.00 -1.64 0.00 0.00 33.01 28.51 1p7m s GLN 125 CO 0.62 0.54 0.36 -1.64 0.50 0.00 0.00 175.29 175.67 1p7m s MET 126 N -1.86 4.18 0.15 1.67 -1.94 -1.26 -0.90 119.30 119.34 1p7m s MET 126 Ca 0.19 0.14 -0.11 0.00 -1.71 0.00 0.00 55.69 54.20 1p7m s MET 126 Cb -0.11 -3.52 -0.00 0.00 2.01 0.00 0.00 34.83 33.21 1p7m s MET 126 CO 0.11 0.01 1.55 1.15 -0.01 0.00 0.00 175.02 177.82 1p7m h THR 127 N 4.98 1.27 -5.22 2.05 2.02 -1.56 -3.47 112.91 112.97 1p7m h THR 127 Ca -0.37 -1.31 -0.32 0.00 0.77 0.00 0.00 66.41 65.18 1p7m h THR 127 Cb 1.16 1.14 0.14 0.00 -1.74 0.00 0.00 68.15 68.85 1p7m h THR 127 CO 0.72 0.45 -0.63 0.00 0.37 0.00 0.00 175.52 176.42 1p7m n GLN 128 N -4.19 -6.42 -4.35 6.66 6.02 -1.26 -5.01 117.38 108.83 1p7m n GLN 128 Ca -0.00 0.74 -0.35 0.00 -0.01 0.00 0.00 57.00 57.37 1p7m n GLN 128 Cb 0.42 -5.46 -0.10 0.00 1.02 0.00 0.00 30.24 26.12 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 -3.30 3.29 -0.56 -1.58 0.00 -1.26 -4.99 121.76 113.36 1p7m s ALA 129 Ca 0.26 -0.80 0.20 0.00 0.00 0.00 0.00 51.96 51.62 1p7m s ALA 129 Cb -0.12 -1.51 -0.26 0.00 0.00 0.00 0.00 23.12 21.23 1p7m s ALA 129 CO 0.64 0.56 0.68 0.25 0.00 0.00 0.00 175.76 177.89 1p7m n THR 130 N 2.24 0.00 -3.99 0.00 -2.24 -1.25 -2.01 114.28 107.02 1p7m n THR 130 Ca -0.19 -0.22 -0.09 0.00 -2.27 0.00 0.00 64.05 61.29 1p7m n THR 130 Cb 0.54 0.59 -0.06 0.00 -2.10 0.00 0.00 70.33 69.30 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 -3.13 0.01 0.39 4.28 -4.23 -1.26 -4.89 115.64 106.81 1p7m s THR 131 Ca 0.01 -1.41 0.06 0.00 -1.18 0.00 0.00 61.69 59.17 1p7m s THR 131 Cb 0.14 -2.16 0.26 0.00 1.34 0.00 0.00 72.50 72.08 1p7m s THR 131 CO 0.84 -0.03 2.04 -0.07 -0.54 0.00 0.00 174.62 176.86 1p7m h LEU 132 N 2.29 0.55 -0.14 4.79 3.38 -1.94 0.39 115.31 124.63 1p7m h LEU 132 Ca -0.27 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1p7m h LEU 132 Cb 1.25 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1p7m h LEU 132 CO 0.37 0.40 0.00 -0.24 0.09 0.00 0.00 178.44 179.06 1p7m n SER 133 N -4.46 0.23 -1.55 -0.43 2.88 -1.26 -2.14 113.62 106.89 1p7m n SER 133 Ca 0.04 0.54 0.09 0.00 -1.33 0.00 0.00 58.87 58.21 1p7m n SER 133 Cb 0.06 -0.60 0.34 0.00 -0.75 0.00 0.00 64.21 63.27 1p7m n SER 133 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1p7m n GLU 134 N -1.74 3.63 -3.51 -1.46 -0.58 0.12 -4.76 120.64 112.35 1p7m n GLU 134 Ca 0.04 -2.74 -0.42 0.00 -0.42 0.00 0.00 57.16 53.63 1p7m n GLU 134 Cb 0.26 -1.88 -0.07 0.00 -0.57 0.00 0.00 31.44 29.18 1p7m n GLU 134 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1p7m s ILE 135 N -1.85 4.45 0.28 -3.67 -1.09 -0.91 -4.60 121.20 113.82 1p7m s ILE 135 Ca 0.49 -1.90 -0.29 0.00 -2.23 0.00 0.00 60.65 56.72 1p7m s ILE 135 Cb 0.32 -3.90 -0.10 0.00 -1.58 0.00 0.00 42.46 37.20 1p7m s ILE 135 CO 0.24 -0.82 1.31 -2.16 -1.23 0.00 0.00 174.94 172.28 1p7m s PRO 136 N 1.17 4.37 0.00 2.79 0.04 -1.26 -4.92 135.00 137.20 1p7m s PRO 136 Ca 0.07 2.16 0.24 0.00 0.04 0.00 0.00 61.00 63.52 1p7m s PRO 136 Cb -0.25 -3.11 0.44 0.00 0.04 0.00 0.00 34.50 31.62 1p7m s PRO 136 CO -0.01 -0.21 1.40 0.25 0.04 0.00 0.00 177.00 178.47 1p7m n THR 137 N 1.49 0.16 -3.50 1.26 -2.24 -1.26 -4.67 114.28 105.52 1p7m n THR 137 Ca 0.02 -0.52 -0.29 0.00 -2.27 0.00 0.00 64.05 61.00 1p7m n THR 137 Cb 0.42 1.09 -0.12 0.00 -2.10 0.00 0.00 70.33 69.61 1p7m n THR 137 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1p7m s SER 138 N -1.81 3.11 0.19 3.42 0.01 -1.26 -3.50 113.70 113.85 1p7m s SER 138 Ca 0.33 -2.13 0.06 0.00 1.31 0.00 0.00 55.95 55.52 1p7m s SER 138 Cb 0.21 -0.46 -0.04 0.00 0.21 0.00 0.00 66.02 65.94 1p7m s SER 138 CO 0.31 -0.32 0.14 0.42 0.41 0.00 0.00 173.24 174.19 1p7m s THR 139 N 1.12 4.41 0.32 1.44 -4.23 -1.26 -4.87 115.64 112.56 1p7m s THR 139 Ca 0.17 -1.19 0.06 0.00 -1.18 0.00 0.00 61.69 59.55 1p7m s THR 139 Cb -0.22 -3.28 0.31 0.00 1.34 0.00 0.00 72.50 70.64 1p7m s THR 139 CO -0.03 -0.17 1.81 1.55 -0.54 0.00 0.00 174.62 177.23 1p7m h PRO 140 N 2.21 0.75 -0.05 3.99 0.13 -2.00 1.91 132.00 138.94 1p7m h PRO 140 Ca -0.48 -0.05 -0.14 0.00 -0.87 0.00 0.00 66.00 64.47 1p7m h PRO 140 Cb 1.21 -0.17 0.01 0.00 0.13 0.00 0.00 31.00 32.18 1p7m h PRO 140 CO 0.62 0.50 -0.50 0.00 -0.23 0.00 0.00 178.00 178.39 1p7m h ALA 141 N 1.61 0.13 -0.37 -0.56 0.00 -1.95 -1.87 119.26 116.25 1p7m h ALA 141 Ca 0.54 -0.52 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 1p7m h ALA 141 Cb 0.82 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1p7m h ALA 141 CO -0.32 0.32 -0.25 0.66 0.00 0.00 0.00 179.25 179.67 1p7m h SER 142 N -0.04 0.78 -0.21 0.00 4.64 -1.52 -2.35 113.55 114.85 1p7m h SER 142 Ca -0.05 -0.29 -0.08 0.00 -0.47 0.00 0.00 61.79 60.90 1p7m h SER 142 Cb 1.17 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 63.03 1p7m h SER 142 CO 0.10 0.99 -0.14 -0.78 -0.87 0.00 0.00 176.83 176.14 1p7m h ASP 143 N 0.66 0.60 -0.62 4.97 1.82 0.29 -2.53 116.42 121.61 1p7m h ASP 143 Ca 0.09 -0.17 -0.07 0.00 -0.39 0.00 0.00 57.03 56.48 1p7m h ASP 143 Cb 0.76 -0.16 -0.03 0.00 0.68 0.00 0.00 39.33 40.58 1p7m h ASP 143 CO 0.06 0.76 0.12 0.00 -1.61 0.00 0.00 179.24 178.58 1p7m h ALA 144 N 1.30 1.00 -0.36 -0.78 0.00 -0.98 -2.40 119.26 117.03 1p7m h ALA 144 Ca 0.10 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.77 1p7m h ALA 144 Cb 0.56 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1p7m h ALA 144 CO 0.04 0.64 0.20 -0.07 0.00 0.00 0.00 179.25 180.06 1p7m h LEU 145 N 0.98 0.33 -0.96 0.00 3.38 -1.01 0.28 115.31 118.32 1p7m h LEU 145 Ca 0.20 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.26 1p7m h LEU 145 Cb 0.40 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 41.02 1p7m h LEU 145 CO 0.01 0.24 0.60 0.28 0.09 0.00 0.00 178.44 179.66 1p7m h SER 146 N 0.42 0.94 0.05 -0.43 0.02 -1.27 1.27 113.55 114.54 1p7m h SER 146 Ca 0.14 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1p7m h SER 146 Cb 0.01 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.38 1p7m h SER 146 CO -0.07 0.57 -0.02 0.11 -1.14 0.00 0.00 176.83 176.27 1p7m h LYS 147 N 1.05 -0.06 -0.42 3.45 1.57 -0.72 0.36 116.57 121.80 1p7m h LYS 147 Ca 0.43 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 59.16 1p7m h LYS 147 Cb 0.26 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 1p7m h LYS 147 CO -0.20 0.24 0.03 0.00 -0.57 0.00 0.00 179.45 178.94 1p7m h ALA 148 N 0.58 0.57 -0.48 3.86 0.00 0.20 -2.20 119.26 121.79 1p7m h ALA 148 Ca -0.01 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.54 1p7m h ALA 148 Cb 0.32 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1p7m h ALA 148 CO 0.01 0.33 -0.15 -0.07 0.00 0.00 0.00 179.25 179.37 1p7m h LEU 149 N 0.57 0.93 -0.91 0.00 3.38 0.16 -2.48 115.31 116.96 1p7m h LEU 149 Ca 0.12 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 1p7m h LEU 149 Cb 0.44 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 1p7m h LEU 149 CO 0.02 1.07 0.52 0.50 0.09 0.00 0.00 178.44 180.64 1p7m h LYS 150 N 0.81 1.26 -0.23 1.13 3.64 -0.10 -0.70 116.57 122.38 1p7m h LYS 150 Ca 0.12 -0.13 -0.07 0.00 -1.27 0.00 0.00 60.65 59.30 1p7m h LYS 150 Cb 0.69 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 1p7m h LYS 150 CO 0.05 0.90 -0.18 0.87 -2.27 0.00 0.00 179.45 178.82 1p7m h LYS 151 N 1.27 0.39 0.00 1.90 1.57 -1.15 -1.32 116.57 119.24 1p7m h LYS 151 Ca 0.32 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1p7m h LYS 151 Cb -0.01 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1p7m h LYS 151 CO -0.06 0.56 0.00 0.54 -0.57 0.00 0.00 179.45 179.92 1p7m n ARG 152 N -4.19 0.61 -1.67 3.15 5.12 -0.73 -4.76 116.66 114.18 1p7m n ARG 152 Ca -0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1p7m n ARG 152 Cb 0.34 -1.35 0.00 0.00 -1.16 0.00 0.00 32.46 30.28 1p7m n ARG 152 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1p7m n GLY 153 N 0.19 0.41 3.56 -0.13 0.00 -0.50 -4.62 105.19 104.11 1p7m n GLY 153 Ca 0.10 -0.93 -0.41 0.00 0.00 0.00 0.00 46.02 44.79 1p7m n GLY 153 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1p7m s PHE 154 N -2.00 3.19 0.58 1.61 2.19 -0.35 -4.63 117.98 118.57 1p7m s PHE 154 Ca 0.00 0.21 -0.03 0.00 0.33 0.00 0.00 56.93 57.44 1p7m s PHE 154 Cb 0.00 -2.89 0.03 0.00 -1.31 0.00 0.00 43.02 38.84 1p7m s PHE 154 CO 0.00 -0.51 0.85 0.15 1.83 0.00 0.00 175.22 177.54 1p7m s LYS 155 N 2.37 2.67 -1.07 10.12 -0.14 -1.26 -4.16 119.74 128.26 1p7m s LYS 155 Ca 0.19 -0.37 -0.09 0.00 -1.36 0.00 0.00 55.97 54.33 1p7m s LYS 155 Cb -0.15 -2.36 -0.06 0.00 -1.68 0.00 0.00 37.83 33.58 1p7m s LYS 155 CO 0.13 -0.75 0.89 1.19 -0.76 0.00 0.00 175.35 176.05 1p7m n PHE 156 N -2.50 -2.33 -2.27 3.18 3.72 -1.26 -4.94 117.46 111.05 1p7m n PHE 156 Ca 0.06 0.76 -0.01 0.00 -0.05 0.00 0.00 57.45 58.21 1p7m n PHE 156 Cb 0.59 -3.98 0.08 0.00 -0.94 0.00 0.00 39.48 35.23 1p7m n PHE 156 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 1p7m n VAL 157 N -3.46 1.28 -0.91 -4.37 0.24 -1.26 -4.22 118.33 105.61 1p7m n VAL 157 Ca -0.08 -2.55 -0.36 0.00 -2.04 0.00 0.00 64.34 59.32 1p7m n VAL 157 Cb 0.61 0.40 0.07 0.00 -1.47 0.00 0.00 33.84 33.45 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 -0.37 -3.40 0.32 7.63 0.00 -1.26 -4.37 105.19 103.75 1p7m n GLY 158 Ca 0.16 -0.60 0.19 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.26 0.27 -0.00 2.61 1.35 -1.90 0.18 112.91 114.15 1p7m h THR 159 Ca -0.44 0.00 -0.19 0.00 -0.55 0.00 0.00 66.41 65.23 1p7m h THR 159 Cb 1.33 0.95 -0.01 0.00 -1.73 0.00 0.00 68.15 68.69 1p7m h THR 159 CO 0.27 0.00 -0.85 0.71 -0.25 0.00 0.00 175.52 175.39 1p7m h THR 160 N 0.00 1.49 -0.25 6.82 1.35 -1.84 -1.94 112.91 118.54 1p7m h THR 160 Ca 0.01 -2.57 -0.06 0.00 -0.55 0.00 0.00 66.41 63.24 1p7m h THR 160 Cb 0.14 2.43 -0.01 0.00 -1.73 0.00 0.00 68.15 68.98 1p7m h THR 160 CO -0.00 0.75 -0.08 0.40 -0.25 0.00 0.00 175.52 176.34 1p7m h ILE 161 N 0.11 1.29 -0.80 6.82 1.08 -0.91 0.70 117.51 125.80 1p7m h ILE 161 Ca -0.04 -1.10 -0.04 0.00 -0.39 0.00 0.00 64.86 63.28 1p7m h ILE 161 Cb 1.47 1.50 -0.04 0.00 -3.07 0.00 0.00 36.82 36.69 1p7m h ILE 161 CO 0.13 0.34 0.33 0.00 -0.69 0.00 0.00 178.15 178.27 1p7m h TYR 163 N 1.16 0.92 -0.53 0.00 3.20 -1.21 -1.53 116.97 118.98 1p7m h TYR 163 Ca 0.27 -0.28 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 1p7m h TYR 163 Cb 0.20 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.25 1p7m h TYR 163 CO 0.02 1.06 0.33 0.77 -1.64 0.00 0.00 178.16 178.69 1p7m h SER 164 N 0.51 0.63 -0.82 -2.11 0.02 -0.58 -2.13 113.55 109.08 1p7m h SER 164 Ca 0.04 -0.05 -0.04 0.00 -0.84 0.00 0.00 61.79 60.90 1p7m h SER 164 Cb 0.92 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 63.26 1p7m h SER 164 CO 0.08 0.49 0.35 0.15 -1.14 0.00 0.00 176.83 176.76 1p7m h PHE 165 N 0.71 1.22 -0.99 3.45 3.57 -1.09 -2.90 116.94 120.92 1p7m h PHE 165 Ca 0.19 -0.08 0.01 0.00 3.53 0.00 0.00 57.97 61.62 1p7m h PHE 165 Cb -0.03 -0.37 -0.05 0.00 2.79 0.00 0.00 35.95 38.29 1p7m h PHE 165 CO -0.03 0.91 0.65 1.98 -2.23 0.00 0.00 178.31 179.59 1p7m h MET 166 N 1.19 1.30 0.09 1.11 4.05 -0.62 -0.06 114.93 121.97 1p7m h MET 166 Ca 0.28 -0.08 -0.12 0.00 -0.28 0.00 0.00 59.70 59.50 1p7m h MET 166 Cb 0.18 -0.29 0.01 0.00 -0.80 0.00 0.00 31.60 30.70 1p7m h MET 166 CO -0.03 0.86 -0.53 -0.56 0.23 0.00 0.00 176.91 176.88 1p7m h GLN 167 N 1.33 0.21 0.00 0.39 3.07 -1.33 -3.10 115.11 115.68 1p7m h GLN 167 Ca 0.36 -0.34 -0.12 0.00 0.09 0.00 0.00 58.65 58.64 1p7m h GLN 167 Cb -0.15 0.12 -0.02 0.00 0.08 0.00 0.00 27.48 27.52 1p7m h GLN 167 CO -0.08 1.15 -0.57 0.00 0.09 0.00 0.00 178.83 179.42 1p7m h ALA 168 N 0.07 0.92 0.00 0.06 0.00 -1.54 -3.18 119.26 115.59 1p7m h ALA 168 Ca -0.09 -0.52 -0.07 0.00 0.00 0.00 0.00 54.91 54.22 1p7m h ALA 168 Cb 1.41 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1p7m h ALA 168 CO 0.10 0.72 -0.35 0.00 0.00 0.00 0.00 179.25 179.72 1p7m n GLY 170 N -0.51 0.72 0.32 0.00 0.00 -1.20 -4.36 105.19 100.16 1p7m n GLY 170 Ca -0.02 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.01 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 0.72 -8.51 0.99 3.38 -1.79 -3.43 115.31 106.67 1p7m h LEU 171 Ca 0.00 -0.05 -0.44 0.00 0.09 0.00 0.00 57.88 57.49 1p7m h LEU 171 Cb 0.00 -0.18 -0.21 0.00 0.09 0.00 0.00 40.66 40.36 1p7m h LEU 171 CO 0.00 0.58 -0.78 0.68 0.09 0.00 0.00 178.44 179.01 1p7m s VAL 172 N -5.58 1.27 0.31 1.22 -7.23 -1.19 -2.62 120.40 106.59 1p7m s VAL 172 Ca -0.10 -1.47 0.09 0.00 -1.81 0.00 0.00 61.98 58.69 1p7m s VAL 172 Cb 0.17 -1.29 -0.05 0.00 0.56 0.00 0.00 36.38 35.77 1p7m s VAL 172 CO 0.77 -0.26 0.01 0.20 -0.31 0.00 0.00 175.10 175.51 1p7m s ASN 173 N -1.99 4.32 0.00 4.85 0.01 -0.08 -4.80 114.94 117.25 1p7m s ASN 173 Ca 0.03 -0.86 0.00 0.00 -0.71 0.00 0.00 52.86 51.32 1p7m s ASN 173 Cb -0.08 -0.64 0.00 0.00 0.41 0.00 0.00 41.25 40.94 1p7m s ASN 173 CO 0.03 -0.15 0.00 0.47 -1.51 0.00 0.00 177.10 175.94 1p7m n ASP 174 N -0.94 -0.36 -0.33 -1.22 8.00 -1.26 -1.75 116.55 118.69 1p7m n ASP 174 Ca -0.05 0.00 0.10 0.00 0.71 0.00 0.00 54.79 55.55 1p7m n ASP 174 Cb 0.61 -0.18 0.27 0.00 -0.02 0.00 0.00 41.12 41.80 1p7m n ASP 174 CO 0.00 0.00 0.00 0.45 -0.39 0.00 0.00 177.20 177.26 1p7m h HIS 175 N 0.00 0.96 0.00 1.24 3.86 -1.93 -3.38 115.15 115.90 1p7m h HIS 175 Ca 0.00 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.18 1p7m h HIS 175 Cb 0.08 -0.28 -0.07 0.00 1.06 0.00 0.00 27.41 28.20 1p7m h HIS 175 CO 0.00 0.25 -0.15 1.55 0.86 0.00 0.00 177.93 180.44 1p7m n VAL 176 N -4.79 0.00 -2.06 2.45 3.14 -1.26 -4.84 118.33 110.97 1p7m n VAL 176 Ca 0.20 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.58 1p7m n VAL 176 Cb 0.48 0.25 0.00 0.00 -1.06 0.00 0.00 33.84 33.52 1p7m n VAL 176 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 1p7m n VAL 177 N 0.00-11.45 -0.42 1.55 0.31 -0.85 -3.96 118.33 103.51 1p7m n VAL 177 Ca -0.14 2.88 0.00 0.00 -0.01 0.00 0.00 64.34 67.07 1p7m n VAL 177 Cb 0.48 -4.83 0.00 0.00 -0.91 0.00 0.00 33.84 28.58 1p7m n VAL 177 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1p7m n GLY 178 N 1.90 0.79 3.78 2.92 0.00 -1.26 -4.86 105.19 108.46 1p7m n GLY 178 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -3.78 3.29 0.60 0.00 6.14 0.60 -4.95 117.35 119.25 1p7m s TYR 182 Ca 0.54 -1.24 -0.18 0.00 0.64 0.00 0.00 57.07 56.83 1p7m s TYR 182 Cb 0.44 -2.97 -0.07 0.00 0.42 0.00 0.00 41.96 39.78 1p7m s TYR 182 CO -0.16 -0.81 0.64 -2.30 0.64 0.00 0.00 175.55 173.56 1p7m n PRO 183 N 5.03 0.58 0.00 4.97 -0.02 -1.26 -4.49 135.00 139.80 1p7m n PRO 183 Ca -0.11 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 1p7m n PRO 183 Cb 0.44 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 1p7m n PRO 183 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1p7m n GLY 184 N 1.64 0.91 0.77 -1.23 0.00 -1.26 -4.96 105.19 101.06 1p7m n GLY 184 Ca 0.12 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 2.24 -1.46 1.61 5.03 -1.26 -5.04 115.26 116.37 1p7m n ASN 185 Ca 0.00 -1.92 0.05 0.00 0.87 0.00 0.00 54.58 53.58 1p7m n ASN 185 Cb 0.00 -0.24 -0.03 0.00 -1.02 0.00 0.00 39.78 38.50 1p7m n ASN 185 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1p7m n LYS 186 N 0.71 -3.37 0.00 3.52 4.01 -1.26 -5.28 118.16 116.49 1p7m n LYS 186 Ca 0.15 2.66 0.00 0.00 -0.51 0.00 0.00 58.31 60.61 1p7m n LYS 186 Cb 0.38 -3.53 0.00 0.00 -0.51 0.00 0.00 35.03 31.37 1p7m n LYS 186 CO 0.00 0.00 0.00 -2.30 -1.11 0.00 0.00 177.40 173.99