#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 3.42 0.16 2.12 2.02 -1.26 -3.76 118.70 121.40 1p7m s GLU 2 Ca 0.00 1.55 -0.03 0.00 0.02 0.00 0.00 54.97 56.51 1p7m s GLU 2 Cb 0.00 -2.02 0.04 0.00 0.10 0.00 0.00 34.13 32.25 1p7m s GLU 2 CO 0.00 -0.78 0.09 0.54 0.02 0.00 0.00 175.26 175.13 1p7m n ARG 3 N -1.30 -2.29 -2.29 1.61 1.74 -1.26 -2.97 116.66 109.90 1p7m n ARG 3 Ca 0.11 -0.16 -0.42 0.00 -0.77 0.00 0.00 57.85 56.61 1p7m n ARG 3 Cb 0.51 -0.20 -0.03 0.00 -1.02 0.00 0.00 32.46 31.72 1p7m n ARG 3 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1p7m h GLY 5 N 6.43 0.00 0.23 0.00 0.00 -1.98 0.13 103.07 107.88 1p7m h GLY 5 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1p7m h GLY 5 CO 0.82 0.00 -0.18 1.87 0.00 0.00 0.00 176.54 179.04 1p7m n TRP 6 N -2.83 0.00 0.42 5.60 -0.00 -1.26 -3.79 117.44 115.58 1p7m n TRP 6 Ca -0.02 0.00 0.04 0.00 -0.00 0.00 0.00 57.50 57.52 1p7m n TRP 6 Cb 0.08 -0.11 -0.05 0.00 -0.00 0.00 0.00 31.31 31.23 1p7m n TRP 6 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 177.69 179.24 1p7m n VAL 7 N -0.56 0.00 1.08 5.87 3.14 0.43 -4.40 118.33 123.89 1p7m n VAL 7 Ca 0.14 -0.28 0.03 0.00 -2.96 0.00 0.00 64.34 61.27 1p7m n VAL 7 Cb 0.34 0.99 0.21 0.00 -1.06 0.00 0.00 33.84 34.31 1p7m n VAL 7 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1p7m n SER 8 N -1.22 0.00 0.00 6.55 7.64 -1.02 -4.13 113.62 121.43 1p7m n SER 8 Ca 0.02 -0.86 0.00 0.00 1.01 0.00 0.00 58.87 59.03 1p7m n SER 8 Cb 0.14 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.34 1p7m n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1p7m n GLN 9 N -0.70 0.00 0.00 1.43 6.02 -1.26 -5.02 117.38 117.85 1p7m n GLN 9 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.04 1p7m n GLN 9 Cb 0.02 -0.48 0.00 0.00 1.02 0.00 0.00 30.24 30.80 1p7m n GLN 9 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1p7m n ASP 10 N -0.06 0.00 -1.33 1.08 8.00 -1.26 -5.12 116.55 117.86 1p7m n ASP 10 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1p7m n ASP 10 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1p7m n ASP 10 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1p7m n PRO 11 N 0.00 2.64 -0.38 -0.24 -0.04 -1.26 -4.77 135.00 130.95 1p7m n PRO 11 Ca 0.00 0.00 0.30 0.00 -0.04 0.00 0.00 63.50 63.76 1p7m n PRO 11 Cb 0.00 0.00 0.47 0.00 -0.04 0.00 0.00 33.50 33.93 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 0.06 -0.33 1.53 4.77 -1.26 -0.31 117.00 121.46 1p7m n LEU 12 Ca 0.00 0.73 0.22 0.00 -0.03 0.00 0.00 56.01 56.93 1p7m n LEU 12 Cb 0.00 -0.36 0.45 0.00 -2.33 0.00 0.00 43.42 41.18 1p7m n LEU 12 CO 0.00 -0.76 1.10 1.88 -1.33 0.00 0.00 177.39 178.28 1p7m h TYR 13 N 0.00 0.86 -0.33 -1.77 0.05 -1.92 0.38 116.97 114.24 1p7m h TYR 13 Ca 0.57 0.04 -0.01 0.00 0.05 0.00 0.00 58.73 59.38 1p7m h TYR 13 Cb 2.10 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 39.60 1p7m h TYR 13 CO -0.00 -0.17 0.17 0.82 -1.05 0.00 0.00 178.16 177.93 1p7m h ILE 14 N 0.32 1.14 0.00 -2.88 2.04 -0.92 0.41 117.51 117.62 1p7m h ILE 14 Ca 0.71 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 66.19 1p7m h ILE 14 Cb 1.58 0.79 0.00 0.00 -0.74 0.00 0.00 36.82 38.46 1p7m h ILE 14 CO -0.61 0.14 -0.00 0.00 0.00 0.00 0.00 178.15 177.68 1p7m h ALA 15 N 1.04 -0.00 -0.69 1.87 0.00 -0.59 -2.08 119.26 118.81 1p7m h ALA 15 Ca 0.11 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1p7m h ALA 15 Cb 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1p7m h ALA 15 CO -0.02 -0.23 0.33 -0.92 0.00 0.00 0.00 179.25 178.41 1p7m h TYR 16 N -0.55 1.01 -0.66 0.00 3.20 -0.73 0.57 116.97 119.81 1p7m h TYR 16 Ca -0.00 -0.05 -0.04 0.00 3.14 0.00 0.00 58.73 61.78 1p7m h TYR 16 Cb 0.55 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 1p7m h TYR 16 CO 0.12 0.75 0.25 1.25 -1.64 0.00 0.00 178.16 178.89 1p7m h HIS 17 N 0.97 0.99 -0.01 -3.82 2.76 -0.22 -2.63 115.15 113.19 1p7m h HIS 17 Ca 0.24 -0.07 0.00 0.00 -2.20 0.00 0.00 60.37 58.34 1p7m h HIS 17 Cb 0.13 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 28.79 1p7m h HIS 17 CO 0.01 0.77 -0.08 -0.25 -1.30 0.00 0.00 177.93 177.07 1p7m n ASP 18 N -4.29 1.30 -0.11 3.26 8.00 -0.78 -4.23 116.55 119.70 1p7m n ASP 18 Ca 0.06 -1.27 -0.13 0.00 0.71 0.00 0.00 54.79 54.16 1p7m n ASP 18 Cb 0.19 0.04 -0.14 0.00 -0.02 0.00 0.00 41.12 41.19 1p7m n ASP 18 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1p7m n ASN 19 N -0.13 0.98 0.00 -2.24 2.04 0.15 -5.01 115.26 111.05 1p7m n ASN 19 Ca 0.17 -0.05 0.00 0.00 -0.44 0.00 0.00 54.58 54.25 1p7m n ASN 19 Cb 0.35 0.43 0.00 0.00 -2.53 0.00 0.00 39.78 38.02 1p7m n ASN 19 CO 0.00 0.00 0.00 -0.62 -0.44 0.00 0.00 177.26 176.20 1p7m n GLU 20 N -2.92 0.00 -4.39 -3.83 1.02 -1.12 -4.91 120.64 104.49 1p7m n GLU 20 Ca -0.36 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.42 1p7m n GLU 20 Cb 1.06 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 32.39 1p7m n GLU 20 CO 0.00 0.00 0.00 1.87 1.18 0.00 0.00 177.13 180.18 1p7m n TRP 21 N -1.90 -1.20 -2.43 -0.32 -0.00 -1.24 -0.53 117.44 109.81 1p7m n TRP 21 Ca 0.00 0.64 -0.05 0.00 -0.00 0.00 0.00 57.50 58.09 1p7m n TRP 21 Cb 0.00 -2.38 0.02 0.00 -0.00 0.00 0.00 31.31 28.96 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 -1.94 0.24 0.07 5.87 0.00 0.49 -4.61 105.19 105.31 1p7m n GLY 22 Ca -0.14 -0.33 -0.08 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.97 0.82 -3.33 1.61 0.31 0.31 -4.32 118.33 111.76 1p7m n VAL 23 Ca -0.07 -0.39 -0.29 0.00 -0.01 0.00 0.00 64.34 63.58 1p7m n VAL 23 Cb 0.54 -0.89 -0.03 0.00 -0.91 0.00 0.00 33.84 32.56 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 -2.29 3.63 0.65 5.55 0.04 -1.26 -4.97 135.00 136.36 1p7m s PRO 24 Ca -0.14 0.01 -0.17 0.00 0.04 0.00 0.00 61.00 60.74 1p7m s PRO 24 Cb 0.04 -2.64 -0.00 0.00 0.04 0.00 0.00 34.50 31.94 1p7m s PRO 24 CO 0.39 0.21 1.20 -2.00 0.04 0.00 0.00 177.00 176.84 1p7m s GLU 25 N -3.56 2.64 0.09 4.56 -6.30 -1.26 -4.28 118.70 110.59 1p7m s GLU 25 Ca 0.44 1.78 -0.15 0.00 -2.50 0.00 0.00 54.97 54.54 1p7m s GLU 25 Cb -0.11 -1.89 -0.06 0.00 0.00 0.00 0.00 34.13 32.07 1p7m s GLU 25 CO 0.30 -1.46 0.50 0.95 0.02 0.00 0.00 175.26 175.57 1p7m s THR 26 N -1.79 4.90 0.22 -1.70 -4.23 -1.26 -4.96 115.64 106.82 1p7m s THR 26 Ca 0.76 0.85 0.05 0.00 -1.18 0.00 0.00 61.69 62.17 1p7m s THR 26 Cb -0.29 -3.75 -0.03 0.00 1.34 0.00 0.00 72.50 69.76 1p7m s THR 26 CO 0.39 0.39 0.26 -0.62 -0.54 0.00 0.00 174.62 174.49 1p7m s ASP 27 N -1.47 5.93 0.43 3.99 -1.08 -1.26 -4.89 116.67 118.33 1p7m s ASP 27 Ca 0.32 -0.06 0.14 0.00 -0.52 0.00 0.00 52.55 52.43 1p7m s ASP 27 Cb -0.16 -1.65 1.02 0.00 -1.46 0.00 0.00 42.92 40.67 1p7m s ASP 27 CO 0.18 -0.02 1.98 0.28 0.52 0.00 0.00 175.17 178.10 1p7m h SER 28 N 1.58 0.38 -0.47 -0.34 0.02 -1.95 -0.98 113.55 111.80 1p7m h SER 28 Ca -0.50 0.01 -0.11 0.00 -0.84 0.00 0.00 61.79 60.35 1p7m h SER 28 Cb 1.22 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.68 1p7m h SER 28 CO 0.62 0.23 -0.13 0.11 -1.14 0.00 0.00 176.83 176.52 1p7m h LYS 29 N 0.42 0.95 -0.49 3.45 1.79 -1.99 -2.93 116.57 117.76 1p7m h LYS 29 Ca 0.28 -0.35 -0.02 0.00 -2.18 0.00 0.00 60.65 58.38 1p7m h LYS 29 Cb 0.55 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.11 1p7m h LYS 29 CO -0.08 1.01 0.24 0.87 -1.08 0.00 0.00 179.45 180.41 1p7m h LYS 30 N 0.84 0.71 -0.69 3.15 1.79 -1.56 -2.67 116.57 118.14 1p7m h LYS 30 Ca 0.13 -0.10 -0.03 0.00 -2.18 0.00 0.00 60.65 58.47 1p7m h LYS 30 Cb 0.67 -0.13 -0.03 0.00 -1.58 0.00 0.00 32.23 31.16 1p7m h LYS 30 CO 0.05 0.59 0.32 -0.07 -1.08 0.00 0.00 179.45 179.25 1p7m h LEU 31 N 0.65 0.90 0.28 2.94 3.38 -1.46 0.24 115.31 122.24 1p7m h LEU 31 Ca 0.17 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1p7m h LEU 31 Cb 0.11 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1p7m h LEU 31 CO -0.02 0.77 -0.14 0.15 0.09 0.00 0.00 178.44 179.29 1p7m h PHE 32 N 0.98 -0.35 -0.41 1.13 3.57 -1.29 0.36 116.94 120.93 1p7m h PHE 32 Ca 0.24 -0.01 -0.14 0.00 3.53 0.00 0.00 57.97 61.59 1p7m h PHE 32 Cb 0.12 0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 1p7m h PHE 32 CO 0.01 -0.15 -0.28 0.93 -2.23 0.00 0.00 178.31 176.59 1p7m h GLU 33 N -0.48 0.91 -0.06 1.11 5.08 -1.37 -2.65 114.58 117.13 1p7m h GLU 33 Ca -0.04 -0.43 -0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1p7m h GLU 33 Cb 0.36 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 1p7m h GLU 33 CO 0.06 1.09 0.02 1.98 -1.00 0.00 0.00 179.01 181.17 1p7m h MET 34 N 0.73 0.08 0.00 2.33 4.05 -0.39 -1.58 114.93 120.14 1p7m h MET 34 Ca 0.08 -0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.47 1p7m h MET 34 Cb 0.86 -0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 31.65 1p7m h MET 34 CO 0.08 0.20 -0.08 0.97 0.23 0.00 0.00 176.91 178.31 1p7m h ILE 35 N -0.05 0.77 0.19 1.77 6.09 -0.29 0.76 117.51 126.75 1p7m h ILE 35 Ca 0.02 -0.30 -0.01 0.00 -1.37 0.00 0.00 64.86 63.20 1p7m h ILE 35 Cb 0.15 1.18 0.00 0.00 0.47 0.00 0.00 36.82 38.61 1p7m h ILE 35 CO -0.00 0.08 -0.09 0.00 -3.07 0.00 0.00 178.15 175.07 1p7m h LEU 37 N -0.82 0.98 -1.80 0.00 -0.00 -1.05 -2.80 115.31 109.82 1p7m h LEU 37 Ca -0.03 -0.52 0.01 0.00 -0.00 0.00 0.00 57.88 57.35 1p7m h LEU 37 Cb 0.52 -0.28 -0.01 0.00 -0.00 0.00 0.00 40.66 40.89 1p7m h LEU 37 CO 0.04 1.32 0.16 -0.08 -0.00 0.00 0.00 178.44 179.88 1p7m h GLU 38 N 0.69 0.26 -0.19 1.13 4.57 0.47 -0.61 114.58 120.90 1p7m h GLU 38 Ca 0.02 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 1p7m h GLU 38 Cb 1.13 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.65 1p7m h GLU 38 CO 0.12 0.17 0.02 0.78 -1.18 0.00 0.00 179.01 178.92 1p7m h GLY 39 N 0.27 0.29 1.94 1.92 0.00 -0.88 -1.90 103.07 104.70 1p7m h GLY 39 Ca 0.09 -0.14 -0.10 0.00 0.00 0.00 0.00 47.33 47.19 1p7m h GLY 39 CO -0.02 0.13 -0.45 -1.61 0.00 0.00 0.00 176.54 174.59 1p7m h GLN 40 N 0.27 0.07 0.00 4.80 5.75 -1.14 -2.93 115.11 121.92 1p7m h GLN 40 Ca 0.07 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1p7m h GLN 40 Cb 0.15 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.70 1p7m h GLN 40 CO 0.00 0.51 0.08 1.04 -2.65 0.00 0.00 178.83 177.81 1p7m n GLN 41 N -4.00 0.00 -1.78 1.69 1.13 -0.71 -3.98 117.38 109.73 1p7m n GLN 41 Ca -0.02 0.10 -0.43 0.00 -1.94 0.00 0.00 57.00 54.72 1p7m n GLN 41 Cb 0.49 -1.58 -0.03 0.00 0.11 0.00 0.00 30.24 29.23 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 -1.92 2.98 0.00 -1.58 0.00 -1.11 -2.23 121.76 117.91 1p7m s ALA 42 Ca 0.00 0.71 0.00 0.00 0.00 0.00 0.00 51.96 52.67 1p7m s ALA 42 Cb 0.00 -3.99 0.00 0.00 0.00 0.00 0.00 23.12 19.13 1p7m s ALA 42 CO 0.00 -2.43 0.00 0.41 0.00 0.00 0.00 175.76 173.74 1p7m n GLY 43 N 5.32 1.06 3.92 0.00 0.00 -1.26 -4.92 105.19 109.30 1p7m n GLY 43 Ca 0.25 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.05 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 4.15 0.28 0.99 1.43 -0.94 -5.09 118.68 119.49 1p7m s LEU 44 Ca 0.00 -0.03 -0.18 0.00 -1.03 0.00 0.00 54.13 52.89 1p7m s LEU 44 Cb 0.00 -2.69 -0.09 0.00 0.03 0.00 0.00 46.19 43.44 1p7m s LEU 44 CO 0.00 -0.05 0.75 -0.94 0.23 0.00 0.00 176.35 176.34 1p7m s SER 45 N -3.86 6.94 0.23 2.29 1.04 -1.26 -4.61 113.70 114.46 1p7m s SER 45 Ca 0.34 1.38 -0.08 0.00 0.48 0.00 0.00 55.95 58.07 1p7m s SER 45 Cb -0.09 -2.41 0.20 0.00 0.10 0.00 0.00 66.02 63.82 1p7m s SER 45 CO 0.28 -0.09 1.87 -0.25 0.98 0.00 0.00 173.24 176.02 1p7m h TRP 46 N 2.83 1.16 -0.65 5.02 2.91 -1.96 -1.15 115.95 124.11 1p7m h TRP 46 Ca -0.48 -0.01 -0.08 0.00 1.13 0.00 0.00 58.89 59.46 1p7m h TRP 46 Cb 1.18 -0.38 -0.03 0.00 -0.51 0.00 0.00 29.16 29.43 1p7m h TRP 46 CO 0.63 0.78 0.10 0.97 -1.03 0.00 0.00 178.44 179.88 1p7m h ILE 47 N 1.21 1.26 -0.86 2.65 -0.00 -1.99 0.17 117.51 119.95 1p7m h ILE 47 Ca 0.31 -1.03 -0.02 0.00 -0.00 0.00 0.00 64.86 64.13 1p7m h ILE 47 Cb -0.04 0.66 -0.04 0.00 -0.00 0.00 0.00 36.82 37.40 1p7m h ILE 47 CO -0.06 0.39 0.48 0.74 -0.00 0.00 0.00 178.15 179.69 1p7m h THR 48 N 1.00 1.25 -0.34 2.19 2.02 -1.81 -1.18 112.91 116.05 1p7m h THR 48 Ca 0.20 -0.62 -0.09 0.00 0.77 0.00 0.00 66.41 66.67 1p7m h THR 48 Cb 0.44 0.09 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 1p7m h THR 48 CO 0.01 0.28 -0.15 0.58 0.37 0.00 0.00 175.52 176.61 1p7m h VAL 49 N 1.20 1.25 0.17 3.16 2.07 -0.48 -2.66 116.25 120.96 1p7m h VAL 49 Ca 0.30 -1.14 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 1p7m h VAL 49 Cb 0.02 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1p7m h VAL 49 CO -0.05 0.38 -0.13 0.25 0.02 0.00 0.00 177.57 178.04 1p7m h LEU 50 N 0.55 -0.33 -0.83 2.57 6.46 0.54 0.69 115.31 124.96 1p7m h LEU 50 Ca 0.09 0.03 0.04 0.00 -0.12 0.00 0.00 57.88 57.92 1p7m h LEU 50 Cb 0.58 0.11 -0.05 0.00 -0.73 0.00 0.00 40.66 40.56 1p7m h LEU 50 CO 0.04 -0.20 0.53 0.11 -0.62 0.00 0.00 178.44 178.30 1p7m h LYS 51 N -0.30 1.00 0.00 1.25 1.57 -1.35 0.37 116.57 119.10 1p7m h LYS 51 Ca -0.01 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 1p7m h LYS 51 Cb 0.27 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 1p7m h LYS 51 CO -0.01 0.66 -0.16 0.87 -0.57 0.00 0.00 179.45 180.24 1p7m h LYS 52 N 1.03 0.00 -0.75 3.15 1.79 -1.02 -2.27 116.57 118.49 1p7m h LYS 52 Ca 0.34 0.00 0.08 0.00 -2.18 0.00 0.00 60.65 58.88 1p7m h LYS 52 Cb 0.03 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.61 1p7m h LYS 52 CO -0.12 0.16 0.42 -0.09 -1.08 0.00 0.00 179.45 178.74 1p7m h ARG 53 N 0.00 0.71 -0.48 3.15 2.43 0.47 1.61 114.38 122.28 1p7m h ARG 53 Ca -0.00 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 58.99 1p7m h ARG 53 Cb 0.41 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 1p7m h ARG 53 CO 0.02 0.47 -0.23 0.93 -1.51 0.00 0.00 179.97 179.65 1p7m h GLU 54 N 0.73 1.00 -0.30 0.20 3.07 -1.29 -2.45 114.58 115.54 1p7m h GLU 54 Ca 0.35 -0.44 -0.15 0.00 -0.50 0.00 0.00 59.36 58.62 1p7m h GLU 54 Cb 0.28 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.16 1p7m h GLU 54 CO -0.22 1.11 -0.41 -0.91 -1.40 0.00 0.00 179.01 177.18 1p7m h ASN 55 N 0.86 0.80 -0.12 1.42 2.35 -0.96 -2.83 115.58 117.10 1p7m h ASN 55 Ca 0.11 -0.37 -0.00 0.00 -0.55 0.00 0.00 56.30 55.49 1p7m h ASN 55 Cb 0.82 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.96 1p7m h ASN 55 CO 0.07 1.11 0.07 0.22 -1.65 0.00 0.00 177.43 177.25 1p7m h TYR 56 N 0.61 0.15 0.00 1.19 3.20 0.24 -1.65 116.97 120.72 1p7m h TYR 56 Ca 0.05 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.89 1p7m h TYR 56 Cb 0.97 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 39.18 1p7m h TYR 56 CO 0.05 0.13 -0.13 0.07 -1.64 0.00 0.00 178.16 176.64 1p7m h ARG 57 N 0.13 0.00 -0.45 1.82 -0.00 -1.45 -2.55 114.38 111.88 1p7m h ARG 57 Ca 0.04 0.00 -0.12 0.00 -0.00 0.00 0.00 59.98 59.91 1p7m h ARG 57 Cb 0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 29.98 1p7m h ARG 57 CO -0.01 0.13 -0.17 0.00 -0.00 0.00 0.00 179.97 179.92 1p7m h ALA 58 N 1.87 0.63 -0.11 0.08 0.00 -1.05 1.46 119.26 122.13 1p7m h ALA 58 Ca -0.00 -0.36 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 1p7m h ALA 58 Cb 0.32 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1p7m h ALA 58 CO 0.02 0.57 -0.20 0.00 0.00 0.00 0.00 179.25 179.64 1p7m h PHE 60 N -0.09 0.11 0.00 0.00 -1.00 -1.54 -3.46 116.94 110.96 1p7m h PHE 60 Ca 0.01 -0.08 0.00 0.00 2.81 0.00 0.00 57.97 60.70 1p7m h PHE 60 Cb 0.78 -0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.33 1p7m h PHE 60 CO 0.10 1.32 0.00 1.58 -1.61 0.00 0.00 178.31 179.71 1p7m n HIS 61 N -4.38 0.00 0.08 -0.55 -0.00 0.50 -4.61 115.22 106.26 1p7m n HIS 61 Ca -0.22 0.00 -0.07 0.00 0.46 0.00 0.00 57.72 57.89 1p7m n HIS 61 Cb 0.66 -0.94 -0.06 0.00 -0.12 0.00 0.00 29.99 29.53 1p7m n HIS 61 CO 0.00 0.00 0.00 1.96 0.46 0.00 0.00 176.34 178.76 1p7m h GLN 62 N 0.00 0.05 -1.61 1.57 4.20 -1.89 -3.46 115.11 113.97 1p7m h GLN 62 Ca 0.00 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.60 1p7m h GLN 62 Cb 0.09 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 1p7m h GLN 62 CO 0.00 0.95 -0.04 1.97 -0.67 0.00 0.00 178.83 181.05 1p7m n PHE 63 N -3.47 -0.76 -3.89 2.96 1.16 -1.26 -4.80 117.46 107.39 1p7m n PHE 63 Ca -0.01 0.00 -0.30 0.00 -1.87 0.00 0.00 57.45 55.26 1p7m n PHE 63 Cb 0.88 -1.18 -0.15 0.00 -1.61 0.00 0.00 39.48 37.42 1p7m n PHE 63 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1p7m s ASP 64 N -1.05 4.36 0.49 5.98 1.01 -1.26 -5.00 116.67 121.21 1p7m s ASP 64 Ca 0.00 -1.83 0.27 0.00 0.71 0.00 0.00 52.55 51.70 1p7m s ASP 64 Cb 0.00 -1.26 1.35 0.00 1.01 0.00 0.00 42.92 44.01 1p7m s ASP 64 CO 0.00 -0.38 1.85 -0.65 0.21 0.00 0.00 175.17 176.20 1p7m h PRO 65 N 7.85 0.15 -0.30 8.23 0.11 -1.95 -1.36 132.00 144.74 1p7m h PRO 65 Ca -0.10 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.99 1p7m h PRO 65 Cb 1.02 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1p7m h PRO 65 CO 0.49 0.10 0.11 0.28 -0.21 0.00 0.00 178.00 178.77 1p7m h VAL 66 N 0.15 1.18 -0.14 3.15 2.07 -1.94 -2.30 116.25 118.43 1p7m h VAL 66 Ca 0.49 -0.56 -0.09 0.00 0.82 0.00 0.00 66.70 67.36 1p7m h VAL 66 Cb 1.66 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 32.42 1p7m h VAL 66 CO -0.09 0.19 -0.33 0.11 0.02 0.00 0.00 177.57 177.47 1p7m h LYS 67 N 0.33 0.28 -0.92 1.57 6.56 -1.66 -2.78 116.57 119.94 1p7m h LYS 67 Ca 0.10 -0.11 0.00 0.00 -1.06 0.00 0.00 60.65 59.58 1p7m h LYS 67 Cb 0.19 -0.01 -0.04 0.00 -0.57 0.00 0.00 32.23 31.79 1p7m h LYS 67 CO -0.01 0.58 0.58 0.28 -2.06 0.00 0.00 179.45 178.83 1p7m h VAL 68 N 0.24 1.24 0.00 0.50 2.07 -0.99 0.53 116.25 119.84 1p7m h VAL 68 Ca 0.03 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.06 1p7m h VAL 68 Cb 0.71 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 1p7m h VAL 68 CO 0.05 0.25 0.00 0.00 0.02 0.00 0.00 177.57 177.89 1p7m h ALA 69 N 1.39 1.00 -0.00 1.67 0.00 -1.14 0.33 119.26 122.51 1p7m h ALA 69 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1p7m h ALA 69 Cb -0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1p7m h ALA 69 CO -0.07 0.00 -0.17 0.00 0.00 0.00 0.00 179.25 179.01 1p7m n ALA 70 N -2.02 2.88 -2.59 0.00 0.00 0.18 -4.73 120.51 114.23 1p7m n ALA 70 Ca -0.01 -0.29 -0.43 0.00 0.00 0.00 0.00 53.44 52.71 1p7m n ALA 70 Cb 0.16 -1.28 -0.04 0.00 0.00 0.00 0.00 19.45 18.29 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 -2.57 3.74 0.61 0.00 -1.94 0.12 -5.02 119.30 114.24 1p7m s MET 71 Ca 0.25 0.40 0.04 0.00 -1.71 0.00 0.00 55.69 54.68 1p7m s MET 71 Cb 0.20 -3.84 0.09 0.00 2.01 0.00 0.00 34.83 33.28 1p7m s MET 71 CO 0.51 -1.00 0.84 -1.14 -0.01 0.00 0.00 175.02 174.23 1p7m s GLN 72 N 3.45 2.15 0.51 2.03 2.00 -1.26 -4.88 119.66 123.66 1p7m s GLN 72 Ca 0.36 -1.27 0.26 0.00 -2.00 0.00 0.00 55.36 52.71 1p7m s GLN 72 Cb -0.12 -2.52 1.36 0.00 0.80 0.00 0.00 33.01 32.54 1p7m s GLN 72 CO 0.20 -1.00 1.93 0.93 -0.50 0.00 0.00 175.29 176.85 1p7m h GLU 73 N -0.06 0.09 -0.09 1.67 5.08 -1.98 0.69 114.58 119.98 1p7m h GLU 73 Ca -0.35 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.02 1p7m h GLU 73 Cb 1.28 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 1p7m h GLU 73 CO 0.43 0.06 0.01 0.93 -1.00 0.00 0.00 179.01 179.43 1p7m h GLU 74 N 0.09 0.04 -0.73 2.33 5.08 -2.00 0.59 114.58 119.99 1p7m h GLU 74 Ca 0.36 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.69 1p7m h GLU 74 Cb 1.30 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.50 1p7m h GLU 74 CO -0.04 0.03 0.34 -0.44 -1.00 0.00 0.00 179.01 177.91 1p7m h ASP 75 N 0.04 0.95 -0.67 1.42 3.32 -1.25 -2.44 116.42 117.79 1p7m h ASP 75 Ca 0.04 -0.11 0.01 0.00 0.02 0.00 0.00 57.03 56.99 1p7m h ASP 75 Cb 0.04 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.32 1p7m h ASP 75 CO -0.06 0.80 0.44 0.58 -1.72 0.00 0.00 179.24 179.28 1p7m h VAL 76 N 1.04 1.16 -0.37 -1.35 2.07 -0.31 -1.61 116.25 116.88 1p7m h VAL 76 Ca 0.25 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1p7m h VAL 76 Cb 0.11 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.05 1p7m h VAL 76 CO -0.03 0.16 0.24 1.05 0.02 0.00 0.00 177.57 179.01 1p7m h GLU 77 N 0.90 0.49 -0.28 1.57 -0.00 -0.44 -1.65 114.58 115.18 1p7m h GLU 77 Ca 0.25 -0.03 -0.02 0.00 -0.00 0.00 0.00 59.36 59.55 1p7m h GLU 77 Cb -0.09 -0.11 -0.01 0.00 -0.00 0.00 0.00 28.75 28.54 1p7m h GLU 77 CO -0.06 0.33 0.08 -0.09 -0.00 0.00 0.00 179.01 179.27 1p7m h ARG 78 N 0.50 0.44 -0.19 1.06 2.43 -1.11 -2.97 114.38 114.54 1p7m h ARG 78 Ca 0.13 -0.10 -0.09 0.00 -0.81 0.00 0.00 59.98 59.12 1p7m h ARG 78 Cb -0.05 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 1p7m h ARG 78 CO -0.03 0.51 -0.28 -0.07 -1.51 0.00 0.00 179.97 178.59 1p7m h LEU 79 N 0.28 0.36 -1.65 3.80 3.38 -1.06 -1.60 115.31 118.82 1p7m h LEU 79 Ca 0.09 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1p7m h LEU 79 Cb 0.26 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1p7m h LEU 79 CO -0.00 0.64 0.32 0.58 0.09 0.00 0.00 178.44 180.06 1p7m h VAL 80 N 0.31 0.00 0.00 1.22 2.07 -1.15 0.29 116.25 118.99 1p7m h VAL 80 Ca 0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.56 1p7m h VAL 80 Cb 0.66 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1p7m h VAL 80 CO 0.05 0.00 -1.26 0.00 0.02 0.00 0.00 177.57 176.38 1p7m n GLN 81 N -2.63 1.04 -2.43 1.57 6.02 -0.67 -4.38 117.38 115.89 1p7m n GLN 81 Ca -0.02 -0.08 -0.43 0.00 -0.01 0.00 0.00 57.00 56.47 1p7m n GLN 81 Cb 0.36 -1.19 -0.02 0.00 1.02 0.00 0.00 30.24 30.40 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 -2.94 6.36 0.00 1.08 1.01 0.10 -3.51 116.67 118.78 1p7m s ASP 82 Ca -0.02 0.57 0.00 0.00 0.71 0.00 0.00 52.55 53.81 1p7m s ASP 82 Cb 0.07 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.45 1p7m s ASP 82 CO 0.43 -1.46 0.00 0.00 0.21 0.00 0.00 175.17 174.35 1p7m n ALA 83 N 8.75 0.00 -2.68 5.23 0.00 -1.26 -3.41 120.51 127.14 1p7m n ALA 83 Ca 0.14 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.44 1p7m n ALA 83 Cb 0.49 -0.03 0.02 0.00 0.00 0.00 0.00 19.45 19.93 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 -1.61 -0.08 3.09 0.00 0.00 -1.23 -4.93 105.19 100.43 1p7m n GLY 84 Ca 0.00 -0.23 -0.35 0.00 0.00 0.00 0.00 46.02 45.44 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 -4.03 0.00 0.23 -0.61 -5.35 -1.22 -4.79 119.36 103.59 1p7m n ILE 85 Ca -0.08 -0.40 0.06 0.00 -0.27 0.00 0.00 62.75 62.06 1p7m n ILE 85 Cb 0.58 -0.14 0.53 0.00 -1.74 0.00 0.00 39.64 38.87 1p7m n ILE 85 CO 0.00 0.00 0.00 -0.29 -1.76 0.00 0.00 176.55 174.50 1p7m h ILE 86 N -1.14 1.05 -4.01 7.28 2.10 -1.97 -3.43 117.51 117.40 1p7m h ILE 86 Ca -0.44 -0.63 -0.53 0.00 1.08 0.00 0.00 64.86 64.34 1p7m h ILE 86 Cb 1.30 1.34 0.11 0.00 -1.09 0.00 0.00 36.82 38.48 1p7m h ILE 86 CO 0.26 0.17 0.59 -0.13 -1.08 0.00 0.00 178.15 177.96 1p7m s ARG 87 N -4.57 3.49 0.28 2.19 0.52 -1.26 -5.03 118.95 114.57 1p7m s ARG 87 Ca -0.04 2.13 0.09 0.00 -0.52 0.00 0.00 55.73 57.39 1p7m s ARG 87 Cb 0.15 -2.42 -0.05 0.00 0.52 0.00 0.00 34.95 33.15 1p7m s ARG 87 CO 0.68 -0.87 -0.13 -1.01 0.02 0.00 0.00 175.30 173.98 1p7m s HIS 88 N -1.35 2.11 0.35 -0.53 3.76 -1.26 -4.87 115.29 113.51 1p7m s HIS 88 Ca 0.66 -0.50 0.17 0.00 -0.15 0.00 0.00 55.06 55.24 1p7m s HIS 88 Cb -0.37 -1.05 1.20 0.00 1.11 0.00 0.00 32.58 33.46 1p7m s HIS 88 CO 0.46 0.51 1.60 0.07 -0.85 0.00 0.00 174.74 176.53 1p7m h ARG 89 N 2.29 0.09 0.34 1.40 0.11 -1.96 0.86 114.38 117.51 1p7m h ARG 89 Ca -0.40 -0.01 -0.02 0.00 0.10 0.00 0.00 59.98 59.66 1p7m h ARG 89 Cb 1.24 -0.02 0.00 0.00 1.11 0.00 0.00 29.97 32.30 1p7m h ARG 89 CO 0.64 0.06 -0.17 0.78 0.10 0.00 0.00 179.97 181.38 1p7m h GLY 90 N 0.10 -0.54 1.22 0.08 0.00 -2.00 -0.34 103.07 101.59 1p7m h GLY 90 Ca 0.78 0.20 -0.02 0.00 0.00 0.00 0.00 47.33 48.30 1p7m h GLY 90 CO -0.74 -0.19 0.36 0.50 0.00 0.00 0.00 176.54 176.47 1p7m h LYS 91 N -0.47 1.02 0.32 4.80 1.57 -1.56 -2.89 116.57 119.37 1p7m h LYS 91 Ca -0.05 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1p7m h LYS 91 Cb 0.36 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1p7m h LYS 91 CO 0.07 0.77 -0.22 0.82 -0.57 0.00 0.00 179.45 180.33 1p7m h ILE 92 N 1.02 0.55 -0.86 1.86 2.04 0.74 -1.20 117.51 121.66 1p7m h ILE 92 Ca 0.25 0.00 0.22 0.00 1.00 0.00 0.00 64.86 66.33 1p7m h ILE 92 Cb 0.07 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 36.65 1p7m h ILE 92 CO -0.04 0.00 0.59 1.56 0.00 0.00 0.00 178.15 180.26 1p7m h GLN 93 N -0.53 0.19 -0.83 2.37 4.20 -0.90 0.20 115.11 119.82 1p7m h GLN 93 Ca -0.03 -0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.63 1p7m h GLN 93 Cb 0.44 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.14 1p7m h GLN 93 CO 0.02 0.13 0.37 0.00 -0.67 0.00 0.00 178.83 178.67 1p7m h ALA 94 N 1.60 1.08 -0.30 3.87 0.00 -1.02 -2.66 119.26 121.83 1p7m h ALA 94 Ca 0.43 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 55.04 1p7m h ALA 94 Cb 1.36 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1p7m h ALA 94 CO -0.09 0.67 -0.30 0.82 0.00 0.00 0.00 179.25 180.35 1p7m h ILE 95 N 1.19 1.28 -0.37 0.00 2.04 -0.27 -2.38 117.51 119.00 1p7m h ILE 95 Ca 0.28 -1.42 0.02 0.00 1.00 0.00 0.00 64.86 64.75 1p7m h ILE 95 Cb 0.17 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 1p7m h ILE 95 CO -0.03 0.46 0.19 0.40 0.00 0.00 0.00 178.15 179.17 1p7m h ILE 96 N 0.54 0.99 -0.48 -0.67 5.03 -1.12 -0.90 117.51 120.91 1p7m h ILE 96 Ca 0.07 -0.14 -0.04 0.00 -0.12 0.00 0.00 64.86 64.63 1p7m h ILE 96 Cb 0.79 0.56 -0.02 0.00 -3.03 0.00 0.00 36.82 35.12 1p7m h ILE 96 CO 0.07 0.07 0.15 1.23 -0.68 0.00 0.00 178.15 178.98 1p7m h GLY 97 N 0.39 0.76 1.15 5.37 0.00 -1.40 -2.01 103.07 107.33 1p7m h GLY 97 Ca 0.16 -0.40 0.04 0.00 0.00 0.00 0.00 47.33 47.12 1p7m h GLY 97 CO -0.10 0.38 0.49 3.43 0.00 0.00 0.00 176.54 180.74 1p7m h ASN 98 N 0.69 0.78 -0.50 0.19 2.35 -0.65 -1.40 115.58 117.03 1p7m h ASN 98 Ca 0.16 -0.01 -0.07 0.00 -0.55 0.00 0.00 56.30 55.83 1p7m h ASN 98 Cb 0.21 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 1p7m h ASN 98 CO -0.01 0.53 0.03 0.00 -1.65 0.00 0.00 177.43 176.33 1p7m h ALA 99 N 1.57 0.67 -0.69 -0.83 0.00 -0.66 -1.92 119.26 117.40 1p7m h ALA 99 Ca 0.30 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.97 1p7m h ALA 99 Cb 0.06 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 1p7m h ALA 99 CO -0.09 0.46 0.45 0.00 0.00 0.00 0.00 179.25 180.07 1p7m h ARG 100 N 0.73 0.82 -0.25 0.00 3.08 -1.14 0.10 114.38 117.73 1p7m h ARG 100 Ca 0.15 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.09 1p7m h ARG 100 Cb 0.48 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 1p7m h ARG 100 CO 0.02 0.54 -0.10 0.00 -1.07 0.00 0.00 179.97 179.36 1p7m h ALA 101 N 1.59 1.36 -0.61 0.04 0.00 -0.65 0.67 119.26 121.66 1p7m h ALA 101 Ca 0.27 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1p7m h ALA 101 Cb 0.04 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1p7m h ALA 101 CO -0.07 0.44 0.26 -0.92 0.00 0.00 0.00 179.25 178.95 1p7m h TYR 102 N 0.38 0.92 -0.28 0.00 3.20 -0.09 -0.56 116.97 120.55 1p7m h TYR 102 Ca 0.08 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 61.83 1p7m h TYR 102 Cb 0.42 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 1p7m h TYR 102 CO 0.01 0.72 -0.06 -0.07 -1.64 0.00 0.00 178.16 177.12 1p7m h LEU 103 N 0.85 0.41 -1.11 2.82 3.38 -0.43 -2.43 115.31 118.80 1p7m h LEU 103 Ca 0.21 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 1p7m h LEU 103 Cb 0.18 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1p7m h LEU 103 CO -0.02 0.53 0.13 1.56 0.09 0.00 0.00 178.44 180.73 1p7m h GLN 104 N 0.42 0.76 -0.32 1.13 4.20 0.67 -1.29 115.11 120.68 1p7m h GLN 104 Ca 0.09 -0.14 -0.10 0.00 0.06 0.00 0.00 58.65 58.55 1p7m h GLN 104 Cb 0.38 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1p7m h GLN 104 CO 0.02 0.68 -0.19 0.52 -0.67 0.00 0.00 178.83 179.19 1p7m h MET 105 N 0.74 0.70 -0.40 1.46 2.86 -0.88 -2.26 114.93 117.15 1p7m h MET 105 Ca 0.17 -0.32 -0.11 0.00 -2.06 0.00 0.00 59.70 57.38 1p7m h MET 105 Cb 0.26 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.90 1p7m h MET 105 CO -0.00 0.93 -0.19 0.93 1.06 0.00 0.00 176.91 179.64 1p7m h GLU 106 N 0.47 0.76 0.00 1.72 5.08 -1.32 0.39 114.58 121.67 1p7m h GLU 106 Ca 0.07 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.12 1p7m h GLU 106 Cb 0.74 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.94 1p7m h GLU 106 CO 0.05 0.90 -0.07 1.96 -1.00 0.00 0.00 179.01 180.85 1p7m h GLN 107 N 0.68 0.00 0.00 2.33 1.08 -1.13 0.18 115.11 118.24 1p7m h GLN 107 Ca 0.10 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.30 1p7m h GLN 107 Cb 0.69 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.12 1p7m h GLN 107 CO 0.05 0.07 -0.76 -1.71 -0.95 0.00 0.00 178.83 175.53 1p7m n ASN 108 N -3.59 0.71 -1.19 1.46 2.85 -0.24 -4.95 115.26 110.32 1p7m n ASN 108 Ca -0.02 -0.55 -0.12 0.00 -0.11 0.00 0.00 54.58 53.78 1p7m n ASN 108 Cb 0.19 0.61 -0.02 0.00 1.24 0.00 0.00 39.78 41.80 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 1.49 0.30 3.05 8.20 0.00 0.12 -4.98 105.19 113.36 1p7m n GLY 109 Ca 0.05 -0.43 -0.32 0.00 0.00 0.00 0.00 46.02 45.31 1p7m n GLY 109 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1p7m s GLU 110 N -4.10 1.63 0.62 1.61 2.56 -0.41 -5.00 118.70 115.61 1p7m s GLU 110 Ca 0.00 -1.84 -0.19 0.00 0.00 0.00 0.00 54.97 52.94 1p7m s GLU 110 Cb 0.00 -3.28 -0.03 0.00 2.00 0.00 0.00 34.13 32.82 1p7m s GLU 110 CO 0.00 -0.95 1.21 -2.30 -0.56 0.00 0.00 175.26 172.65 1p7m n PRO 111 N 4.34 1.12 0.05 4.30 -0.02 -1.26 -4.61 135.00 138.92 1p7m n PRO 111 Ca 0.02 0.43 0.04 0.00 -2.02 0.00 0.00 63.50 61.97 1p7m n PRO 111 Cb 0.42 -2.43 0.44 0.00 -0.02 0.00 0.00 33.50 31.91 1p7m n PRO 111 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 1p7m h PHE 112 N 0.63 0.42 -0.15 6.00 -1.00 -1.94 -2.60 116.94 118.31 1p7m h PHE 112 Ca -0.50 0.00 -0.15 0.00 2.81 0.00 0.00 57.97 60.13 1p7m h PHE 112 Cb 1.34 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 40.76 1p7m h PHE 112 CO 0.40 0.30 -0.55 0.00 -1.61 0.00 0.00 178.31 176.85 1p7m h ALA 113 N 1.75 0.78 -0.04 2.45 0.00 -1.84 -2.70 119.26 119.66 1p7m h ALA 113 Ca 0.12 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1p7m h ALA 113 Cb 0.02 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1p7m h ALA 113 CO -0.02 0.69 0.03 -0.44 0.00 0.00 0.00 179.25 179.51 1p7m h ASP 114 N 0.34 0.05 0.11 0.00 3.32 -1.82 0.16 116.42 118.57 1p7m h ASP 114 Ca 0.01 -0.02 -0.15 0.00 0.02 0.00 0.00 57.03 56.88 1p7m h ASP 114 Cb 1.07 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 1p7m h ASP 114 CO 0.10 0.06 -0.55 2.19 -1.72 0.00 0.00 179.24 179.31 1p7m h PHE 115 N 0.04 0.59 0.37 4.55 -0.00 -1.62 -2.45 116.94 118.41 1p7m h PHE 115 Ca 0.02 -0.21 -0.02 0.00 -0.00 0.00 0.00 57.97 57.76 1p7m h PHE 115 Cb 0.02 -0.11 0.00 0.00 -0.00 0.00 0.00 35.95 35.86 1p7m h PHE 115 CO -0.07 0.92 -0.18 0.28 -0.00 0.00 0.00 178.31 179.26 1p7m h VAL 116 N 0.36 0.64 -0.03 0.88 2.07 -1.23 -1.78 116.25 117.17 1p7m h VAL 116 Ca 0.01 -0.37 0.01 0.00 0.82 0.00 0.00 66.70 67.17 1p7m h VAL 116 Cb 1.08 0.82 -0.00 0.00 -1.52 0.00 0.00 31.29 31.67 1p7m h VAL 116 CO 0.10 0.07 0.13 -0.50 0.02 0.00 0.00 177.57 177.39 1p7m h TRP 117 N -0.70 0.00 -0.16 1.57 4.06 -0.71 -0.02 115.95 119.98 1p7m h TRP 117 Ca -0.05 0.00 -0.18 0.00 2.06 0.00 0.00 58.89 60.72 1p7m h TRP 117 Cb 0.49 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.65 1p7m h TRP 117 CO -0.00 0.00 -0.64 0.66 -3.56 0.00 0.00 178.44 174.90 1p7m h SER 118 N 0.00 0.68 0.16 -3.49 4.64 -0.83 1.75 113.55 116.46 1p7m h SER 118 Ca 0.01 -0.40 -0.12 0.00 -0.47 0.00 0.00 61.79 60.81 1p7m h SER 118 Cb 0.28 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1p7m h SER 118 CO -0.00 1.15 -0.45 -0.26 -0.87 0.00 0.00 176.83 176.40 1p7m h PHE 119 N 0.43 0.43 -0.23 4.77 0.04 -0.68 -2.57 116.94 119.13 1p7m h PHE 119 Ca -0.01 -0.13 0.00 0.00 2.80 0.00 0.00 57.97 60.63 1p7m h PHE 119 Cb 1.21 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 39.28 1p7m h PHE 119 CO 0.06 0.75 0.00 1.33 -0.60 0.00 0.00 178.31 179.84 1p7m n VAL 120 N -4.00 0.96 -3.11 -0.55 0.24 -1.14 -4.81 118.33 105.92 1p7m n VAL 120 Ca -0.02 -0.51 -0.17 0.00 -2.04 0.00 0.00 64.34 61.59 1p7m n VAL 120 Cb 0.52 -0.32 0.05 0.00 -1.47 0.00 0.00 33.84 32.62 1p7m n VAL 120 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1p7m n ASN 121 N 0.26 -5.17 -3.82 -1.34 2.85 -0.97 -2.80 115.26 104.26 1p7m n ASN 121 Ca 0.11 -0.32 -0.29 0.00 -0.11 0.00 0.00 54.58 53.97 1p7m n ASN 121 Cb 0.56 -3.88 -0.04 0.00 1.24 0.00 0.00 39.78 37.65 1p7m n ASN 121 CO 0.00 0.00 0.00 1.57 -2.11 0.00 0.00 177.26 176.72 1p7m n HIS 122 N -4.31 -1.53 -3.71 1.20 -0.00 0.59 -4.89 115.22 102.58 1p7m n HIS 122 Ca -0.03 0.50 -0.14 0.00 -0.00 0.00 0.00 57.72 58.04 1p7m n HIS 122 Cb 0.57 -1.95 -0.08 0.00 -0.00 0.00 0.00 29.99 28.52 1p7m n HIS 122 CO 0.00 0.00 0.00 1.14 -0.00 0.00 0.00 176.34 177.48 1p7m s GLN 123 N -6.46 0.72 0.38 1.57 1.03 -1.12 -5.06 119.66 110.71 1p7m s GLN 123 Ca 0.55 0.02 -0.26 0.00 0.04 0.00 0.00 55.36 55.72 1p7m s GLN 123 Cb -0.32 0.33 -0.09 0.00 0.03 0.00 0.00 33.01 32.96 1p7m s GLN 123 CO 0.68 -0.19 1.18 -1.25 -2.54 0.00 0.00 175.29 173.16 1p7m s PRO 124 N -1.05 4.13 0.02 9.60 0.04 -1.26 -4.87 135.00 141.61 1p7m s PRO 124 Ca -0.11 1.87 0.02 0.00 0.04 0.00 0.00 61.00 62.82 1p7m s PRO 124 Cb -0.04 -2.75 -0.04 0.00 0.04 0.00 0.00 34.50 31.71 1p7m s PRO 124 CO 0.05 -0.26 0.00 -1.14 0.04 0.00 0.00 177.00 175.68 1p7m s GLN 125 N -2.19 2.74 -0.26 4.56 -0.44 -1.09 -4.95 119.66 118.03 1p7m s GLN 125 Ca 0.55 -0.66 -0.13 0.00 -2.50 0.00 0.00 55.36 52.62 1p7m s GLN 125 Cb -0.32 -2.64 -0.04 0.00 -1.64 0.00 0.00 33.01 28.37 1p7m s GLN 125 CO 0.40 0.61 0.27 0.00 0.50 0.00 0.00 175.29 177.07 1p7m s MET 126 N -1.73 4.02 -0.26 1.67 0.23 -1.26 -0.48 119.30 121.49 1p7m s MET 126 Ca 0.21 -0.13 -0.20 0.00 -1.03 0.00 0.00 55.69 54.54 1p7m s MET 126 Cb -0.12 -3.63 -0.02 0.00 -1.53 0.00 0.00 34.83 29.54 1p7m s MET 126 CO 0.12 -0.16 0.62 0.99 -2.03 0.00 0.00 175.02 174.56 1p7m s THR 127 N 1.71 4.99 -0.77 3.16 2.01 -0.22 -4.92 115.64 121.60 1p7m s THR 127 Ca 0.11 1.09 0.09 0.00 0.31 0.00 0.00 61.69 63.29 1p7m s THR 127 Cb -0.15 -3.92 0.46 0.00 0.01 0.00 0.00 72.50 68.90 1p7m s THR 127 CO 0.09 0.03 1.24 0.00 -0.69 0.00 0.00 174.62 175.29 1p7m n GLN 128 N 5.70 3.09 -1.84 4.92 6.02 -1.26 -4.73 117.38 129.28 1p7m n GLN 128 Ca -0.01 -1.79 -0.40 0.00 -0.01 0.00 0.00 57.00 54.79 1p7m n GLN 128 Cb 0.49 -1.86 0.02 0.00 1.02 0.00 0.00 30.24 29.90 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 -1.94 3.21 -0.11 -1.58 0.00 -1.26 -4.74 121.76 115.34 1p7m s ALA 129 Ca 0.31 1.42 0.14 0.00 0.00 0.00 0.00 51.96 53.83 1p7m s ALA 129 Cb 0.23 -3.57 -0.21 0.00 0.00 0.00 0.00 23.12 19.57 1p7m s ALA 129 CO 0.11 -1.14 0.15 0.25 0.00 0.00 0.00 175.76 175.12 1p7m n THR 130 N -0.20 0.72 -4.33 0.00 -2.24 -1.26 0.19 114.28 107.16 1p7m n THR 130 Ca 0.05 -0.56 -0.17 0.00 -2.27 0.00 0.00 64.05 61.10 1p7m n THR 130 Cb 0.42 -0.37 -0.10 0.00 -2.10 0.00 0.00 70.33 68.18 1p7m n THR 130 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1p7m s THR 131 N -2.61 1.20 0.34 4.28 -4.23 -1.26 -4.28 115.64 109.09 1p7m s THR 131 Ca -0.07 -2.06 0.05 0.00 -1.18 0.00 0.00 61.69 58.42 1p7m s THR 131 Cb 0.06 -2.23 0.29 0.00 1.34 0.00 0.00 72.50 71.97 1p7m s THR 131 CO 0.64 -0.43 1.93 -0.07 -0.54 0.00 0.00 174.62 176.15 1p7m h LEU 132 N 2.52 0.73 -0.34 4.79 3.38 -1.95 0.36 115.31 124.80 1p7m h LEU 132 Ca -0.38 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1p7m h LEU 132 Cb 1.22 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1p7m h LEU 132 CO 0.65 0.45 0.00 -1.20 0.09 0.00 0.00 178.44 178.43 1p7m n SER 133 N -4.49 0.50 -1.05 -0.43 7.64 -1.26 -2.97 113.62 111.56 1p7m n SER 133 Ca 0.13 -1.54 0.12 0.00 1.01 0.00 0.00 58.87 58.58 1p7m n SER 133 Cb 0.26 -0.03 0.24 0.00 -1.01 0.00 0.00 64.21 63.67 1p7m n SER 133 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1p7m n GLU 134 N -0.44 2.38 -3.68 1.43 4.07 0.13 -4.86 120.64 119.67 1p7m n GLU 134 Ca 0.14 -2.08 -0.36 0.00 -0.06 0.00 0.00 57.16 54.80 1p7m n GLU 134 Cb 0.14 -1.49 -0.09 0.00 -0.06 0.00 0.00 31.44 29.94 1p7m n GLU 134 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 1p7m s ILE 135 N -1.55 5.37 0.30 6.31 1.01 -1.16 -4.59 121.20 126.90 1p7m s ILE 135 Ca 0.38 0.20 -0.29 0.00 0.00 0.00 0.00 60.65 60.94 1p7m s ILE 135 Cb 0.22 -3.50 -0.10 0.00 0.01 0.00 0.00 42.46 39.09 1p7m s ILE 135 CO 0.31 0.38 1.19 -2.16 0.00 0.00 0.00 174.94 174.66 1p7m s PRO 136 N 0.79 4.51 0.00 2.79 0.04 -1.26 -4.93 135.00 136.94 1p7m s PRO 136 Ca 0.08 1.98 0.20 0.00 0.04 0.00 0.00 61.00 63.30 1p7m s PRO 136 Cb -0.13 -3.14 0.07 0.00 0.04 0.00 0.00 34.50 31.34 1p7m s PRO 136 CO 0.02 0.03 1.04 -2.37 0.04 0.00 0.00 177.00 175.76 1p7m n THR 137 N 1.09 0.00 -3.64 1.26 5.66 -1.26 -4.75 114.28 112.64 1p7m n THR 137 Ca -0.00 -0.40 -0.29 0.00 -3.05 0.00 0.00 64.05 60.31 1p7m n THR 137 Cb 0.43 1.32 -0.14 0.00 -1.55 0.00 0.00 70.33 70.39 1p7m n THR 137 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1p7m s SER 138 N -1.93 3.66 0.27 1.09 0.15 -1.26 -4.38 113.70 111.29 1p7m s SER 138 Ca 0.19 -1.84 0.10 0.00 0.70 0.00 0.00 55.95 55.11 1p7m s SER 138 Cb 0.16 -0.69 -0.04 0.00 -1.71 0.00 0.00 66.02 63.73 1p7m s SER 138 CO 0.37 -0.38 -0.05 0.42 1.20 0.00 0.00 173.24 174.81 1p7m s THR 139 N 1.40 3.23 0.28 6.45 -4.23 -1.26 -4.95 115.64 116.55 1p7m s THR 139 Ca 0.13 -2.01 0.01 0.00 -1.18 0.00 0.00 61.69 58.63 1p7m s THR 139 Cb -0.19 -2.72 0.27 0.00 1.34 0.00 0.00 72.50 71.20 1p7m s THR 139 CO -0.18 -0.37 1.81 -0.65 -0.54 0.00 0.00 174.62 174.69 1p7m h PRO 140 N 2.01 0.86 -0.18 3.99 0.11 -2.00 0.40 132.00 137.19 1p7m h PRO 140 Ca -0.43 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 65.54 1p7m h PRO 140 Cb 1.25 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 1p7m h PRO 140 CO 0.60 0.57 -0.22 0.00 -0.21 0.00 0.00 178.00 178.74 1p7m h ALA 141 N 1.54 0.27 -0.74 -0.75 0.00 -1.95 -1.19 119.26 116.45 1p7m h ALA 141 Ca 0.49 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1p7m h ALA 141 Cb 0.54 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1p7m h ALA 141 CO -0.29 0.22 0.48 0.77 0.00 0.00 0.00 179.25 180.43 1p7m h SER 142 N 0.13 0.85 -0.62 0.00 0.02 -1.59 0.91 113.55 113.25 1p7m h SER 142 Ca 0.02 -0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 60.88 1p7m h SER 142 Cb 0.77 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 63.08 1p7m h SER 142 CO 0.05 0.63 0.14 0.44 -1.14 0.00 0.00 176.83 176.95 1p7m h ASP 143 N 1.00 0.96 0.67 3.07 3.32 -0.16 -0.51 116.42 124.76 1p7m h ASP 143 Ca 0.27 -0.24 -0.13 0.00 0.02 0.00 0.00 57.03 56.95 1p7m h ASP 143 Cb -0.10 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.18 1p7m h ASP 143 CO -0.06 0.95 -0.61 0.00 -1.72 0.00 0.00 179.24 177.81 1p7m h ALA 144 N 1.04 0.95 -0.11 3.45 0.00 -0.54 -2.19 119.26 121.86 1p7m h ALA 144 Ca 0.19 -0.55 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 1p7m h ALA 144 Cb 0.38 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1p7m h ALA 144 CO 0.00 0.76 -0.05 1.25 0.00 0.00 0.00 179.25 181.21 1p7m h LEU 145 N 0.00 0.23 -0.56 0.00 7.12 0.14 -1.59 115.31 120.65 1p7m h LEU 145 Ca -0.01 -0.41 -0.04 0.00 0.13 0.00 0.00 57.88 57.55 1p7m h LEU 145 Cb 1.10 -0.06 -0.02 0.00 -0.53 0.00 0.00 40.66 41.15 1p7m h LEU 145 CO 0.08 0.60 0.19 -1.28 -0.13 0.00 0.00 178.44 177.89 1p7m h SER 146 N -0.13 0.81 -0.77 1.25 0.87 -1.09 -2.00 113.55 112.50 1p7m h SER 146 Ca 0.02 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.39 1p7m h SER 146 Cb 0.51 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 62.22 1p7m h SER 146 CO 0.02 0.79 0.48 0.50 -0.53 0.00 0.00 176.83 178.09 1p7m h LYS 147 N 0.79 1.03 -0.24 2.24 3.64 -1.34 0.44 116.57 123.12 1p7m h LYS 147 Ca 0.18 -0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 59.45 1p7m h LYS 147 Cb 0.26 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.85 1p7m h LYS 147 CO -0.01 0.70 0.02 0.00 -2.27 0.00 0.00 179.45 177.89 1p7m h ALA 148 N 1.26 0.32 -0.47 5.00 0.00 -1.05 -1.13 119.26 123.19 1p7m h ALA 148 Ca 0.28 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 1p7m h ALA 148 Cb -0.08 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1p7m h ALA 148 CO -0.06 0.02 -0.17 -0.07 0.00 0.00 0.00 179.25 178.98 1p7m h LEU 149 N 0.19 0.93 -1.07 0.00 3.38 -1.07 0.11 115.31 117.77 1p7m h LEU 149 Ca 0.07 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 1p7m h LEU 149 Cb 0.37 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1p7m h LEU 149 CO 0.01 1.08 0.47 0.50 0.09 0.00 0.00 178.44 180.59 1p7m h LYS 150 N 0.81 1.11 0.00 1.13 3.64 0.03 0.18 116.57 123.46 1p7m h LYS 150 Ca 0.12 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1p7m h LYS 150 Cb 0.72 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1p7m h LYS 150 CO 0.06 0.79 -0.13 1.63 -2.27 0.00 0.00 179.45 179.53 1p7m n LYS 151 N -4.36 0.24 -0.00 1.90 5.02 -0.44 -2.95 118.16 117.57 1p7m n LYS 151 Ca 0.09 0.17 0.14 0.00 -2.02 0.00 0.00 58.31 56.69 1p7m n LYS 151 Cb 0.08 -1.75 0.75 0.00 -0.02 0.00 0.00 35.03 34.09 1p7m n LYS 151 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1p7m n ARG 152 N -2.15 1.23 -0.48 1.97 3.00 0.34 -4.83 116.66 115.74 1p7m n ARG 152 Ca 0.05 -0.34 0.00 0.00 -0.00 0.00 0.00 57.85 57.57 1p7m n ARG 152 Cb 0.42 -1.46 0.00 0.00 0.00 0.00 0.00 32.46 31.42 1p7m n ARG 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1p7m n GLY 153 N 1.03 0.70 3.48 5.14 0.00 -1.06 -4.60 105.19 109.89 1p7m n GLY 153 Ca 0.21 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 45.29 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 0.41 1.61 0.08 0.44 -4.14 117.98 117.61 1p7m s PHE 154 Ca 0.00 -0.44 0.04 0.00 0.12 0.00 0.00 56.93 56.65 1p7m s PHE 154 Cb 0.00 -2.51 0.00 0.00 -0.57 0.00 0.00 43.02 39.94 1p7m s PHE 154 CO 0.00 -0.48 0.58 0.15 -0.10 0.00 0.00 175.22 175.37 1p7m s LYS 155 N 1.69 2.98 -0.80 0.44 1.02 -1.26 -3.77 119.74 120.03 1p7m s LYS 155 Ca 0.05 -0.88 -0.02 0.00 0.02 0.00 0.00 55.97 55.15 1p7m s LYS 155 Cb -0.18 -2.70 -0.02 0.00 -0.52 0.00 0.00 37.83 34.42 1p7m s LYS 155 CO 0.10 -0.19 0.74 1.19 -0.92 0.00 0.00 175.35 176.27 1p7m n PHE 156 N -1.89 -2.80 -2.68 3.18 3.72 -1.26 -4.96 117.46 110.77 1p7m n PHE 156 Ca 0.03 1.05 -0.03 0.00 -0.05 0.00 0.00 57.45 58.45 1p7m n PHE 156 Cb 0.58 -4.08 0.12 0.00 -0.94 0.00 0.00 39.48 35.17 1p7m n PHE 156 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 176.76 178.26 1p7m n VAL 157 N -2.13 0.07 -0.55 -4.37 3.14 -1.26 -4.52 118.33 108.71 1p7m n VAL 157 Ca -0.02 -1.19 -0.26 0.00 -2.96 0.00 0.00 64.34 59.91 1p7m n VAL 157 Cb 0.53 1.01 0.18 0.00 -1.06 0.00 0.00 33.84 34.50 1p7m n VAL 157 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1p7m n GLY 158 N -1.35 -2.65 0.29 7.55 0.00 -1.26 -4.41 105.19 103.36 1p7m n GLY 158 Ca -0.14 -0.92 0.15 0.00 0.00 0.00 0.00 46.02 45.11 1p7m n GLY 158 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1p7m h THR 159 N -2.53 0.46 -0.52 2.61 1.35 -1.91 -0.14 112.91 112.24 1p7m h THR 159 Ca -0.41 -0.24 -0.10 0.00 -0.55 0.00 0.00 66.41 65.12 1p7m h THR 159 Cb 1.12 1.16 -0.02 0.00 -1.73 0.00 0.00 68.15 68.68 1p7m h THR 159 CO 0.28 0.05 -0.06 0.74 -0.25 0.00 0.00 175.52 176.28 1p7m h THR 160 N 0.00 1.26 -0.20 6.82 2.02 -1.87 0.33 112.91 121.28 1p7m h THR 160 Ca -0.00 -1.16 -0.09 0.00 0.77 0.00 0.00 66.41 65.93 1p7m h THR 160 Cb 0.15 0.92 -0.00 0.00 -1.74 0.00 0.00 68.15 67.48 1p7m h THR 160 CO 0.01 0.41 -0.22 0.40 0.37 0.00 0.00 175.52 176.49 1p7m h ILE 161 N 0.85 1.33 -0.35 3.11 1.08 -1.32 -2.25 117.51 119.96 1p7m h ILE 161 Ca 0.15 -1.40 -0.02 0.00 -0.39 0.00 0.00 64.86 63.20 1p7m h ILE 161 Cb 0.58 1.79 -0.02 0.00 -3.07 0.00 0.00 36.82 36.10 1p7m h ILE 161 CO 0.04 0.43 0.13 0.00 -0.69 0.00 0.00 178.15 178.05 1p7m h TYR 163 N 0.50 0.24 -0.12 0.00 3.20 -0.80 -2.53 116.97 117.46 1p7m h TYR 163 Ca 0.12 -0.09 -0.09 0.00 3.14 0.00 0.00 58.73 61.81 1p7m h TYR 163 Cb 0.13 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.34 1p7m h TYR 163 CO 0.00 0.74 -0.31 0.66 -1.64 0.00 0.00 178.16 177.62 1p7m h SER 164 N -0.33 0.24 -0.39 -2.11 4.64 -1.24 -2.69 113.55 111.66 1p7m h SER 164 Ca -0.00 -0.08 -0.08 0.00 -0.47 0.00 0.00 61.79 61.16 1p7m h SER 164 Cb 0.74 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.75 1p7m h SER 164 CO 0.03 0.55 -0.03 0.15 -0.87 0.00 0.00 176.83 176.66 1p7m h PHE 165 N 0.21 0.85 -0.30 4.77 3.04 -0.98 -2.55 116.94 121.98 1p7m h PHE 165 Ca 0.03 -0.13 -0.11 0.00 3.98 0.00 0.00 57.97 61.74 1p7m h PHE 165 Cb 0.66 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 38.94 1p7m h PHE 165 CO 0.01 0.80 -0.25 1.98 -2.02 0.00 0.00 178.31 178.83 1p7m h MET 166 N 0.73 0.70 -0.39 1.11 4.05 -1.12 -1.20 114.93 118.81 1p7m h MET 166 Ca 0.14 -0.35 -0.12 0.00 -0.28 0.00 0.00 59.70 59.08 1p7m h MET 166 Cb 0.49 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.28 1p7m h MET 166 CO 0.02 0.96 -0.23 -0.56 0.23 0.00 0.00 176.91 177.33 1p7m h GLN 167 N 0.45 0.84 0.08 0.39 3.07 -1.44 -2.83 115.11 115.67 1p7m h GLN 167 Ca 0.05 -0.39 -0.27 0.00 0.09 0.00 0.00 58.65 58.14 1p7m h GLN 167 Cb 0.81 -0.01 0.01 0.00 0.08 0.00 0.00 27.48 28.37 1p7m h GLN 167 CO 0.06 1.03 -1.14 0.00 0.09 0.00 0.00 178.83 178.87 1p7m h ALA 168 N 0.80 0.14 -0.45 0.06 0.00 -1.50 -3.23 119.26 115.08 1p7m h ALA 168 Ca 0.08 -0.77 -0.03 0.00 0.00 0.00 0.00 54.91 54.18 1p7m h ALA 168 Cb 0.80 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1p7m h ALA 168 CO 0.07 0.79 0.16 0.00 0.00 0.00 0.00 179.25 180.27 1p7m n GLY 170 N -0.72 0.12 0.34 0.00 0.00 -1.17 -4.29 105.19 99.46 1p7m n GLY 170 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1p7m n GLY 170 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1p7m h LEU 171 N 0.00 0.82 -8.42 0.99 3.38 -1.80 -3.43 115.31 106.86 1p7m h LEU 171 Ca 0.00 -0.04 -0.49 0.00 0.09 0.00 0.00 57.88 57.44 1p7m h LEU 171 Cb 0.00 -0.21 -0.25 0.00 0.09 0.00 0.00 40.66 40.30 1p7m h LEU 171 CO 0.00 0.63 -0.81 0.68 0.09 0.00 0.00 178.44 179.03 1p7m s VAL 172 N -5.70 1.31 0.32 1.22 -7.23 -1.23 -2.68 120.40 106.41 1p7m s VAL 172 Ca -0.11 -1.11 0.08 0.00 -1.81 0.00 0.00 61.98 59.03 1p7m s VAL 172 Cb 0.17 -1.17 -0.04 0.00 0.56 0.00 0.00 36.38 35.90 1p7m s VAL 172 CO 0.78 0.04 0.19 0.20 -0.31 0.00 0.00 175.10 176.00 1p7m s ASN 173 N -1.24 4.98 0.00 4.85 0.01 0.37 -4.81 114.94 119.09 1p7m s ASN 173 Ca 0.03 -0.60 0.00 0.00 -0.71 0.00 0.00 52.86 51.58 1p7m s ASN 173 Cb -0.08 -0.90 0.00 0.00 0.41 0.00 0.00 41.25 40.68 1p7m s ASN 173 CO 0.02 -0.27 0.00 0.47 -1.51 0.00 0.00 177.10 175.81 1p7m n ASP 174 N -1.22 -0.86 0.02 -1.22 8.00 -1.26 -1.06 116.55 118.95 1p7m n ASP 174 Ca -0.03 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.45 1p7m n ASP 174 Cb 0.60 -0.43 -0.01 0.00 -0.02 0.00 0.00 41.12 41.26 1p7m n ASP 174 CO 0.00 0.00 0.00 0.45 -0.39 0.00 0.00 177.20 177.26 1p7m h HIS 175 N 0.00 -0.10 -3.62 1.24 3.86 -1.91 -3.40 115.15 111.22 1p7m h HIS 175 Ca 0.00 0.00 -0.37 0.00 -1.16 0.00 0.00 60.37 58.84 1p7m h HIS 175 Cb 0.05 0.04 -0.18 0.00 1.06 0.00 0.00 27.41 28.38 1p7m h HIS 175 CO 0.00 -0.04 -0.74 0.14 0.86 0.00 0.00 177.93 178.14 1p7m s VAL 176 N -3.19 1.15 0.12 2.45 -7.23 -1.26 -4.69 120.40 107.74 1p7m s VAL 176 Ca -0.01 -1.71 -0.31 0.00 -1.81 0.00 0.00 61.98 58.13 1p7m s VAL 176 Cb 0.00 -1.48 -0.10 0.00 0.56 0.00 0.00 36.38 35.37 1p7m s VAL 176 CO 0.04 -0.50 1.68 -0.69 -0.31 0.00 0.00 175.10 175.32 1p7m s VAL 177 N -2.36 2.71 0.00 1.32 1.01 0.13 -2.69 120.40 120.52 1p7m s VAL 177 Ca 0.08 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.39 1p7m s VAL 177 Cb -0.03 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.13 1p7m s VAL 177 CO 0.02 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.73 1p7m n GLY 178 N 3.99 0.96 2.28 4.51 0.00 -1.26 -4.88 105.19 110.79 1p7m n GLY 178 Ca 0.16 -0.67 -0.05 0.00 0.00 0.00 0.00 46.02 45.46 1p7m n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p7m n TYR 182 N 1.62 2.30 -2.24 0.00 0.18 -1.20 -4.95 117.16 112.86 1p7m n TYR 182 Ca 0.01 -0.26 -0.32 0.00 1.88 0.00 0.00 57.90 59.21 1p7m n TYR 182 Cb 0.71 -2.77 -0.01 0.00 -0.38 0.00 0.00 39.34 36.89 1p7m n TYR 182 CO 0.00 0.00 0.00 -1.25 -2.08 0.00 0.00 176.86 173.53 1p7m s PRO 183 N 5.14 3.67 0.00 -3.48 0.04 -1.26 -4.48 135.00 134.64 1p7m s PRO 183 Ca 0.94 1.07 0.00 0.00 0.04 0.00 0.00 61.00 63.04 1p7m s PRO 183 Cb -0.42 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.03 1p7m s PRO 183 CO 0.40 -0.51 0.00 0.41 0.04 0.00 0.00 177.00 177.35 1p7m n GLY 184 N -1.31 1.07 0.30 0.56 0.00 -1.26 -4.93 105.19 99.62 1p7m n GLY 184 Ca 0.08 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.24 1p7m n GLY 184 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1p7m n ASN 185 N 0.00 0.99 -3.58 1.61 3.02 -1.26 -4.39 115.26 111.65 1p7m n ASN 185 Ca 0.00 -1.20 -0.27 0.00 -0.03 0.00 0.00 54.58 53.08 1p7m n ASN 185 Cb 0.00 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.07 1p7m n ASN 185 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1p7m n LYS 186 N -0.32 1.27 0.00 3.52 2.85 -1.26 -5.27 118.16 118.95 1p7m n LYS 186 Ca 0.19 -3.94 0.16 0.00 -1.05 0.00 0.00 58.31 53.67 1p7m n LYS 186 Cb 0.29 -1.95 0.88 0.00 -0.65 0.00 0.00 35.03 33.60 1p7m n LYS 186 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00