#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 3.84 0.79 0.03 -1.05 -1.19 -4.72 118.70 116.41 1p7m s GLU 2 Ca 0.00 0.31 -0.12 0.00 -0.15 0.00 0.00 54.97 55.01 1p7m s GLU 2 Cb 0.00 -2.80 0.06 0.00 -0.44 0.00 0.00 34.13 30.95 1p7m s GLU 2 CO 0.00 0.42 1.13 1.03 0.95 0.00 0.00 175.26 178.78 1p7m s ARG 3 N -2.39 2.16 0.62 -4.83 0.52 -1.26 -2.18 118.95 111.58 1p7m s ARG 3 Ca 0.42 0.37 -0.18 0.00 -0.52 0.00 0.00 55.73 55.82 1p7m s ARG 3 Cb -0.13 -1.95 -0.02 0.00 0.52 0.00 0.00 34.95 33.37 1p7m s ARG 3 CO 0.20 -1.51 1.25 0.00 0.02 0.00 0.00 175.30 175.26 1p7m h GLY 5 N 0.74 1.28 0.46 0.00 0.00 -1.99 -0.69 103.07 102.88 1p7m h GLY 5 Ca -0.51 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.42 1p7m h GLY 5 CO 0.54 0.30 -0.07 -2.67 0.00 0.00 0.00 176.54 174.65 1p7m n TRP 6 N -4.59 0.00 0.10 5.60 2.14 -1.26 -3.55 117.44 115.88 1p7m n TRP 6 Ca 0.12 0.00 -0.19 0.00 2.07 0.00 0.00 57.50 59.50 1p7m n TRP 6 Cb 0.14 -0.08 -0.12 0.00 -0.81 0.00 0.00 31.31 30.44 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 1.03 1.36 -0.00 -1.67 2.07 -1.46 -2.94 116.25 114.64 1p7m h VAL 7 Ca 0.00 -2.63 0.00 0.00 0.82 0.00 0.00 66.70 64.89 1p7m h VAL 7 Cb 0.34 2.73 0.00 0.00 -1.52 0.00 0.00 31.29 32.84 1p7m h VAL 7 CO 0.00 0.79 0.00 -1.20 0.02 0.00 0.00 177.57 177.18 1p7m n SER 8 N -3.71 0.14 0.01 0.57 7.64 -1.15 -3.86 113.62 113.25 1p7m n SER 8 Ca -0.11 -1.11 -0.08 0.00 1.01 0.00 0.00 58.87 58.57 1p7m n SER 8 Cb 0.98 -0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 64.11 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 0.21 -0.13 -4.41 1.43 4.15 -1.61 -3.48 115.11 111.27 1p7m h GLN 9 Ca 0.00 0.01 -0.17 0.00 0.77 0.00 0.00 58.65 59.26 1p7m h GLN 9 Cb 0.04 0.03 -0.15 0.00 0.21 0.00 0.00 27.48 27.61 1p7m h GLN 9 CO 0.00 0.29 -0.68 -0.51 -1.93 0.00 0.00 178.83 176.00 1p7m s ASP 10 N -5.62 0.69 0.22 -0.69 1.11 -1.25 -5.06 116.67 106.08 1p7m s ASP 10 Ca -0.10 -1.04 -0.01 0.00 0.18 0.00 0.00 52.55 51.57 1p7m s ASP 10 Cb -0.00 0.18 0.22 0.00 1.07 0.00 0.00 42.92 44.39 1p7m s ASP 10 CO 0.37 -0.58 1.60 1.55 1.18 0.00 0.00 175.17 179.29 1p7m h PRO 11 N 3.03 0.56 -0.34 8.23 0.13 -1.93 -3.11 132.00 138.58 1p7m h PRO 11 Ca -0.35 -0.28 -0.03 0.00 -0.87 0.00 0.00 66.00 64.47 1p7m h PRO 11 Cb 1.16 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.27 1p7m h PRO 11 CO 0.65 0.86 0.08 -0.07 -0.23 0.00 0.00 178.00 179.29 1p7m h LEU 12 N 0.46 0.45 -1.32 1.56 3.38 -1.97 -1.93 115.31 115.95 1p7m h LEU 12 Ca 0.04 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 57.98 1p7m h LEU 12 Cb 0.89 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.49 1p7m h LEU 12 CO 0.08 0.46 0.48 1.88 0.09 0.00 0.00 178.44 181.43 1p7m h TYR 13 N 0.49 0.86 -0.61 1.13 0.05 -1.86 -2.41 116.97 114.62 1p7m h TYR 13 Ca 0.11 0.02 0.11 0.00 0.05 0.00 0.00 58.73 59.02 1p7m h TYR 13 Cb 0.20 -0.29 -0.08 0.00 1.01 0.00 0.00 36.73 37.57 1p7m h TYR 13 CO 0.01 0.52 0.18 0.82 -1.05 0.00 0.00 178.16 178.63 1p7m h ILE 14 N 0.91 0.70 -0.07 -2.88 5.03 -1.45 1.22 117.51 120.97 1p7m h ILE 14 Ca 0.28 -0.11 -0.02 0.00 -0.12 0.00 0.00 64.86 64.89 1p7m h ILE 14 Cb 0.00 0.34 -0.00 0.00 -3.03 0.00 0.00 36.82 34.13 1p7m h ILE 14 CO -0.07 0.06 -0.03 0.00 -0.68 0.00 0.00 178.15 177.43 1p7m h ALA 15 N 1.45 0.09 -0.79 1.87 0.00 -1.54 0.46 119.26 120.82 1p7m h ALA 15 Ca 0.32 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1p7m h ALA 15 Cb 0.44 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 1p7m h ALA 15 CO -0.36 -0.17 0.29 -0.92 0.00 0.00 0.00 179.25 178.09 1p7m h TYR 16 N -0.23 1.22 0.01 0.00 3.20 -1.14 -2.88 116.97 117.14 1p7m h TYR 16 Ca 0.02 -0.10 -0.26 0.00 3.14 0.00 0.00 58.73 61.53 1p7m h TYR 16 Cb 0.45 -0.36 0.02 0.00 1.54 0.00 0.00 36.73 38.38 1p7m h TYR 16 CO 0.06 0.93 -1.01 1.25 -1.64 0.00 0.00 178.16 177.75 1p7m h HIS 17 N 1.15 1.00 0.00 -3.82 2.76 0.16 -3.26 115.15 113.14 1p7m h HIS 17 Ca 0.26 -0.55 0.00 0.00 -2.20 0.00 0.00 60.37 57.88 1p7m h HIS 17 Cb 0.25 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 29.10 1p7m h HIS 17 CO 0.02 1.39 0.00 -0.44 -1.30 0.00 0.00 177.93 177.60 1p7m h ASP 18 N 0.33 0.00 0.00 3.26 5.19 0.02 -3.32 116.42 121.89 1p7m h ASP 18 Ca -0.13 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.28 1p7m h ASP 18 Cb 1.67 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.18 1p7m h ASP 18 CO 0.20 0.00 0.00 -0.46 -3.12 0.00 0.00 179.24 175.86 1p7m n ASN 19 N -2.32 0.00 0.00 6.45 0.23 -1.10 -4.97 115.26 113.56 1p7m n ASN 19 Ca 0.01 0.37 0.00 0.00 -0.53 0.00 0.00 54.58 54.43 1p7m n ASN 19 Cb 0.17 -0.15 0.00 0.00 -2.08 0.00 0.00 39.78 37.73 1p7m n ASN 19 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 1p7m n GLU 20 N -0.94 0.00 -2.78 -3.83 0.28 -1.25 -5.08 120.64 107.04 1p7m n GLU 20 Ca 0.00 0.00 -0.03 0.00 -0.16 0.00 0.00 57.16 56.97 1p7m n GLU 20 Cb 0.00 -0.03 0.00 0.00 1.43 0.00 0.00 31.44 32.85 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 -2.41 -3.74 -2.85 -1.84 -0.00 -1.26 -4.26 117.44 101.09 1p7m n TRP 21 Ca 0.00 1.62 -0.12 0.00 -0.00 0.00 0.00 57.50 59.00 1p7m n TRP 21 Cb 0.00 -3.92 0.03 0.00 -0.00 0.00 0.00 31.31 27.42 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 0.45 0.15 0.05 5.87 0.00 0.87 -4.93 105.19 107.65 1p7m n GLY 22 Ca 0.03 -0.27 -0.06 0.00 0.00 0.00 0.00 46.02 45.72 1p7m n GLY 22 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1p7m n VAL 23 N -3.81 0.69 -2.99 1.61 0.31 -1.25 -4.19 118.33 108.70 1p7m n VAL 23 Ca -0.03 -0.38 -0.32 0.00 -0.01 0.00 0.00 64.34 63.61 1p7m n VAL 23 Cb 0.54 -0.80 -0.05 0.00 -0.91 0.00 0.00 33.84 32.63 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 -2.24 3.92 1.04 5.55 0.04 -1.25 -4.94 135.00 137.11 1p7m s PRO 24 Ca -0.08 0.61 -0.12 0.00 0.04 0.00 0.00 61.00 61.45 1p7m s PRO 24 Cb 0.03 -2.39 0.21 0.00 0.04 0.00 0.00 34.50 32.39 1p7m s PRO 24 CO 0.37 0.06 1.08 -1.83 0.04 0.00 0.00 177.00 176.71 1p7m s GLU 25 N -3.38 0.12 0.01 4.56 1.03 -1.26 -3.98 118.70 115.80 1p7m s GLU 25 Ca 0.53 0.63 -0.13 0.00 0.03 0.00 0.00 54.97 56.03 1p7m s GLU 25 Cb -0.10 -1.69 -0.06 0.00 -0.80 0.00 0.00 34.13 31.48 1p7m s GLU 25 CO 0.23 -2.97 0.38 0.95 -1.33 0.00 0.00 175.26 172.53 1p7m s THR 26 N -2.83 5.09 0.07 1.83 -4.23 -1.26 -4.90 115.64 109.40 1p7m s THR 26 Ca 0.66 0.70 0.02 0.00 -1.18 0.00 0.00 61.69 61.88 1p7m s THR 26 Cb -0.20 -3.67 -0.04 0.00 1.34 0.00 0.00 72.50 69.93 1p7m s THR 26 CO 0.59 0.52 0.14 -1.81 -0.54 0.00 0.00 174.62 173.52 1p7m s ASP 27 N -1.23 5.92 0.33 3.99 1.01 -1.26 -4.74 116.67 120.69 1p7m s ASP 27 Ca 0.25 0.12 0.02 0.00 0.71 0.00 0.00 52.55 53.65 1p7m s ASP 27 Cb -0.16 -1.70 0.57 0.00 1.01 0.00 0.00 42.92 42.64 1p7m s ASP 27 CO 0.14 0.17 1.93 -1.28 0.21 0.00 0.00 175.17 176.33 1p7m h SER 28 N 3.16 0.68 0.01 0.27 0.87 -1.94 -1.68 113.55 114.92 1p7m h SER 28 Ca -0.46 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.03 1p7m h SER 28 Cb 1.16 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 1p7m h SER 28 CO 0.70 0.60 -0.00 0.11 -0.53 0.00 0.00 176.83 177.70 1p7m h LYS 29 N 0.75 -0.01 -0.18 2.24 1.57 -2.01 -3.24 116.57 115.68 1p7m h LYS 29 Ca 0.18 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.94 1p7m h LYS 29 Cb 0.11 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1p7m h LYS 29 CO -0.02 0.71 -0.01 1.57 -0.57 0.00 0.00 179.45 181.13 1p7m h LYS 30 N -0.76 0.27 -0.82 3.15 2.10 -1.96 -1.23 116.57 117.32 1p7m h LYS 30 Ca -0.00 -0.04 0.07 0.00 -2.00 0.00 0.00 60.65 58.67 1p7m h LYS 30 Cb 0.73 -0.05 -0.05 0.00 -0.90 0.00 0.00 32.23 31.96 1p7m h LYS 30 CO 0.00 0.31 0.54 -0.07 -2.00 0.00 0.00 179.45 178.23 1p7m h LEU 31 N 0.26 0.79 -0.29 7.07 3.38 -1.36 0.68 115.31 125.84 1p7m h LEU 31 Ca 0.06 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1p7m h LEU 31 Cb 0.21 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1p7m h LEU 31 CO 0.01 0.50 0.02 0.15 0.09 0.00 0.00 178.44 179.21 1p7m h PHE 32 N 0.89 0.54 -0.72 1.13 3.57 -1.25 -1.99 116.94 119.11 1p7m h PHE 32 Ca 0.36 -0.09 -0.07 0.00 3.53 0.00 0.00 57.97 61.70 1p7m h PHE 32 Cb 0.24 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.81 1p7m h PHE 32 CO -0.00 0.62 0.19 0.93 -2.23 0.00 0.00 178.31 177.82 1p7m h GLU 33 N 0.31 1.14 -0.26 1.11 4.39 -1.12 -2.85 114.58 117.30 1p7m h GLU 33 Ca 0.09 -0.26 -0.01 0.00 0.34 0.00 0.00 59.36 59.51 1p7m h GLU 33 Cb 0.39 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1p7m h GLU 33 CO 0.01 0.99 0.13 1.98 -1.16 0.00 0.00 179.01 180.96 1p7m h MET 34 N 1.08 0.37 0.00 2.33 1.85 -0.74 -2.33 114.93 117.48 1p7m h MET 34 Ca 0.23 -0.05 -0.02 0.00 -0.61 0.00 0.00 59.70 59.25 1p7m h MET 34 Cb 0.35 -0.07 -0.00 0.00 0.43 0.00 0.00 31.60 32.31 1p7m h MET 34 CO -0.00 0.35 -0.09 0.97 -0.40 0.00 0.00 176.91 177.74 1p7m h ILE 35 N 0.29 0.80 -0.00 1.77 6.09 -1.25 0.65 117.51 125.86 1p7m h ILE 35 Ca 0.09 -0.35 -0.00 0.00 -1.37 0.00 0.00 64.86 63.23 1p7m h ILE 35 Cb 0.10 1.20 -0.00 0.00 0.47 0.00 0.00 36.82 38.59 1p7m h ILE 35 CO -0.01 0.09 -0.00 0.00 -3.07 0.00 0.00 178.15 175.16 1p7m h LEU 37 N -0.51 0.79 -1.19 0.00 -0.00 -1.16 -2.96 115.31 110.28 1p7m h LEU 37 Ca 0.00 -0.45 -0.08 0.00 -0.00 0.00 0.00 57.88 57.35 1p7m h LEU 37 Cb 0.51 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 40.94 1p7m h LEU 37 CO 0.00 1.08 -0.26 -0.08 -0.00 0.00 0.00 178.44 179.17 1p7m h GLU 38 N 0.52 0.22 -0.70 1.13 4.57 -0.93 -2.52 114.58 116.87 1p7m h GLU 38 Ca 0.06 -0.07 0.19 0.00 -1.18 0.00 0.00 59.36 58.36 1p7m h GLU 38 Cb 0.83 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.37 1p7m h GLU 38 CO 0.07 0.48 0.50 0.78 -1.18 0.00 0.00 179.01 179.65 1p7m h GLY 39 N 0.98 0.11 -0.16 1.92 0.00 -0.60 0.68 103.07 105.99 1p7m h GLY 39 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1p7m h GLY 39 CO 0.04 0.00 -0.03 -1.06 0.00 0.00 0.00 176.54 175.50 1p7m n GLN 40 N -4.36 1.47 -0.00 4.80 1.13 -0.95 -3.75 117.38 115.72 1p7m n GLN 40 Ca 0.14 -0.77 0.11 0.00 -1.94 0.00 0.00 57.00 54.53 1p7m n GLN 40 Cb 0.73 -1.48 0.62 0.00 0.11 0.00 0.00 30.24 30.21 1p7m n GLN 40 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 1p7m n GLN 41 N -0.10 1.04 -2.41 -1.09 1.13 0.24 -4.21 117.38 111.98 1p7m n GLN 41 Ca 0.19 -0.07 -0.43 0.00 -1.94 0.00 0.00 57.00 54.75 1p7m n GLN 41 Cb 0.32 -1.34 -0.02 0.00 0.11 0.00 0.00 30.24 29.31 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 -1.99 3.49 0.00 -1.58 0.00 -1.25 -3.11 121.76 117.33 1p7m s ALA 42 Ca 0.32 0.27 0.00 0.00 0.00 0.00 0.00 51.96 52.55 1p7m s ALA 42 Cb 0.15 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.56 1p7m s ALA 42 CO 0.25 -1.52 0.00 0.41 0.00 0.00 0.00 175.76 174.90 1p7m n GLY 43 N 4.02 0.63 3.94 0.00 0.00 -1.26 -4.92 105.19 107.60 1p7m n GLY 43 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 1p7m n GLY 43 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1p7m s LEU 44 N 0.00 3.56 0.00 0.99 2.96 -1.18 -5.10 118.68 119.91 1p7m s LEU 44 Ca 0.00 -0.55 -0.12 0.00 -0.22 0.00 0.00 54.13 53.24 1p7m s LEU 44 Cb 0.00 -2.37 -0.05 0.00 0.50 0.00 0.00 46.19 44.27 1p7m s LEU 44 CO 0.00 -0.65 0.36 -0.55 -1.32 0.00 0.00 176.35 174.18 1p7m s SER 45 N -4.21 6.68 0.42 3.68 0.15 -1.26 -4.79 113.70 114.37 1p7m s SER 45 Ca 0.50 0.82 0.14 0.00 0.70 0.00 0.00 55.95 58.11 1p7m s SER 45 Cb -0.07 -2.19 1.02 0.00 -1.71 0.00 0.00 66.02 63.07 1p7m s SER 45 CO 0.30 0.29 1.95 -0.25 1.20 0.00 0.00 173.24 176.74 1p7m h TRP 46 N 4.43 0.48 0.03 3.44 2.91 -1.94 -0.94 115.95 124.37 1p7m h TRP 46 Ca -0.51 0.01 -0.26 0.00 1.13 0.00 0.00 58.89 59.26 1p7m h TRP 46 Cb 1.21 -0.16 0.01 0.00 -0.51 0.00 0.00 29.16 29.72 1p7m h TRP 46 CO 0.70 0.21 -1.05 0.82 -1.03 0.00 0.00 178.44 178.09 1p7m h ILE 47 N 0.44 1.35 -0.52 2.65 1.08 -1.99 -1.85 117.51 118.67 1p7m h ILE 47 Ca 0.32 -2.44 0.04 0.00 -0.39 0.00 0.00 64.86 62.39 1p7m h ILE 47 Cb 0.65 2.50 -0.04 0.00 -3.07 0.00 0.00 36.82 36.86 1p7m h ILE 47 CO -0.10 0.74 0.29 0.74 -0.69 0.00 0.00 178.15 179.13 1p7m h THR 48 N 0.28 1.00 0.00 -0.27 2.02 -1.59 0.02 112.91 114.37 1p7m h THR 48 Ca -0.12 -0.20 -0.10 0.00 0.77 0.00 0.00 66.41 66.77 1p7m h THR 48 Cb 1.70 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 68.49 1p7m h THR 48 CO 0.19 0.10 -0.46 1.62 0.37 0.00 0.00 175.52 177.34 1p7m h VAL 49 N 0.57 1.27 -0.90 3.16 3.04 -1.39 -2.81 116.25 119.19 1p7m h VAL 49 Ca 0.22 -1.61 0.07 0.00 -1.01 0.00 0.00 66.70 64.37 1p7m h VAL 49 Cb 0.08 1.89 -0.07 0.00 -2.01 0.00 0.00 31.29 31.18 1p7m h VAL 49 CO -0.13 0.45 0.56 0.25 -1.01 0.00 0.00 177.57 177.69 1p7m h LEU 50 N 0.00 0.86 -0.88 3.16 6.46 -0.13 0.40 115.31 125.19 1p7m h LEU 50 Ca -0.00 0.02 0.05 0.00 -0.12 0.00 0.00 57.88 57.83 1p7m h LEU 50 Cb 0.85 -0.15 -0.06 0.00 -0.73 0.00 0.00 40.66 40.57 1p7m h LEU 50 CO 0.06 0.53 0.55 0.11 -0.62 0.00 0.00 178.44 179.08 1p7m h LYS 51 N 0.99 1.01 0.00 1.25 1.79 -1.15 0.33 116.57 120.78 1p7m h LYS 51 Ca 0.40 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.81 1p7m h LYS 51 Cb 0.23 -0.23 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 1p7m h LYS 51 CO -0.19 0.67 0.00 0.87 -1.08 0.00 0.00 179.45 179.71 1p7m h LYS 52 N 1.04 0.00 -0.73 3.15 6.56 -0.76 -2.88 116.57 122.94 1p7m h LYS 52 Ca 0.37 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.96 1p7m h LYS 52 Cb 0.10 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 31.73 1p7m h LYS 52 CO -0.15 0.00 0.45 -0.09 -2.06 0.00 0.00 179.45 177.60 1p7m h ARG 53 N 0.00 0.98 -0.17 3.15 2.43 0.37 2.06 114.38 123.21 1p7m h ARG 53 Ca 0.00 -0.08 -0.06 0.00 -0.81 0.00 0.00 59.98 59.03 1p7m h ARG 53 Cb 0.61 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1p7m h ARG 53 CO 0.00 0.68 -0.13 0.93 -1.51 0.00 0.00 179.97 179.94 1p7m h GLU 54 N 0.99 0.38 -0.21 0.20 4.39 -1.37 -2.77 114.58 116.20 1p7m h GLU 54 Ca 0.26 -0.19 -0.05 0.00 0.34 0.00 0.00 59.36 59.72 1p7m h GLU 54 Cb -0.06 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 1p7m h GLU 54 CO -0.05 0.74 -0.09 -0.91 -1.16 0.00 0.00 179.01 177.54 1p7m h ASN 55 N 0.04 0.31 -0.58 1.42 2.35 -1.32 -2.36 115.58 115.44 1p7m h ASN 55 Ca 0.03 -0.06 0.07 0.00 -0.55 0.00 0.00 56.30 55.79 1p7m h ASN 55 Cb 0.65 -0.08 -0.06 0.00 0.05 0.00 0.00 38.32 38.88 1p7m h ASN 55 CO 0.03 0.44 0.27 0.22 -1.65 0.00 0.00 177.43 176.74 1p7m h TYR 56 N 0.31 0.49 -0.84 1.19 3.20 0.36 0.22 116.97 121.91 1p7m h TYR 56 Ca 0.07 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.97 1p7m h TYR 56 Cb 0.35 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.45 1p7m h TYR 56 CO 0.01 0.20 0.55 0.00 -1.64 0.00 0.00 178.16 177.28 1p7m h ARG 57 N 0.50 1.10 -0.38 1.82 3.08 -1.21 -0.43 114.38 118.86 1p7m h ARG 57 Ca 0.27 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 60.17 1p7m h ARG 57 Cb 0.23 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 1p7m h ARG 57 CO -0.22 0.73 -0.10 0.00 -1.07 0.00 0.00 179.97 179.31 1p7m h ALA 58 N 1.47 1.10 -0.13 0.04 0.00 -0.62 2.92 119.26 124.04 1p7m h ALA 58 Ca 0.31 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1p7m h ALA 58 Cb -0.13 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1p7m h ALA 58 CO -0.07 0.56 -0.29 0.00 0.00 0.00 0.00 179.25 179.45 1p7m n PHE 60 N -4.41 0.00 0.00 0.00 3.01 -0.28 -4.95 117.46 110.82 1p7m n PHE 60 Ca -0.07 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.39 1p7m n PHE 60 Cb 0.47 -0.41 0.00 0.00 -0.01 0.00 0.00 39.48 39.53 1p7m n PHE 60 CO 0.00 0.00 0.00 1.58 1.01 0.00 0.00 176.76 179.35 1p7m n HIS 61 N -3.32 0.00 0.06 1.38 -0.00 0.97 -4.24 115.22 110.08 1p7m n HIS 61 Ca -0.22 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 57.85 1p7m n HIS 61 Cb 0.67 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 30.54 1p7m n HIS 61 CO 0.00 0.00 0.00 -0.56 0.46 0.00 0.00 176.34 176.24 1p7m h GLN 62 N 0.00 0.38 -1.47 1.57 3.07 -1.93 -3.45 115.11 113.28 1p7m h GLN 62 Ca 0.00 -0.36 -0.02 0.00 0.09 0.00 0.00 58.65 58.36 1p7m h GLN 62 Cb 0.00 0.09 -0.01 0.00 0.08 0.00 0.00 27.48 27.64 1p7m h GLN 62 CO 0.00 1.02 -0.02 1.97 0.09 0.00 0.00 178.83 181.90 1p7m n PHE 63 N -3.78 -0.72 -2.73 0.06 1.16 -1.26 -4.83 117.46 105.37 1p7m n PHE 63 Ca -0.05 0.00 -0.38 0.00 -1.87 0.00 0.00 57.45 55.15 1p7m n PHE 63 Cb 0.77 -1.00 -0.06 0.00 -1.61 0.00 0.00 39.48 37.58 1p7m n PHE 63 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1p7m s ASP 64 N -0.86 7.38 0.02 5.98 1.11 -1.26 -4.97 116.67 124.07 1p7m s ASP 64 Ca 0.00 1.92 -0.25 0.00 0.18 0.00 0.00 52.55 54.40 1p7m s ASP 64 Cb 0.00 -2.59 -0.17 0.00 1.07 0.00 0.00 42.92 41.22 1p7m s ASP 64 CO 0.00 -0.04 1.37 1.55 1.18 0.00 0.00 175.17 179.23 1p7m h PRO 65 N 3.46 -0.24 -0.39 8.23 0.13 -1.95 -1.24 132.00 140.00 1p7m h PRO 65 Ca -0.46 0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 64.64 1p7m h PRO 65 Cb 1.20 0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.37 1p7m h PRO 65 CO 0.66 0.06 0.07 0.28 -0.23 0.00 0.00 178.00 178.84 1p7m h VAL 66 N -0.54 1.24 -0.55 1.56 2.07 -1.94 -2.52 116.25 115.58 1p7m h VAL 66 Ca -0.02 -0.86 -0.05 0.00 0.82 0.00 0.00 66.70 66.59 1p7m h VAL 66 Cb 0.41 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 1p7m h VAL 66 CO 0.04 0.29 0.14 0.11 0.02 0.00 0.00 177.57 178.18 1p7m h LYS 67 N 0.50 0.83 -0.74 1.57 6.56 -1.97 -2.53 116.57 120.79 1p7m h LYS 67 Ca 0.12 -0.16 -0.05 0.00 -1.06 0.00 0.00 60.65 59.50 1p7m h LYS 67 Cb 0.36 -0.13 -0.03 0.00 -0.57 0.00 0.00 32.23 31.86 1p7m h LYS 67 CO 0.01 0.74 0.27 0.28 -2.06 0.00 0.00 179.45 178.69 1p7m h VAL 68 N 0.80 1.25 0.00 0.50 2.07 -0.99 0.10 116.25 119.99 1p7m h VAL 68 Ca 0.18 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.86 1p7m h VAL 68 Cb 0.28 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1p7m h VAL 68 CO -0.00 0.33 0.00 0.00 0.02 0.00 0.00 177.57 177.92 1p7m h ALA 69 N 1.20 1.00 -0.01 1.67 0.00 -1.03 0.18 119.26 122.27 1p7m h ALA 69 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1p7m h ALA 69 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1p7m h ALA 69 CO -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 179.25 179.09 1p7m n ALA 70 N -1.87 2.86 -2.52 0.00 0.00 0.32 -4.78 120.51 114.53 1p7m n ALA 70 Ca 0.00 -0.42 -0.43 0.00 0.00 0.00 0.00 53.44 52.59 1p7m n ALA 70 Cb 0.17 -1.15 -0.02 0.00 0.00 0.00 0.00 19.45 18.45 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 -2.29 3.85 0.46 0.00 -1.94 0.64 -5.00 119.30 115.01 1p7m s MET 71 Ca 0.30 0.96 0.03 0.00 -1.71 0.00 0.00 55.69 55.27 1p7m s MET 71 Cb 0.20 -3.87 0.01 0.00 2.01 0.00 0.00 34.83 33.18 1p7m s MET 71 CO 0.44 -1.21 0.65 -1.14 -0.01 0.00 0.00 175.02 173.76 1p7m s GLN 72 N 4.23 2.86 0.53 2.03 0.74 -1.26 -4.93 119.66 123.86 1p7m s GLN 72 Ca 0.52 -0.82 0.28 0.00 0.05 0.00 0.00 55.36 55.39 1p7m s GLN 72 Cb -0.12 -2.62 1.42 0.00 1.10 0.00 0.00 33.01 32.79 1p7m s GLN 72 CO 0.25 -0.36 1.93 0.93 -0.55 0.00 0.00 175.29 177.49 1p7m h GLU 73 N 0.42 0.03 -0.55 1.67 5.08 -1.99 0.12 114.58 119.35 1p7m h GLU 73 Ca -0.44 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 57.97 1p7m h GLU 73 Cb 1.27 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.47 1p7m h GLU 73 CO 0.53 0.02 0.30 0.93 -1.00 0.00 0.00 179.01 179.78 1p7m h GLU 74 N 0.03 0.56 -0.80 2.33 5.08 -2.00 0.60 114.58 120.37 1p7m h GLU 74 Ca 0.36 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.64 1p7m h GLU 74 Cb 1.39 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 30.48 1p7m h GLU 74 CO -0.01 0.37 0.34 -0.44 -1.00 0.00 0.00 179.01 178.26 1p7m h ASP 75 N 0.57 1.09 -0.74 1.42 3.32 -1.15 -2.48 116.42 118.45 1p7m h ASP 75 Ca 0.24 -0.16 0.01 0.00 0.02 0.00 0.00 57.03 57.15 1p7m h ASP 75 Cb 0.12 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.35 1p7m h ASP 75 CO -0.15 0.95 0.49 0.58 -1.72 0.00 0.00 179.24 179.38 1p7m h VAL 76 N 1.16 1.17 -0.79 -1.35 2.07 -0.60 -1.12 116.25 116.78 1p7m h VAL 76 Ca 0.27 -0.34 0.07 0.00 0.82 0.00 0.00 66.70 67.52 1p7m h VAL 76 Cb 0.19 0.10 -0.05 0.00 -1.52 0.00 0.00 31.29 30.01 1p7m h VAL 76 CO -0.03 0.18 0.52 -0.33 0.02 0.00 0.00 177.57 177.93 1p7m h GLU 77 N 0.98 0.82 -0.43 1.57 4.39 -0.50 0.63 114.58 122.04 1p7m h GLU 77 Ca 0.28 -0.05 -0.09 0.00 0.34 0.00 0.00 59.36 59.84 1p7m h GLU 77 Cb -0.08 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.37 1p7m h GLU 77 CO -0.07 0.54 -0.09 -0.09 -1.16 0.00 0.00 179.01 178.14 1p7m h ARG 78 N 0.85 0.76 -0.65 2.33 2.43 -1.05 -3.14 114.38 115.90 1p7m h ARG 78 Ca 0.34 -0.24 -0.08 0.00 -0.81 0.00 0.00 59.98 59.19 1p7m h ARG 78 Cb 0.25 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.71 1p7m h ARG 78 CO -0.12 0.83 0.10 -0.07 -1.51 0.00 0.00 179.97 179.20 1p7m h LEU 79 N 0.69 1.04 -1.95 3.80 3.38 -0.07 -0.25 115.31 121.96 1p7m h LEU 79 Ca 0.12 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1p7m h LEU 79 Cb 0.56 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1p7m h LEU 79 CO 0.03 1.04 0.04 -0.37 0.09 0.00 0.00 178.44 179.28 1p7m h VAL 80 N 1.01 0.00 0.00 1.22 -1.51 -1.38 0.25 116.25 115.84 1p7m h VAL 80 Ca 0.20 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.67 1p7m h VAL 80 Cb 0.45 0.65 0.00 0.00 -2.13 0.00 0.00 31.29 30.26 1p7m h VAL 80 CO 0.01 0.00 -1.20 0.00 -1.23 0.00 0.00 177.57 175.15 1p7m n GLN 81 N -2.55 1.14 -2.65 5.19 6.02 -0.66 -4.24 117.38 119.63 1p7m n GLN 81 Ca -0.02 -0.07 -0.42 0.00 -0.01 0.00 0.00 57.00 56.48 1p7m n GLN 81 Cb 0.09 -1.32 -0.03 0.00 1.02 0.00 0.00 30.24 29.99 1p7m n GLN 81 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1p7m s ASP 82 N -3.14 6.39 0.00 1.08 1.01 0.89 -3.95 116.67 118.95 1p7m s ASP 82 Ca 0.01 -0.07 0.00 0.00 0.71 0.00 0.00 52.55 53.20 1p7m s ASP 82 Cb 0.12 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.52 1p7m s ASP 82 CO 0.68 -1.44 0.00 0.00 0.21 0.00 0.00 175.17 174.62 1p7m n ALA 83 N 8.24 0.00 -2.86 5.23 0.00 -1.26 -3.14 120.51 126.72 1p7m n ALA 83 Ca 0.06 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.34 1p7m n ALA 83 Cb 0.49 -0.16 0.03 0.00 0.00 0.00 0.00 19.45 19.80 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 -1.59 -0.14 0.00 0.00 0.00 -1.25 -4.95 105.19 97.26 1p7m n GLY 84 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -4.15 0.00 0.00 -0.61 -5.35 -1.19 -4.88 119.36 103.18 1p7m n ILE 85 Ca -0.07 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.41 1p7m n ILE 85 Cb 0.58 -0.19 0.00 0.00 -1.74 0.00 0.00 39.64 38.29 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 -1.72 7.28 3.06 -1.26 -5.02 119.36 121.71 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 0.06 0.00 0.54 0.00 0.00 39.64 40.24 1p7m n ILE 86 CO 0.00 0.00 0.00 0.54 -2.50 0.00 0.00 176.55 174.59 1p7m n ARG 87 N -0.66 1.20 -4.12 9.51 1.74 -1.26 -5.01 116.66 118.06 1p7m n ARG 87 Ca 0.00 0.46 -0.22 0.00 -0.77 0.00 0.00 57.85 57.32 1p7m n ARG 87 Cb 0.00 -2.49 -0.05 0.00 -1.02 0.00 0.00 32.46 28.90 1p7m n ARG 87 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1p7m s HIS 88 N -1.38 3.07 0.27 -1.55 3.76 -1.26 -4.82 115.29 113.38 1p7m s HIS 88 Ca 0.80 -0.13 -0.03 0.00 -0.15 0.00 0.00 55.06 55.55 1p7m s HIS 88 Cb -0.39 -1.40 0.57 0.00 1.11 0.00 0.00 32.58 32.46 1p7m s HIS 88 CO 0.43 0.52 1.64 0.07 -0.85 0.00 0.00 174.74 176.54 1p7m h ARG 89 N 1.51 0.14 0.24 1.40 0.11 -1.95 1.64 114.38 117.47 1p7m h ARG 89 Ca -0.48 -0.01 -0.01 0.00 0.10 0.00 0.00 59.98 59.58 1p7m h ARG 89 Cb 1.24 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 32.29 1p7m h ARG 89 CO 0.61 0.10 -0.11 0.78 0.10 0.00 0.00 179.97 181.44 1p7m h GLY 90 N 0.15 -0.33 1.02 0.08 0.00 -2.00 -1.41 103.07 100.57 1p7m h GLY 90 Ca 0.48 0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.93 1p7m h GLY 90 CO -0.67 -0.12 0.51 0.50 0.00 0.00 0.00 176.54 176.76 1p7m h LYS 91 N -0.57 1.20 -0.27 4.80 1.57 -1.45 -2.60 116.57 119.24 1p7m h LYS 91 Ca -0.03 -0.12 0.02 0.00 -1.87 0.00 0.00 60.65 58.65 1p7m h LYS 91 Cb 0.42 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 1p7m h LYS 91 CO 0.05 0.85 0.14 0.82 -0.57 0.00 0.00 179.45 180.74 1p7m h ILE 92 N 1.21 0.99 -0.86 1.86 2.04 0.24 -0.75 117.51 122.24 1p7m h ILE 92 Ca 0.31 -0.10 0.18 0.00 1.00 0.00 0.00 64.86 66.25 1p7m h ILE 92 Cb -0.02 0.68 -0.06 0.00 -0.74 0.00 0.00 36.82 36.68 1p7m h ILE 92 CO -0.06 0.05 0.57 1.56 0.00 0.00 0.00 178.15 180.27 1p7m h GLN 93 N 0.29 0.43 -0.86 2.37 1.08 -0.87 0.65 115.11 118.20 1p7m h GLN 93 Ca 0.11 -0.03 0.02 0.00 -1.45 0.00 0.00 58.65 57.31 1p7m h GLN 93 Cb 0.03 -0.10 -0.05 0.00 -0.05 0.00 0.00 27.48 27.32 1p7m h GLN 93 CO -0.08 0.29 0.57 0.00 -0.95 0.00 0.00 178.83 178.66 1p7m h ALA 94 N 1.62 1.42 -0.20 3.87 0.00 -0.93 -0.01 119.26 125.03 1p7m h ALA 94 Ca 0.44 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.28 1p7m h ALA 94 Cb 1.01 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1p7m h ALA 94 CO -0.16 0.51 0.07 0.82 0.00 0.00 0.00 179.25 180.49 1p7m h ILE 95 N 1.12 1.18 -0.90 0.00 2.04 0.55 -1.75 117.51 119.74 1p7m h ILE 95 Ca 0.33 -0.55 0.01 0.00 1.00 0.00 0.00 64.86 65.64 1p7m h ILE 95 Cb -0.06 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.14 1p7m h ILE 95 CO -0.08 0.18 0.59 0.40 0.00 0.00 0.00 178.15 179.24 1p7m h ILE 96 N 0.16 1.23 -0.56 -0.67 5.03 -0.73 -0.42 117.51 121.56 1p7m h ILE 96 Ca 0.07 -0.43 -0.00 0.00 -0.12 0.00 0.00 64.86 64.37 1p7m h ILE 96 Cb 0.21 -0.09 -0.03 0.00 -3.03 0.00 0.00 36.82 33.88 1p7m h ILE 96 CO -0.00 0.23 0.34 1.23 -0.68 0.00 0.00 178.15 179.26 1p7m h GLY 97 N 1.23 0.80 1.25 5.37 0.00 -0.63 -1.51 103.07 109.57 1p7m h GLY 97 Ca 0.33 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 47.31 1p7m h GLY 97 CO -0.07 0.31 0.30 3.43 0.00 0.00 0.00 176.54 180.51 1p7m h ASN 98 N 0.77 0.88 -0.56 0.19 4.21 -0.19 -1.47 115.58 119.41 1p7m h ASN 98 Ca 0.20 -0.10 -0.05 0.00 1.21 0.00 0.00 56.30 57.56 1p7m h ASN 98 Cb -0.03 -0.23 -0.02 0.00 -1.12 0.00 0.00 38.32 36.92 1p7m h ASN 98 CO -0.04 0.76 0.16 0.00 -1.29 0.00 0.00 177.43 177.02 1p7m h ALA 99 N 1.37 0.74 -0.59 -0.83 0.00 -0.99 0.06 119.26 119.02 1p7m h ALA 99 Ca 0.23 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1p7m h ALA 99 Cb 0.13 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1p7m h ALA 99 CO -0.03 0.42 0.01 0.00 0.00 0.00 0.00 179.25 179.65 1p7m h ARG 100 N 0.79 1.01 0.00 0.00 3.08 -1.21 -1.67 114.38 116.39 1p7m h ARG 100 Ca 0.18 -0.31 -0.07 0.00 0.07 0.00 0.00 59.98 59.85 1p7m h ARG 100 Cb 0.31 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 1p7m h ARG 100 CO -0.00 0.99 -0.34 0.00 -1.07 0.00 0.00 179.97 179.54 1p7m h ALA 101 N 1.07 1.34 -0.44 0.04 0.00 -0.98 -1.86 119.26 118.42 1p7m h ALA 101 Ca 0.17 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1p7m h ALA 101 Cb 0.53 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1p7m h ALA 101 CO 0.03 0.43 0.17 -0.92 0.00 0.00 0.00 179.25 178.96 1p7m h TYR 102 N 0.00 0.68 -0.14 0.00 3.20 -0.10 -1.16 116.97 119.45 1p7m h TYR 102 Ca -0.00 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 61.78 1p7m h TYR 102 Cb 0.65 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.70 1p7m h TYR 102 CO 0.00 0.60 -0.06 -0.07 -1.64 0.00 0.00 178.16 176.99 1p7m h LEU 103 N 0.57 0.19 -1.03 2.82 3.38 -0.78 -2.02 115.31 118.44 1p7m h LEU 103 Ca 0.15 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 1p7m h LEU 103 Cb 0.21 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1p7m h LEU 103 CO -0.01 0.28 -0.01 1.56 0.09 0.00 0.00 178.44 180.36 1p7m h GLN 104 N 0.20 0.68 -0.51 1.13 1.08 -0.43 -1.32 115.11 115.95 1p7m h GLN 104 Ca 0.05 -0.17 -0.13 0.00 -1.45 0.00 0.00 58.65 56.95 1p7m h GLN 104 Cb 0.24 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 1p7m h GLN 104 CO 0.01 0.70 -0.19 0.52 -0.95 0.00 0.00 178.83 178.93 1p7m h MET 105 N 0.64 1.02 -0.44 1.46 2.86 -0.87 -2.05 114.93 117.56 1p7m h MET 105 Ca 0.13 -0.42 -0.15 0.00 -2.06 0.00 0.00 59.70 57.20 1p7m h MET 105 Cb 0.41 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 1p7m h MET 105 CO 0.02 1.11 -0.30 0.93 1.06 0.00 0.00 176.91 179.72 1p7m h GLU 106 N 0.89 0.97 0.00 1.72 5.08 -1.29 -1.20 114.58 120.75 1p7m h GLU 106 Ca 0.12 -0.46 -0.01 0.00 -1.00 0.00 0.00 59.36 58.01 1p7m h GLU 106 Cb 0.77 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.01 1p7m h GLU 106 CO 0.06 1.13 -0.04 1.96 -1.00 0.00 0.00 179.01 181.12 1p7m h GLN 107 N 0.81 0.00 -0.00 2.33 4.20 -1.13 0.87 115.11 122.19 1p7m h GLN 107 Ca 0.09 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1p7m h GLN 107 Cb 0.89 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.67 1p7m h GLN 107 CO 0.08 0.04 -0.20 -1.71 -0.67 0.00 0.00 178.83 176.37 1p7m n ASN 108 N -3.58 0.45 -1.20 1.46 2.85 -0.54 -4.90 115.26 109.79 1p7m n ASN 108 Ca -0.02 -0.31 -0.12 0.00 -0.11 0.00 0.00 54.58 54.01 1p7m n ASN 108 Cb 0.15 -0.05 -0.02 0.00 1.24 0.00 0.00 39.78 41.09 1p7m n ASN 108 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1p7m n GLY 109 N 1.39 0.41 2.92 8.20 0.00 0.30 -4.99 105.19 113.43 1p7m n GLY 109 Ca 0.10 -0.42 -0.31 0.00 0.00 0.00 0.00 46.02 45.40 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 -4.00 1.31 0.58 1.61 2.02 -0.67 -5.01 118.70 114.53 1p7m s GLU 110 Ca 0.00 -1.47 -0.21 0.00 0.02 0.00 0.00 54.97 53.31 1p7m s GLU 110 Cb 0.00 -2.73 -0.04 0.00 0.10 0.00 0.00 34.13 31.46 1p7m s GLU 110 CO 0.00 -0.88 1.34 -2.14 0.02 0.00 0.00 175.26 173.59 1p7m s PRO 111 N 1.20 2.97 0.33 0.39 0.02 -1.26 -4.45 135.00 134.20 1p7m s PRO 111 Ca 0.07 2.18 0.03 0.00 0.02 0.00 0.00 61.00 63.30 1p7m s PRO 111 Cb -0.18 -2.13 0.62 0.00 0.02 0.00 0.00 34.50 32.82 1p7m s PRO 111 CO -0.13 -1.30 1.93 0.74 -0.33 0.00 0.00 177.00 177.91 1p7m h PHE 112 N 1.19 0.93 0.00 6.54 -1.00 -1.91 -0.63 116.94 122.05 1p7m h PHE 112 Ca -0.51 0.02 -0.05 0.00 2.81 0.00 0.00 57.97 60.24 1p7m h PHE 112 Cb 1.31 -0.31 -0.01 0.00 3.61 0.00 0.00 35.95 40.56 1p7m h PHE 112 CO 0.45 0.49 -0.24 0.00 -1.61 0.00 0.00 178.31 177.40 1p7m h ALA 113 N 1.55 1.59 0.04 2.45 0.00 -1.85 -2.83 119.26 120.22 1p7m h ALA 113 Ca 0.36 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1p7m h ALA 113 Cb 0.22 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1p7m h ALA 113 CO -0.13 0.30 -0.02 0.22 0.00 0.00 0.00 179.25 179.62 1p7m h ASP 114 N 0.00 -0.05 -0.06 0.00 3.58 -1.46 -2.77 116.42 115.66 1p7m h ASP 114 Ca -0.00 -0.30 -0.19 0.00 0.42 0.00 0.00 57.03 56.95 1p7m h ASP 114 Cb 0.43 0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.49 1p7m h ASP 114 CO 0.03 0.28 -0.66 2.19 -2.88 0.00 0.00 179.24 178.20 1p7m h PHE 115 N -0.39 0.89 -0.10 0.28 -0.00 -1.53 -2.62 116.94 113.48 1p7m h PHE 115 Ca -0.01 -0.36 0.00 0.00 -0.00 0.00 0.00 57.97 57.61 1p7m h PHE 115 Cb 0.35 -0.15 -0.00 0.00 -0.00 0.00 0.00 35.95 36.15 1p7m h PHE 115 CO 0.04 1.15 0.06 -0.39 -0.00 0.00 0.00 178.31 179.17 1p7m h VAL 116 N 0.50 1.04 0.00 0.88 -1.51 -1.57 0.19 116.25 115.78 1p7m h VAL 116 Ca -0.02 -0.10 -0.00 0.00 -1.23 0.00 0.00 66.70 65.35 1p7m h VAL 116 Cb 1.25 0.94 -0.00 0.00 -2.13 0.00 0.00 31.29 31.35 1p7m h VAL 116 CO 0.13 0.04 -0.01 -0.50 -1.23 0.00 0.00 177.57 176.00 1p7m h TRP 117 N 0.11 0.00 -0.55 5.19 4.06 -1.51 -1.69 115.95 121.57 1p7m h TRP 117 Ca 0.03 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.93 1p7m h TRP 117 Cb 0.01 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.15 1p7m h TRP 117 CO -0.06 0.01 0.13 0.77 -3.56 0.00 0.00 178.44 175.72 1p7m h SER 118 N 0.00 0.84 0.16 -3.49 0.02 -0.56 1.28 113.55 111.80 1p7m h SER 118 Ca -0.00 -0.24 -0.10 0.00 -0.84 0.00 0.00 61.79 60.62 1p7m h SER 118 Cb 0.02 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 1p7m h SER 118 CO 0.00 0.86 -0.35 -0.26 -1.14 0.00 0.00 176.83 175.94 1p7m h PHE 119 N 0.78 0.32 -0.27 3.45 0.04 -1.04 -2.20 116.94 118.01 1p7m h PHE 119 Ca 0.17 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.86 1p7m h PHE 119 Cb 0.35 -0.07 0.00 0.00 2.20 0.00 0.00 35.95 38.42 1p7m h PHE 119 CO 0.02 0.60 0.00 0.28 -0.60 0.00 0.00 178.31 178.61 1p7m n VAL 120 N -4.07 0.97 -3.33 -0.55 0.31 -1.01 -4.85 118.33 105.79 1p7m n VAL 120 Ca -0.01 -0.55 -0.24 0.00 -0.01 0.00 0.00 64.34 63.52 1p7m n VAL 120 Cb 0.44 -0.21 0.04 0.00 -0.91 0.00 0.00 33.84 33.19 1p7m n VAL 120 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1p7m n ASN 121 N 0.33 -5.56 -3.18 4.52 5.03 -0.83 -1.54 115.26 114.04 1p7m n ASN 121 Ca 0.12 -0.43 -0.17 0.00 0.87 0.00 0.00 54.58 54.97 1p7m n ASN 121 Cb 0.54 -4.47 -0.02 0.00 -1.02 0.00 0.00 39.78 34.81 1p7m n ASN 121 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 1p7m n HIS 122 N -4.54 -1.69 -4.02 3.10 8.25 0.44 -4.89 115.22 111.86 1p7m n HIS 122 Ca -0.05 0.28 -0.09 0.00 -0.26 0.00 0.00 57.72 57.60 1p7m n HIS 122 Cb 0.58 -1.94 -0.11 0.00 1.12 0.00 0.00 29.99 29.64 1p7m n HIS 122 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 1p7m s GLN 123 N -5.77 0.41 0.38 -0.41 -2.07 -0.59 -5.09 119.66 106.52 1p7m s GLN 123 Ca 0.29 -0.75 -0.25 0.00 -1.82 0.00 0.00 55.36 52.83 1p7m s GLN 123 Cb -0.16 0.04 -0.09 0.00 -1.09 0.00 0.00 33.01 31.71 1p7m s GLN 123 CO 0.36 -0.04 1.08 -1.25 -1.32 0.00 0.00 175.29 174.12 1p7m s PRO 124 N -1.93 4.22 -0.03 9.60 0.04 -1.26 -4.88 135.00 140.77 1p7m s PRO 124 Ca -0.11 1.64 0.03 0.00 0.04 0.00 0.00 61.00 62.60 1p7m s PRO 124 Cb -0.07 -2.69 -0.03 0.00 0.04 0.00 0.00 34.50 31.75 1p7m s PRO 124 CO -0.02 -0.12 -0.10 -1.14 0.04 0.00 0.00 177.00 175.66 1p7m s GLN 125 N -2.26 2.54 -0.30 4.56 -0.44 -0.89 -4.98 119.66 117.89 1p7m s GLN 125 Ca 0.55 -0.70 -0.15 0.00 -2.50 0.00 0.00 55.36 52.57 1p7m s GLN 125 Cb -0.26 -2.46 -0.03 0.00 -1.64 0.00 0.00 33.01 28.63 1p7m s GLN 125 CO 0.32 0.62 0.35 -1.64 0.50 0.00 0.00 175.29 175.45 1p7m s MET 126 N -1.06 3.82 -0.30 1.67 -1.94 -1.26 -0.78 119.30 119.45 1p7m s MET 126 Ca 0.14 -0.18 -0.22 0.00 -1.71 0.00 0.00 55.69 53.72 1p7m s MET 126 Cb -0.11 -3.72 -0.01 0.00 2.01 0.00 0.00 34.83 33.01 1p7m s MET 126 CO 0.04 -0.38 0.70 0.99 -0.01 0.00 0.00 175.02 176.36 1p7m s THR 127 N 2.03 4.88 -0.61 2.05 2.01 -0.40 -4.91 115.64 120.70 1p7m s THR 127 Ca 0.13 1.02 0.06 0.00 0.31 0.00 0.00 61.69 63.21 1p7m s THR 127 Cb -0.16 -4.06 0.39 0.00 0.01 0.00 0.00 72.50 68.68 1p7m s THR 127 CO 0.11 -0.18 1.13 0.00 -0.69 0.00 0.00 174.62 174.99 1p7m n GLN 128 N 6.01 2.78 -2.09 4.92 6.02 -1.26 -4.59 117.38 129.16 1p7m n GLN 128 Ca 0.01 -1.51 -0.41 0.00 -0.01 0.00 0.00 57.00 55.08 1p7m n GLN 128 Cb 0.48 -1.85 -0.03 0.00 1.02 0.00 0.00 30.24 29.87 1p7m n GLN 128 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1p7m s ALA 129 N -1.83 3.58 -0.04 -1.58 0.00 -1.26 -4.90 121.76 115.74 1p7m s ALA 129 Ca 0.26 1.25 0.21 0.00 0.00 0.00 0.00 51.96 53.68 1p7m s ALA 129 Cb 0.20 -3.52 -0.33 0.00 0.00 0.00 0.00 23.12 19.47 1p7m s ALA 129 CO 0.07 -0.66 0.47 0.25 0.00 0.00 0.00 175.76 175.89 1p7m n THR 130 N 2.31 0.00 -4.29 0.00 -2.24 -1.26 -2.65 114.28 106.16 1p7m n THR 130 Ca 0.06 -0.48 -0.17 0.00 -2.27 0.00 0.00 64.05 61.19 1p7m n THR 130 Cb 0.41 0.03 -0.10 0.00 -2.10 0.00 0.00 70.33 68.57 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 -3.46 1.47 0.25 4.28 -4.23 -1.26 -4.77 115.64 107.92 1p7m s THR 131 Ca -0.08 -2.06 -0.04 0.00 -1.18 0.00 0.00 61.69 58.33 1p7m s THR 131 Cb 0.14 -1.88 0.24 0.00 1.34 0.00 0.00 72.50 72.34 1p7m s THR 131 CO 0.88 -0.61 1.88 -0.07 -0.54 0.00 0.00 174.62 176.16 1p7m h LEU 132 N 2.84 0.98 -0.84 4.79 3.38 -1.93 0.10 115.31 124.62 1p7m h LEU 132 Ca -0.38 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.59 1p7m h LEU 132 Cb 1.21 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1p7m h LEU 132 CO 0.60 0.65 0.00 -1.28 0.09 0.00 0.00 178.44 178.50 1p7m h SER 133 N 1.13 0.00 0.67 -0.43 0.87 -1.99 -2.50 113.55 111.30 1p7m h SER 133 Ca 0.39 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.95 1p7m h SER 133 Cb 0.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.06 1p7m h SER 133 CO -0.15 0.00 0.00 1.21 -0.53 0.00 0.00 176.83 177.36 1p7m n GLU 134 N -2.96 0.05 -2.96 2.24 4.07 0.33 -4.68 120.64 116.74 1p7m n GLU 134 Ca 0.02 0.13 -0.40 0.00 -0.06 0.00 0.00 57.16 56.85 1p7m n GLU 134 Cb 0.38 -1.50 -0.05 0.00 -0.06 0.00 0.00 31.44 30.21 1p7m n GLU 134 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 1p7m s ILE 135 N -2.93 4.84 0.19 6.31 1.01 -0.94 -4.70 121.20 124.98 1p7m s ILE 135 Ca 0.12 1.64 -0.30 0.00 0.00 0.00 0.00 60.65 62.11 1p7m s ILE 135 Cb 0.14 -4.12 -0.08 0.00 0.01 0.00 0.00 42.46 38.41 1p7m s ILE 135 CO 0.37 0.30 1.17 -2.16 0.00 0.00 0.00 174.94 174.63 1p7m s PRO 136 N 0.35 4.52 0.00 2.79 0.04 -1.26 -4.93 135.00 136.51 1p7m s PRO 136 Ca 0.40 1.84 0.22 0.00 0.04 0.00 0.00 61.00 63.50 1p7m s PRO 136 Cb -0.20 -3.25 0.35 0.00 0.04 0.00 0.00 34.50 31.45 1p7m s PRO 136 CO 0.22 -0.05 1.34 0.25 0.04 0.00 0.00 177.00 178.80 1p7m n THR 137 N 2.44 0.39 -3.46 1.26 -2.24 -1.26 -4.71 114.28 106.70 1p7m n THR 137 Ca 0.04 -0.69 -0.27 0.00 -2.27 0.00 0.00 64.05 60.85 1p7m n THR 137 Cb 0.45 1.10 -0.12 0.00 -2.10 0.00 0.00 70.33 69.66 1p7m n THR 137 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1p7m s SER 138 N -1.55 2.82 0.21 3.42 1.04 -1.26 -4.15 113.70 114.23 1p7m s SER 138 Ca 0.35 -1.95 0.08 0.00 0.48 0.00 0.00 55.95 54.91 1p7m s SER 138 Cb 0.21 -0.26 -0.04 0.00 0.10 0.00 0.00 66.02 66.03 1p7m s SER 138 CO 0.30 -0.33 0.02 0.42 0.98 0.00 0.00 173.24 174.64 1p7m s THR 139 N 1.30 3.73 0.31 2.02 -4.23 -1.26 -4.93 115.64 112.58 1p7m s THR 139 Ca 0.16 -1.57 0.06 0.00 -1.18 0.00 0.00 61.69 59.17 1p7m s THR 139 Cb -0.21 -2.93 0.30 0.00 1.34 0.00 0.00 72.50 71.01 1p7m s THR 139 CO -0.06 -0.22 1.80 -0.65 -0.54 0.00 0.00 174.62 174.95 1p7m h PRO 140 N 2.31 0.76 -0.25 3.99 0.11 -2.00 0.57 132.00 137.49 1p7m h PRO 140 Ca -0.46 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 65.48 1p7m h PRO 140 Cb 1.22 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 1p7m h PRO 140 CO 0.59 0.50 -0.33 0.00 -0.21 0.00 0.00 178.00 178.55 1p7m h ALA 141 N 1.62 0.38 -0.63 -0.75 0.00 -1.95 -2.02 119.26 115.91 1p7m h ALA 141 Ca 0.55 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1p7m h ALA 141 Cb 0.83 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 1p7m h ALA 141 CO -0.34 0.43 0.24 0.66 0.00 0.00 0.00 179.25 180.24 1p7m h SER 142 N 0.39 0.88 -0.74 0.00 4.64 -1.26 -2.01 113.55 115.46 1p7m h SER 142 Ca 0.03 -0.18 -0.06 0.00 -0.47 0.00 0.00 61.79 61.11 1p7m h SER 142 Cb 0.91 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.74 1p7m h SER 142 CO 0.08 0.82 0.23 -0.78 -0.87 0.00 0.00 176.83 176.31 1p7m h ASP 143 N 0.89 1.08 -0.17 4.97 3.58 0.08 -2.42 116.42 124.43 1p7m h ASP 143 Ca 0.21 -0.20 -0.07 0.00 0.42 0.00 0.00 57.03 57.38 1p7m h ASP 143 Cb 0.23 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 1p7m h ASP 143 CO -0.01 1.00 -0.11 0.00 -2.88 0.00 0.00 179.24 177.23 1p7m h ALA 144 N 1.14 1.22 -0.23 -0.78 0.00 -1.05 -2.78 119.26 116.78 1p7m h ALA 144 Ca 0.24 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1p7m h ALA 144 Cb 0.31 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1p7m h ALA 144 CO -0.01 0.51 -0.01 -0.07 0.00 0.00 0.00 179.25 179.67 1p7m h LEU 145 N 0.50 0.40 -0.11 0.00 3.38 -0.92 -0.30 115.31 118.25 1p7m h LEU 145 Ca 0.09 -0.32 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 1p7m h LEU 145 Cb 0.49 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1p7m h LEU 145 CO 0.03 0.62 0.07 0.28 0.09 0.00 0.00 178.44 179.52 1p7m h SER 146 N 0.17 0.14 -0.28 -0.43 0.02 -1.31 0.25 113.55 112.10 1p7m h SER 146 Ca 0.06 -0.06 -0.12 0.00 -0.84 0.00 0.00 61.79 60.84 1p7m h SER 146 Cb 0.42 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 1p7m h SER 146 CO 0.01 0.15 -0.24 0.07 -1.14 0.00 0.00 176.83 175.68 1p7m h LYS 147 N 0.11 0.77 -0.17 3.45 2.10 -1.51 0.23 116.57 121.55 1p7m h LYS 147 Ca 0.04 -0.32 -0.03 0.00 -2.00 0.00 0.00 60.65 58.34 1p7m h LYS 147 Cb 0.04 -0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 31.34 1p7m h LYS 147 CO -0.01 0.93 0.00 0.00 -2.00 0.00 0.00 179.45 178.38 1p7m h ALA 148 N 1.06 0.23 -0.39 0.07 0.00 -0.75 -0.73 119.26 118.75 1p7m h ALA 148 Ca 0.09 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 1p7m h ALA 148 Cb 0.75 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1p7m h ALA 148 CO 0.06 -0.07 -0.14 -0.07 0.00 0.00 0.00 179.25 179.04 1p7m h LEU 149 N 0.05 0.80 -1.26 0.00 3.38 -0.42 -2.66 115.31 115.19 1p7m h LEU 149 Ca 0.05 -0.38 0.02 0.00 0.09 0.00 0.00 57.88 57.65 1p7m h LEU 149 Cb 0.38 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 1p7m h LEU 149 CO 0.01 1.00 0.51 0.50 0.09 0.00 0.00 178.44 180.54 1p7m h LYS 150 N 0.59 0.96 0.00 1.13 1.63 -0.42 -0.26 116.57 120.20 1p7m h LYS 150 Ca 0.09 -0.06 -0.05 0.00 -0.85 0.00 0.00 60.65 59.79 1p7m h LYS 150 Cb 0.67 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 32.08 1p7m h LYS 150 CO 0.05 0.64 -0.22 0.87 -3.45 0.00 0.00 179.45 177.34 1p7m h LYS 151 N 0.99 0.00 -0.09 1.90 1.57 -0.96 -2.77 116.57 117.22 1p7m h LYS 151 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 1p7m h LYS 151 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1p7m h LYS 151 CO -0.07 0.22 0.00 0.54 -0.57 0.00 0.00 179.45 179.57 1p7m n ARG 152 N -3.27 1.29 -0.54 3.15 1.74 -0.44 -4.83 116.66 113.75 1p7m n ARG 152 Ca 0.01 -0.44 0.00 0.00 -0.77 0.00 0.00 57.85 56.65 1p7m n ARG 152 Cb 0.49 -1.26 0.00 0.00 -1.02 0.00 0.00 32.46 30.67 1p7m n ARG 152 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1p7m n GLY 153 N 0.85 0.76 3.49 -0.13 0.00 -1.04 -4.72 105.19 104.40 1p7m n GLY 153 Ca 0.12 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.19 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 3.23 0.78 1.61 0.40 -0.24 -4.43 117.98 117.33 1p7m s PHE 154 Ca 0.00 -0.41 -0.04 0.00 -0.60 0.00 0.00 56.93 55.88 1p7m s PHE 154 Cb 0.00 -2.57 0.15 0.00 0.51 0.00 0.00 43.02 41.11 1p7m s PHE 154 CO 0.00 -0.50 1.07 0.15 0.70 0.00 0.00 175.22 176.64 1p7m s LYS 155 N 1.74 1.40 -1.15 0.44 1.02 -1.26 -3.71 119.74 118.22 1p7m s LYS 155 Ca 0.06 -1.03 -0.08 0.00 0.02 0.00 0.00 55.97 54.94 1p7m s LYS 155 Cb -0.18 -2.23 -0.03 0.00 -0.52 0.00 0.00 37.83 34.86 1p7m s LYS 155 CO 0.10 -1.69 0.85 1.19 -0.92 0.00 0.00 175.35 174.88 1p7m n PHE 156 N -3.04 -2.17 -2.61 3.18 3.01 -1.26 -4.92 117.46 109.66 1p7m n PHE 156 Ca 0.16 0.75 -0.07 0.00 1.01 0.00 0.00 57.45 59.30 1p7m n PHE 156 Cb 0.60 -4.11 0.04 0.00 -0.01 0.00 0.00 39.48 36.01 1p7m n PHE 156 CO 0.00 0.00 0.00 1.33 1.01 0.00 0.00 176.76 179.10 1p7m n VAL 157 N -3.81 1.61 -0.97 -4.37 0.24 -1.26 -4.49 118.33 105.27 1p7m n VAL 157 Ca -0.15 -3.31 -0.34 0.00 -2.04 0.00 0.00 64.34 58.49 1p7m n VAL 157 Cb 0.63 0.57 0.09 0.00 -1.47 0.00 0.00 33.84 33.66 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 -0.60 -2.26 0.41 7.63 0.00 -1.26 -4.52 105.19 104.58 1p7m n GLY 158 Ca 0.18 -0.63 0.21 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.09 0.68 -0.26 2.61 2.02 -1.92 0.55 112.91 115.50 1p7m h THR 159 Ca -0.44 -0.08 -0.13 0.00 0.77 0.00 0.00 66.41 66.53 1p7m h THR 159 Cb 1.31 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 1p7m h THR 159 CO 0.35 0.04 -0.37 0.74 0.37 0.00 0.00 175.52 176.66 1p7m h THR 160 N 0.23 1.29 -0.44 3.16 2.02 -1.86 -2.41 112.91 114.90 1p7m h THR 160 Ca 0.40 -1.51 -0.01 0.00 0.77 0.00 0.00 66.41 66.05 1p7m h THR 160 Cb 1.21 1.49 -0.02 0.00 -1.74 0.00 0.00 68.15 69.09 1p7m h THR 160 CO -0.09 0.48 0.22 0.40 0.37 0.00 0.00 175.52 176.90 1p7m h ILE 161 N 0.49 1.17 -0.71 3.11 1.08 -0.17 0.06 117.51 122.53 1p7m h ILE 161 Ca 0.05 -0.47 -0.06 0.00 -0.39 0.00 0.00 64.86 63.98 1p7m h ILE 161 Cb 0.86 0.68 -0.03 0.00 -3.07 0.00 0.00 36.82 35.26 1p7m h ILE 161 CO 0.07 0.18 0.19 0.00 -0.69 0.00 0.00 178.15 177.91 1p7m h TYR 163 N 1.07 0.78 -0.59 0.00 3.20 -1.08 -2.85 116.97 117.51 1p7m h TYR 163 Ca 0.23 -0.20 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 1p7m h TYR 163 Cb 0.35 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.41 1p7m h TYR 163 CO 0.03 0.90 0.28 0.77 -1.64 0.00 0.00 178.16 178.49 1p7m h SER 164 N 0.44 0.74 0.05 -2.11 0.02 -0.82 -2.26 113.55 109.60 1p7m h SER 164 Ca 0.07 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1p7m h SER 164 Cb 0.70 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.05 1p7m h SER 164 CO 0.05 0.63 -0.02 0.15 -1.14 0.00 0.00 176.83 176.50 1p7m h PHE 165 N 0.82 -0.06 -0.65 3.45 3.57 -1.16 -1.60 116.94 121.32 1p7m h PHE 165 Ca 0.20 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.67 1p7m h PHE 165 Cb 0.09 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.82 1p7m h PHE 165 CO 0.01 0.02 0.27 0.00 -2.23 0.00 0.00 178.31 176.38 1p7m h MET 166 N -0.12 0.94 -0.51 1.11 -0.00 -1.28 -0.36 114.93 114.71 1p7m h MET 166 Ca -0.01 -0.14 -0.10 0.00 -0.00 0.00 0.00 59.70 59.45 1p7m h MET 166 Cb 0.10 -0.17 -0.02 0.00 -0.00 0.00 0.00 31.60 31.52 1p7m h MET 166 CO 0.01 0.76 -0.09 0.37 -0.00 0.00 0.00 176.91 177.96 1p7m h GLN 167 N 0.93 0.97 0.16 -0.10 5.75 -1.15 -2.81 115.11 118.85 1p7m h GLN 167 Ca 0.22 -0.35 -0.32 0.00 -0.15 0.00 0.00 58.65 58.04 1p7m h GLN 167 Cb 0.16 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.65 1p7m h GLN 167 CO -0.02 1.02 -1.63 0.00 -2.65 0.00 0.00 178.83 175.55 1p7m h ALA 168 N 0.91 0.17 0.02 3.38 0.00 -1.09 -3.35 119.26 119.30 1p7m h ALA 168 Ca 0.13 -1.13 -0.00 0.00 0.00 0.00 0.00 54.91 53.92 1p7m h ALA 168 Cb 0.64 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1p7m h ALA 168 CO 0.04 0.95 -0.01 0.00 0.00 0.00 0.00 179.25 180.24 1p7m n GLY 170 N -0.62 -0.83 0.31 0.00 0.00 -1.19 -3.78 105.19 99.08 1p7m n GLY 170 Ca -0.08 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.99 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 0.45 -8.51 0.99 3.38 -1.78 -3.43 115.31 106.42 1p7m h LEU 171 Ca 0.00 -0.01 -0.44 0.00 0.09 0.00 0.00 57.88 57.52 1p7m h LEU 171 Cb 0.00 -0.11 -0.21 0.00 0.09 0.00 0.00 40.66 40.43 1p7m h LEU 171 CO 0.00 0.33 -0.79 0.68 0.09 0.00 0.00 178.44 178.75 1p7m s VAL 172 N -5.48 1.28 0.33 1.22 -7.23 -1.18 -2.08 120.40 107.25 1p7m s VAL 172 Ca -0.08 -1.44 0.10 0.00 -1.81 0.00 0.00 61.98 58.75 1p7m s VAL 172 Cb 0.17 -1.26 -0.06 0.00 0.56 0.00 0.00 36.38 35.79 1p7m s VAL 172 CO 0.73 -0.23 -0.06 0.20 -0.31 0.00 0.00 175.10 175.44 1p7m s ASN 173 N -1.92 3.96 0.00 4.85 0.01 0.04 -4.81 114.94 117.07 1p7m s ASN 173 Ca 0.02 -1.06 0.00 0.00 -0.71 0.00 0.00 52.86 51.11 1p7m s ASN 173 Cb -0.09 -0.45 0.00 0.00 0.41 0.00 0.00 41.25 41.12 1p7m s ASN 173 CO 0.03 -0.18 0.00 -0.67 -1.51 0.00 0.00 177.10 174.77 1p7m n ASP 174 N -0.85 -0.40 -0.05 -1.22 -0.08 -1.26 -1.27 116.55 111.42 1p7m n ASP 174 Ca -0.05 0.00 -0.08 0.00 -1.51 0.00 0.00 54.79 53.16 1p7m n ASP 174 Cb 0.62 -0.20 -0.02 0.00 2.34 0.00 0.00 41.12 43.87 1p7m n ASP 174 CO 0.00 0.00 0.00 0.45 0.12 0.00 0.00 177.20 177.77 1p7m h HIS 175 N 0.00 -0.08 0.00 -0.67 3.86 -1.92 -3.39 115.15 112.95 1p7m h HIS 175 Ca 0.00 0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.17 1p7m h HIS 175 Cb 0.00 0.07 -0.08 0.00 1.06 0.00 0.00 27.41 28.46 1p7m h HIS 175 CO 0.00 -0.07 -0.21 1.33 0.86 0.00 0.00 177.93 179.83 1p7m n VAL 176 N -5.19 0.00 -2.26 2.45 0.24 -1.26 -4.84 118.33 107.47 1p7m n VAL 176 Ca -0.02 -0.06 0.00 0.00 -2.04 0.00 0.00 64.34 62.23 1p7m n VAL 176 Cb 0.13 0.30 0.00 0.00 -1.47 0.00 0.00 33.84 32.80 1p7m n VAL 176 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1p7m n VAL 177 N 0.03-11.08 -0.08 3.34 0.31 -1.08 -4.00 118.33 105.76 1p7m n VAL 177 Ca -0.11 2.65 0.00 0.00 -0.01 0.00 0.00 64.34 66.86 1p7m n VAL 177 Cb 0.63 -5.19 0.00 0.00 -0.91 0.00 0.00 33.84 28.37 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 1.89 0.96 3.82 2.92 0.00 -1.26 -4.87 105.19 108.65 1p7m n GLY 178 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.27 3.53 0.00 0.00 5.04 0.34 -4.99 117.35 117.99 1p7m s TYR 182 Ca -0.00 -3.14 0.00 0.00 -2.44 0.00 0.00 57.07 51.48 1p7m s TYR 182 Cb 0.04 -2.93 0.00 0.00 0.35 0.00 0.00 41.96 39.43 1p7m s TYR 182 CO 0.14 -0.68 0.00 -0.35 -1.34 0.00 0.00 175.55 173.32 1p7m n PRO 183 N 2.54 0.00 0.00 4.97 -0.04 -1.24 -3.93 135.00 137.30 1p7m n PRO 183 Ca 0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 1p7m n PRO 183 Cb 0.35 -0.02 0.00 0.00 -0.04 0.00 0.00 33.50 33.79 1p7m n PRO 183 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1p7m n GLY 184 N 3.14 2.03 0.09 0.55 0.00 -1.26 -4.87 105.19 104.87 1p7m n GLY 184 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1p7m n GLY 184 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1p7m h ASN 185 N 0.00 0.00 -3.89 1.61 -1.24 -2.02 -3.45 115.58 106.58 1p7m h ASN 185 Ca 0.00 -0.67 -0.47 0.00 0.71 0.00 0.00 56.30 55.88 1p7m h ASN 185 Cb 0.00 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.03 1p7m h ASN 185 CO 0.00 1.23 0.22 -1.59 -1.29 0.00 0.00 177.43 175.99 1p7m s LYS 186 N -2.27 4.12 0.00 6.67 -2.85 -1.26 -5.35 119.74 118.80 1p7m s LYS 186 Ca -0.23 0.89 0.00 0.00 -1.00 0.00 0.00 55.97 55.63 1p7m s LYS 186 Cb 0.02 -2.31 0.00 0.00 -2.06 0.00 0.00 37.83 33.48 1p7m s LYS 186 CO 0.59 0.07 0.00 -2.30 0.10 0.00 0.00 175.35 173.81