#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 3.21 1.19 2.12 2.02 -1.26 -4.93 118.70 121.05 1p7m s GLU 2 Ca 0.00 -0.60 -0.19 0.00 0.02 0.00 0.00 54.97 54.20 1p7m s GLU 2 Cb 0.00 -2.89 0.28 0.00 0.10 0.00 0.00 34.13 31.62 1p7m s GLU 2 CO 0.00 0.56 1.12 1.03 0.02 0.00 0.00 175.26 178.00 1p7m s ARG 3 N -2.69 -1.10 0.29 1.61 0.52 -1.26 -2.54 118.95 113.78 1p7m s ARG 3 Ca 0.33 -0.08 -0.26 0.00 -0.52 0.00 0.00 55.73 55.20 1p7m s ARG 3 Cb -0.12 -1.61 -0.15 0.00 0.52 0.00 0.00 34.95 33.59 1p7m s ARG 3 CO 0.26 -3.63 0.64 0.00 0.02 0.00 0.00 175.30 172.59 1p7m h GLY 5 N 1.19 0.53 0.21 0.00 0.00 -1.90 -2.10 103.07 101.00 1p7m h GLY 5 Ca -0.35 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 46.77 1p7m h GLY 5 CO 0.56 0.21 0.00 -2.67 0.00 0.00 0.00 176.54 174.64 1p7m n TRP 6 N -4.80 0.03 -0.08 5.60 4.27 -1.26 -3.83 117.44 117.37 1p7m n TRP 6 Ca -0.00 -0.01 -0.17 0.00 -3.89 0.00 0.00 57.50 53.43 1p7m n TRP 6 Cb 0.04 0.00 -0.12 0.00 -1.36 0.00 0.00 31.31 29.87 1p7m n TRP 6 CO 0.00 0.00 0.00 0.28 -2.29 0.00 0.00 177.69 175.68 1p7m h VAL 7 N 1.06 1.41 0.00 -1.67 2.07 -1.71 -3.25 116.25 114.16 1p7m h VAL 7 Ca 0.00 -2.24 0.00 0.00 0.82 0.00 0.00 66.70 65.28 1p7m h VAL 7 Cb 0.23 2.84 0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1p7m h VAL 7 CO 0.00 0.48 0.00 -0.24 0.02 0.00 0.00 177.57 177.83 1p7m n SER 8 N -4.55 0.00 -0.27 0.57 2.88 -1.13 -2.55 113.62 108.57 1p7m n SER 8 Ca -0.18 -0.06 -0.05 0.00 -1.33 0.00 0.00 58.87 57.26 1p7m n SER 8 Cb 0.54 -0.19 0.10 0.00 -0.75 0.00 0.00 64.21 63.91 1p7m n SER 8 CO 0.00 0.00 0.00 -0.61 -1.23 0.00 0.00 175.04 173.20 1p7m h GLN 9 N 0.00 1.13 -1.55 -1.46 4.15 -1.66 -3.46 115.11 112.26 1p7m h GLN 9 Ca 0.00 -0.19 0.22 0.00 0.77 0.00 0.00 58.65 59.45 1p7m h GLN 9 Cb 0.08 -0.19 -0.19 0.00 0.21 0.00 0.00 27.48 27.38 1p7m h GLN 9 CO 0.00 0.91 0.76 -0.51 -1.93 0.00 0.00 178.83 178.06 1p7m s ASP 10 N -6.38 -0.17 0.10 -0.69 1.01 -1.06 -5.15 116.67 104.33 1p7m s ASP 10 Ca -0.12 0.03 0.00 0.00 0.71 0.00 0.00 52.55 53.17 1p7m s ASP 10 Cb 0.16 0.18 0.00 0.00 1.01 0.00 0.00 42.92 44.27 1p7m s ASP 10 CO 0.83 -0.27 0.00 -0.81 0.21 0.00 0.00 175.17 175.12 1p7m n PRO 11 N -0.00 0.95 0.00 8.23 -0.04 -1.26 -3.69 135.00 139.18 1p7m n PRO 11 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 1p7m n PRO 11 Cb 0.59 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.05 1p7m n PRO 11 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1p7m n LEU 12 N 0.00 0.00 0.15 1.53 4.77 -1.26 -4.15 117.00 118.04 1p7m n LEU 12 Ca 0.00 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 56.04 1p7m n LEU 12 Cb 0.00 0.00 0.54 0.00 -2.33 0.00 0.00 43.42 41.63 1p7m n LEU 12 CO 0.00 0.00 1.09 1.88 -1.33 0.00 0.00 177.39 179.03 1p7m h TYR 13 N 0.00 0.21 -0.98 -1.77 0.05 -1.88 -1.29 116.97 111.31 1p7m h TYR 13 Ca 0.00 0.00 0.08 0.00 0.05 0.00 0.00 58.73 58.87 1p7m h TYR 13 Cb 0.00 -0.07 -0.07 0.00 1.01 0.00 0.00 36.73 37.60 1p7m h TYR 13 CO 0.00 0.15 0.62 0.82 -1.05 0.00 0.00 178.16 178.70 1p7m h ILE 14 N 0.22 1.02 0.02 -2.88 1.08 -1.77 0.82 117.51 116.02 1p7m h ILE 14 Ca 0.06 -0.37 -0.00 0.00 -0.39 0.00 0.00 64.86 64.16 1p7m h ILE 14 Cb 0.01 -0.15 0.00 0.00 -3.07 0.00 0.00 36.82 33.60 1p7m h ILE 14 CO -0.01 0.20 -0.01 0.00 -0.69 0.00 0.00 178.15 177.64 1p7m h ALA 15 N 1.48 -0.03 -0.75 1.87 0.00 -1.59 -2.67 119.26 117.57 1p7m h ALA 15 Ca 0.45 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1p7m h ALA 15 Cb 0.29 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1p7m h ALA 15 CO -0.21 -0.22 0.31 -0.92 0.00 0.00 0.00 179.25 178.21 1p7m h TYR 16 N -0.63 1.13 -0.61 0.00 3.20 -1.15 0.73 116.97 119.65 1p7m h TYR 16 Ca -0.00 -0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.79 1p7m h TYR 16 Cb 0.59 -0.34 -0.03 0.00 1.54 0.00 0.00 36.73 38.49 1p7m h TYR 16 CO 0.13 0.86 0.39 1.25 -1.64 0.00 0.00 178.16 179.15 1p7m h HIS 17 N 1.08 0.77 0.00 -3.82 2.76 0.59 -2.35 115.15 114.18 1p7m h HIS 17 Ca 0.25 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.43 1p7m h HIS 17 Cb 0.20 -0.26 0.00 0.00 1.55 0.00 0.00 27.41 28.90 1p7m h HIS 17 CO 0.02 0.50 -0.15 -0.25 -1.30 0.00 0.00 177.93 176.75 1p7m n ASP 18 N -4.65 0.74 -0.04 3.26 8.00 -1.01 -4.05 116.55 118.81 1p7m n ASP 18 Ca 0.04 0.45 -0.04 0.00 0.71 0.00 0.00 54.79 55.95 1p7m n ASP 18 Cb 0.03 -0.55 -0.04 0.00 -0.02 0.00 0.00 41.12 40.55 1p7m n ASP 18 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1p7m h ASN 19 N 0.00 -0.03 -0.20 -2.24 7.08 -0.32 -3.47 115.58 116.41 1p7m h ASN 19 Ca 0.00 -0.27 -0.01 0.00 -3.08 0.00 0.00 56.30 52.94 1p7m h ASN 19 Cb 0.72 0.01 -0.15 0.00 -2.08 0.00 0.00 38.32 36.82 1p7m h ASN 19 CO 0.00 0.60 -0.14 -1.84 -2.08 0.00 0.00 177.43 173.97 1p7m n GLU 20 N -4.76 0.13 -2.95 4.14 0.28 -1.10 -5.00 120.64 111.38 1p7m n GLU 20 Ca -0.03 -0.84 -0.42 0.00 -0.16 0.00 0.00 57.16 55.71 1p7m n GLU 20 Cb 0.14 0.01 0.01 0.00 1.43 0.00 0.00 31.44 33.03 1p7m n GLU 20 CO 0.00 0.00 0.00 1.87 -0.16 0.00 0.00 177.13 178.84 1p7m n TRP 21 N 2.47 2.37 -1.60 -1.84 -0.00 -1.26 -4.52 117.44 113.07 1p7m n TRP 21 Ca 0.11 -2.62 0.00 0.00 -0.00 0.00 0.00 57.50 54.99 1p7m n TRP 21 Cb 0.65 -1.21 0.00 0.00 -0.00 0.00 0.00 31.31 30.75 1p7m n TRP 21 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1p7m n GLY 22 N 1.04 0.94 0.05 5.87 0.00 -1.21 -4.86 105.19 107.01 1p7m n GLY 22 Ca 0.30 -0.52 -0.05 0.00 0.00 0.00 0.00 46.02 45.75 1p7m n GLY 22 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1p7m n VAL 23 N -2.18 0.63 -2.90 1.61 0.31 -1.26 -4.53 118.33 110.01 1p7m n VAL 23 Ca 0.00 -0.38 -0.31 0.00 -0.01 0.00 0.00 64.34 63.65 1p7m n VAL 23 Cb 0.34 -0.77 -0.04 0.00 -0.91 0.00 0.00 33.84 32.47 1p7m n VAL 23 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1p7m s PRO 24 N -2.22 3.81 1.10 5.55 0.04 -1.26 -4.99 135.00 137.03 1p7m s PRO 24 Ca -0.05 0.49 -0.13 0.00 0.04 0.00 0.00 61.00 61.35 1p7m s PRO 24 Cb 0.03 -2.40 0.25 0.00 0.04 0.00 0.00 34.50 32.42 1p7m s PRO 24 CO 0.36 -0.01 1.06 -1.83 0.04 0.00 0.00 177.00 176.63 1p7m s GLU 25 N -3.72 -0.43 -0.20 4.56 -1.05 -1.26 -4.03 118.70 112.57 1p7m s GLU 25 Ca 0.52 0.58 -0.18 0.00 -0.15 0.00 0.00 54.97 55.74 1p7m s GLU 25 Cb -0.10 -1.63 -0.03 0.00 -0.44 0.00 0.00 34.13 31.92 1p7m s GLU 25 CO 0.29 -3.33 0.50 0.95 0.95 0.00 0.00 175.26 174.62 1p7m s THR 26 N -2.73 5.12 0.05 1.83 -4.23 -1.24 -4.84 115.64 109.60 1p7m s THR 26 Ca 0.67 0.91 0.01 0.00 -1.18 0.00 0.00 61.69 62.10 1p7m s THR 26 Cb -0.21 -3.82 -0.04 0.00 1.34 0.00 0.00 72.50 69.77 1p7m s THR 26 CO 0.61 0.20 0.15 -1.81 -0.54 0.00 0.00 174.62 173.22 1p7m s ASP 27 N 1.11 5.98 0.22 3.99 1.01 -1.26 -4.77 116.67 122.96 1p7m s ASP 27 Ca 0.23 0.16 -0.06 0.00 0.71 0.00 0.00 52.55 53.60 1p7m s ASP 27 Cb -0.15 -1.75 0.20 0.00 1.01 0.00 0.00 42.92 42.22 1p7m s ASP 27 CO 0.09 0.19 1.72 0.28 0.21 0.00 0.00 175.17 177.67 1p7m h SER 28 N 3.34 0.95 0.03 0.27 0.02 -1.94 -1.91 113.55 114.31 1p7m h SER 28 Ca -0.46 -0.23 -0.00 0.00 -0.84 0.00 0.00 61.79 60.26 1p7m h SER 28 Cb 1.17 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1p7m h SER 28 CO 0.70 0.97 -0.01 0.11 -1.14 0.00 0.00 176.83 177.45 1p7m h LYS 29 N 0.93 -0.03 -0.27 3.45 1.57 -1.99 -3.00 116.57 117.23 1p7m h LYS 29 Ca 0.18 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.93 1p7m h LYS 29 Cb 0.43 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 1p7m h LYS 29 CO 0.01 0.58 -0.01 1.57 -0.57 0.00 0.00 179.45 181.03 1p7m h LYS 30 N -0.68 0.40 -0.85 3.15 2.10 -1.98 -1.94 116.57 116.79 1p7m h LYS 30 Ca -0.00 -0.08 -0.01 0.00 -2.00 0.00 0.00 60.65 58.56 1p7m h LYS 30 Cb 0.62 -0.06 -0.04 0.00 -0.90 0.00 0.00 32.23 31.85 1p7m h LYS 30 CO 0.01 0.44 0.48 -0.07 -2.00 0.00 0.00 179.45 178.30 1p7m h LEU 31 N 0.39 1.04 -0.84 7.07 4.07 -1.38 0.14 115.31 125.82 1p7m h LEU 31 Ca 0.09 -0.08 0.02 0.00 0.08 0.00 0.00 57.88 57.99 1p7m h LEU 31 Cb 0.27 -0.26 -0.05 0.00 1.08 0.00 0.00 40.66 41.70 1p7m h LEU 31 CO 0.01 0.82 0.54 0.15 -1.08 0.00 0.00 178.44 178.89 1p7m h PHE 32 N 1.18 1.03 -0.17 1.13 3.57 -1.20 0.00 116.94 122.48 1p7m h PHE 32 Ca 0.30 0.03 -0.17 0.00 3.53 0.00 0.00 57.97 61.66 1p7m h PHE 32 Cb 0.00 -0.34 -0.00 0.00 2.79 0.00 0.00 35.95 38.39 1p7m h PHE 32 CO 0.01 0.62 -0.59 0.93 -2.23 0.00 0.00 178.31 177.05 1p7m h GLU 33 N 1.09 0.55 -0.20 1.11 5.08 -1.19 -2.86 114.58 118.16 1p7m h GLU 33 Ca 0.32 -0.36 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1p7m h GLU 33 Cb -0.06 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1p7m h GLU 33 CO -0.09 0.98 0.04 1.98 -1.00 0.00 0.00 179.01 180.91 1p7m h MET 34 N 0.41 0.32 -0.39 2.33 4.05 0.16 -0.34 114.93 121.48 1p7m h MET 34 Ca -0.00 -0.08 -0.08 0.00 -0.28 0.00 0.00 59.70 59.25 1p7m h MET 34 Cb 1.14 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.89 1p7m h MET 34 CO 0.11 0.47 -0.10 0.97 0.23 0.00 0.00 176.91 178.59 1p7m h ILE 35 N 0.13 1.25 -0.32 1.77 6.09 -1.07 -0.82 117.51 124.53 1p7m h ILE 35 Ca 0.06 -1.09 -0.16 0.00 -1.37 0.00 0.00 64.86 62.30 1p7m h ILE 35 Cb 0.30 1.06 -0.01 0.00 0.47 0.00 0.00 36.82 38.65 1p7m h ILE 35 CO 0.00 0.37 -0.44 0.00 -3.07 0.00 0.00 178.15 175.01 1p7m h LEU 37 N 0.66 0.57 -1.06 0.00 4.07 -0.77 -2.93 115.31 115.86 1p7m h LEU 37 Ca 0.04 -0.34 -0.09 0.00 0.08 0.00 0.00 57.88 57.57 1p7m h LEU 37 Cb 1.01 -0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.59 1p7m h LEU 37 CO 0.10 0.77 -0.34 -0.33 -1.08 0.00 0.00 178.44 177.56 1p7m h GLU 38 N 0.36 0.24 -0.91 1.13 4.39 -1.12 -2.52 114.58 116.15 1p7m h GLU 38 Ca 0.08 -0.10 0.23 0.00 0.34 0.00 0.00 59.36 59.92 1p7m h GLU 38 Cb 0.50 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.08 1p7m h GLU 38 CO 0.02 0.55 0.62 0.78 -1.16 0.00 0.00 179.01 179.83 1p7m h GLY 39 N 1.11 0.64 1.57 -3.84 0.00 -1.04 0.36 103.07 101.86 1p7m h GLY 39 Ca 0.03 -0.13 -0.22 0.00 0.00 0.00 0.00 47.33 47.01 1p7m h GLY 39 CO 0.05 -0.02 -0.90 -1.61 0.00 0.00 0.00 176.54 174.07 1p7m h GLN 40 N 0.28 0.40 0.00 4.80 5.75 -1.50 -3.19 115.11 121.64 1p7m h GLN 40 Ca 0.47 -0.41 0.00 0.00 -0.15 0.00 0.00 58.65 58.56 1p7m h GLN 40 Cb 1.37 0.11 0.00 0.00 1.07 0.00 0.00 27.48 30.03 1p7m h GLN 40 CO -0.14 1.07 0.47 1.04 -2.65 0.00 0.00 178.83 178.62 1p7m n GLN 41 N -3.76 0.02 -1.65 1.69 1.13 0.13 -4.03 117.38 110.90 1p7m n GLN 41 Ca -0.06 0.26 -0.43 0.00 -1.94 0.00 0.00 57.00 54.83 1p7m n GLN 41 Cb 0.81 -2.02 -0.03 0.00 0.11 0.00 0.00 30.24 29.11 1p7m n GLN 41 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1p7m s ALA 42 N -2.55 2.96 0.00 -1.58 0.00 -1.21 -2.32 121.76 117.06 1p7m s ALA 42 Ca -0.00 0.89 0.00 0.00 0.00 0.00 0.00 51.96 52.85 1p7m s ALA 42 Cb 0.01 -4.01 0.00 0.00 0.00 0.00 0.00 23.12 19.12 1p7m s ALA 42 CO 0.02 -2.46 0.00 0.41 0.00 0.00 0.00 175.76 173.73 1p7m n GLY 43 N 5.41 1.48 3.86 0.00 0.00 -1.26 -4.95 105.19 109.72 1p7m n GLY 43 Ca 0.27 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.95 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 4.29 0.69 0.99 1.43 -0.98 -5.06 118.68 120.03 1p7m s LEU 44 Ca 0.00 0.94 -0.14 0.00 -1.03 0.00 0.00 54.13 53.90 1p7m s LEU 44 Cb 0.00 -3.32 0.01 0.00 0.03 0.00 0.00 46.19 42.91 1p7m s LEU 44 CO 0.00 0.07 1.11 -0.44 0.23 0.00 0.00 176.35 177.31 1p7m s SER 45 N -1.95 4.96 0.27 2.29 0.01 -1.26 -4.49 113.70 113.53 1p7m s SER 45 Ca 0.40 1.96 -0.02 0.00 1.31 0.00 0.00 55.95 59.59 1p7m s SER 45 Cb -0.13 -2.54 0.37 0.00 0.21 0.00 0.00 66.02 63.92 1p7m s SER 45 CO 0.20 -1.73 1.85 -0.25 0.41 0.00 0.00 173.24 173.72 1p7m h TRP 46 N -0.24 0.96 -0.73 2.43 2.91 -1.97 -2.55 115.95 116.76 1p7m h TRP 46 Ca -0.46 -0.06 -0.05 0.00 1.13 0.00 0.00 58.89 59.45 1p7m h TRP 46 Cb 1.24 -0.29 -0.03 0.00 -0.51 0.00 0.00 29.16 29.57 1p7m h TRP 46 CO 0.55 0.74 0.26 0.97 -1.03 0.00 0.00 178.44 179.92 1p7m h ILE 47 N 0.94 1.25 -0.86 2.65 -0.00 -2.01 -1.75 117.51 117.74 1p7m h ILE 47 Ca 0.22 -0.84 0.03 0.00 -0.00 0.00 0.00 64.86 64.27 1p7m h ILE 47 Cb 0.18 0.42 -0.05 0.00 -0.00 0.00 0.00 36.82 37.36 1p7m h ILE 47 CO -0.02 0.34 0.56 0.74 -0.00 0.00 0.00 178.15 179.77 1p7m h THR 48 N 1.07 1.14 -0.56 2.19 2.02 -1.83 -0.70 112.91 116.25 1p7m h THR 48 Ca 0.24 -0.37 -0.06 0.00 0.77 0.00 0.00 66.41 66.99 1p7m h THR 48 Cb 0.26 -0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.62 1p7m h THR 48 CO -0.01 0.20 0.10 0.58 0.37 0.00 0.00 175.52 176.75 1p7m h VAL 49 N 1.07 1.24 -0.44 3.16 2.07 -1.14 -2.51 116.25 119.70 1p7m h VAL 49 Ca 0.34 -0.90 0.06 0.00 0.82 0.00 0.00 66.70 67.02 1p7m h VAL 49 Cb 0.03 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 30.45 1p7m h VAL 49 CO -0.10 0.33 0.14 0.25 0.02 0.00 0.00 177.57 178.22 1p7m h LEU 50 N 0.84 0.14 -0.27 2.57 6.46 -0.58 2.25 115.31 126.72 1p7m h LEU 50 Ca 0.18 0.05 -0.01 0.00 -0.12 0.00 0.00 57.88 57.98 1p7m h LEU 50 Cb 0.36 0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 40.32 1p7m h LEU 50 CO 0.01 0.11 0.14 0.11 -0.62 0.00 0.00 178.44 178.19 1p7m h LYS 51 N 0.31 0.38 0.00 1.25 1.57 -1.29 -1.25 116.57 117.54 1p7m h LYS 51 Ca 0.21 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1p7m h LYS 51 Cb 0.21 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1p7m h LYS 51 CO -0.22 0.35 0.00 1.63 -0.57 0.00 0.00 179.45 180.64 1p7m n LYS 52 N -4.82 0.09 -0.10 3.15 4.01 -0.79 -3.11 118.16 116.59 1p7m n LYS 52 Ca -0.02 0.15 -0.10 0.00 -0.51 0.00 0.00 58.31 57.83 1p7m n LYS 52 Cb 0.09 -1.62 -0.02 0.00 -0.51 0.00 0.00 35.03 32.96 1p7m n LYS 52 CO 0.00 0.00 0.00 -0.09 -1.11 0.00 0.00 177.40 176.20 1p7m h ARG 53 N 0.00 0.47 -0.23 1.97 2.43 0.50 0.60 114.38 120.12 1p7m h ARG 53 Ca 0.00 -0.08 -0.16 0.00 -0.81 0.00 0.00 59.98 58.92 1p7m h ARG 53 Cb 0.50 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1p7m h ARG 53 CO 0.00 0.47 -0.49 0.93 -1.51 0.00 0.00 179.97 179.37 1p7m h GLU 54 N 0.36 0.73 -0.18 0.20 4.39 -1.47 -2.69 114.58 115.93 1p7m h GLU 54 Ca 0.10 -0.49 -0.08 0.00 0.34 0.00 0.00 59.36 59.24 1p7m h GLU 54 Cb 0.18 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.89 1p7m h GLU 54 CO -0.01 1.11 -0.20 -2.95 -1.16 0.00 0.00 179.01 175.80 1p7m h ASN 55 N 0.46 0.48 -0.15 1.42 -1.07 -1.46 -2.86 115.58 112.41 1p7m h ASN 55 Ca 0.00 -0.49 -0.00 0.00 0.07 0.00 0.00 56.30 55.88 1p7m h ASN 55 Cb 1.10 -0.14 -0.01 0.00 -2.07 0.00 0.00 38.32 37.21 1p7m h ASN 55 CO 0.11 0.88 0.09 0.22 0.07 0.00 0.00 177.43 178.79 1p7m h TYR 56 N 0.10 0.19 -0.38 4.14 5.03 0.14 -1.36 116.97 124.84 1p7m h TYR 56 Ca 0.03 -0.00 0.06 0.00 2.58 0.00 0.00 58.73 61.40 1p7m h TYR 56 Cb 0.75 -0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.95 1p7m h TYR 56 CO 0.08 0.16 0.26 0.00 -1.32 0.00 0.00 178.16 177.34 1p7m h ARG 57 N 0.17 0.23 -0.15 1.82 2.47 -1.53 -0.89 114.38 116.50 1p7m h ARG 57 Ca 0.05 -0.01 -0.22 0.00 -1.26 0.00 0.00 59.98 58.54 1p7m h ARG 57 Cb 0.03 -0.05 0.01 0.00 -1.65 0.00 0.00 29.97 28.30 1p7m h ARG 57 CO -0.01 0.15 -0.76 0.00 0.56 0.00 0.00 179.97 179.91 1p7m h ALA 58 N 1.80 0.37 0.00 0.04 0.00 -1.13 0.40 119.26 120.74 1p7m h ALA 58 Ca 0.17 -0.60 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 1p7m h ALA 58 Cb 0.36 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1p7m h ALA 58 CO -0.03 0.70 -0.40 0.00 0.00 0.00 0.00 179.25 179.52 1p7m n PHE 60 N -3.50 0.00 -3.17 0.00 3.72 -0.48 -5.01 117.46 109.02 1p7m n PHE 60 Ca 0.00 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.45 1p7m n PHE 60 Cb 0.54 -0.34 -0.02 0.00 -0.94 0.00 0.00 39.48 38.71 1p7m n PHE 60 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 176.76 173.33 1p7m s HIS 61 N -2.18 -0.25 0.42 1.38 -3.43 0.22 -4.61 115.29 106.85 1p7m s HIS 61 Ca -0.13 0.30 0.23 0.00 -0.80 0.00 0.00 55.06 54.65 1p7m s HIS 61 Cb 0.05 0.10 1.22 0.00 -1.43 0.00 0.00 32.58 32.52 1p7m s HIS 61 CO 0.18 -0.13 1.74 1.96 -2.00 0.00 0.00 174.74 176.48 1p7m h GLN 62 N 7.80 0.28 0.00 -0.38 4.20 -0.62 -3.37 115.11 123.02 1p7m h GLN 62 Ca -0.12 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.56 1p7m h GLN 62 Cb 1.16 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.87 1p7m h GLN 62 CO -0.13 0.18 -0.03 1.97 -0.67 0.00 0.00 178.83 180.16 1p7m n PHE 63 N -4.60 -0.21 -3.60 2.96 -1.74 -1.26 -4.88 117.46 104.13 1p7m n PHE 63 Ca 0.28 -0.17 -0.28 0.00 -0.56 0.00 0.00 57.45 56.72 1p7m n PHE 63 Cb 1.03 0.64 -0.11 0.00 1.52 0.00 0.00 39.48 42.56 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 -0.12 2.87 0.29 5.98 1.01 -1.26 -4.95 116.67 120.49 1p7m s ASP 64 Ca 0.01 -3.30 0.10 0.00 0.71 0.00 0.00 52.55 50.07 1p7m s ASP 64 Cb 0.04 -0.92 0.56 0.00 1.01 0.00 0.00 42.92 43.62 1p7m s ASP 64 CO -0.01 -0.15 1.19 -2.65 0.21 0.00 0.00 175.17 173.75 1p7m n PRO 65 N 2.60 0.07 0.00 8.23 -0.02 -1.26 -0.68 135.00 143.95 1p7m n PRO 65 Ca 0.24 0.53 -0.13 0.00 -2.02 0.00 0.00 63.50 62.12 1p7m n PRO 65 Cb 0.42 -2.07 -0.01 0.00 -0.02 0.00 0.00 33.50 31.82 1p7m n PRO 65 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1p7m h VAL 66 N 0.00 1.32 -0.10 -1.45 2.07 -1.92 -2.82 116.25 113.35 1p7m h VAL 66 Ca 0.00 -1.97 -0.19 0.00 0.82 0.00 0.00 66.70 65.36 1p7m h VAL 66 Cb 0.68 1.95 -0.00 0.00 -1.52 0.00 0.00 31.29 32.39 1p7m h VAL 66 CO 0.00 0.61 -0.72 0.11 0.02 0.00 0.00 177.57 177.60 1p7m h LYS 67 N 0.43 0.47 -0.90 1.57 1.57 -1.29 -3.07 116.57 115.36 1p7m h LYS 67 Ca -0.03 -0.37 0.02 0.00 -1.87 0.00 0.00 60.65 58.40 1p7m h LYS 67 Cb 1.28 0.07 -0.05 0.00 0.08 0.00 0.00 32.23 33.62 1p7m h LYS 67 CO 0.13 1.00 0.59 0.28 -0.57 0.00 0.00 179.45 180.89 1p7m h VAL 68 N 0.32 1.20 0.00 0.50 2.07 -1.49 0.41 116.25 119.26 1p7m h VAL 68 Ca -0.03 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1p7m h VAL 68 Cb 1.29 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1p7m h VAL 68 CO 0.13 0.22 0.00 0.00 0.02 0.00 0.00 177.57 177.93 1p7m h ALA 69 N 1.45 1.00 -0.01 1.67 0.00 -1.41 -0.61 119.26 121.35 1p7m h ALA 69 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.25 1p7m h ALA 69 Cb -0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1p7m h ALA 69 CO -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 179.25 178.86 1p7m n ALA 70 N -1.88 3.19 -2.61 0.00 0.00 0.14 -4.80 120.51 114.55 1p7m n ALA 70 Ca 0.01 -0.45 -0.43 0.00 0.00 0.00 0.00 53.44 52.57 1p7m n ALA 70 Cb 0.22 -1.07 -0.02 0.00 0.00 0.00 0.00 19.45 18.58 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 -2.51 4.08 0.64 0.00 -1.94 -0.24 -5.01 119.30 114.31 1p7m s MET 71 Ca 0.23 1.15 0.04 0.00 -1.71 0.00 0.00 55.69 55.40 1p7m s MET 71 Cb 0.19 -3.74 0.10 0.00 2.01 0.00 0.00 34.83 33.39 1p7m s MET 71 CO 0.54 -0.89 0.88 1.14 -0.01 0.00 0.00 175.02 176.68 1p7m s GLN 72 N 3.66 2.03 0.39 2.03 -2.07 -1.26 -4.90 119.66 119.53 1p7m s GLN 72 Ca 0.47 -1.32 0.06 0.00 -1.82 0.00 0.00 55.36 52.75 1p7m s GLN 72 Cb -0.13 -2.49 0.78 0.00 -1.09 0.00 0.00 33.01 30.08 1p7m s GLN 72 CO 0.15 -1.12 2.03 0.93 -1.32 0.00 0.00 175.29 175.96 1p7m h GLU 73 N -0.15 0.65 -0.41 9.60 5.08 -1.99 -1.31 114.58 126.05 1p7m h GLU 73 Ca -0.34 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.01 1p7m h GLU 73 Cb 1.28 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 30.35 1p7m h GLU 73 CO 0.41 0.43 0.22 1.49 -1.00 0.00 0.00 179.01 180.56 1p7m h GLU 74 N 0.67 0.44 -0.62 2.33 4.81 -2.00 -0.96 114.58 119.25 1p7m h GLU 74 Ca 0.21 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.34 1p7m h GLU 74 Cb 0.01 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.27 1p7m h GLU 74 CO -0.05 0.29 0.09 -0.44 -0.73 0.00 0.00 179.01 178.17 1p7m h ASP 75 N 0.45 0.96 -0.71 1.04 3.32 -1.72 -2.68 116.42 117.08 1p7m h ASP 75 Ca 0.17 -0.22 0.06 0.00 0.02 0.00 0.00 57.03 57.06 1p7m h ASP 75 Cb 0.05 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 39.29 1p7m h ASP 75 CO -0.10 0.97 0.40 0.58 -1.72 0.00 0.00 179.24 179.37 1p7m h VAL 76 N 0.95 0.97 -0.79 -1.35 2.07 -0.20 -1.33 116.25 116.57 1p7m h VAL 76 Ca 0.19 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.43 1p7m h VAL 76 Cb 0.42 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.32 1p7m h VAL 76 CO 0.01 0.13 0.38 -0.33 0.02 0.00 0.00 177.57 177.78 1p7m h GLU 77 N 0.73 1.14 -0.89 1.57 5.08 -0.88 -1.25 114.58 120.08 1p7m h GLU 77 Ca 0.32 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1p7m h GLU 77 Cb 0.21 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 1p7m h GLU 77 CO -0.19 0.88 0.54 -0.09 -1.00 0.00 0.00 179.01 179.14 1p7m h ARG 78 N 1.13 1.20 -0.14 2.33 2.43 -1.08 -2.17 114.38 118.08 1p7m h ARG 78 Ca 0.27 -0.11 -0.11 0.00 -0.81 0.00 0.00 59.98 59.23 1p7m h ARG 78 Cb 0.12 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 1p7m h ARG 78 CO -0.03 0.84 -0.40 -0.07 -1.51 0.00 0.00 179.97 178.80 1p7m h LEU 79 N 1.22 0.33 -1.37 3.80 3.38 -0.47 -2.08 115.31 120.13 1p7m h LEU 79 Ca 0.32 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1p7m h LEU 79 Cb -0.06 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.60 1p7m h LEU 79 CO -0.06 0.70 0.40 0.58 0.09 0.00 0.00 178.44 180.16 1p7m h VAL 80 N 0.27 0.00 0.00 1.22 2.07 -0.58 0.23 116.25 119.46 1p7m h VAL 80 Ca 0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1p7m h VAL 80 Cb 0.83 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1p7m h VAL 80 CO 0.07 0.00 -0.21 0.00 0.02 0.00 0.00 177.57 177.45 1p7m n GLN 81 N -2.54 5.61 -2.57 1.57 6.02 -0.97 -4.56 117.38 119.93 1p7m n GLN 81 Ca -0.01 -0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.55 1p7m n GLN 81 Cb 0.44 -0.63 -0.02 0.00 1.02 0.00 0.00 30.24 31.04 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 -1.28 6.59 0.00 1.08 2.15 0.80 -3.55 116.67 122.46 1p7m s ASP 82 Ca 0.00 0.48 0.00 0.00 0.43 0.00 0.00 52.55 53.46 1p7m s ASP 82 Cb 0.01 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.08 1p7m s ASP 82 CO 0.05 -1.29 0.00 0.00 -0.17 0.00 0.00 175.17 173.76 1p7m n ALA 83 N 8.00 0.00 -2.89 3.66 0.00 -1.26 -3.55 120.51 124.48 1p7m n ALA 83 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.38 1p7m n ALA 83 Cb 0.49 -0.02 0.03 0.00 0.00 0.00 0.00 19.45 19.95 1p7m n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p7m n GLY 84 N -1.67 -0.27 0.00 0.00 0.00 -1.23 -4.95 105.19 97.07 1p7m n GLY 84 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 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 -4.28 0.00 0.00 -0.61 -5.35 -1.23 -4.93 119.36 102.96 1p7m n ILE 85 Ca -0.09 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.39 1p7m n ILE 85 Cb 0.59 -0.15 0.00 0.00 -1.74 0.00 0.00 39.64 38.35 1p7m n ILE 85 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1p7m n ILE 86 N 0.00 0.00 -1.91 7.28 3.06 -1.26 -5.10 119.36 121.43 1p7m n ILE 86 Ca 0.00 0.00 -0.37 0.00 -2.50 0.00 0.00 62.75 59.88 1p7m n ILE 86 Cb 0.00 0.00 0.04 0.00 0.54 0.00 0.00 39.64 40.22 1p7m n ILE 86 CO 0.00 0.00 0.00 -0.13 -2.50 0.00 0.00 176.55 173.92 1p7m s ARG 87 N -1.83 2.95 0.38 9.51 0.52 -1.26 -5.02 118.95 124.20 1p7m s ARG 87 Ca 0.00 1.97 0.08 0.00 -0.52 0.00 0.00 55.73 57.25 1p7m s ARG 87 Cb 0.00 -2.00 -0.03 0.00 0.52 0.00 0.00 34.95 33.44 1p7m s ARG 87 CO 0.00 -1.26 0.30 -1.01 0.02 0.00 0.00 175.30 173.35 1p7m s HIS 88 N -1.48 2.76 0.34 -0.53 3.76 -1.26 -4.71 115.29 114.17 1p7m s HIS 88 Ca 0.77 -0.43 0.15 0.00 -0.15 0.00 0.00 55.06 55.40 1p7m s HIS 88 Cb -0.34 -1.96 1.11 0.00 1.11 0.00 0.00 32.58 32.50 1p7m s HIS 88 CO 0.38 0.07 1.63 0.07 -0.85 0.00 0.00 174.74 176.04 1p7m h ARG 89 N 1.21 0.21 0.65 1.40 0.11 -1.95 2.06 114.38 118.06 1p7m h ARG 89 Ca -0.43 -0.01 -0.03 0.00 0.10 0.00 0.00 59.98 59.61 1p7m h ARG 89 Cb 1.26 -0.05 0.01 0.00 1.11 0.00 0.00 29.97 32.30 1p7m h ARG 89 CO 0.60 0.14 -0.31 0.78 0.10 0.00 0.00 179.97 181.27 1p7m h GLY 90 N 0.21 -0.91 1.04 0.08 0.00 -2.00 -1.32 103.07 100.18 1p7m h GLY 90 Ca 0.74 0.34 -0.03 0.00 0.00 0.00 0.00 47.33 48.38 1p7m h GLY 90 CO -0.67 -0.33 0.39 0.50 0.00 0.00 0.00 176.54 176.43 1p7m h LYS 91 N -1.18 1.21 0.28 4.80 1.57 -1.33 -2.88 116.57 119.03 1p7m h LYS 91 Ca -0.09 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.49 1p7m h LYS 91 Cb 0.69 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.79 1p7m h LYS 91 CO 0.15 0.94 -0.15 0.82 -0.57 0.00 0.00 179.45 180.64 1p7m h ILE 92 N 1.19 0.70 -0.85 1.86 2.04 0.32 -2.08 117.51 120.68 1p7m h ILE 92 Ca 0.28 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.34 1p7m h ILE 92 Cb 0.14 0.70 -0.06 0.00 -0.74 0.00 0.00 36.82 36.86 1p7m h ILE 92 CO -0.03 0.00 0.57 1.56 0.00 0.00 0.00 178.15 180.25 1p7m h GLN 93 N -0.39 0.31 -0.78 2.37 4.20 -1.11 0.23 115.11 119.95 1p7m h GLN 93 Ca -0.03 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.61 1p7m h GLN 93 Cb 0.31 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 1p7m h GLN 93 CO 0.05 0.21 0.32 0.00 -0.67 0.00 0.00 178.83 178.73 1p7m h ALA 94 N 1.62 1.09 -0.06 3.87 0.00 -1.17 -2.65 119.26 121.95 1p7m h ALA 94 Ca 0.43 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 55.01 1p7m h ALA 94 Cb 1.18 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1p7m h ALA 94 CO -0.13 0.65 -0.61 0.82 0.00 0.00 0.00 179.25 179.98 1p7m h ILE 95 N 1.13 1.39 -0.77 0.00 2.04 -0.32 -3.12 117.51 117.86 1p7m h ILE 95 Ca 0.26 -2.01 0.04 0.00 1.00 0.00 0.00 64.86 64.16 1p7m h ILE 95 Cb 0.20 2.02 -0.05 0.00 -0.74 0.00 0.00 36.82 38.26 1p7m h ILE 95 CO -0.02 0.59 0.48 0.40 0.00 0.00 0.00 178.15 179.60 1p7m h ILE 96 N 0.16 1.07 0.00 -0.67 1.08 -0.96 0.72 117.51 118.92 1p7m h ILE 96 Ca -0.01 -0.31 -0.05 0.00 -0.39 0.00 0.00 64.86 64.10 1p7m h ILE 96 Cb 1.12 0.08 -0.01 0.00 -3.07 0.00 0.00 36.82 34.94 1p7m h ILE 96 CO 0.09 0.17 -0.22 1.23 -0.69 0.00 0.00 178.15 178.73 1p7m h GLY 97 N 0.91 0.00 0.98 5.37 0.00 -1.49 -2.80 103.07 106.03 1p7m h GLY 97 Ca 0.32 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.62 1p7m h GLY 97 CO -0.14 0.00 0.18 3.43 0.00 0.00 0.00 176.54 180.02 1p7m h ASN 98 N 0.00 0.73 -0.18 0.19 2.35 -0.80 0.48 115.58 118.35 1p7m h ASN 98 Ca -0.00 -0.19 -0.03 0.00 -0.55 0.00 0.00 56.30 55.52 1p7m h ASN 98 Cb 0.48 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 1p7m h ASN 98 CO 0.03 0.72 -0.02 0.00 -1.65 0.00 0.00 177.43 176.51 1p7m h ALA 99 N 1.04 0.24 -0.52 -0.83 0.00 -1.28 -1.83 119.26 116.08 1p7m h ALA 99 Ca 0.17 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1p7m h ALA 99 Cb 0.24 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1p7m h ALA 99 CO -0.01 -0.02 0.25 -0.09 0.00 0.00 0.00 179.25 179.38 1p7m h ARG 100 N 0.06 0.72 -0.17 0.00 2.43 -1.34 -0.43 114.38 115.65 1p7m h ARG 100 Ca 0.05 -0.08 -0.04 0.00 -0.81 0.00 0.00 59.98 59.09 1p7m h ARG 100 Cb 0.43 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 1p7m h ARG 100 CO 0.01 0.56 -0.09 0.00 -1.51 0.00 0.00 179.97 178.94 1p7m h ALA 101 N 1.56 1.54 -0.50 2.80 0.00 0.33 -1.64 119.26 123.35 1p7m h ALA 101 Ca 0.18 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1p7m h ALA 101 Cb 0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1p7m h ALA 101 CO -0.03 0.33 0.13 -0.92 0.00 0.00 0.00 179.25 178.76 1p7m h TYR 102 N 0.25 0.83 0.00 0.00 3.20 -0.24 -0.68 116.97 120.33 1p7m h TYR 102 Ca 0.05 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.82 1p7m h TYR 102 Cb 0.32 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.36 1p7m h TYR 102 CO 0.01 0.74 -0.04 -0.07 -1.64 0.00 0.00 178.16 177.15 1p7m h LEU 103 N 0.68 0.00 -0.62 2.82 3.38 -0.84 -1.07 115.31 119.65 1p7m h LEU 103 Ca 0.16 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.00 1p7m h LEU 103 Cb 0.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1p7m h LEU 103 CO 0.00 0.04 -0.24 0.06 0.09 0.00 0.00 178.44 178.40 1p7m h GLN 104 N 0.00 0.83 -0.88 1.13 3.07 -0.33 -2.54 115.11 116.40 1p7m h GLN 104 Ca -0.00 -0.35 -0.01 0.00 0.09 0.00 0.00 58.65 58.38 1p7m h GLN 104 Cb 0.09 -0.03 -0.04 0.00 0.08 0.00 0.00 27.48 27.58 1p7m h GLN 104 CO 0.01 0.98 0.52 1.98 0.09 0.00 0.00 178.83 182.40 1p7m h MET 105 N 0.72 1.20 -0.56 0.06 4.05 -0.77 -1.57 114.93 118.06 1p7m h MET 105 Ca 0.09 -0.12 -0.04 0.00 -0.28 0.00 0.00 59.70 59.36 1p7m h MET 105 Cb 0.77 -0.25 -0.03 0.00 -0.80 0.00 0.00 31.60 31.30 1p7m h MET 105 CO 0.06 0.85 0.19 0.93 0.23 0.00 0.00 176.91 179.18 1p7m h GLU 106 N 1.21 0.84 0.00 0.39 4.39 -1.28 0.33 114.58 120.45 1p7m h GLU 106 Ca 0.31 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.87 1p7m h GLU 106 Cb -0.03 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 28.48 1p7m h GLU 106 CO -0.06 0.71 -0.01 1.96 -1.16 0.00 0.00 179.01 180.45 1p7m h GLN 107 N 0.82 0.00 0.00 2.33 4.20 -0.88 0.62 115.11 122.20 1p7m h GLN 107 Ca 0.19 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.90 1p7m h GLN 107 Cb 0.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.99 1p7m h GLN 107 CO -0.01 0.01 -0.68 0.09 -0.67 0.00 0.00 178.83 177.57 1p7m n ASN 108 N -3.89 0.60 -1.33 1.46 3.02 0.90 -4.94 115.26 111.07 1p7m n ASN 108 Ca -0.03 -0.19 -0.13 0.00 -0.03 0.00 0.00 54.58 54.20 1p7m n ASN 108 Cb 0.10 0.40 -0.02 0.00 -0.61 0.00 0.00 39.78 39.65 1p7m n ASN 108 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p7m n GLY 109 N 1.43 0.22 3.08 7.41 0.00 0.22 -4.98 105.19 112.56 1p7m n GLY 109 Ca 0.04 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.36 1p7m n GLY 109 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1p7m s GLU 110 N -4.25 1.86 0.41 1.61 8.01 -1.11 -5.02 118.70 120.22 1p7m s GLU 110 Ca 0.00 -1.70 -0.24 0.00 0.01 0.00 0.00 54.97 53.04 1p7m s GLU 110 Cb 0.00 -3.26 -0.12 0.00 -4.31 0.00 0.00 34.13 26.44 1p7m s GLU 110 CO 0.00 -0.88 0.83 -2.30 0.01 0.00 0.00 175.26 172.92 1p7m n PRO 111 N 4.42 1.01 -0.35 0.39 -0.02 -1.26 -4.71 135.00 134.48 1p7m n PRO 111 Ca -0.03 0.36 0.05 0.00 -2.02 0.00 0.00 63.50 61.86 1p7m n PRO 111 Cb 0.42 -1.80 0.20 0.00 -0.02 0.00 0.00 33.50 32.30 1p7m n PRO 111 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1p7m h PHE 112 N 1.26 1.09 0.00 6.00 3.57 -1.92 0.30 116.94 127.23 1p7m h PHE 112 Ca -0.42 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.03 1p7m h PHE 112 Cb 1.36 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.75 1p7m h PHE 112 CO 0.41 0.47 -0.36 0.00 -2.23 0.00 0.00 178.31 176.60 1p7m h ALA 113 N 1.49 1.11 0.35 2.41 0.00 -1.84 -2.93 119.26 119.86 1p7m h ALA 113 Ca 0.45 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1p7m h ALA 113 Cb 0.37 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1p7m h ALA 113 CO -0.24 0.45 -0.17 0.22 0.00 0.00 0.00 179.25 179.52 1p7m h ASP 114 N 0.00 -0.40 0.31 0.00 3.58 -1.26 -0.27 116.42 118.39 1p7m h ASP 114 Ca -0.00 -0.02 -0.13 0.00 0.42 0.00 0.00 57.03 57.30 1p7m h ASP 114 Cb 0.79 0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.93 1p7m h ASP 114 CO 0.05 -0.25 -0.52 2.19 -2.88 0.00 0.00 179.24 177.83 1p7m h PHE 115 N -0.52 0.29 0.32 0.28 -0.00 -1.59 -2.60 116.94 113.13 1p7m h PHE 115 Ca -0.05 -0.10 -0.02 0.00 -0.00 0.00 0.00 57.97 57.81 1p7m h PHE 115 Cb 0.39 -0.06 0.00 0.00 -0.00 0.00 0.00 35.95 36.29 1p7m h PHE 115 CO -0.04 0.71 -0.16 0.28 -0.00 0.00 0.00 178.31 179.11 1p7m h VAL 116 N 0.19 0.69 -0.18 0.88 2.07 -1.34 0.21 116.25 118.78 1p7m h VAL 116 Ca 0.00 -0.44 0.05 0.00 0.82 0.00 0.00 66.70 67.13 1p7m h VAL 116 Cb 0.99 0.92 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 1p7m h VAL 116 CO 0.08 0.09 0.17 -0.50 0.02 0.00 0.00 177.57 177.43 1p7m h TRP 117 N -0.68 0.00 0.02 1.57 4.06 -1.07 0.38 115.95 120.22 1p7m h TRP 117 Ca -0.04 0.00 -0.20 0.00 2.06 0.00 0.00 58.89 60.70 1p7m h TRP 117 Cb 0.48 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.62 1p7m h TRP 117 CO 0.01 0.00 -0.94 0.66 -3.56 0.00 0.00 178.44 174.61 1p7m h SER 118 N 0.00 0.14 0.23 -3.49 4.64 -0.99 0.67 113.55 114.75 1p7m h SER 118 Ca 0.08 -0.12 -0.10 0.00 -0.47 0.00 0.00 61.79 61.18 1p7m h SER 118 Cb 0.42 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 1p7m h SER 118 CO -0.00 1.00 -0.40 -0.26 -0.87 0.00 0.00 176.83 176.29 1p7m h PHE 119 N 0.04 0.27 -0.26 4.77 -1.00 0.12 -2.32 116.94 118.56 1p7m h PHE 119 Ca -0.04 -0.07 0.00 0.00 2.81 0.00 0.00 57.97 60.67 1p7m h PHE 119 Cb 1.62 -0.06 0.00 0.00 3.61 0.00 0.00 35.95 41.12 1p7m h PHE 119 CO 0.02 0.60 0.00 1.55 -1.61 0.00 0.00 178.31 178.87 1p7m n VAL 120 N -4.03 1.07 -2.05 -0.55 3.14 -1.06 -4.60 118.33 110.24 1p7m n VAL 120 Ca -0.01 -0.58 -0.14 0.00 -2.96 0.00 0.00 64.34 60.65 1p7m n VAL 120 Cb 0.47 -0.30 -0.02 0.00 -1.06 0.00 0.00 33.84 32.93 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 0.30 -4.47 -2.93 6.55 4.05 -0.87 -2.55 115.26 115.34 1p7m n ASN 121 Ca 0.12 0.08 -0.18 0.00 0.45 0.00 0.00 54.58 55.05 1p7m n ASN 121 Cb 0.59 -3.53 -0.00 0.00 1.23 0.00 0.00 39.78 38.08 1p7m n ASN 121 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 177.26 175.78 1p7m n HIS 122 N -3.64 -1.66 -4.04 1.20 -0.00 0.23 -4.94 115.22 102.38 1p7m n HIS 122 Ca -0.16 0.27 -0.12 0.00 -0.00 0.00 0.00 57.72 57.71 1p7m n HIS 122 Cb 0.59 -2.98 -0.11 0.00 -0.00 0.00 0.00 29.99 27.49 1p7m n HIS 122 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 1p7m s GLN 123 N -5.56 0.47 0.41 1.57 -1.52 -1.05 -5.07 119.66 108.91 1p7m s GLN 123 Ca 0.22 -0.72 -0.24 0.00 -1.95 0.00 0.00 55.36 52.67 1p7m s GLN 123 Cb -0.11 -0.18 -0.09 0.00 -0.22 0.00 0.00 33.01 32.41 1p7m s GLN 123 CO 0.27 0.02 1.10 -1.25 -0.25 0.00 0.00 175.29 175.18 1p7m s PRO 124 N -1.55 4.06 -0.17 2.91 0.04 -1.26 -4.90 135.00 134.14 1p7m s PRO 124 Ca -0.12 1.63 -0.04 0.00 0.04 0.00 0.00 61.00 62.51 1p7m s PRO 124 Cb -0.10 -2.54 -0.03 0.00 0.04 0.00 0.00 34.50 31.87 1p7m s PRO 124 CO 0.00 -0.26 -0.02 -1.14 0.04 0.00 0.00 177.00 175.63 1p7m s GLN 125 N -2.49 3.71 -0.29 4.56 -0.44 -1.00 -5.00 119.66 118.71 1p7m s GLN 125 Ca 0.59 -0.49 0.01 0.00 -2.50 0.00 0.00 55.36 52.97 1p7m s GLN 125 Cb -0.25 -2.98 0.06 0.00 -1.64 0.00 0.00 33.01 28.20 1p7m s GLN 125 CO 0.31 0.22 -0.04 -1.64 0.50 0.00 0.00 175.29 174.64 1p7m s MET 126 N 0.45 2.22 -0.20 1.67 -1.94 -1.26 0.34 119.30 120.58 1p7m s MET 126 Ca -0.02 -1.40 -0.08 0.00 -1.71 0.00 0.00 55.69 52.48 1p7m s MET 126 Cb -0.14 -3.06 -0.04 0.00 2.01 0.00 0.00 34.83 33.59 1p7m s MET 126 CO 0.02 -0.65 0.09 0.99 -0.01 0.00 0.00 175.02 175.46 1p7m s THR 127 N 1.14 4.95 -0.49 2.05 2.01 -1.14 -4.98 115.64 119.17 1p7m s THR 127 Ca -0.05 0.03 0.01 0.00 0.31 0.00 0.00 61.69 61.99 1p7m s THR 127 Cb -0.20 -3.25 0.51 0.00 0.01 0.00 0.00 72.50 69.57 1p7m s THR 127 CO -0.04 0.43 1.92 0.00 -0.69 0.00 0.00 174.62 176.25 1p7m n GLN 128 N 3.71 2.30 -1.71 4.92 6.02 -1.26 -4.59 117.38 126.76 1p7m n GLN 128 Ca -0.16 -2.80 -0.39 0.00 -0.01 0.00 0.00 57.00 53.64 1p7m n GLN 128 Cb 0.52 -2.10 0.04 0.00 1.02 0.00 0.00 30.24 29.72 1p7m n GLN 128 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1p7m n ALA 129 N -0.83 1.31 0.52 -1.58 0.00 -1.26 -4.85 120.51 113.82 1p7m n ALA 129 Ca 0.55 0.14 0.12 0.00 0.00 0.00 0.00 53.44 54.25 1p7m n ALA 129 Cb 1.14 -2.30 0.07 0.00 0.00 0.00 0.00 19.45 18.36 1p7m n ALA 129 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1p7m n THR 130 N -0.93 0.27 -4.05 0.00 -2.24 -1.25 -3.56 114.28 102.51 1p7m n THR 130 Ca 0.10 -0.28 -0.09 0.00 -2.27 0.00 0.00 64.05 61.51 1p7m n THR 130 Cb 0.44 0.04 -0.09 0.00 -2.10 0.00 0.00 70.33 68.62 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 -3.21 0.14 0.44 4.28 -4.23 -1.26 -4.60 115.64 107.20 1p7m s THR 131 Ca 0.04 -1.67 0.10 0.00 -1.18 0.00 0.00 61.69 58.98 1p7m s THR 131 Cb 0.14 -1.74 0.27 0.00 1.34 0.00 0.00 72.50 72.51 1p7m s THR 131 CO 0.77 -0.62 2.07 -0.07 -0.54 0.00 0.00 174.62 176.23 1p7m h LEU 132 N 2.87 0.35 -1.52 4.79 3.38 -1.92 -1.11 115.31 122.14 1p7m h LEU 132 Ca -0.34 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.57 1p7m h LEU 132 Cb 1.19 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 1p7m h LEU 132 CO 0.59 0.25 -0.25 0.28 0.09 0.00 0.00 178.44 179.40 1p7m h SER 133 N 0.41 0.00 0.12 -0.43 0.02 -1.98 -1.97 113.55 109.72 1p7m h SER 133 Ca 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1p7m h SER 133 Cb 0.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.56 1p7m h SER 133 CO -0.03 0.25 -0.05 -0.62 -1.14 0.00 0.00 176.83 175.24 1p7m n GLU 134 N -4.11 1.12 -2.78 3.45 -0.58 -0.43 -4.85 120.64 112.45 1p7m n GLU 134 Ca -0.02 -0.43 -0.37 0.00 -0.42 0.00 0.00 57.16 55.91 1p7m n GLU 134 Cb 0.31 -1.49 -0.06 0.00 -0.57 0.00 0.00 31.44 29.62 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 -2.18 4.20 0.36 -3.67 1.01 -0.74 -4.77 121.20 115.41 1p7m s ILE 135 Ca 0.37 1.85 -0.26 0.00 0.00 0.00 0.00 60.65 62.61 1p7m s ILE 135 Cb 0.21 -4.05 -0.09 0.00 0.01 0.00 0.00 42.46 38.54 1p7m s ILE 135 CO 0.40 0.19 1.15 -2.16 0.00 0.00 0.00 174.94 174.52 1p7m s PRO 136 N -1.93 4.24 0.00 2.79 0.04 -1.26 -4.94 135.00 133.93 1p7m s PRO 136 Ca 0.49 1.82 0.00 0.00 0.04 0.00 0.00 61.00 63.35 1p7m s PRO 136 Cb -0.20 -2.82 0.00 0.00 0.04 0.00 0.00 34.50 31.52 1p7m s PRO 136 CO 0.25 -0.15 0.61 -2.37 0.04 0.00 0.00 177.00 175.37 1p7m n THR 137 N 0.39 0.35 -3.16 1.26 5.66 -1.26 -4.90 114.28 112.63 1p7m n THR 137 Ca 0.03 -0.54 -0.04 0.00 -3.05 0.00 0.00 64.05 60.45 1p7m n THR 137 Cb 0.46 0.96 -0.02 0.00 -1.55 0.00 0.00 70.33 70.18 1p7m n THR 137 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1p7m s SER 138 N -0.35 -0.99 0.31 1.09 1.04 -1.26 -4.42 113.70 109.12 1p7m s SER 138 Ca 0.00 -1.17 0.08 0.00 0.48 0.00 0.00 55.95 55.34 1p7m s SER 138 Cb 0.00 1.65 -0.03 0.00 0.10 0.00 0.00 66.02 67.74 1p7m s SER 138 CO 0.00 -0.16 0.24 0.42 0.98 0.00 0.00 173.24 174.71 1p7m s THR 139 N 1.54 3.70 0.29 2.02 -4.23 -1.26 -4.90 115.64 112.79 1p7m s THR 139 Ca 0.19 -1.44 0.03 0.00 -1.18 0.00 0.00 61.69 59.29 1p7m s THR 139 Cb -0.05 -3.20 0.29 0.00 1.34 0.00 0.00 72.50 70.88 1p7m s THR 139 CO -0.06 -0.23 1.83 -0.65 -0.54 0.00 0.00 174.62 174.97 1p7m h PRO 140 N 1.37 0.92 -0.18 3.99 0.11 -1.98 0.51 132.00 136.73 1p7m h PRO 140 Ca -0.45 -0.06 -0.13 0.00 0.11 0.00 0.00 66.00 65.47 1p7m h PRO 140 Cb 1.25 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1p7m h PRO 140 CO 0.60 0.61 -0.40 0.00 -0.21 0.00 0.00 178.00 178.59 1p7m h ALA 141 N 1.56 0.30 -0.47 -0.75 0.00 -1.95 -1.47 119.26 116.47 1p7m h ALA 141 Ca 0.50 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1p7m h ALA 141 Cb 0.56 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1p7m h ALA 141 CO -0.27 0.40 0.17 0.66 0.00 0.00 0.00 179.25 180.21 1p7m h SER 142 N 0.26 0.66 -0.63 0.00 4.64 -1.61 -1.36 113.55 115.51 1p7m h SER 142 Ca 0.00 -0.18 -0.03 0.00 -0.47 0.00 0.00 61.79 61.11 1p7m h SER 142 Cb 1.01 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.90 1p7m h SER 142 CO 0.09 0.66 0.29 0.44 -0.87 0.00 0.00 176.83 177.44 1p7m h ASP 143 N 0.61 0.85 -0.67 4.97 3.32 -0.00 -2.27 116.42 123.23 1p7m h ASP 143 Ca 0.15 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 57.03 1p7m h ASP 143 Cb 0.22 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 1p7m h ASP 143 CO -0.01 0.74 0.14 0.00 -1.72 0.00 0.00 179.24 178.39 1p7m h ALA 144 N 1.39 0.89 -0.58 3.45 0.00 -0.72 -2.73 119.26 120.96 1p7m h ALA 144 Ca 0.23 -0.26 0.08 0.00 0.00 0.00 0.00 54.91 54.96 1p7m h ALA 144 Cb 0.13 -0.26 -0.06 0.00 0.00 0.00 0.00 17.79 17.60 1p7m h ALA 144 CO -0.03 0.63 0.25 -0.07 0.00 0.00 0.00 179.25 180.04 1p7m h LEU 145 N 1.02 0.30 -0.99 0.00 3.38 -0.67 -0.30 115.31 118.06 1p7m h LEU 145 Ca 0.21 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.27 1p7m h LEU 145 Cb 0.40 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.11 1p7m h LEU 145 CO 0.01 0.19 0.65 -1.28 0.09 0.00 0.00 178.44 178.10 1p7m h SER 146 N 0.46 1.09 -0.05 -0.43 0.87 -1.31 0.34 113.55 114.53 1p7m h SER 146 Ca 0.28 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.83 1p7m h SER 146 Cb 0.29 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 61.99 1p7m h SER 146 CO -0.25 0.76 0.02 0.50 -0.53 0.00 0.00 176.83 177.33 1p7m h LYS 147 N 1.27 0.07 -0.38 2.24 3.64 -0.84 0.53 116.57 123.10 1p7m h LYS 147 Ca 0.39 -0.01 -0.16 0.00 -1.27 0.00 0.00 60.65 59.60 1p7m h LYS 147 Cb -0.04 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1p7m h LYS 147 CO -0.11 0.18 -0.38 0.00 -2.27 0.00 0.00 179.45 176.87 1p7m h ALA 148 N 0.89 0.60 -0.56 5.00 0.00 -0.94 -2.78 119.26 121.47 1p7m h ALA 148 Ca 0.02 -0.45 -0.11 0.00 0.00 0.00 0.00 54.91 54.36 1p7m h ALA 148 Cb 0.14 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1p7m h ALA 148 CO -0.00 0.68 -0.08 -0.07 0.00 0.00 0.00 179.25 179.77 1p7m h LEU 149 N 0.76 1.03 -1.05 0.00 3.38 -0.18 -1.50 115.31 117.74 1p7m h LEU 149 Ca 0.06 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1p7m h LEU 149 Cb 0.97 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 1p7m h LEU 149 CO 0.09 1.12 0.47 0.50 0.09 0.00 0.00 178.44 180.71 1p7m h LYS 150 N 0.92 1.13 0.00 1.13 3.64 0.17 -0.14 116.57 123.42 1p7m h LYS 150 Ca 0.15 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1p7m h LYS 150 Cb 0.65 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1p7m h LYS 150 CO 0.04 0.81 -0.34 1.63 -2.27 0.00 0.00 179.45 179.32 1p7m n LYS 151 N -4.36 0.27 -0.13 1.90 5.02 -1.06 -3.45 118.16 116.35 1p7m n LYS 151 Ca 0.09 0.14 0.07 0.00 -2.02 0.00 0.00 58.31 56.58 1p7m n LYS 151 Cb 0.08 -1.73 0.22 0.00 -0.02 0.00 0.00 35.03 33.58 1p7m n LYS 151 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1p7m n ARG 152 N -2.16 1.71 -0.75 1.97 1.74 -0.58 -4.85 116.66 113.73 1p7m n ARG 152 Ca 0.04 -1.09 0.00 0.00 -0.77 0.00 0.00 57.85 56.03 1p7m n ARG 152 Cb 0.43 -1.29 0.00 0.00 -1.02 0.00 0.00 32.46 30.58 1p7m n ARG 152 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1p7m n GLY 153 N 1.03 0.61 3.45 -0.13 0.00 -1.20 -4.61 105.19 104.34 1p7m n GLY 153 Ca 0.12 -0.73 -0.42 0.00 0.00 0.00 0.00 46.02 44.99 1p7m n GLY 153 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1p7m s PHE 154 N -2.00 3.24 0.64 1.61 0.40 -0.11 -4.03 117.98 117.73 1p7m s PHE 154 Ca 0.00 -0.65 0.02 0.00 -0.60 0.00 0.00 56.93 55.70 1p7m s PHE 154 Cb 0.00 -2.55 0.09 0.00 0.51 0.00 0.00 43.02 41.07 1p7m s PHE 154 CO 0.00 -0.59 0.88 0.15 0.70 0.00 0.00 175.22 176.36 1p7m s LYS 155 N 1.65 2.07 -1.12 0.44 1.02 -1.26 -3.95 119.74 118.60 1p7m s LYS 155 Ca 0.04 -1.08 -0.08 0.00 0.02 0.00 0.00 55.97 54.87 1p7m s LYS 155 Cb -0.19 -2.44 -0.04 0.00 -0.52 0.00 0.00 37.83 34.64 1p7m s LYS 155 CO 0.09 -1.10 0.88 1.19 -0.92 0.00 0.00 175.35 175.49 1p7m n PHE 156 N -2.57 -2.25 -2.42 3.18 3.72 -1.26 -4.92 117.46 110.93 1p7m n PHE 156 Ca 0.13 0.78 -0.15 0.00 -0.05 0.00 0.00 57.45 58.16 1p7m n PHE 156 Cb 0.60 -4.14 0.03 0.00 -0.94 0.00 0.00 39.48 35.04 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 -3.67 1.92 -0.84 -4.37 0.24 -1.26 -4.24 118.33 106.12 1p7m n VAL 157 Ca -0.13 -3.74 -0.34 0.00 -2.04 0.00 0.00 64.34 58.09 1p7m n VAL 157 Cb 0.63 -0.13 0.10 0.00 -1.47 0.00 0.00 33.84 32.97 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 -0.58 -2.84 0.40 7.63 0.00 -1.26 -4.45 105.19 104.10 1p7m n GLY 158 Ca 0.27 -0.71 0.22 0.00 0.00 0.00 0.00 46.02 45.80 1p7m n GLY 158 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1p7m h THR 159 N -1.47 0.65 -0.03 2.61 2.02 -1.95 0.60 112.91 115.33 1p7m h THR 159 Ca -0.45 0.00 -0.16 0.00 0.77 0.00 0.00 66.41 66.57 1p7m h THR 159 Cb 1.31 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 68.39 1p7m h THR 159 CO 0.31 0.00 -0.70 0.71 0.37 0.00 0.00 175.52 176.21 1p7m h THR 160 N 0.00 1.44 -0.36 3.16 1.35 -1.85 -2.64 112.91 114.01 1p7m h THR 160 Ca 0.29 -2.24 -0.01 0.00 -0.55 0.00 0.00 66.41 63.89 1p7m h THR 160 Cb 1.18 2.19 -0.02 0.00 -1.73 0.00 0.00 68.15 69.78 1p7m h THR 160 CO -0.00 0.65 0.17 0.40 -0.25 0.00 0.00 175.52 176.49 1p7m h ILE 161 N 0.12 1.17 -0.62 6.82 1.08 -0.05 0.81 117.51 126.85 1p7m h ILE 161 Ca -0.02 -0.50 -0.05 0.00 -0.39 0.00 0.00 64.86 63.91 1p7m h ILE 161 Cb 1.25 0.83 -0.03 0.00 -3.07 0.00 0.00 36.82 35.80 1p7m h ILE 161 CO 0.11 0.18 0.18 0.00 -0.69 0.00 0.00 178.15 177.93 1p7m h TYR 163 N 0.91 0.47 -0.05 0.00 3.20 -1.06 -1.12 116.97 119.32 1p7m h TYR 163 Ca 0.20 -0.11 -0.10 0.00 3.14 0.00 0.00 58.73 61.86 1p7m h TYR 163 Cb 0.28 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 38.42 1p7m h TYR 163 CO 0.02 0.68 -0.42 0.66 -1.64 0.00 0.00 178.16 177.46 1p7m h SER 164 N 0.12 0.12 -0.15 -2.11 4.64 -0.64 -1.22 113.55 114.31 1p7m h SER 164 Ca 0.05 -0.05 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1p7m h SER 164 Cb 0.55 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.60 1p7m h SER 164 CO 0.03 0.53 0.04 0.15 -0.87 0.00 0.00 176.83 176.71 1p7m h PHE 165 N 0.09 0.24 -0.04 4.77 3.57 -0.05 -2.66 116.94 122.87 1p7m h PHE 165 Ca 0.01 -0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.33 1p7m h PHE 165 Cb 0.79 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.45 1p7m h PHE 165 CO 0.01 0.37 -0.66 0.00 -2.23 0.00 0.00 178.31 175.79 1p7m h MET 166 N 0.05 0.19 -0.81 1.11 -0.00 -1.10 -0.89 114.93 113.49 1p7m h MET 166 Ca 0.05 -0.15 0.04 0.00 -0.00 0.00 0.00 59.70 59.64 1p7m h MET 166 Cb 0.24 0.03 -0.05 0.00 -0.00 0.00 0.00 31.60 31.82 1p7m h MET 166 CO -0.00 0.79 0.51 0.37 -0.00 0.00 0.00 176.91 178.58 1p7m h GLN 167 N 0.14 0.95 0.03 -0.10 5.75 -1.05 -3.02 115.11 117.80 1p7m h GLN 167 Ca -0.01 -0.06 -0.33 0.00 -0.15 0.00 0.00 58.65 58.10 1p7m h GLN 167 Cb 1.19 -0.21 -0.05 0.00 1.07 0.00 0.00 27.48 29.48 1p7m h GLN 167 CO 0.10 0.63 -1.97 0.00 -2.65 0.00 0.00 178.83 174.94 1p7m n ALA 168 N -2.34 1.36 0.20 3.38 0.00 -1.02 -3.85 120.51 118.24 1p7m n ALA 168 Ca 0.10 -0.87 0.18 0.00 0.00 0.00 0.00 53.44 52.85 1p7m n ALA 168 Cb 0.11 -0.62 0.81 0.00 0.00 0.00 0.00 19.45 19.76 1p7m n ALA 168 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p7m n GLY 170 N -1.38 0.60 0.27 0.00 0.00 -1.17 -3.73 105.19 99.79 1p7m n GLY 170 Ca 0.03 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.05 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 0.44 -8.69 0.99 3.38 -1.82 -3.43 115.31 106.17 1p7m h LEU 171 Ca 0.00 -0.08 -0.61 0.00 0.09 0.00 0.00 57.88 57.28 1p7m h LEU 171 Cb 0.00 -0.12 -0.24 0.00 0.09 0.00 0.00 40.66 40.40 1p7m h LEU 171 CO 0.00 0.51 -0.85 0.54 0.09 0.00 0.00 178.44 178.73 1p7m s VAL 172 N -4.97 1.88 -0.31 1.22 0.11 -1.23 -2.38 120.40 114.71 1p7m s VAL 172 Ca -0.07 -1.46 0.04 0.00 -2.93 0.00 0.00 61.98 57.56 1p7m s VAL 172 Cb 0.16 -1.66 0.09 0.00 -1.53 0.00 0.00 36.38 33.43 1p7m s VAL 172 CO 0.76 0.12 -0.00 0.20 -3.33 0.00 0.00 175.10 172.84 1p7m s ASN 173 N -1.61 4.67 -0.36 3.54 0.02 0.15 -4.87 114.94 116.48 1p7m s ASN 173 Ca 0.09 -1.89 -0.01 0.00 -1.02 0.00 0.00 52.86 50.03 1p7m s ASN 173 Cb -0.10 -1.61 0.26 0.00 0.02 0.00 0.00 41.25 39.83 1p7m s ASN 173 CO 0.03 -0.32 1.16 -0.90 0.02 0.00 0.00 177.10 177.10 1p7m n ASP 174 N 4.32 -1.60 -0.26 -1.22 5.68 -1.26 -2.91 116.55 119.30 1p7m n ASP 174 Ca -0.02 -1.99 -0.02 0.00 -0.50 0.00 0.00 54.79 52.26 1p7m n ASP 174 Cb 0.42 0.91 0.09 0.00 -1.14 0.00 0.00 41.12 41.40 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 3.39 0.83 0.00 2.11 3.86 -1.93 -3.43 115.15 119.97 1p7m h HIS 175 Ca -0.20 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.03 1p7m h HIS 175 Cb 1.17 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 29.38 1p7m h HIS 175 CO -0.09 0.45 0.00 1.55 0.86 0.00 0.00 177.93 180.70 1p7m n VAL 176 N -4.68 0.00 0.00 2.45 3.14 -1.26 -4.76 118.33 113.22 1p7m n VAL 176 Ca 0.09 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.47 1p7m n VAL 176 Cb 0.12 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.90 1p7m n VAL 176 CO 0.00 0.00 0.00 0.55 -6.46 0.00 0.00 176.83 170.92 1p7m n VAL 177 N 0.00 0.00 1.37 1.55 3.14 -1.23 -3.91 118.33 119.25 1p7m n VAL 177 Ca 0.00 0.00 0.02 0.00 -2.96 0.00 0.00 64.34 61.40 1p7m n VAL 177 Cb 0.00 0.00 0.07 0.00 -1.06 0.00 0.00 33.84 32.85 1p7m n VAL 177 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1p7m n GLY 178 N 0.00 0.07 3.65 7.55 0.00 -1.26 -4.80 105.19 110.40 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 -1.25 3.49 0.37 0.00 6.14 0.18 -5.09 117.35 121.19 1p7m s TYR 182 Ca 0.00 -3.22 -0.26 0.00 0.64 0.00 0.00 57.07 54.22 1p7m s TYR 182 Cb 0.00 -2.83 -0.12 0.00 0.42 0.00 0.00 41.96 39.43 1p7m s TYR 182 CO 0.00 -0.64 1.15 -2.30 0.64 0.00 0.00 175.55 174.39 1p7m n PRO 183 N 2.43 1.70 0.00 4.97 -0.02 -1.26 -4.46 135.00 138.36 1p7m n PRO 183 Ca 0.15 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1p7m n PRO 183 Cb 0.35 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 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 0.99 0.42 0.22 -1.23 0.00 -1.26 -4.96 105.19 99.38 1p7m n GLY 184 Ca 0.07 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.20 1p7m n GLY 184 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1p7m n ASN 185 N 0.00 0.68 -4.91 1.61 2.85 -1.26 -4.86 115.26 109.37 1p7m n ASN 185 Ca 0.00 -1.47 -0.27 0.00 -0.11 0.00 0.00 54.58 52.73 1p7m n ASN 185 Cb 0.00 -0.03 0.01 0.00 1.24 0.00 0.00 39.78 41.00 1p7m n ASN 185 CO 0.00 0.00 0.00 -1.59 -2.11 0.00 0.00 177.26 173.56 1p7m s LYS 186 N -1.93 3.24 0.00 1.20 -2.85 -1.26 -5.25 119.74 112.89 1p7m s LYS 186 Ca 0.33 0.09 0.00 0.00 -1.00 0.00 0.00 55.97 55.38 1p7m s LYS 186 Cb 0.16 -2.33 0.00 0.00 -2.06 0.00 0.00 37.83 33.60 1p7m s LYS 186 CO 0.26 -0.45 0.06 -2.30 0.10 0.00 0.00 175.35 173.03