#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 3.11 0.76 0.03 2.56 -1.26 -4.71 118.70 119.19 1p7m s GLU 2 Ca 0.00 -0.37 -0.09 0.00 0.00 0.00 0.00 54.97 54.51 1p7m s GLU 2 Cb 0.00 -2.90 0.08 0.00 2.00 0.00 0.00 34.13 33.31 1p7m s GLU 2 CO 0.00 0.70 1.10 1.03 -0.56 0.00 0.00 175.26 177.53 1p7m s ARG 3 N -1.17 1.95 0.43 4.30 0.52 -1.26 -1.24 118.95 122.48 1p7m s ARG 3 Ca 0.16 -0.18 -0.25 0.00 -0.52 0.00 0.00 55.73 54.95 1p7m s ARG 3 Cb -0.12 -2.07 -0.08 0.00 0.52 0.00 0.00 34.95 33.20 1p7m s ARG 3 CO 0.06 -1.48 1.33 0.00 0.02 0.00 0.00 175.30 175.23 1p7m h GLY 5 N 2.44 0.00 1.43 0.00 0.00 -1.94 0.56 103.07 105.56 1p7m h GLY 5 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1p7m h GLY 5 CO 0.62 0.00 0.00 1.87 0.00 0.00 0.00 176.54 179.03 1p7m n TRP 6 N -3.19 0.00 -0.09 5.60 -0.00 -1.26 -3.06 117.44 115.44 1p7m n TRP 6 Ca -0.01 0.00 -0.10 0.00 -0.00 0.00 0.00 57.50 57.39 1p7m n TRP 6 Cb 0.28 -0.21 -0.14 0.00 -0.00 0.00 0.00 31.31 31.24 1p7m n TRP 6 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 1p7m n VAL 7 N -1.21 1.24 1.05 5.87 0.31 0.20 -4.25 118.33 121.54 1p7m n VAL 7 Ca 0.14 -0.72 0.03 0.00 -0.01 0.00 0.00 64.34 63.78 1p7m n VAL 7 Cb 0.18 -0.64 0.17 0.00 -0.91 0.00 0.00 33.84 32.64 1p7m n VAL 7 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1p7m n SER 8 N -2.74 0.00 0.00 4.52 7.64 -1.15 -4.39 113.62 117.50 1p7m n SER 8 Ca -0.31 -0.87 0.00 0.00 1.01 0.00 0.00 58.87 58.70 1p7m n SER 8 Cb 1.06 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.26 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 -0.67 0.00 -2.13 1.43 6.02 -1.25 -4.98 117.38 115.79 1p7m n GLN 9 Ca 0.04 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.74 1p7m n GLN 9 Cb 0.02 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.29 1p7m n GLN 9 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1p7m s ASP 10 N -1.00 6.24 0.24 1.08 1.11 -1.26 -4.99 116.67 118.10 1p7m s ASP 10 Ca 0.00 1.25 -0.00 0.00 0.18 0.00 0.00 52.55 53.98 1p7m s ASP 10 Cb 0.00 -2.39 0.29 0.00 1.07 0.00 0.00 42.92 41.88 1p7m s ASP 10 CO 0.00 -0.77 1.65 1.55 1.18 0.00 0.00 175.17 178.78 1p7m h PRO 11 N -0.13 0.56 -0.17 8.23 0.13 -1.94 -3.11 132.00 135.57 1p7m h PRO 11 Ca -0.45 -0.25 -0.01 0.00 -0.87 0.00 0.00 66.00 64.43 1p7m h PRO 11 Cb 1.19 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1p7m h PRO 11 CO 0.62 0.81 0.07 -0.07 -0.23 0.00 0.00 178.00 179.19 1p7m h LEU 12 N 0.48 0.21 -1.65 1.56 3.38 -1.96 -2.32 115.31 115.01 1p7m h LEU 12 Ca 0.06 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.06 1p7m h LEU 12 Cb 0.78 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 1p7m h LEU 12 CO 0.06 0.19 0.31 1.88 0.09 0.00 0.00 178.44 180.98 1p7m h TYR 13 N 0.24 0.44 -0.91 1.13 0.05 -1.87 -1.59 116.97 114.45 1p7m h TYR 13 Ca 0.06 0.01 0.04 0.00 0.05 0.00 0.00 58.73 58.89 1p7m h TYR 13 Cb 0.05 -0.15 -0.05 0.00 1.01 0.00 0.00 36.73 37.59 1p7m h TYR 13 CO 0.00 0.25 0.59 0.82 -1.05 0.00 0.00 178.16 178.77 1p7m h ILE 14 N 0.45 1.14 0.05 -2.88 5.03 -1.59 1.02 117.51 120.73 1p7m h ILE 14 Ca 0.19 -0.39 -0.00 0.00 -0.12 0.00 0.00 64.86 64.54 1p7m h ILE 14 Cb 0.20 -0.10 0.00 0.00 -3.03 0.00 0.00 36.82 33.90 1p7m h ILE 14 CO -0.05 0.21 -0.02 0.00 -0.68 0.00 0.00 178.15 177.61 1p7m h ALA 15 N 1.38 -0.06 -0.65 1.87 0.00 -1.44 0.24 119.26 120.60 1p7m h ALA 15 Ca 0.37 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1p7m h ALA 15 Cb 0.02 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1p7m h ALA 15 CO -0.13 -0.33 0.23 -0.92 0.00 0.00 0.00 179.25 178.10 1p7m h TYR 16 N -0.46 0.99 -0.42 0.00 3.20 -1.16 -1.65 116.97 117.47 1p7m h TYR 16 Ca -0.01 -0.07 -0.08 0.00 3.14 0.00 0.00 58.73 61.71 1p7m h TYR 16 Cb 0.42 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.38 1p7m h TYR 16 CO 0.06 0.78 -0.03 1.25 -1.64 0.00 0.00 178.16 178.58 1p7m h HIS 17 N 0.95 0.84 0.00 -3.82 2.76 0.12 -2.59 115.15 113.41 1p7m h HIS 17 Ca 0.22 -0.16 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 1p7m h HIS 17 Cb 0.23 -0.22 0.00 0.00 1.55 0.00 0.00 27.41 28.97 1p7m h HIS 17 CO 0.02 0.85 0.00 -0.25 -1.30 0.00 0.00 177.93 177.24 1p7m n ASP 18 N -4.38 0.04 0.00 3.26 8.00 0.06 -3.96 116.55 119.57 1p7m n ASP 18 Ca -0.01 0.51 0.00 0.00 0.71 0.00 0.00 54.79 56.00 1p7m n ASP 18 Cb 0.32 -0.52 0.00 0.00 -0.02 0.00 0.00 41.12 40.90 1p7m n ASP 18 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1p7m n ASN 19 N -1.54 0.00 0.00 -2.24 3.02 -0.65 -4.94 115.26 108.91 1p7m n ASN 19 Ca 0.05 0.44 0.00 0.00 -0.03 0.00 0.00 54.58 55.04 1p7m n ASN 19 Cb 0.25 -0.18 0.00 0.00 -0.61 0.00 0.00 39.78 39.25 1p7m n ASN 19 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1p7m n GLU 20 N -1.03 0.00 0.00 3.52 1.02 -1.24 -5.01 120.64 117.89 1p7m n GLU 20 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1p7m n GLU 20 Cb 0.00 -0.20 0.00 0.00 -0.02 0.00 0.00 31.44 31.22 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 -1.45 0.00 0.00 -0.32 -0.00 -1.25 0.04 117.44 114.46 1p7m n TRP 21 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 1p7m n TRP 21 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.31 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 0.00 1.06 0.02 5.87 0.00 -1.26 -4.96 105.19 105.91 1p7m n GLY 22 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1p7m n GLY 22 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1p7m n VAL 23 N 0.00 0.78 -2.56 1.61 0.24 0.11 -4.60 118.33 113.91 1p7m n VAL 23 Ca 0.00 -0.81 -0.38 0.00 -2.04 0.00 0.00 64.34 61.12 1p7m n VAL 23 Cb 0.00 0.58 -0.04 0.00 -1.47 0.00 0.00 33.84 32.90 1p7m n VAL 23 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1p7m s PRO 24 N -0.84 4.38 0.28 7.34 0.04 -1.26 -4.99 135.00 139.95 1p7m s PRO 24 Ca 0.02 1.57 -0.16 0.00 0.04 0.00 0.00 61.00 62.48 1p7m s PRO 24 Cb 0.02 -2.79 -0.09 0.00 0.04 0.00 0.00 34.50 31.68 1p7m s PRO 24 CO 0.00 0.04 0.72 -2.00 0.04 0.00 0.00 177.00 175.80 1p7m s GLU 25 N -2.08 4.06 -0.24 4.56 2.12 -1.26 -3.87 118.70 121.99 1p7m s GLU 25 Ca 0.52 0.70 -0.22 0.00 0.36 0.00 0.00 54.97 56.34 1p7m s GLU 25 Cb -0.25 -2.58 -0.02 0.00 0.26 0.00 0.00 34.13 31.55 1p7m s GLU 25 CO 0.31 0.24 0.69 0.95 -0.54 0.00 0.00 175.26 176.91 1p7m s THR 26 N -1.83 4.95 0.24 -1.70 -4.23 -1.26 -4.96 115.64 106.85 1p7m s THR 26 Ca 0.50 1.26 0.07 0.00 -1.18 0.00 0.00 61.69 62.34 1p7m s THR 26 Cb -0.12 -3.99 -0.04 0.00 1.34 0.00 0.00 72.50 69.70 1p7m s THR 26 CO 0.19 0.01 0.19 -0.62 -0.54 0.00 0.00 174.62 173.85 1p7m s ASP 27 N 1.39 5.51 0.24 3.99 2.15 -1.26 -4.76 116.67 123.93 1p7m s ASP 27 Ca 0.29 -0.24 -0.04 0.00 0.43 0.00 0.00 52.55 52.99 1p7m s ASP 27 Cb -0.16 -1.40 0.27 0.00 -0.30 0.00 0.00 42.92 41.33 1p7m s ASP 27 CO 0.09 -0.02 1.76 0.28 -0.17 0.00 0.00 175.17 177.10 1p7m h SER 28 N 1.63 0.88 -0.00 -0.34 0.02 -1.94 -2.55 113.55 111.25 1p7m h SER 28 Ca -0.48 -0.19 -0.00 0.00 -0.84 0.00 0.00 61.79 60.27 1p7m h SER 28 Cb 1.23 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.54 1p7m h SER 28 CO 0.61 0.89 -0.01 0.11 -1.14 0.00 0.00 176.83 177.29 1p7m h LYS 29 N 0.88 0.01 -0.96 3.45 1.79 -2.00 -3.01 116.57 116.71 1p7m h LYS 29 Ca 0.18 -0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.67 1p7m h LYS 29 Cb 0.39 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.99 1p7m h LYS 29 CO 0.01 0.76 0.63 0.87 -1.08 0.00 0.00 179.45 180.64 1p7m h LYS 30 N -0.75 1.22 -0.69 3.15 1.57 -1.97 -2.02 116.57 117.07 1p7m h LYS 30 Ca -0.00 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.67 1p7m h LYS 30 Cb 0.76 -0.27 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 1p7m h LYS 30 CO 0.00 0.80 0.29 -0.07 -0.57 0.00 0.00 179.45 179.90 1p7m h LEU 31 N 1.25 0.92 -1.06 2.94 4.07 -1.54 0.25 115.31 122.15 1p7m h LEU 31 Ca 0.37 -0.12 0.01 0.00 0.08 0.00 0.00 57.88 58.22 1p7m h LEU 31 Cb -0.06 -0.24 -0.05 0.00 1.08 0.00 0.00 40.66 41.39 1p7m h LEU 31 CO -0.10 0.81 0.63 0.15 -1.08 0.00 0.00 178.44 178.85 1p7m h PHE 32 N 0.99 1.20 -0.11 1.13 3.57 -1.23 -0.61 116.94 121.89 1p7m h PHE 32 Ca 0.23 0.03 -0.24 0.00 3.53 0.00 0.00 57.97 61.53 1p7m h PHE 32 Cb 0.17 -0.41 0.01 0.00 2.79 0.00 0.00 35.95 38.52 1p7m h PHE 32 CO 0.01 0.75 -0.85 0.93 -2.23 0.00 0.00 178.31 176.92 1p7m h GLU 33 N 1.29 0.77 -0.06 1.11 5.08 -1.12 -2.95 114.58 118.70 1p7m h GLU 33 Ca 0.35 -0.67 0.01 0.00 -1.00 0.00 0.00 59.36 58.04 1p7m h GLU 33 Cb -0.14 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1p7m h GLU 33 CO -0.08 1.27 0.02 1.98 -1.00 0.00 0.00 179.01 181.20 1p7m h MET 34 N 0.50 0.05 -0.46 2.33 4.05 0.21 0.24 114.93 121.85 1p7m h MET 34 Ca -0.07 -0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.32 1p7m h MET 34 Cb 1.49 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 32.25 1p7m h MET 34 CO 0.17 0.03 0.18 0.97 0.23 0.00 0.00 176.91 178.50 1p7m h ILE 35 N 0.05 1.17 -0.38 1.77 6.09 -1.21 0.69 117.51 125.69 1p7m h ILE 35 Ca 0.03 -0.55 -0.10 0.00 -1.37 0.00 0.00 64.86 62.87 1p7m h ILE 35 Cb 0.01 0.63 -0.02 0.00 0.47 0.00 0.00 36.82 37.92 1p7m h ILE 35 CO -0.03 0.21 -0.19 0.00 -3.07 0.00 0.00 178.15 175.08 1p7m h LEU 37 N 0.65 0.12 -1.02 0.00 4.07 0.84 -2.05 115.31 117.91 1p7m h LEU 37 Ca 0.10 -0.66 -0.04 0.00 0.08 0.00 0.00 57.88 57.36 1p7m h LEU 37 Cb 0.67 -0.04 -0.03 0.00 1.08 0.00 0.00 40.66 42.35 1p7m h LEU 37 CO 0.05 0.75 0.21 -0.33 -1.08 0.00 0.00 178.44 178.04 1p7m h GLU 38 N -0.51 0.91 -0.46 1.13 4.39 0.41 -1.63 114.58 118.81 1p7m h GLU 38 Ca -0.01 -0.16 -0.04 0.00 0.34 0.00 0.00 59.36 59.49 1p7m h GLU 38 Cb 0.75 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.23 1p7m h GLU 38 CO 0.02 0.77 0.10 0.78 -1.16 0.00 0.00 179.01 179.52 1p7m h GLY 39 N 1.00 0.75 1.86 -3.84 0.00 -0.12 -0.17 103.07 102.56 1p7m h GLY 39 Ca 0.20 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1p7m h GLY 39 CO -0.01 0.40 0.00 -0.18 0.00 0.00 0.00 176.54 176.74 1p7m n GLN 40 N -4.29 0.10 0.00 4.80 7.27 -0.66 -2.72 117.38 121.87 1p7m n GLN 40 Ca 0.03 0.12 0.11 0.00 0.07 0.00 0.00 57.00 57.33 1p7m n GLN 40 Cb 0.22 -1.50 0.54 0.00 2.41 0.00 0.00 30.24 31.91 1p7m n GLN 40 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1p7m n GLN 41 N -1.43 0.31 -1.68 3.69 -0.00 -0.08 -4.33 117.38 113.87 1p7m n GLN 41 Ca 0.07 0.08 -0.44 0.00 -0.00 0.00 0.00 57.00 56.71 1p7m n GLN 41 Cb 0.22 -1.50 -0.03 0.00 -0.00 0.00 0.00 30.24 28.93 1p7m n GLN 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1p7m n ALA 42 N -1.28 1.67 0.00 2.61 0.00 -1.10 -1.41 120.51 120.99 1p7m n ALA 42 Ca 0.10 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.83 1p7m n ALA 42 Cb 0.17 -2.59 0.00 0.00 0.00 0.00 0.00 19.45 17.03 1p7m n ALA 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p7m n GLY 43 N 4.31 1.16 3.75 0.00 0.00 -1.26 -4.89 105.19 108.27 1p7m n GLY 43 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1p7m n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p7m s LEU 44 N 0.00 3.77 0.63 0.99 1.43 -0.50 -5.10 118.68 119.90 1p7m s LEU 44 Ca 0.00 0.11 -0.13 0.00 -1.03 0.00 0.00 54.13 53.08 1p7m s LEU 44 Cb 0.00 -2.15 -0.02 0.00 0.03 0.00 0.00 46.19 44.05 1p7m s LEU 44 CO 0.00 0.29 1.05 -0.44 0.23 0.00 0.00 176.35 177.48 1p7m s SER 45 N -1.59 5.74 0.41 2.29 0.01 -1.26 -4.39 113.70 114.91 1p7m s SER 45 Ca 0.21 1.66 0.11 0.00 1.31 0.00 0.00 55.95 59.24 1p7m s SER 45 Cb -0.12 -2.51 0.93 0.00 0.21 0.00 0.00 66.02 64.54 1p7m s SER 45 CO 0.12 -1.20 1.98 -0.25 0.41 0.00 0.00 173.24 174.29 1p7m h TRP 46 N -0.09 0.54 -0.23 2.43 2.91 -1.95 -0.50 115.95 119.06 1p7m h TRP 46 Ca -0.45 0.01 -0.13 0.00 1.13 0.00 0.00 58.89 59.46 1p7m h TRP 46 Cb 1.21 -0.18 -0.01 0.00 -0.51 0.00 0.00 29.16 29.67 1p7m h TRP 46 CO 0.61 0.27 -0.39 0.82 -1.03 0.00 0.00 178.44 178.72 1p7m h ILE 47 N 0.52 1.30 -0.48 2.65 1.08 -2.00 -2.34 117.51 118.25 1p7m h ILE 47 Ca 0.28 -1.54 -0.02 0.00 -0.39 0.00 0.00 64.86 63.19 1p7m h ILE 47 Cb 0.42 1.55 -0.02 0.00 -3.07 0.00 0.00 36.82 35.70 1p7m h ILE 47 CO -0.08 0.48 0.22 0.74 -0.69 0.00 0.00 178.15 178.81 1p7m h THR 48 N 0.43 1.20 0.00 -0.27 2.02 -1.45 -2.04 112.91 112.79 1p7m h THR 48 Ca 0.04 -0.57 -0.05 0.00 0.77 0.00 0.00 66.41 66.59 1p7m h THR 48 Cb 0.88 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 1p7m h THR 48 CO 0.07 0.22 -0.25 -0.37 0.37 0.00 0.00 175.52 175.57 1p7m h VAL 49 N 0.63 0.66 -0.27 3.16 -1.51 -1.37 -3.10 116.25 114.45 1p7m h VAL 49 Ca 0.16 -1.11 0.02 0.00 -1.23 0.00 0.00 66.70 64.54 1p7m h VAL 49 Cb 0.15 1.72 -0.02 0.00 -2.13 0.00 0.00 31.29 31.01 1p7m h VAL 49 CO -0.02 0.24 0.13 0.25 -1.23 0.00 0.00 177.57 176.94 1p7m h LEU 50 N 0.00 0.18 -0.03 4.19 6.46 -0.80 1.87 115.31 127.18 1p7m h LEU 50 Ca -0.00 0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.77 1p7m h LEU 50 Cb 0.70 -0.02 -0.00 0.00 -0.73 0.00 0.00 40.66 40.62 1p7m h LEU 50 CO 0.03 0.14 0.02 0.11 -0.62 0.00 0.00 178.44 178.12 1p7m h LYS 51 N 0.27 0.04 0.00 1.25 1.57 -1.47 -0.97 116.57 117.27 1p7m h LYS 51 Ca 0.11 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1p7m h LYS 51 Cb 0.05 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.35 1p7m h LYS 51 CO -0.09 0.10 0.00 1.63 -0.57 0.00 0.00 179.45 180.52 1p7m n LYS 52 N -5.03 0.36 0.21 3.15 4.01 -1.05 -3.16 118.16 116.65 1p7m n LYS 52 Ca -0.07 0.04 -0.14 0.00 -0.51 0.00 0.00 58.31 57.64 1p7m n LYS 52 Cb 0.06 -1.50 -0.08 0.00 -0.51 0.00 0.00 35.03 33.00 1p7m n LYS 52 CO 0.00 0.00 0.00 -0.09 -1.11 0.00 0.00 177.40 176.20 1p7m h ARG 53 N 0.00 -0.53 -0.26 1.97 2.43 0.43 0.96 114.38 119.38 1p7m h ARG 53 Ca 0.00 0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 1p7m h ARG 53 Cb 0.25 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 1p7m h ARG 53 CO 0.00 -0.23 0.00 1.49 -1.51 0.00 0.00 179.97 179.72 1p7m h GLU 54 N -0.85 0.45 -0.25 0.20 4.81 -1.56 -1.21 114.58 116.17 1p7m h GLU 54 Ca -0.06 -0.14 -0.04 0.00 -0.13 0.00 0.00 59.36 58.99 1p7m h GLU 54 Cb 0.55 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.88 1p7m h GLU 54 CO 0.09 0.62 -0.00 -0.97 -0.73 0.00 0.00 179.01 178.02 1p7m h ASN 55 N 0.23 0.44 -0.29 1.04 -1.24 -1.55 -2.88 115.58 111.33 1p7m h ASN 55 Ca 0.07 -0.31 -0.02 0.00 0.71 0.00 0.00 56.30 56.75 1p7m h ASN 55 Cb 0.42 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 39.34 1p7m h ASN 55 CO 0.01 0.64 0.11 0.22 -1.29 0.00 0.00 177.43 177.13 1p7m h TYR 56 N 0.23 0.45 -0.76 0.67 3.20 0.98 -2.45 116.97 119.29 1p7m h TYR 56 Ca 0.07 -0.04 0.15 0.00 3.14 0.00 0.00 58.73 62.05 1p7m h TYR 56 Cb 0.42 -0.13 -0.05 0.00 1.54 0.00 0.00 36.73 38.50 1p7m h TYR 56 CO 0.04 0.45 0.51 0.00 -1.64 0.00 0.00 178.16 177.52 1p7m h ARG 57 N 0.32 0.42 -0.33 1.82 2.47 -1.20 0.12 114.38 118.00 1p7m h ARG 57 Ca 0.10 -0.03 -0.13 0.00 -1.26 0.00 0.00 59.98 58.66 1p7m h ARG 57 Cb 0.20 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.41 1p7m h ARG 57 CO -0.01 0.28 -0.33 0.00 0.56 0.00 0.00 179.97 180.48 1p7m h ALA 58 N 1.64 0.81 -0.12 0.04 0.00 -1.22 -0.30 119.26 120.11 1p7m h ALA 58 Ca 0.37 -0.41 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 1p7m h ALA 58 Cb 0.84 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1p7m h ALA 58 CO -0.12 0.64 -0.45 0.00 0.00 0.00 0.00 179.25 179.32 1p7m n PHE 60 N -4.26 0.00 -2.11 0.00 3.01 -0.82 -4.75 117.46 108.53 1p7m n PHE 60 Ca -0.07 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 57.98 1p7m n PHE 60 Cb 0.57 -0.41 -0.00 0.00 -0.01 0.00 0.00 39.48 39.62 1p7m n PHE 60 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 1p7m n HIS 61 N -3.25 2.64 -0.30 1.38 8.25 -0.15 -4.65 115.22 119.14 1p7m n HIS 61 Ca -0.21 -2.79 0.22 0.00 -0.26 0.00 0.00 57.72 54.68 1p7m n HIS 61 Cb 0.68 -1.78 0.52 0.00 1.12 0.00 0.00 29.99 30.53 1p7m n HIS 61 CO 0.00 0.00 0.00 1.96 0.64 0.00 0.00 176.34 178.94 1p7m h GLN 62 N 4.69 0.37 0.00 -0.41 4.20 -1.69 -3.41 115.11 118.87 1p7m h GLN 62 Ca 0.65 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 59.34 1p7m h GLN 62 Cb 0.34 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.04 1p7m h GLN 62 CO 1.46 0.24 0.00 1.97 -0.67 0.00 0.00 178.83 181.84 1p7m n PHE 63 N -4.57 0.00 -3.97 2.96 1.16 -1.26 -4.97 117.46 106.82 1p7m n PHE 63 Ca 0.24 0.00 -0.31 0.00 -1.87 0.00 0.00 57.45 55.51 1p7m n PHE 63 Cb 0.85 0.00 -0.14 0.00 -1.61 0.00 0.00 39.48 38.57 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 0.00 4.59 0.58 5.98 1.01 -1.26 -4.95 116.67 122.61 1p7m s ASP 64 Ca 0.00 -2.60 0.29 0.00 0.71 0.00 0.00 52.55 50.96 1p7m s ASP 64 Cb 0.00 -1.65 1.45 0.00 1.01 0.00 0.00 42.92 43.73 1p7m s ASP 64 CO 0.00 -0.31 1.87 -0.65 0.21 0.00 0.00 175.17 176.28 1p7m h PRO 65 N 7.06 0.00 -0.28 8.23 0.11 -1.96 -0.83 132.00 144.34 1p7m h PRO 65 Ca -0.06 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.02 1p7m h PRO 65 Cb 0.96 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 1p7m h PRO 65 CO 0.62 0.00 0.06 0.28 -0.21 0.00 0.00 178.00 178.75 1p7m h VAL 66 N 0.00 1.22 -0.31 3.15 2.07 -1.92 -2.55 116.25 117.91 1p7m h VAL 66 Ca 0.28 -0.73 -0.07 0.00 0.82 0.00 0.00 66.70 67.00 1p7m h VAL 66 Cb 1.39 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 32.31 1p7m h VAL 66 CO -0.00 0.24 -0.11 0.11 0.02 0.00 0.00 177.57 177.83 1p7m h LYS 67 N 0.29 0.52 -0.75 1.57 6.56 -1.56 -2.49 116.57 120.70 1p7m h LYS 67 Ca 0.09 -0.14 0.00 0.00 -1.06 0.00 0.00 60.65 59.54 1p7m h LYS 67 Cb 0.30 -0.06 -0.04 0.00 -0.57 0.00 0.00 32.23 31.86 1p7m h LYS 67 CO 0.00 0.62 0.47 0.28 -2.06 0.00 0.00 179.45 178.77 1p7m h VAL 68 N 0.48 1.20 0.00 0.50 2.07 -1.27 0.32 116.25 119.54 1p7m h VAL 68 Ca 0.09 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1p7m h VAL 68 Cb 0.47 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1p7m h VAL 68 CO 0.03 0.20 0.00 0.00 0.02 0.00 0.00 177.57 177.82 1p7m h ALA 69 N 1.50 1.00 -0.01 1.67 0.00 -1.05 -1.59 119.26 120.78 1p7m h ALA 69 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1p7m h ALA 69 Cb -0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1p7m h ALA 69 CO -0.06 0.00 -0.34 0.00 0.00 0.00 0.00 179.25 178.85 1p7m n ALA 70 N -1.81 3.27 -2.54 0.00 0.00 0.11 -4.82 120.51 114.71 1p7m n ALA 70 Ca 0.02 -0.48 -0.43 0.00 0.00 0.00 0.00 53.44 52.54 1p7m n ALA 70 Cb 0.23 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.64 1p7m n ALA 70 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1p7m s MET 71 N -2.51 4.04 0.62 0.00 -1.94 -0.60 -5.01 119.30 113.90 1p7m s MET 71 Ca 0.22 1.22 0.03 0.00 -1.71 0.00 0.00 55.69 55.45 1p7m s MET 71 Cb 0.19 -3.79 0.09 0.00 2.01 0.00 0.00 34.83 33.33 1p7m s MET 71 CO 0.54 -0.94 0.86 -0.65 -0.01 0.00 0.00 175.02 174.82 1p7m s GLN 72 N 3.80 2.13 0.43 2.03 -0.21 -1.26 -4.91 119.66 121.66 1p7m s GLN 72 Ca 0.50 -1.20 0.12 0.00 0.02 0.00 0.00 55.36 54.80 1p7m s GLN 72 Cb -0.15 -2.49 0.98 0.00 1.00 0.00 0.00 33.01 32.36 1p7m s GLN 72 CO 0.18 -1.03 2.02 0.93 -2.12 0.00 0.00 175.29 175.26 1p7m h GLU 73 N -0.11 0.42 -0.83 2.91 5.08 -1.96 -0.49 114.58 119.60 1p7m h GLU 73 Ca -0.36 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.02 1p7m h GLU 73 Cb 1.28 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 30.38 1p7m h GLU 73 CO 0.43 0.28 0.52 0.93 -1.00 0.00 0.00 179.01 180.17 1p7m h GLU 74 N 0.44 0.95 -0.52 2.33 5.08 -2.00 0.14 114.58 121.00 1p7m h GLU 74 Ca 0.22 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.44 1p7m h GLU 74 Cb 0.30 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1p7m h GLU 74 CO -0.06 0.63 0.00 -0.44 -1.00 0.00 0.00 179.01 178.15 1p7m h ASP 75 N 0.98 0.85 -0.84 1.42 3.32 -1.48 -2.66 116.42 118.01 1p7m h ASP 75 Ca 0.35 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 57.15 1p7m h ASP 75 Cb 0.10 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.38 1p7m h ASP 75 CO -0.15 0.91 0.39 0.58 -1.72 0.00 0.00 179.24 179.25 1p7m h VAL 76 N 0.81 1.26 -0.61 -1.35 2.07 -0.11 0.33 116.25 118.65 1p7m h VAL 76 Ca 0.15 -0.75 -0.09 0.00 0.82 0.00 0.00 66.70 66.83 1p7m h VAL 76 Cb 0.48 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 1p7m h VAL 76 CO 0.02 0.32 0.02 1.05 0.02 0.00 0.00 177.57 179.00 1p7m h GLU 77 N 1.20 1.07 -0.07 1.57 4.11 -0.56 -0.70 114.58 121.20 1p7m h GLU 77 Ca 0.29 -0.33 -0.23 0.00 0.07 0.00 0.00 59.36 59.15 1p7m h GLU 77 Cb 0.14 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.30 1p7m h GLU 77 CO -0.03 1.03 -0.88 0.07 0.07 0.00 0.00 179.01 179.26 1p7m h ARG 78 N 0.97 0.66 -0.16 1.06 0.11 -1.26 -3.17 114.38 112.59 1p7m h ARG 78 Ca 0.17 -0.62 -0.06 0.00 0.10 0.00 0.00 59.98 59.57 1p7m h ARG 78 Cb 0.54 0.15 -0.01 0.00 1.11 0.00 0.00 29.97 31.76 1p7m h ARG 78 CO 0.03 1.22 -0.19 -0.07 0.10 0.00 0.00 179.97 181.06 1p7m h LEU 79 N 0.42 0.25 -1.17 0.08 3.38 -0.82 -2.76 115.31 114.70 1p7m h LEU 79 Ca -0.08 -0.06 0.27 0.00 0.09 0.00 0.00 57.88 58.09 1p7m h LEU 79 Cb 1.52 -0.07 -0.11 0.00 0.09 0.00 0.00 40.66 42.09 1p7m h LEU 79 CO 0.17 0.46 0.64 0.58 0.09 0.00 0.00 178.44 180.38 1p7m h VAL 80 N 0.24 0.50 -0.17 1.22 2.07 -1.09 0.60 116.25 119.63 1p7m h VAL 80 Ca 0.04 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1p7m h VAL 80 Cb 0.48 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1p7m h VAL 80 CO 0.03 0.09 0.00 0.00 0.02 0.00 0.00 177.57 177.71 1p7m n GLN 81 N -4.78 2.35 -2.92 1.57 10.64 -1.06 -4.16 117.38 119.02 1p7m n GLN 81 Ca 0.27 -1.99 -0.43 0.00 -1.83 0.00 0.00 57.00 53.02 1p7m n GLN 81 Cb 0.84 -1.48 -0.05 0.00 -0.86 0.00 0.00 30.24 28.69 1p7m n GLN 81 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1p7m s ASP 82 N -1.80 6.45 0.00 2.61 2.15 0.21 -3.77 116.67 122.52 1p7m s ASP 82 Ca 0.33 0.01 0.00 0.00 0.43 0.00 0.00 52.55 53.32 1p7m s ASP 82 Cb 0.21 -2.40 0.00 0.00 -0.30 0.00 0.00 42.92 40.43 1p7m s ASP 82 CO 0.31 -0.93 0.00 0.00 -0.17 0.00 0.00 175.17 174.38 1p7m n ALA 83 N 6.80 0.00 -2.64 3.66 0.00 -1.26 -3.82 120.51 123.24 1p7m n ALA 83 Ca 0.03 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.40 1p7m n ALA 83 Cb 0.48 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.95 1p7m n ALA 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p7m n GLY 84 N -2.00 0.41 0.00 0.00 0.00 -1.25 -5.02 105.19 97.33 1p7m n GLY 84 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1p7m n GLY 84 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1p7m n ILE 85 N -3.45 0.00 -1.90 -0.61 -5.35 -1.25 -4.68 119.36 102.12 1p7m n ILE 85 Ca -0.02 0.00 -0.29 0.00 -0.27 0.00 0.00 62.75 62.17 1p7m n ILE 85 Cb 0.53 0.00 -0.04 0.00 -1.74 0.00 0.00 39.64 38.38 1p7m n ILE 85 CO 0.00 0.00 0.00 -0.51 -1.76 0.00 0.00 176.55 174.28 1p7m s ILE 86 N -0.59 3.29 -0.21 7.28 2.07 -1.26 -4.89 121.20 126.89 1p7m s ILE 86 Ca 0.00 -0.08 -0.36 0.00 -1.41 0.00 0.00 60.65 58.79 1p7m s ILE 86 Cb 0.00 -3.70 -0.13 0.00 0.13 0.00 0.00 42.46 38.76 1p7m s ILE 86 CO 0.00 -0.67 1.90 0.54 -1.91 0.00 0.00 174.94 174.81 1p7m n ARG 87 N 8.98 1.58 0.00 3.50 1.74 -1.26 -4.72 116.66 126.48 1p7m n ARG 87 Ca 0.35 0.56 0.00 0.00 -0.77 0.00 0.00 57.85 57.98 1p7m n ARG 87 Cb 0.49 -2.42 0.00 0.00 -1.02 0.00 0.00 32.46 29.51 1p7m n ARG 87 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1p7m n HIS 88 N 6.94 0.00 -0.31 -1.55 8.25 -1.26 -5.02 115.22 122.27 1p7m n HIS 88 Ca 0.28 0.00 0.27 0.00 -0.26 0.00 0.00 57.72 58.01 1p7m n HIS 88 Cb 0.22 0.00 0.59 0.00 1.12 0.00 0.00 29.99 31.93 1p7m n HIS 88 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1p7m h ARG 89 N 0.00 0.24 0.47 -0.41 0.11 -1.91 -0.72 114.38 112.16 1p7m h ARG 89 Ca 0.00 -0.01 -0.02 0.00 0.10 0.00 0.00 59.98 60.05 1p7m h ARG 89 Cb 0.00 -0.05 -0.01 0.00 1.11 0.00 0.00 29.97 31.01 1p7m h ARG 89 CO 0.00 0.16 -0.37 0.78 0.10 0.00 0.00 179.97 180.64 1p7m h GLY 90 N 0.25 -1.11 1.03 0.08 0.00 -1.97 0.35 103.07 101.70 1p7m h GLY 90 Ca 0.58 0.49 -0.03 0.00 0.00 0.00 0.00 47.33 48.36 1p7m h GLY 90 CO -0.20 -0.36 0.38 0.50 0.00 0.00 0.00 176.54 176.86 1p7m h LYS 91 N -0.82 1.15 -0.57 4.80 1.57 -1.75 -2.81 116.57 118.15 1p7m h LYS 91 Ca -0.06 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.54 1p7m h LYS 91 Cb 0.68 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 1p7m h LYS 91 CO 0.01 0.89 0.33 0.82 -0.57 0.00 0.00 179.45 180.93 1p7m h ILE 92 N 1.13 1.18 -0.69 1.86 1.08 -0.95 -2.02 117.51 119.09 1p7m h ILE 92 Ca 0.27 -0.42 0.03 0.00 -0.39 0.00 0.00 64.86 64.35 1p7m h ILE 92 Cb 0.13 0.42 -0.04 0.00 -3.07 0.00 0.00 36.82 34.26 1p7m h ILE 92 CO -0.03 0.19 0.45 0.06 -0.69 0.00 0.00 178.15 178.13 1p7m h GLN 93 N 0.77 0.81 -0.31 2.37 3.07 -0.05 -1.45 115.11 120.32 1p7m h GLN 93 Ca 0.20 -0.05 -0.12 0.00 0.09 0.00 0.00 58.65 58.77 1p7m h GLN 93 Cb 0.01 -0.18 -0.01 0.00 0.08 0.00 0.00 27.48 27.37 1p7m h GLN 93 CO -0.04 0.54 -0.31 0.00 0.09 0.00 0.00 178.83 179.11 1p7m h ALA 94 N 1.60 0.88 -0.11 0.06 0.00 -1.18 -2.72 119.26 117.79 1p7m h ALA 94 Ca 0.27 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1p7m h ALA 94 Cb 0.04 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1p7m h ALA 94 CO -0.07 0.63 0.01 0.82 0.00 0.00 0.00 179.25 180.63 1p7m h ILE 95 N 0.56 1.07 -0.42 0.00 2.04 -0.59 -1.87 117.51 118.29 1p7m h ILE 95 Ca 0.07 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.70 1p7m h ILE 95 Cb 0.81 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.83 1p7m h ILE 95 CO 0.07 0.08 0.24 0.40 0.00 0.00 0.00 178.15 178.94 1p7m h ILE 96 N 0.15 1.02 -0.24 -0.67 1.08 -1.21 -0.97 117.51 116.66 1p7m h ILE 96 Ca 0.04 -0.16 -0.05 0.00 -0.39 0.00 0.00 64.86 64.29 1p7m h ILE 96 Cb 0.09 0.50 -0.01 0.00 -3.07 0.00 0.00 36.82 34.32 1p7m h ILE 96 CO 0.00 0.09 -0.07 1.23 -0.69 0.00 0.00 178.15 178.71 1p7m h GLY 97 N 0.48 0.40 0.62 5.37 0.00 -1.42 -2.60 103.07 105.92 1p7m h GLY 97 Ca 0.17 -0.24 0.08 0.00 0.00 0.00 0.00 47.33 47.34 1p7m h GLY 97 CO -0.09 0.22 0.49 3.43 0.00 0.00 0.00 176.54 180.59 1p7m h ASN 98 N 0.36 0.74 -0.12 0.19 2.35 -0.70 0.27 115.58 118.66 1p7m h ASN 98 Ca 0.08 0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 1p7m h ASN 98 Cb 0.35 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.60 1p7m h ASN 98 CO 0.02 0.45 -0.05 0.00 -1.65 0.00 0.00 177.43 176.19 1p7m h ALA 99 N 1.43 0.16 -0.75 -0.83 0.00 -1.24 -2.70 119.26 115.33 1p7m h ALA 99 Ca 0.38 -0.25 0.08 0.00 0.00 0.00 0.00 54.91 55.12 1p7m h ALA 99 Cb 0.27 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1p7m h ALA 99 CO -0.21 -0.06 0.49 -0.09 0.00 0.00 0.00 179.25 179.38 1p7m h ARG 100 N -0.11 0.70 -0.11 0.00 2.43 -1.17 0.21 114.38 116.33 1p7m h ARG 100 Ca 0.03 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 1p7m h ARG 100 Cb 0.51 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1p7m h ARG 100 CO 0.02 0.46 -0.15 0.00 -1.51 0.00 0.00 179.97 178.79 1p7m h ALA 101 N 1.61 1.56 -0.57 2.80 0.00 -0.26 -1.26 119.26 123.14 1p7m h ALA 101 Ca 0.34 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1p7m h ALA 101 Cb 0.38 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1p7m h ALA 101 CO -0.12 0.32 0.20 -0.92 0.00 0.00 0.00 179.25 178.73 1p7m h TYR 102 N 0.16 0.90 -0.27 0.00 3.20 -0.27 -0.75 116.97 119.93 1p7m h TYR 102 Ca 0.03 -0.08 -0.02 0.00 3.14 0.00 0.00 58.73 61.81 1p7m h TYR 102 Cb 0.36 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 1p7m h TYR 102 CO 0.00 0.74 0.10 -0.07 -1.64 0.00 0.00 178.16 177.30 1p7m h LEU 103 N 0.79 0.34 -1.06 2.82 -0.00 -0.90 -1.23 115.31 116.06 1p7m h LEU 103 Ca 0.19 -0.03 -0.05 0.00 -0.00 0.00 0.00 57.88 57.99 1p7m h LEU 103 Cb 0.25 -0.09 -0.02 0.00 -0.00 0.00 0.00 40.66 40.80 1p7m h LEU 103 CO -0.01 0.32 0.13 1.56 -0.00 0.00 0.00 178.44 180.43 1p7m h GLN 104 N 0.38 0.80 -0.68 1.13 1.08 -0.08 -1.89 115.11 115.84 1p7m h GLN 104 Ca 0.10 -0.16 -0.06 0.00 -1.45 0.00 0.00 58.65 57.08 1p7m h GLN 104 Cb 0.09 -0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 27.37 1p7m h GLN 104 CO -0.01 0.72 0.20 1.98 -0.95 0.00 0.00 178.83 180.77 1p7m h MET 105 N 0.77 1.08 -0.76 1.46 4.05 -0.63 -2.34 114.93 118.55 1p7m h MET 105 Ca 0.17 -0.24 -0.03 0.00 -0.28 0.00 0.00 59.70 59.31 1p7m h MET 105 Cb 0.28 -0.15 -0.03 0.00 -0.80 0.00 0.00 31.60 30.90 1p7m h MET 105 CO -0.00 0.94 0.34 0.93 0.23 0.00 0.00 176.91 179.34 1p7m h GLU 106 N 1.01 1.10 0.00 0.39 4.39 -1.05 0.74 114.58 121.16 1p7m h GLU 106 Ca 0.22 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.74 1p7m h GLU 106 Cb 0.33 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1p7m h GLU 106 CO -0.00 0.87 -0.03 1.96 -1.16 0.00 0.00 179.01 180.64 1p7m h GLN 107 N 1.09 0.00 0.00 2.33 4.20 -0.86 0.63 115.11 122.49 1p7m h GLN 107 Ca 0.26 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.97 1p7m h GLN 107 Cb 0.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.93 1p7m h GLN 107 CO -0.03 0.03 -0.87 0.09 -0.67 0.00 0.00 178.83 177.39 1p7m n ASN 108 N -3.67 0.68 -1.35 1.46 4.13 0.14 -4.95 115.26 111.70 1p7m n ASN 108 Ca -0.03 0.04 -0.13 0.00 1.68 0.00 0.00 54.58 56.14 1p7m n ASN 108 Cb 0.13 0.48 -0.02 0.00 -1.54 0.00 0.00 39.78 38.83 1p7m n ASN 108 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1p7m n GLY 109 N 1.32 0.27 3.03 7.41 0.00 0.22 -4.98 105.19 112.45 1p7m n GLY 109 Ca 0.02 -0.36 -0.31 0.00 0.00 0.00 0.00 46.02 45.37 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 -4.22 1.63 0.22 1.61 2.56 -1.08 -5.01 118.70 114.41 1p7m s GLU 110 Ca 0.00 -1.78 -0.30 0.00 0.00 0.00 0.00 54.97 52.90 1p7m s GLU 110 Cb 0.00 -3.15 -0.15 0.00 2.00 0.00 0.00 34.13 32.83 1p7m s GLU 110 CO 0.00 -0.87 0.92 -2.30 -0.56 0.00 0.00 175.26 172.45 1p7m n PRO 111 N 4.29 0.89 -0.34 4.30 -0.02 -1.26 -4.77 135.00 138.09 1p7m n PRO 111 Ca 0.01 0.31 0.13 0.00 -2.02 0.00 0.00 63.50 61.93 1p7m n PRO 111 Cb 0.42 -1.62 0.34 0.00 -0.02 0.00 0.00 33.50 32.62 1p7m n PRO 111 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1p7m h PHE 112 N 2.12 1.00 0.00 6.00 3.57 -1.91 0.60 116.94 128.31 1p7m h PHE 112 Ca -0.38 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.11 1p7m h PHE 112 Cb 1.37 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.80 1p7m h PHE 112 CO 0.48 0.26 -0.20 0.00 -2.23 0.00 0.00 178.31 176.62 1p7m h ALA 113 N 1.62 1.19 -0.08 2.41 0.00 -1.86 -3.04 119.26 119.50 1p7m h ALA 113 Ca 0.55 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 1p7m h ALA 113 Cb 0.88 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 1p7m h ALA 113 CO -0.33 0.25 -0.01 0.22 0.00 0.00 0.00 179.25 179.38 1p7m h ASP 114 N 0.00 0.14 0.02 0.00 3.58 -0.10 -2.23 116.42 117.84 1p7m h ASP 114 Ca -0.00 -0.33 -0.22 0.00 0.42 0.00 0.00 57.03 56.90 1p7m h ASP 114 Cb 0.54 -0.04 0.01 0.00 1.72 0.00 0.00 39.33 41.56 1p7m h ASP 114 CO 0.03 0.44 -0.81 2.19 -2.88 0.00 0.00 179.24 178.20 1p7m h PHE 115 N -0.15 0.90 0.17 0.28 -0.00 -1.52 -2.58 116.94 114.03 1p7m h PHE 115 Ca 0.02 -0.41 -0.01 0.00 -0.00 0.00 0.00 57.97 57.57 1p7m h PHE 115 Cb 0.37 -0.13 0.00 0.00 -0.00 0.00 0.00 35.95 36.19 1p7m h PHE 115 CO 0.04 1.23 -0.08 -0.39 -0.00 0.00 0.00 178.31 179.11 1p7m h VAL 116 N 0.43 0.95 -0.35 0.88 -1.51 -1.60 -0.08 116.25 114.97 1p7m h VAL 116 Ca -0.06 -0.69 0.10 0.00 -1.23 0.00 0.00 66.70 64.82 1p7m h VAL 116 Cb 1.43 1.36 -0.01 0.00 -2.13 0.00 0.00 31.29 31.94 1p7m h VAL 116 CO 0.16 0.16 0.33 -0.50 -1.23 0.00 0.00 177.57 176.48 1p7m h TRP 117 N -0.57 0.00 0.01 5.19 4.06 -1.49 -0.01 115.95 123.14 1p7m h TRP 117 Ca -0.02 0.00 -0.27 0.00 2.06 0.00 0.00 58.89 60.65 1p7m h TRP 117 Cb 0.43 0.00 0.02 0.00 -1.00 0.00 0.00 29.16 28.62 1p7m h TRP 117 CO 0.03 0.00 -1.07 1.03 -3.56 0.00 0.00 178.44 174.87 1p7m h SER 118 N 0.00 0.92 0.02 -3.49 0.87 -0.96 1.25 113.55 112.16 1p7m h SER 118 Ca 0.17 -0.75 -0.00 0.00 -1.23 0.00 0.00 61.79 59.98 1p7m h SER 118 Cb 0.82 -0.28 -0.00 0.00 -0.44 0.00 0.00 62.40 62.50 1p7m h SER 118 CO -0.00 1.55 -0.01 -0.26 -0.53 0.00 0.00 176.83 177.58 1p7m h PHE 119 N 0.39 0.00 -0.57 2.24 -1.00 0.88 0.16 116.94 119.04 1p7m h PHE 119 Ca -0.14 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.64 1p7m h PHE 119 Cb 1.73 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.29 1p7m h PHE 119 CO 0.10 0.01 0.00 1.33 -1.61 0.00 0.00 178.31 178.14 1p7m n VAL 120 N -3.78 2.60 -3.15 -0.55 0.24 -1.07 -4.69 118.33 107.92 1p7m n VAL 120 Ca -0.03 -1.41 -0.23 0.00 -2.04 0.00 0.00 64.34 60.64 1p7m n VAL 120 Cb 0.09 -0.21 0.04 0.00 -1.47 0.00 0.00 33.84 32.29 1p7m n VAL 120 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1p7m n ASN 121 N 0.64 -6.15 -3.54 -1.34 3.02 0.56 -2.20 115.26 106.24 1p7m n ASN 121 Ca 0.27 -0.35 -0.26 0.00 -0.03 0.00 0.00 54.58 54.21 1p7m n ASN 121 Cb 1.14 -4.94 0.01 0.00 -0.61 0.00 0.00 39.78 35.38 1p7m n ASN 121 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1p7m n HIS 122 N -4.62 -2.02 -3.73 3.10 8.25 0.43 -4.95 115.22 111.68 1p7m n HIS 122 Ca -0.09 0.66 -0.14 0.00 -0.26 0.00 0.00 57.72 57.89 1p7m n HIS 122 Cb 0.61 -3.62 -0.08 0.00 1.12 0.00 0.00 29.99 28.02 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 -6.22 0.72 0.55 -0.41 -2.07 -0.94 -5.07 119.66 106.23 1p7m s GLN 123 Ca 0.50 -0.12 -0.19 0.00 -1.82 0.00 0.00 55.36 53.73 1p7m s GLN 123 Cb -0.25 0.32 -0.06 0.00 -1.09 0.00 0.00 33.01 31.94 1p7m s GLN 123 CO 0.61 -0.20 1.11 -1.25 -1.32 0.00 0.00 175.29 174.24 1p7m s PRO 124 N -1.29 3.37 -0.17 9.60 0.04 -1.26 -4.82 135.00 140.47 1p7m s PRO 124 Ca -0.13 1.53 -0.08 0.00 0.04 0.00 0.00 61.00 62.36 1p7m s PRO 124 Cb -0.04 -2.02 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 1p7m s PRO 124 CO 0.05 -0.82 0.09 -1.14 0.04 0.00 0.00 177.00 175.22 1p7m s GLN 125 N -3.40 3.90 -0.30 4.56 -0.44 0.65 -4.93 119.66 119.69 1p7m s GLN 125 Ca 0.71 -0.29 -0.17 0.00 -2.50 0.00 0.00 55.36 53.11 1p7m s GLN 125 Cb -0.22 -3.24 -0.02 0.00 -1.64 0.00 0.00 33.01 27.89 1p7m s GLN 125 CO 0.28 0.38 0.46 -1.64 0.50 0.00 0.00 175.29 175.27 1p7m s MET 126 N 0.09 3.85 -0.27 1.67 -1.94 -1.26 -0.12 119.30 121.32 1p7m s MET 126 Ca 0.07 0.01 -0.17 0.00 -1.71 0.00 0.00 55.69 53.88 1p7m s MET 126 Cb -0.12 -3.72 -0.03 0.00 2.01 0.00 0.00 34.83 32.97 1p7m s MET 126 CO 0.00 -0.45 0.49 0.99 -0.01 0.00 0.00 175.02 176.05 1p7m s THR 127 N 2.24 5.08 -0.54 2.05 2.01 -0.25 -4.93 115.64 121.31 1p7m s THR 127 Ca 0.18 0.77 0.07 0.00 0.31 0.00 0.00 61.69 63.01 1p7m s THR 127 Cb -0.16 -3.82 0.43 0.00 0.01 0.00 0.00 72.50 68.96 1p7m s THR 127 CO 0.11 0.07 1.22 0.00 -0.69 0.00 0.00 174.62 175.32 1p7m n GLN 128 N 5.53 2.89 -2.14 4.92 6.02 -1.26 -4.68 117.38 128.66 1p7m n GLN 128 Ca -0.05 -1.68 -0.39 0.00 -0.01 0.00 0.00 57.00 54.87 1p7m n GLN 128 Cb 0.50 -1.87 -0.01 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 -1.92 3.30 -0.08 -1.58 0.00 -1.26 -4.73 121.76 115.49 1p7m s ALA 129 Ca 0.29 1.16 0.13 0.00 0.00 0.00 0.00 51.96 53.55 1p7m s ALA 129 Cb 0.23 -3.45 -0.20 0.00 0.00 0.00 0.00 23.12 19.70 1p7m s ALA 129 CO 0.08 -0.68 0.18 0.25 0.00 0.00 0.00 175.76 175.59 1p7m n THR 130 N 0.32 0.47 -4.33 0.00 -2.24 -1.26 -0.85 114.28 106.38 1p7m n THR 130 Ca 0.03 -0.46 -0.17 0.00 -2.27 0.00 0.00 64.05 61.18 1p7m n THR 130 Cb 0.44 -0.24 -0.10 0.00 -2.10 0.00 0.00 70.33 68.33 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 -2.67 1.19 0.39 4.28 -4.23 -1.26 -4.51 115.64 108.83 1p7m s THR 131 Ca -0.06 -2.06 0.09 0.00 -1.18 0.00 0.00 61.69 58.47 1p7m s THR 131 Cb 0.07 -2.26 0.30 0.00 1.34 0.00 0.00 72.50 71.94 1p7m s THR 131 CO 0.58 -0.40 1.99 -0.07 -0.54 0.00 0.00 174.62 176.17 1p7m h LEU 132 N 2.50 0.53 -1.33 4.79 3.38 -1.95 0.07 115.31 123.31 1p7m h LEU 132 Ca -0.38 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.58 1p7m h LEU 132 Cb 1.22 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.83 1p7m h LEU 132 CO 0.65 0.35 0.31 -1.28 0.09 0.00 0.00 178.44 178.55 1p7m h SER 133 N 0.61 0.68 0.00 -0.43 0.87 -2.01 0.65 113.55 113.92 1p7m h SER 133 Ca 0.27 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.78 1p7m h SER 133 Cb 0.28 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.07 1p7m h SER 133 CO -0.08 0.55 0.00 -0.62 -0.53 0.00 0.00 176.83 176.15 1p7m n GLU 134 N -4.40 0.93 -2.68 2.24 1.02 -0.01 -4.75 120.64 112.99 1p7m n GLU 134 Ca 0.05 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.77 1p7m n GLU 134 Cb 0.10 -1.47 -0.03 0.00 -0.02 0.00 0.00 31.44 30.02 1p7m n GLU 134 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 1p7m s ILE 135 N -2.00 4.77 0.09 -3.67 1.10 0.22 -4.55 121.20 117.16 1p7m s ILE 135 Ca 0.42 2.03 -0.30 0.00 -0.51 0.00 0.00 60.65 62.29 1p7m s ILE 135 Cb 0.19 -4.31 -0.06 0.00 0.15 0.00 0.00 42.46 38.44 1p7m s ILE 135 CO 0.33 0.02 1.10 -2.16 -2.11 0.00 0.00 174.94 172.12 1p7m s PRO 136 N 1.91 4.53 0.00 3.50 0.04 -1.26 -4.92 135.00 138.80 1p7m s PRO 136 Ca 0.49 1.66 0.10 0.00 0.04 0.00 0.00 61.00 63.28 1p7m s PRO 136 Cb -0.19 -3.35 0.22 0.00 0.04 0.00 0.00 34.50 31.22 1p7m s PRO 136 CO 0.19 -0.06 1.11 0.25 0.04 0.00 0.00 177.00 178.53 1p7m n THR 137 N 3.30 0.71 -3.39 1.26 -2.24 -1.26 -4.81 114.28 107.85 1p7m n THR 137 Ca 0.06 -0.86 -0.22 0.00 -2.27 0.00 0.00 64.05 60.76 1p7m n THR 137 Cb 0.47 0.70 -0.09 0.00 -2.10 0.00 0.00 70.33 69.31 1p7m n THR 137 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1p7m s SER 138 N -0.95 1.78 0.12 3.42 0.01 -1.26 -4.45 113.70 112.36 1p7m s SER 138 Ca 0.18 -1.89 0.06 0.00 1.31 0.00 0.00 55.95 55.60 1p7m s SER 138 Cb 0.10 0.19 -0.04 0.00 0.21 0.00 0.00 66.02 66.48 1p7m s SER 138 CO 0.14 -0.27 0.02 0.42 0.41 0.00 0.00 173.24 173.96 1p7m s THR 139 N 1.20 3.99 0.42 1.44 -4.23 -1.26 -4.93 115.64 112.27 1p7m s THR 139 Ca 0.18 -1.13 0.16 0.00 -1.18 0.00 0.00 61.69 59.73 1p7m s THR 139 Cb -0.17 -2.95 0.36 0.00 1.34 0.00 0.00 72.50 71.08 1p7m s THR 139 CO -0.02 0.03 1.90 1.55 -0.54 0.00 0.00 174.62 177.53 1p7m h PRO 140 N 3.10 0.42 -0.08 3.99 0.13 -1.99 1.02 132.00 138.60 1p7m h PRO 140 Ca -0.47 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 64.54 1p7m h PRO 140 Cb 1.18 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1p7m h PRO 140 CO 0.60 0.28 -0.31 0.00 -0.23 0.00 0.00 178.00 178.34 1p7m h ALA 141 N 1.63 0.14 -0.29 -0.56 0.00 -1.95 -1.55 119.26 116.68 1p7m h ALA 141 Ca 0.41 -0.43 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 1p7m h ALA 141 Cb 0.93 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1p7m h ALA 141 CO -0.14 0.19 -0.35 0.66 0.00 0.00 0.00 179.25 179.60 1p7m h SER 142 N -0.13 0.69 -0.69 0.00 4.64 -1.51 -0.90 113.55 115.65 1p7m h SER 142 Ca -0.02 -0.29 -0.05 0.00 -0.47 0.00 0.00 61.79 60.97 1p7m h SER 142 Cb 0.95 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.82 1p7m h SER 142 CO 0.06 0.98 0.24 0.44 -0.87 0.00 0.00 176.83 177.68 1p7m h ASP 143 N 0.55 0.99 0.69 4.97 3.32 0.10 -0.91 116.42 126.13 1p7m h ASP 143 Ca 0.06 -0.17 -0.08 0.00 0.02 0.00 0.00 57.03 56.86 1p7m h ASP 143 Cb 0.86 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 1p7m h ASP 143 CO 0.07 0.91 -0.39 0.00 -1.72 0.00 0.00 179.24 178.11 1p7m h ALA 144 N 1.23 1.08 -0.22 3.45 0.00 -0.96 -2.97 119.26 120.87 1p7m h ALA 144 Ca 0.23 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 1p7m h ALA 144 Cb 0.25 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1p7m h ALA 144 CO -0.01 0.49 -0.15 1.25 0.00 0.00 0.00 179.25 180.82 1p7m h LEU 145 N 0.00 0.52 -0.25 0.00 5.85 0.16 -2.10 115.31 119.49 1p7m h LEU 145 Ca -0.00 -0.44 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 1p7m h LEU 145 Cb 0.84 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 1p7m h LEU 145 CO 0.05 0.85 0.11 -1.28 -0.34 0.00 0.00 178.44 177.83 1p7m h SER 146 N 0.19 0.33 -0.48 1.25 0.87 -1.21 0.89 113.55 115.38 1p7m h SER 146 Ca 0.04 -0.14 -0.07 0.00 -1.23 0.00 0.00 61.79 60.39 1p7m h SER 146 Cb 0.68 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.53 1p7m h SER 146 CO 0.04 0.37 0.04 0.07 -0.53 0.00 0.00 176.83 176.82 1p7m h LYS 147 N 0.26 0.89 -0.21 2.24 2.10 -1.55 0.11 116.57 120.40 1p7m h LYS 147 Ca 0.08 -0.23 -0.08 0.00 -2.00 0.00 0.00 60.65 58.42 1p7m h LYS 147 Cb 0.14 -0.11 -0.00 0.00 -0.90 0.00 0.00 32.23 31.36 1p7m h LYS 147 CO -0.01 0.86 -0.18 0.00 -2.00 0.00 0.00 179.45 178.12 1p7m h ALA 148 N 1.21 0.31 -0.67 0.07 0.00 -1.16 -2.80 119.26 116.22 1p7m h ALA 148 Ca 0.16 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1p7m h ALA 148 Cb 0.44 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1p7m h ALA 148 CO 0.02 0.22 0.24 -0.07 0.00 0.00 0.00 179.25 179.66 1p7m h LEU 149 N 0.19 0.92 -0.83 0.00 -0.00 -0.64 -2.73 115.31 112.22 1p7m h LEU 149 Ca 0.04 -0.14 -0.01 0.00 -0.00 0.00 0.00 57.88 57.76 1p7m h LEU 149 Cb 0.71 -0.24 -0.04 0.00 -0.00 0.00 0.00 40.66 41.09 1p7m h LEU 149 CO 0.05 0.84 0.47 0.50 -0.00 0.00 0.00 178.44 180.30 1p7m h LYS 150 N 0.97 1.14 -0.30 1.13 3.64 -0.87 -0.40 116.57 121.88 1p7m h LYS 150 Ca 0.22 -0.12 -0.12 0.00 -1.27 0.00 0.00 60.65 59.36 1p7m h LYS 150 Cb 0.23 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1p7m h LYS 150 CO -0.01 0.82 -0.32 0.87 -2.27 0.00 0.00 179.45 178.54 1p7m h LYS 151 N 1.15 0.65 0.00 1.90 1.57 -1.22 -2.59 116.57 118.02 1p7m h LYS 151 Ca 0.29 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1p7m h LYS 151 Cb -0.00 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.30 1p7m h LYS 151 CO -0.05 0.89 0.00 0.54 -0.57 0.00 0.00 179.45 180.26 1p7m n ARG 152 N -4.07 0.56 -1.08 3.15 1.74 -1.09 -4.73 116.66 111.13 1p7m n ARG 152 Ca -0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 1p7m n ARG 152 Cb 0.48 -1.15 0.00 0.00 -1.02 0.00 0.00 32.46 30.77 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 0.07 0.51 3.52 -0.13 0.00 -0.98 -4.54 105.19 103.64 1p7m n GLY 153 Ca 0.04 -0.89 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 1p7m n GLY 153 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1p7m s PHE 154 N -2.00 3.17 0.58 1.61 2.19 -0.18 -4.54 117.98 118.80 1p7m s PHE 154 Ca 0.00 -0.10 0.05 0.00 0.33 0.00 0.00 56.93 57.21 1p7m s PHE 154 Cb 0.00 -2.91 0.07 0.00 -1.31 0.00 0.00 43.02 38.87 1p7m s PHE 154 CO 0.00 -0.62 0.80 0.15 1.83 0.00 0.00 175.22 177.38 1p7m s LYS 155 N 2.27 2.28 -1.23 10.12 1.02 -1.26 -3.83 119.74 129.11 1p7m s LYS 155 Ca 0.15 -1.25 -0.01 0.00 0.02 0.00 0.00 55.97 54.88 1p7m s LYS 155 Cb -0.16 -2.55 0.00 0.00 -0.52 0.00 0.00 37.83 34.60 1p7m s LYS 155 CO 0.14 -0.88 1.01 1.19 -0.92 0.00 0.00 175.35 175.89 1p7m n PHE 156 N -2.35 -2.27 -2.23 3.18 3.01 -1.26 -4.92 117.46 110.62 1p7m n PHE 156 Ca 0.12 0.95 -0.22 0.00 1.01 0.00 0.00 57.45 59.31 1p7m n PHE 156 Cb 0.60 -5.05 0.02 0.00 -0.01 0.00 0.00 39.48 35.05 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 -4.25 2.33 -0.87 -4.37 0.24 -1.26 -4.10 118.33 106.05 1p7m n VAL 157 Ca -0.25 -4.27 -0.34 0.00 -2.04 0.00 0.00 64.34 57.44 1p7m n VAL 157 Cb 0.66 -0.92 0.09 0.00 -1.47 0.00 0.00 33.84 32.20 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 -0.62 -3.03 0.34 7.63 0.00 -1.26 -4.29 105.19 103.97 1p7m n GLY 158 Ca 0.39 -0.77 0.14 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.35 0.86 -0.00 2.61 2.02 -1.95 0.31 112.91 115.40 1p7m h THR 159 Ca -0.44 -0.04 -0.18 0.00 0.77 0.00 0.00 66.41 66.53 1p7m h THR 159 Cb 1.29 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 68.43 1p7m h THR 159 CO 0.30 0.02 -0.81 0.71 0.37 0.00 0.00 175.52 176.10 1p7m h THR 160 N 0.10 1.52 -0.13 3.16 1.35 -1.87 -2.12 112.91 114.92 1p7m h THR 160 Ca 0.18 -2.61 -0.18 0.00 -0.55 0.00 0.00 66.41 63.25 1p7m h THR 160 Cb 0.58 2.43 -0.00 0.00 -1.73 0.00 0.00 68.15 69.42 1p7m h THR 160 CO -0.02 0.75 -0.66 0.40 -0.25 0.00 0.00 175.52 175.75 1p7m h ILE 161 N 0.06 1.34 -0.40 6.82 2.04 -0.82 -1.61 117.51 124.95 1p7m h ILE 161 Ca -0.02 -1.97 -0.14 0.00 1.00 0.00 0.00 64.86 63.72 1p7m h ILE 161 Cb 1.42 1.95 -0.01 0.00 -0.74 0.00 0.00 36.82 39.45 1p7m h ILE 161 CO 0.12 0.60 -0.31 0.00 0.00 0.00 0.00 178.15 178.56 1p7m h TYR 163 N 0.73 0.56 -0.86 0.00 3.20 -1.33 -2.46 116.97 116.80 1p7m h TYR 163 Ca 0.07 -0.12 -0.01 0.00 3.14 0.00 0.00 58.73 61.81 1p7m h TYR 163 Cb 0.90 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.99 1p7m h TYR 163 CO 0.06 0.72 0.48 1.03 -1.64 0.00 0.00 178.16 178.81 1p7m h SER 164 N 0.24 1.06 -0.28 -2.11 0.87 -1.26 0.64 113.55 112.71 1p7m h SER 164 Ca 0.06 -0.08 0.02 0.00 -1.23 0.00 0.00 61.79 60.56 1p7m h SER 164 Cb 0.54 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.20 1p7m h SER 164 CO 0.03 0.84 0.13 0.15 -0.53 0.00 0.00 176.83 177.45 1p7m h PHE 165 N 1.20 0.24 -0.21 2.24 3.04 -1.04 0.23 116.94 122.65 1p7m h PHE 165 Ca 0.31 0.01 -0.20 0.00 3.98 0.00 0.00 57.97 62.06 1p7m h PHE 165 Cb 0.01 -0.07 0.00 0.00 2.56 0.00 0.00 35.95 38.45 1p7m h PHE 165 CO 0.01 0.13 -0.67 0.52 -2.02 0.00 0.00 178.31 176.28 1p7m h MET 166 N 0.28 0.81 -0.56 1.11 0.00 -1.07 0.15 114.93 115.65 1p7m h MET 166 Ca 0.12 -0.59 -0.04 0.00 0.00 0.00 0.00 59.70 59.19 1p7m h MET 166 Cb 0.04 0.10 -0.02 0.00 0.00 0.00 0.00 31.60 31.72 1p7m h MET 166 CO -0.09 1.21 0.21 0.37 0.00 0.00 0.00 176.91 178.61 1p7m h GLN 167 N 0.58 0.84 0.13 1.72 -0.00 -0.59 -1.53 115.11 116.28 1p7m h GLN 167 Ca -0.02 -0.16 -0.30 0.00 -0.00 0.00 0.00 58.65 58.17 1p7m h GLN 167 Cb 1.29 -0.13 0.02 0.00 0.00 0.00 0.00 27.48 28.66 1p7m h GLN 167 CO 0.14 0.74 -1.26 0.00 0.00 0.00 0.00 178.83 178.45 1p7m h ALA 168 N 1.06 0.02 0.00 3.38 0.00 -0.54 -3.13 119.26 120.06 1p7m h ALA 168 Ca 0.18 -0.80 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1p7m h ALA 168 Cb 0.22 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1p7m h ALA 168 CO -0.01 0.75 0.23 0.00 0.00 0.00 0.00 179.25 180.22 1p7m n GLY 170 N -1.25 0.49 0.25 0.00 0.00 -1.12 -3.98 105.19 99.59 1p7m n GLY 170 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.06 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 0.10 -8.87 0.99 3.38 -1.50 -3.42 115.31 106.00 1p7m h LEU 171 Ca 0.00 -0.01 -0.69 0.00 0.09 0.00 0.00 57.88 57.27 1p7m h LEU 171 Cb 0.00 -0.03 -0.24 0.00 0.09 0.00 0.00 40.66 40.48 1p7m h LEU 171 CO 0.00 0.17 -0.81 -0.69 0.09 0.00 0.00 178.44 177.20 1p7m s VAL 172 N -4.93 2.75 0.26 1.22 1.01 -1.17 -0.25 120.40 119.28 1p7m s VAL 172 Ca -0.05 -0.99 0.08 0.00 0.00 0.00 0.00 61.98 61.02 1p7m s VAL 172 Cb 0.16 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.40 1p7m s VAL 172 CO 0.70 0.49 -0.11 0.20 0.00 0.00 0.00 175.10 176.37 1p7m s ASN 173 N -0.99 2.85 0.00 3.32 0.01 0.82 -4.80 114.94 116.15 1p7m s ASN 173 Ca 0.12 -1.11 0.00 0.00 -0.71 0.00 0.00 52.86 51.17 1p7m s ASN 173 Cb -0.10 -0.18 0.00 0.00 0.41 0.00 0.00 41.25 41.37 1p7m s ASN 173 CO 0.02 -0.22 0.00 -0.67 -1.51 0.00 0.00 177.10 174.72 1p7m n ASP 174 N -0.52 -1.07 0.11 -1.22 -0.08 -1.26 -1.09 116.55 111.42 1p7m n ASP 174 Ca -0.06 0.00 -0.16 0.00 -1.51 0.00 0.00 54.79 53.06 1p7m n ASP 174 Cb 0.62 -0.52 -0.09 0.00 2.34 0.00 0.00 41.12 43.47 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 -1.42 -3.93 -0.67 3.86 -1.92 -3.40 115.15 107.68 1p7m h HIS 175 Ca 0.00 0.04 -0.21 0.00 -1.16 0.00 0.00 60.37 59.04 1p7m h HIS 175 Cb 0.54 0.60 -0.15 0.00 1.06 0.00 0.00 27.41 29.46 1p7m h HIS 175 CO 0.00 -0.57 -0.69 0.14 0.86 0.00 0.00 177.93 177.67 1p7m s VAL 176 N -5.82 0.57 -0.14 2.45 -7.23 -1.26 -4.70 120.40 104.26 1p7m s VAL 176 Ca -0.16 -1.91 -0.29 0.00 -1.81 0.00 0.00 61.98 57.81 1p7m s VAL 176 Cb 0.07 -1.71 -0.06 0.00 0.56 0.00 0.00 36.38 35.23 1p7m s VAL 176 CO 0.62 -0.84 2.15 -0.69 -0.31 0.00 0.00 175.10 176.02 1p7m s VAL 177 N -3.71 3.01 -0.13 1.32 1.01 -0.03 -3.07 120.40 118.79 1p7m s VAL 177 Ca 0.13 0.01 -0.00 0.00 0.00 0.00 0.00 61.98 62.11 1p7m s VAL 177 Cb 0.06 -3.01 -0.00 0.00 0.00 0.00 0.00 36.38 33.43 1p7m s VAL 177 CO -0.05 -0.01 0.12 0.61 0.00 0.00 0.00 175.10 175.78 1p7m n GLY 178 N 5.39 -0.18 2.95 4.51 0.00 -1.24 -4.92 105.19 111.71 1p7m n GLY 178 Ca 0.27 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 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 0.00 3.12 0.19 0.00 5.04 -1.20 -5.03 117.35 119.47 1p7m s TYR 182 Ca 0.00 0.58 -0.30 0.00 -2.44 0.00 0.00 57.07 54.92 1p7m s TYR 182 Cb 0.00 -3.38 -0.08 0.00 0.35 0.00 0.00 41.96 38.85 1p7m s TYR 182 CO 0.00 -0.72 1.05 -1.25 -1.34 0.00 0.00 175.55 173.29 1p7m s PRO 183 N 3.09 4.66 0.00 4.97 0.04 -1.26 -3.57 135.00 142.93 1p7m s PRO 183 Ca 0.31 1.65 0.00 0.00 0.04 0.00 0.00 61.00 63.00 1p7m s PRO 183 Cb -0.13 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 31.13 1p7m s PRO 183 CO 0.16 0.19 0.03 0.41 0.04 0.00 0.00 177.00 177.84 1p7m n GLY 184 N 1.87 0.83 0.10 0.56 0.00 -1.26 -4.90 105.19 102.39 1p7m n GLY 184 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.90 1p7m n GLY 184 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1p7m n ASN 185 N -0.17 1.92 -4.93 1.61 6.94 -1.26 -4.98 115.26 114.39 1p7m n ASN 185 Ca 0.00 0.38 -0.28 0.00 -0.02 0.00 0.00 54.58 54.66 1p7m n ASN 185 Cb 0.05 -0.78 -0.03 0.00 -2.36 0.00 0.00 39.78 36.66 1p7m n ASN 185 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1p7m s LYS 186 N -2.71 3.46 0.00 -3.83 1.02 -1.26 -5.27 119.74 111.15 1p7m s LYS 186 Ca -0.29 -0.50 0.15 0.00 0.02 0.00 0.00 55.97 55.34 1p7m s LYS 186 Cb 0.06 -2.97 0.87 0.00 -0.52 0.00 0.00 37.83 35.27 1p7m s LYS 186 CO 0.42 0.53 1.28 -0.35 -0.92 0.00 0.00 175.35 176.32