#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 3.49 1.04 2.12 2.12 -1.26 -4.53 118.70 121.67 1p7m s GLU 2 Ca 0.00 -0.20 -0.13 0.00 0.36 0.00 0.00 54.97 55.00 1p7m s GLU 2 Cb 0.00 -3.11 0.21 0.00 0.26 0.00 0.00 34.13 31.49 1p7m s GLU 2 CO 0.00 0.69 1.09 0.50 -0.54 0.00 0.00 175.26 177.00 1p7m s ARG 3 N -1.67 0.12 0.50 4.30 3.52 -1.26 -0.87 118.95 123.58 1p7m s ARG 3 Ca 0.24 0.49 -0.19 0.00 -0.13 0.00 0.00 55.73 56.15 1p7m s ARG 3 Cb -0.13 -1.70 -0.14 0.00 -1.56 0.00 0.00 34.95 31.42 1p7m s ARG 3 CO 0.15 -2.94 0.09 0.00 -0.81 0.00 0.00 175.30 171.79 1p7m h GLY 5 N 0.14 0.33 -0.01 0.00 0.00 -1.99 -2.96 103.07 98.58 1p7m h GLY 5 Ca -0.41 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.49 1p7m h GLY 5 CO 0.44 0.38 0.00 -2.67 0.00 0.00 0.00 176.54 174.69 1p7m n TRP 6 N -3.87 0.06 -0.06 5.60 2.14 -1.26 -3.44 117.44 116.60 1p7m n TRP 6 Ca -0.03 -0.03 -0.11 0.00 2.07 0.00 0.00 57.50 59.40 1p7m n TRP 6 Cb 0.64 0.00 -0.05 0.00 -0.81 0.00 0.00 31.31 31.09 1p7m n TRP 6 CO 0.00 0.00 0.00 1.33 2.07 0.00 0.00 177.69 181.09 1p7m n VAL 7 N -0.25 0.71 0.30 -1.67 0.24 -1.20 -4.39 118.33 112.07 1p7m n VAL 7 Ca 0.18 -0.22 0.16 0.00 -2.04 0.00 0.00 64.34 62.42 1p7m n VAL 7 Cb 0.23 -1.32 0.75 0.00 -1.47 0.00 0.00 33.84 32.03 1p7m n VAL 7 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1p7m h SER 8 N -0.25 0.00 -0.62 -1.34 4.64 -1.68 -1.76 113.55 112.54 1p7m h SER 8 Ca -0.31 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.94 1p7m h SER 8 Cb 1.36 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.42 1p7m h SER 8 CO -0.13 0.00 0.08 -0.61 -0.87 0.00 0.00 176.83 175.30 1p7m h GLN 9 N 0.00 1.04 -3.46 4.77 5.75 -1.76 -3.46 115.11 117.99 1p7m h GLN 9 Ca 0.00 -0.29 -0.05 0.00 -0.15 0.00 0.00 58.65 58.16 1p7m h GLN 9 Cb 0.23 -0.12 -0.12 0.00 1.07 0.00 0.00 27.48 28.55 1p7m h GLN 9 CO 0.00 0.98 -0.08 0.16 -2.65 0.00 0.00 178.83 177.24 1p7m s ASP 10 N -6.45 -0.18 0.18 -0.69 -4.77 -0.66 -5.13 116.67 98.97 1p7m s ASP 10 Ca -0.12 -0.51 0.00 0.00 -3.30 0.00 0.00 52.55 48.62 1p7m s ASP 10 Cb 0.13 0.51 0.00 0.00 -1.09 0.00 0.00 42.92 42.48 1p7m s ASP 10 CO 0.84 -0.95 0.00 -0.81 0.70 0.00 0.00 175.17 174.95 1p7m n PRO 11 N -0.27 0.61 0.00 2.11 -0.04 -1.26 -4.11 135.00 132.04 1p7m n PRO 11 Ca -0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 1p7m n PRO 11 Cb 0.63 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.09 1p7m n PRO 11 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1p7m n LEU 12 N 0.00 0.00 -0.17 1.53 4.77 -1.26 -4.13 117.00 117.74 1p7m n LEU 12 Ca 0.00 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.94 1p7m n LEU 12 Cb 0.00 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.14 1p7m n LEU 12 CO 0.00 0.00 1.02 1.88 -1.33 0.00 0.00 177.39 178.96 1p7m h TYR 13 N 0.00 0.47 -0.80 -1.77 0.05 -1.88 -2.07 116.97 110.97 1p7m h TYR 13 Ca 0.00 0.02 0.10 0.00 0.05 0.00 0.00 58.73 58.90 1p7m h TYR 13 Cb 0.00 -0.14 -0.07 0.00 1.01 0.00 0.00 36.73 37.53 1p7m h TYR 13 CO 0.00 0.23 0.43 0.82 -1.05 0.00 0.00 178.16 178.59 1p7m h ILE 14 N 0.50 0.87 -0.70 -2.88 2.04 -1.75 1.25 117.51 116.84 1p7m h ILE 14 Ca 0.23 -0.25 -0.04 0.00 1.00 0.00 0.00 64.86 65.79 1p7m h ILE 14 Cb 0.14 0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.28 1p7m h ILE 14 CO -0.16 0.13 0.27 0.00 0.00 0.00 0.00 178.15 178.39 1p7m h ALA 15 N 1.46 0.91 -0.04 1.87 0.00 -1.73 -2.25 119.26 119.48 1p7m h ALA 15 Ca 0.39 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.98 1p7m h ALA 15 Cb 0.40 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1p7m h ALA 15 CO -0.27 0.55 -0.58 -0.92 0.00 0.00 0.00 179.25 178.03 1p7m h TYR 16 N 1.01 0.16 -0.40 0.00 3.20 -0.47 -2.65 116.97 117.82 1p7m h TYR 16 Ca 0.23 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 62.01 1p7m h TYR 16 Cb 0.23 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 1p7m h TYR 16 CO 0.02 0.68 0.12 1.25 -1.64 0.00 0.00 178.16 178.59 1p7m h HIS 17 N 0.10 0.65 -0.01 -3.82 2.76 0.21 -3.21 115.15 111.81 1p7m h HIS 17 Ca -0.00 -0.07 0.00 0.00 -2.20 0.00 0.00 60.37 58.10 1p7m h HIS 17 Cb 1.06 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 29.83 1p7m h HIS 17 CO 0.01 0.61 -0.40 -0.25 -1.30 0.00 0.00 177.93 176.60 1p7m n ASP 18 N -4.59 1.85 0.02 3.26 8.00 -1.03 -3.47 116.55 120.60 1p7m n ASP 18 Ca -0.00 -1.41 0.11 0.00 0.71 0.00 0.00 54.79 54.20 1p7m n ASP 18 Cb 0.18 0.37 -0.05 0.00 -0.02 0.00 0.00 41.12 41.61 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 -0.09 0.54 0.00 -2.24 2.04 -1.00 -4.78 115.26 109.73 1p7m n ASN 19 Ca 0.10 -0.23 0.00 0.00 -0.44 0.00 0.00 54.58 54.01 1p7m n ASN 19 Cb 0.45 1.09 0.00 0.00 -2.53 0.00 0.00 39.78 38.78 1p7m n ASN 19 CO 0.00 0.00 0.00 -1.84 -0.44 0.00 0.00 177.26 174.98 1p7m n GLU 20 N -2.03 0.00 -3.62 -3.83 0.28 -1.21 -4.93 120.64 105.30 1p7m n GLU 20 Ca 0.01 0.00 -0.28 0.00 -0.16 0.00 0.00 57.16 56.73 1p7m n GLU 20 Cb 0.46 0.00 -0.12 0.00 1.43 0.00 0.00 31.44 33.22 1p7m n GLU 20 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 177.13 176.51 1p7m s TRP 21 N 0.00 1.96 0.00 -1.84 -0.11 -1.23 -4.66 118.94 113.06 1p7m s TRP 21 Ca 0.00 -2.57 0.00 0.00 1.22 0.00 0.00 56.10 54.75 1p7m s TRP 21 Cb 0.00 -1.65 0.00 0.00 -1.50 0.00 0.00 33.47 30.32 1p7m s TRP 21 CO 0.00 -0.74 0.00 0.41 -4.62 0.00 0.00 176.95 172.00 1p7m n GLY 22 N 2.89 2.34 0.00 5.86 0.00 -1.26 -4.85 105.19 110.18 1p7m n GLY 22 Ca 0.20 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.27 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 -0.26 0.00 -2.76 1.61 0.24 -1.26 -4.81 118.33 111.09 1p7m n VAL 23 Ca 0.00 -0.26 -0.33 0.00 -2.04 0.00 0.00 64.34 61.71 1p7m n VAL 23 Cb 0.00 0.83 -0.06 0.00 -1.47 0.00 0.00 33.84 33.13 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 -2.11 4.19 0.31 7.34 0.04 -1.26 -5.02 135.00 138.47 1p7m s PRO 24 Ca 0.02 1.09 0.02 0.00 0.04 0.00 0.00 61.00 62.17 1p7m s PRO 24 Cb 0.07 -2.18 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 1p7m s PRO 24 CO 0.41 -0.07 0.48 -2.00 0.04 0.00 0.00 177.00 175.87 1p7m s GLU 25 N -3.32 3.47 -0.43 4.56 2.12 -1.25 -3.84 118.70 120.02 1p7m s GLU 25 Ca 0.61 -0.46 -0.24 0.00 0.36 0.00 0.00 54.97 55.24 1p7m s GLU 25 Cb -0.09 -2.74 0.02 0.00 0.26 0.00 0.00 34.13 31.58 1p7m s GLU 25 CO 0.16 0.25 0.84 0.95 -0.54 0.00 0.00 175.26 176.92 1p7m s THR 26 N -2.20 4.61 0.29 -1.70 -4.23 -1.26 -4.93 115.64 106.22 1p7m s THR 26 Ca 0.38 0.71 -0.02 0.00 -1.18 0.00 0.00 61.69 61.58 1p7m s THR 26 Cb -0.09 -4.33 -0.04 0.00 1.34 0.00 0.00 72.50 69.37 1p7m s THR 26 CO 0.34 -0.67 0.51 -1.81 -0.54 0.00 0.00 174.62 172.45 1p7m s ASP 27 N 2.08 6.37 0.17 3.99 1.01 -1.26 -4.73 116.67 124.30 1p7m s ASP 27 Ca 0.33 0.53 -0.09 0.00 0.71 0.00 0.00 52.55 54.03 1p7m s ASP 27 Cb -0.12 -2.07 0.05 0.00 1.01 0.00 0.00 42.92 41.80 1p7m s ASP 27 CO 0.22 -0.20 1.59 0.28 0.21 0.00 0.00 175.17 177.28 1p7m h SER 28 N 1.40 1.02 0.00 0.27 0.02 -1.95 -2.44 113.55 111.86 1p7m h SER 28 Ca -0.49 -0.35 -0.00 0.00 -0.84 0.00 0.00 61.79 60.12 1p7m h SER 28 Cb 1.20 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.46 1p7m h SER 28 CO 0.65 1.14 -0.00 0.11 -1.14 0.00 0.00 176.83 177.59 1p7m h LYS 29 N 0.89 -0.00 -0.01 3.45 1.57 -2.00 -3.25 116.57 117.22 1p7m h LYS 29 Ca 0.13 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 1p7m h LYS 29 Cb 0.70 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.01 1p7m h LYS 29 CO 0.05 0.75 -0.06 1.57 -0.57 0.00 0.00 179.45 181.19 1p7m h LYS 30 N -0.76 0.01 -0.98 3.15 2.10 -1.98 -0.70 116.57 117.41 1p7m h LYS 30 Ca -0.00 -0.00 0.07 0.00 -2.00 0.00 0.00 60.65 58.72 1p7m h LYS 30 Cb 0.75 -0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 32.01 1p7m h LYS 30 CO 0.00 0.07 0.63 -0.07 -2.00 0.00 0.00 179.45 178.09 1p7m h LEU 31 N 0.01 0.99 -0.36 7.07 4.07 -1.47 0.71 115.31 126.33 1p7m h LEU 31 Ca 0.00 0.01 -0.02 0.00 0.08 0.00 0.00 57.88 57.95 1p7m h LEU 31 Cb 0.11 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.64 1p7m h LEU 31 CO 0.01 0.63 0.14 0.15 -1.08 0.00 0.00 178.44 178.29 1p7m h PHE 32 N 1.12 0.56 -0.50 1.13 3.04 -1.17 0.34 116.94 121.46 1p7m h PHE 32 Ca 0.43 -0.04 -0.11 0.00 3.98 0.00 0.00 57.97 62.22 1p7m h PHE 32 Cb 0.20 -0.17 -0.02 0.00 2.56 0.00 0.00 35.95 38.53 1p7m h PHE 32 CO -0.00 0.51 -0.13 0.93 -2.02 0.00 0.00 178.31 177.60 1p7m h GLU 33 N 0.44 0.97 0.19 1.11 5.08 -1.02 0.74 114.58 122.10 1p7m h GLU 33 Ca 0.12 -0.37 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1p7m h GLU 33 Cb 0.19 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1p7m h GLU 33 CO -0.01 1.04 -0.09 1.98 -1.00 0.00 0.00 179.01 180.93 1p7m h MET 34 N 0.83 -0.25 0.00 2.33 4.05 0.69 0.09 114.93 122.67 1p7m h MET 34 Ca 0.13 0.02 -0.04 0.00 -0.28 0.00 0.00 59.70 59.52 1p7m h MET 34 Cb 0.69 0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.54 1p7m h MET 34 CO 0.05 0.02 -0.21 0.97 0.23 0.00 0.00 176.91 177.98 1p7m h ILE 35 N -0.51 0.86 0.12 1.77 6.09 -0.33 0.17 117.51 125.68 1p7m h ILE 35 Ca -0.03 -0.79 -0.01 0.00 -1.37 0.00 0.00 64.86 62.67 1p7m h ILE 35 Cb 0.39 1.46 0.00 0.00 0.47 0.00 0.00 36.82 39.14 1p7m h ILE 35 CO 0.04 0.20 -0.06 0.00 -3.07 0.00 0.00 178.15 175.27 1p7m h LEU 37 N -0.68 0.98 -0.93 0.00 3.38 -0.80 -2.75 115.31 114.49 1p7m h LEU 37 Ca -0.02 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.59 1p7m h LEU 37 Cb 0.52 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 1p7m h LEU 37 CO 0.03 1.08 0.12 -0.08 0.09 0.00 0.00 178.44 179.67 1p7m h GLU 38 N 0.88 0.90 -0.42 1.13 4.57 -0.67 -2.36 114.58 118.62 1p7m h GLU 38 Ca 0.14 -0.20 0.04 0.00 -1.18 0.00 0.00 59.36 58.17 1p7m h GLU 38 Cb 0.63 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.07 1p7m h GLU 38 CO 0.04 0.82 0.28 0.78 -1.18 0.00 0.00 179.01 179.75 1p7m h GLY 39 N 1.00 0.47 0.91 1.92 0.00 -0.50 0.25 103.07 107.11 1p7m h GLY 39 Ca 0.18 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1p7m h GLY 39 CO 0.00 0.13 -0.01 -1.06 0.00 0.00 0.00 176.54 175.60 1p7m n GLN 40 N -4.48 0.95 0.00 4.80 1.13 -0.89 -3.24 117.38 115.65 1p7m n GLN 40 Ca 0.05 -0.14 0.15 0.00 -1.94 0.00 0.00 57.00 55.11 1p7m n GLN 40 Cb 0.19 -1.50 0.82 0.00 0.11 0.00 0.00 30.24 29.87 1p7m n GLN 40 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1p7m n GLN 41 N -0.90 0.73 -2.26 -1.09 -0.00 0.89 -4.22 117.38 110.52 1p7m n GLN 41 Ca 0.21 0.01 -0.43 0.00 -0.00 0.00 0.00 57.00 56.79 1p7m n GLN 41 Cb 0.18 -1.50 -0.02 0.00 -0.00 0.00 0.00 30.24 28.90 1p7m n GLN 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1p7m s ALA 42 N -2.22 3.24 0.00 2.61 0.00 -1.20 -2.93 121.76 121.26 1p7m s ALA 42 Ca 0.38 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.56 1p7m s ALA 42 Cb 0.20 -3.85 0.00 0.00 0.00 0.00 0.00 23.12 19.47 1p7m s ALA 42 CO 0.38 -2.00 0.00 0.41 0.00 0.00 0.00 175.76 174.55 1p7m n GLY 43 N 4.65 2.26 3.88 0.00 0.00 -1.26 -4.97 105.19 109.74 1p7m n GLY 43 Ca 0.17 -0.15 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 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 4.35 0.58 0.99 2.01 -1.15 -5.07 118.68 120.39 1p7m s LEU 44 Ca 0.00 0.68 -0.17 0.00 0.01 0.00 0.00 54.13 54.65 1p7m s LEU 44 Cb 0.00 -2.90 -0.04 0.00 0.01 0.00 0.00 46.19 43.27 1p7m s LEU 44 CO 0.00 0.19 1.09 -0.44 1.01 0.00 0.00 176.35 178.20 1p7m s SER 45 N -1.81 5.67 0.54 2.29 0.01 -1.26 -4.60 113.70 114.53 1p7m s SER 45 Ca 0.32 1.97 0.20 0.00 1.31 0.00 0.00 55.95 59.75 1p7m s SER 45 Cb -0.13 -2.55 1.40 0.00 0.21 0.00 0.00 66.02 64.94 1p7m s SER 45 CO 0.18 -1.25 2.16 -0.25 0.41 0.00 0.00 173.24 174.49 1p7m h TRP 46 N 0.69 0.00 0.00 2.43 2.91 -1.96 -1.11 115.95 118.91 1p7m h TRP 46 Ca -0.48 0.00 -0.19 0.00 1.13 0.00 0.00 58.89 59.35 1p7m h TRP 46 Cb 1.24 0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 29.86 1p7m h TRP 46 CO 0.55 0.00 -0.89 0.82 -1.03 0.00 0.00 178.44 177.89 1p7m h ILE 47 N 0.00 1.58 -0.28 2.65 1.08 -2.01 -2.96 117.51 117.57 1p7m h ILE 47 Ca 0.02 -3.11 -0.08 0.00 -0.39 0.00 0.00 64.86 61.29 1p7m h ILE 47 Cb 0.06 2.71 -0.01 0.00 -3.07 0.00 0.00 36.82 36.51 1p7m h ILE 47 CO -0.00 0.87 -0.15 0.74 -0.69 0.00 0.00 178.15 178.92 1p7m h THR 48 N 0.00 1.30 0.00 -0.27 2.02 -1.58 -2.53 112.91 111.84 1p7m h THR 48 Ca -0.01 -1.25 -0.02 0.00 0.77 0.00 0.00 66.41 65.89 1p7m h THR 48 Cb 1.63 1.51 -0.00 0.00 -1.74 0.00 0.00 68.15 69.56 1p7m h THR 48 CO 0.12 0.40 -0.11 1.62 0.37 0.00 0.00 175.52 177.91 1p7m h VAL 49 N 0.33 0.69 -0.71 3.16 3.04 -1.45 -1.78 116.25 119.53 1p7m h VAL 49 Ca 0.06 -0.46 0.09 0.00 -1.01 0.00 0.00 66.70 65.38 1p7m h VAL 49 Cb 0.67 1.28 -0.07 0.00 -2.01 0.00 0.00 31.29 31.16 1p7m h VAL 49 CO 0.04 0.11 0.36 0.25 -1.01 0.00 0.00 177.57 177.33 1p7m h LEU 50 N 0.00 0.48 -1.01 3.16 6.46 -1.27 0.81 115.31 123.93 1p7m h LEU 50 Ca -0.00 0.06 -0.05 0.00 -0.12 0.00 0.00 57.88 57.76 1p7m h LEU 50 Cb 0.27 -0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.15 1p7m h LEU 50 CO 0.01 0.28 0.12 0.11 -0.62 0.00 0.00 178.44 178.34 1p7m h LYS 51 N 0.62 0.83 -0.56 1.25 6.56 -1.37 -1.23 116.57 122.67 1p7m h LYS 51 Ca 0.34 -0.17 -0.04 0.00 -1.06 0.00 0.00 60.65 59.72 1p7m h LYS 51 Cb 0.34 -0.12 -0.03 0.00 -0.57 0.00 0.00 32.23 31.85 1p7m h LYS 51 CO -0.26 0.76 0.18 -0.22 -2.06 0.00 0.00 179.45 177.85 1p7m h LYS 52 N 0.80 0.83 -0.42 3.15 3.64 -0.06 -2.72 116.57 121.79 1p7m h LYS 52 Ca 0.17 -0.15 0.03 0.00 -1.27 0.00 0.00 60.65 59.44 1p7m h LYS 52 Cb 0.31 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 1p7m h LYS 52 CO 0.00 0.72 0.21 -0.09 -2.27 0.00 0.00 179.45 178.02 1p7m h ARG 53 N 0.81 0.41 -0.12 1.90 2.43 0.16 0.97 114.38 120.95 1p7m h ARG 53 Ca 0.19 -0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.21 1p7m h ARG 53 Cb 0.23 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1p7m h ARG 53 CO -0.01 0.27 -0.39 1.05 -1.51 0.00 0.00 179.97 179.39 1p7m h GLU 54 N 0.43 0.48 -0.04 0.20 4.11 -1.34 -2.92 114.58 115.50 1p7m h GLU 54 Ca 0.18 -0.35 -0.15 0.00 0.07 0.00 0.00 59.36 59.10 1p7m h GLU 54 Cb 0.08 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1p7m h GLU 54 CO -0.12 0.97 -0.67 -2.95 0.07 0.00 0.00 179.01 176.31 1p7m h ASN 55 N 0.08 0.21 -0.40 3.06 -0.00 -1.38 -2.90 115.58 114.24 1p7m h ASN 55 Ca -0.01 -0.13 0.02 0.00 -0.00 0.00 0.00 56.30 56.18 1p7m h ASN 55 Cb 1.01 -0.06 -0.03 0.00 -0.00 0.00 0.00 38.32 39.24 1p7m h ASN 55 CO 0.08 0.82 0.22 0.22 -0.00 0.00 0.00 177.43 178.77 1p7m h TYR 56 N 0.12 0.41 -0.15 4.14 3.20 1.00 -0.97 116.97 124.72 1p7m h TYR 56 Ca -0.01 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.81 1p7m h TYR 56 Cb 1.20 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.33 1p7m h TYR 56 CO 0.02 0.23 -0.17 0.07 -1.64 0.00 0.00 178.16 176.66 1p7m h ARG 57 N 0.45 0.24 -0.63 1.82 0.11 -1.47 0.19 114.38 115.08 1p7m h ARG 57 Ca 0.16 -0.06 -0.01 0.00 0.10 0.00 0.00 59.98 60.17 1p7m h ARG 57 Cb 0.04 -0.03 -0.03 0.00 1.11 0.00 0.00 29.97 31.06 1p7m h ARG 57 CO -0.09 0.42 0.35 0.00 0.10 0.00 0.00 179.97 180.75 1p7m h ALA 58 N 1.60 0.81 0.05 0.08 0.00 -1.00 3.17 119.26 123.97 1p7m h ALA 58 Ca 0.04 -0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.70 1p7m h ALA 58 Cb 0.44 -0.25 0.02 0.00 0.00 0.00 0.00 17.79 18.00 1p7m h ALA 58 CO 0.03 0.31 -0.66 0.00 0.00 0.00 0.00 179.25 178.93 1p7m n PHE 60 N -4.20 1.53 0.18 0.00 3.72 0.61 -4.57 117.46 114.73 1p7m n PHE 60 Ca -0.12 -0.53 0.01 0.00 -0.05 0.00 0.00 57.45 56.76 1p7m n PHE 60 Cb 0.72 -0.40 0.04 0.00 -0.94 0.00 0.00 39.48 38.90 1p7m n PHE 60 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1p7m h HIS 61 N 2.96 0.00 -0.91 1.38 2.76 0.58 0.12 115.15 122.05 1p7m h HIS 61 Ca 0.00 0.00 0.25 0.00 -2.20 0.00 0.00 60.37 58.42 1p7m h HIS 61 Cb 1.58 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 30.49 1p7m h HIS 61 CO 0.80 0.00 0.64 1.96 -1.30 0.00 0.00 177.93 180.03 1p7m h GLN 62 N 0.00 0.10 -3.23 5.26 4.20 -1.80 -3.44 115.11 116.20 1p7m h GLN 62 Ca 0.00 -0.01 -0.23 0.00 0.06 0.00 0.00 58.65 58.47 1p7m h GLN 62 Cb 1.48 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 29.20 1p7m h GLN 62 CO 0.00 0.06 -0.28 1.19 -0.67 0.00 0.00 178.83 179.14 1p7m n PHE 63 N -4.34 -1.18 -3.84 2.96 3.01 0.03 -4.89 117.46 109.22 1p7m n PHE 63 Ca 0.19 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.35 1p7m n PHE 63 Cb 0.91 -2.58 -0.14 0.00 -0.01 0.00 0.00 39.48 37.66 1p7m n PHE 63 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1p7m s ASP 64 N -2.02 4.09 0.43 4.37 1.11 -1.26 -4.98 116.67 118.42 1p7m s ASP 64 Ca 0.00 -2.59 0.22 0.00 0.18 0.00 0.00 52.55 50.36 1p7m s ASP 64 Cb 0.00 -1.32 1.20 0.00 1.07 0.00 0.00 42.92 43.87 1p7m s ASP 64 CO 0.00 -0.29 1.80 -0.65 1.18 0.00 0.00 175.17 177.21 1p7m h PRO 65 N 6.92 0.29 -0.48 8.23 0.11 -1.97 0.13 132.00 145.23 1p7m h PRO 65 Ca -0.05 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.99 1p7m h PRO 65 Cb 0.94 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.96 1p7m h PRO 65 CO 0.56 0.19 0.11 0.28 -0.21 0.00 0.00 178.00 178.94 1p7m h VAL 66 N 0.30 1.24 -0.21 3.15 2.07 -1.93 -1.65 116.25 119.22 1p7m h VAL 66 Ca 0.56 -0.84 -0.07 0.00 0.82 0.00 0.00 66.70 67.17 1p7m h VAL 66 Cb 1.60 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 32.21 1p7m h VAL 66 CO -0.21 0.30 -0.18 0.11 0.02 0.00 0.00 177.57 177.61 1p7m h LYS 67 N 0.66 0.35 -0.84 1.57 6.56 -1.23 -2.23 116.57 121.41 1p7m h LYS 67 Ca 0.15 -0.10 -0.00 0.00 -1.06 0.00 0.00 60.65 59.63 1p7m h LYS 67 Cb 0.33 -0.04 -0.04 0.00 -0.57 0.00 0.00 32.23 31.92 1p7m h LYS 67 CO 0.00 0.53 0.51 0.28 -2.06 0.00 0.00 179.45 178.71 1p7m h VAL 68 N 0.33 1.23 0.00 0.50 2.07 -0.36 0.57 116.25 120.58 1p7m h VAL 68 Ca 0.06 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.09 1p7m h VAL 68 Cb 0.51 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 1p7m h VAL 68 CO 0.03 0.24 0.00 0.00 0.02 0.00 0.00 177.57 177.86 1p7m n ALA 69 N -2.41 1.50 0.78 1.67 0.00 -0.70 -0.82 120.51 120.52 1p7m n ALA 69 Ca 0.09 0.11 0.11 0.00 0.00 0.00 0.00 53.44 53.76 1p7m n ALA 69 Cb 0.06 -1.36 0.08 0.00 0.00 0.00 0.00 19.45 18.22 1p7m n ALA 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1p7m n ALA 70 N -1.77 3.66 -2.44 0.00 0.00 0.19 -4.79 120.51 115.36 1p7m n ALA 70 Ca 0.01 -0.41 -0.43 0.00 0.00 0.00 0.00 53.44 52.61 1p7m n ALA 70 Cb 0.18 -0.99 -0.02 0.00 0.00 0.00 0.00 19.45 18.61 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 -3.10 3.64 0.32 0.00 -1.94 -0.00 -4.99 119.30 113.23 1p7m s MET 71 Ca 0.07 0.82 0.03 0.00 -1.71 0.00 0.00 55.69 54.90 1p7m s MET 71 Cb 0.16 -3.98 0.06 0.00 2.01 0.00 0.00 34.83 33.07 1p7m s MET 71 CO 0.78 -1.48 0.43 0.94 -0.01 0.00 0.00 175.02 175.68 1p7m n GLN 72 N 7.96 0.58 0.01 2.03 -0.06 -1.26 -4.89 117.38 121.74 1p7m n GLN 72 Ca 0.15 -1.45 0.18 0.00 -2.00 0.00 0.00 57.00 53.88 1p7m n GLN 72 Cb 0.48 -0.21 0.66 0.00 -4.06 0.00 0.00 30.24 27.11 1p7m n GLN 72 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 1p7m h GLU 73 N 0.00 0.06 -0.76 3.69 5.08 -1.98 -1.00 114.58 119.67 1p7m h GLU 73 Ca -0.15 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1p7m h GLU 73 Cb 0.61 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.81 1p7m h GLU 73 CO 0.18 0.04 0.47 1.05 -1.00 0.00 0.00 179.01 179.75 1p7m h GLU 74 N 0.06 1.02 -0.51 2.33 4.11 -1.99 -1.54 114.58 118.06 1p7m h GLU 74 Ca 0.24 -0.08 -0.11 0.00 0.07 0.00 0.00 59.36 59.48 1p7m h GLU 74 Cb 0.85 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 1p7m h GLU 74 CO -0.02 0.70 -0.11 -0.44 0.07 0.00 0.00 179.01 179.22 1p7m h ASP 75 N 1.03 0.94 -0.21 3.06 3.32 -1.54 -2.92 116.42 120.11 1p7m h ASP 75 Ca 0.27 -0.30 -0.10 0.00 0.02 0.00 0.00 57.03 56.92 1p7m h ASP 75 Cb -0.06 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.22 1p7m h ASP 75 CO -0.05 1.06 -0.20 -0.37 -1.72 0.00 0.00 179.24 177.95 1p7m h VAL 76 N 0.85 1.26 -0.66 -1.35 -1.51 -1.25 -1.25 116.25 112.33 1p7m h VAL 76 Ca 0.14 -1.26 0.02 0.00 -1.23 0.00 0.00 66.70 64.37 1p7m h VAL 76 Cb 0.65 1.22 -0.04 0.00 -2.13 0.00 0.00 31.29 30.99 1p7m h VAL 76 CO 0.04 0.41 0.44 -0.33 -1.23 0.00 0.00 177.57 176.91 1p7m h GLU 77 N 0.58 0.81 -0.28 5.19 5.08 -1.12 -0.43 114.58 124.42 1p7m h GLU 77 Ca 0.09 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.26 1p7m h GLU 77 Cb 0.66 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.73 1p7m h GLU 77 CO 0.05 0.54 -0.35 -0.09 -1.00 0.00 0.00 179.01 178.15 1p7m h ARG 78 N 0.84 0.74 -0.18 2.33 2.43 -1.21 -3.27 114.38 116.06 1p7m h ARG 78 Ca 0.25 -0.42 -0.13 0.00 -0.81 0.00 0.00 59.98 58.88 1p7m h ARG 78 Cb -0.01 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 1p7m h ARG 78 CO -0.06 1.04 -0.44 -0.07 -1.51 0.00 0.00 179.97 178.93 1p7m h LEU 79 N 0.49 0.47 -1.04 3.80 3.38 -0.36 -2.57 115.31 119.48 1p7m h LEU 79 Ca 0.04 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1p7m h LEU 79 Cb 0.94 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.56 1p7m h LEU 79 CO 0.08 0.85 0.42 -0.37 0.09 0.00 0.00 178.44 179.51 1p7m h VAL 80 N 0.36 0.00 0.00 1.22 -1.51 -1.15 0.45 116.25 115.62 1p7m h VAL 80 Ca 0.03 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.50 1p7m h VAL 80 Cb 0.92 0.35 0.00 0.00 -2.13 0.00 0.00 31.29 30.42 1p7m h VAL 80 CO 0.08 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.42 1p7m n GLN 81 N -2.31 2.44 -2.66 5.19 10.64 -1.08 -4.58 117.38 125.02 1p7m n GLN 81 Ca -0.01 -0.27 -0.43 0.00 -1.83 0.00 0.00 57.00 54.46 1p7m n GLN 81 Cb 0.44 -0.76 -0.03 0.00 -0.86 0.00 0.00 30.24 29.04 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 -0.42 6.57 0.00 2.61 -1.08 0.16 -3.53 116.67 120.98 1p7m s ASP 82 Ca 0.00 0.32 0.00 0.00 -0.52 0.00 0.00 52.55 52.35 1p7m s ASP 82 Cb 0.00 -2.52 0.00 0.00 -1.46 0.00 0.00 42.92 38.94 1p7m s ASP 82 CO 0.00 -1.22 0.00 0.00 0.52 0.00 0.00 175.17 174.47 1p7m n ALA 83 N 7.72 0.00 -2.07 3.66 0.00 -1.26 -3.37 120.51 125.19 1p7m n ALA 83 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1p7m n ALA 83 Cb 0.49 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.91 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 -1.85 0.54 2.88 0.00 0.00 -1.23 -5.03 105.19 100.50 1p7m n GLY 84 Ca 0.00 -0.82 -0.21 0.00 0.00 0.00 0.00 46.02 44.99 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 -3.58 0.00 -1.60 -0.61 -5.35 -1.22 -4.57 119.36 102.44 1p7m n ILE 85 Ca 0.00 0.00 -0.14 0.00 -0.27 0.00 0.00 62.75 62.34 1p7m n ILE 85 Cb 0.49 -0.68 -0.07 0.00 -1.74 0.00 0.00 39.64 37.64 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 -1.99 3.04 0.46 7.28 2.07 -1.26 -4.87 121.20 125.93 1p7m s ILE 86 Ca 0.46 -0.03 -0.24 0.00 -1.41 0.00 0.00 60.65 59.43 1p7m s ILE 86 Cb -0.08 -3.09 -0.09 0.00 0.13 0.00 0.00 42.46 39.33 1p7m s ILE 86 CO 0.38 -0.08 1.19 -2.11 -1.91 0.00 0.00 174.94 172.41 1p7m n ARG 87 N 8.82 1.63 0.00 3.50 1.85 -1.26 -4.89 116.66 126.32 1p7m n ARG 87 Ca 0.46 0.59 0.00 0.00 -1.00 0.00 0.00 57.85 57.90 1p7m n ARG 87 Cb 0.43 -2.31 0.00 0.00 -1.05 0.00 0.00 32.46 29.54 1p7m n ARG 87 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 1p7m n HIS 88 N -0.58 0.00 -0.32 2.89 8.25 -1.26 -4.98 115.22 119.22 1p7m n HIS 88 Ca 0.09 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.71 1p7m n HIS 88 Cb 0.41 0.00 0.40 0.00 1.12 0.00 0.00 29.99 31.92 1p7m n HIS 88 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1p7m h ARG 89 N 0.00 0.59 -0.05 -0.41 3.08 -1.91 0.77 114.38 116.45 1p7m h ARG 89 Ca 0.00 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1p7m h ARG 89 Cb 0.00 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 29.91 1p7m h ARG 89 CO 0.00 0.39 0.00 0.78 -1.07 0.00 0.00 179.97 180.07 1p7m h GLY 90 N 0.61 0.10 0.96 0.04 0.00 -1.99 -1.30 103.07 101.49 1p7m h GLY 90 Ca 0.55 -0.07 -0.02 0.00 0.00 0.00 0.00 47.33 47.80 1p7m h GLY 90 CO -0.32 0.06 0.21 1.70 0.00 0.00 0.00 176.54 178.19 1p7m h LYS 91 N -0.20 0.61 -0.53 4.80 3.64 -1.51 -2.57 116.57 120.81 1p7m h LYS 91 Ca 0.01 -0.09 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 1p7m h LYS 91 Cb 0.33 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 1p7m h LYS 91 CO 0.00 0.53 0.28 0.82 -2.27 0.00 0.00 179.45 178.81 1p7m h ILE 92 N 0.54 1.18 -0.73 2.00 2.04 -0.89 -1.36 117.51 120.30 1p7m h ILE 92 Ca 0.15 -0.48 0.14 0.00 1.00 0.00 0.00 64.86 65.67 1p7m h ILE 92 Cb 0.12 0.53 -0.05 0.00 -0.74 0.00 0.00 36.82 36.68 1p7m h ILE 92 CO -0.02 0.20 0.49 1.56 0.00 0.00 0.00 178.15 180.38 1p7m h GLN 93 N 0.71 0.39 -0.66 2.37 4.20 -0.99 0.24 115.11 121.38 1p7m h GLN 93 Ca 0.19 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.86 1p7m h GLN 93 Cb 0.06 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.72 1p7m h GLN 93 CO -0.03 0.26 0.36 0.00 -0.67 0.00 0.00 178.83 178.75 1p7m h ALA 94 N 1.65 0.85 -0.81 3.87 0.00 -0.85 -2.02 119.26 121.94 1p7m h ALA 94 Ca 0.35 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1p7m h ALA 94 Cb 0.81 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1p7m h ALA 94 CO -0.11 0.37 0.41 0.82 0.00 0.00 0.00 179.25 180.75 1p7m h ILE 95 N 0.91 1.25 -0.70 0.00 1.08 -0.77 -1.71 117.51 117.56 1p7m h ILE 95 Ca 0.23 -0.66 0.01 0.00 -0.39 0.00 0.00 64.86 64.06 1p7m h ILE 95 Cb 0.05 0.18 -0.04 0.00 -3.07 0.00 0.00 36.82 33.94 1p7m h ILE 95 CO -0.04 0.29 0.46 0.40 -0.69 0.00 0.00 178.15 178.57 1p7m h ILE 96 N 1.15 1.16 -0.21 -0.67 1.08 -0.99 -1.27 117.51 117.76 1p7m h ILE 96 Ca 0.28 -0.32 -0.05 0.00 -0.39 0.00 0.00 64.86 64.38 1p7m h ILE 96 Cb 0.07 0.15 -0.01 0.00 -3.07 0.00 0.00 36.82 33.96 1p7m h ILE 96 CO -0.04 0.17 -0.10 1.23 -0.69 0.00 0.00 178.15 178.72 1p7m h GLY 97 N 0.93 0.36 1.01 5.37 0.00 -0.74 -2.58 103.07 107.42 1p7m h GLY 97 Ca 0.26 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 1p7m h GLY 97 CO -0.07 0.21 0.46 3.43 0.00 0.00 0.00 176.54 180.57 1p7m h ASN 98 N 0.31 0.98 -0.64 0.19 -0.26 -0.36 -0.89 115.58 114.91 1p7m h ASN 98 Ca 0.06 -0.08 -0.04 0.00 -0.56 0.00 0.00 56.30 55.68 1p7m h ASN 98 Cb 0.38 -0.25 -0.03 0.00 -1.06 0.00 0.00 38.32 37.37 1p7m h ASN 98 CO 0.02 0.77 0.25 0.00 -1.06 0.00 0.00 177.43 177.41 1p7m h ALA 99 N 1.25 0.84 -0.83 -0.83 0.00 -1.20 -1.78 119.26 116.70 1p7m h ALA 99 Ca 0.28 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1p7m h ALA 99 Cb -0.01 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 1p7m h ALA 99 CO -0.05 0.47 0.39 0.00 0.00 0.00 0.00 179.25 180.06 1p7m h ARG 100 N 0.91 1.21 -0.36 0.00 3.08 -1.26 -1.95 114.38 116.00 1p7m h ARG 100 Ca 0.21 -0.18 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 1p7m h ARG 100 Cb 0.22 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 1p7m h ARG 100 CO -0.02 0.93 0.05 0.00 -1.07 0.00 0.00 179.97 179.86 1p7m h ALA 101 N 1.21 1.41 -0.68 0.04 0.00 -0.68 0.90 119.26 121.45 1p7m h ALA 101 Ca 0.29 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1p7m h ALA 101 Cb 0.13 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1p7m h ALA 101 CO -0.03 0.42 0.43 -0.92 0.00 0.00 0.00 179.25 179.15 1p7m h TYR 102 N 0.53 0.87 -0.18 0.00 3.20 -0.57 0.50 116.97 121.32 1p7m h TYR 102 Ca 0.12 0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.91 1p7m h TYR 102 Cb 0.27 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 1p7m h TYR 102 CO 0.01 0.57 -0.27 -0.07 -1.64 0.00 0.00 178.16 176.76 1p7m h LEU 103 N 0.92 0.34 -1.05 2.82 3.38 -0.86 -2.55 115.31 118.30 1p7m h LEU 103 Ca 0.25 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 1p7m h LEU 103 Cb -0.08 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 1p7m h LEU 103 CO -0.05 0.61 0.23 1.56 0.09 0.00 0.00 178.44 180.87 1p7m h GLN 104 N 0.30 0.91 -0.75 1.13 4.20 0.13 -1.53 115.11 119.49 1p7m h GLN 104 Ca 0.05 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.57 1p7m h GLN 104 Cb 0.63 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.23 1p7m h GLN 104 CO 0.05 0.75 0.33 1.98 -0.67 0.00 0.00 178.83 181.27 1p7m h MET 105 N 0.89 1.11 -0.43 1.46 4.05 -0.79 -1.81 114.93 119.41 1p7m h MET 105 Ca 0.21 -0.18 -0.04 0.00 -0.28 0.00 0.00 59.70 59.40 1p7m h MET 105 Cb 0.20 -0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 30.79 1p7m h MET 105 CO -0.02 0.89 0.11 0.93 0.23 0.00 0.00 176.91 179.05 1p7m h GLU 106 N 1.08 0.64 0.00 0.39 4.39 -1.17 0.55 114.58 120.46 1p7m h GLU 106 Ca 0.25 -0.11 -0.00 0.00 0.34 0.00 0.00 59.36 59.84 1p7m h GLU 106 Cb 0.17 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 28.72 1p7m h GLU 106 CO -0.03 0.58 -0.02 -0.56 -1.16 0.00 0.00 179.01 177.82 1p7m h GLN 107 N 0.62 0.00 0.00 2.33 3.07 -0.47 0.27 115.11 120.94 1p7m h GLN 107 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.88 1p7m h GLN 107 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.79 1p7m h GLN 107 CO -0.00 0.02 -1.08 -1.71 0.09 0.00 0.00 178.83 176.15 1p7m n ASN 108 N -3.20 0.65 -1.28 0.06 5.15 0.15 -4.96 115.26 111.84 1p7m n ASN 108 Ca -0.01 0.09 -0.12 0.00 -0.60 0.00 0.00 54.58 53.94 1p7m n ASN 108 Cb 0.19 0.71 -0.02 0.00 -0.53 0.00 0.00 39.78 40.13 1p7m n ASN 108 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1p7m n GLY 109 N 1.27 0.19 3.11 8.20 0.00 0.11 -4.99 105.19 113.09 1p7m n GLY 109 Ca 0.01 -0.40 -0.34 0.00 0.00 0.00 0.00 46.02 45.29 1p7m n GLY 109 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1p7m s GLU 110 N -4.25 2.18 0.41 1.61 0.41 -1.13 -5.02 118.70 112.92 1p7m s GLU 110 Ca 0.00 -1.45 -0.24 0.00 -0.41 0.00 0.00 54.97 52.88 1p7m s GLU 110 Cb 0.00 -3.14 -0.12 0.00 -1.78 0.00 0.00 34.13 29.09 1p7m s GLU 110 CO 0.00 -0.70 0.76 -2.30 -0.49 0.00 0.00 175.26 172.52 1p7m n PRO 111 N 4.51 0.89 -0.17 0.39 -0.02 -1.26 -4.73 135.00 134.60 1p7m n PRO 111 Ca -0.10 0.32 -0.08 0.00 -2.02 0.00 0.00 63.50 61.63 1p7m n PRO 111 Cb 0.42 -1.72 0.01 0.00 -0.02 0.00 0.00 33.50 32.20 1p7m n PRO 111 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1p7m h PHE 112 N 1.14 0.68 0.00 6.00 3.04 -1.94 -2.67 116.94 123.20 1p7m h PHE 112 Ca -0.41 -0.02 -0.10 0.00 3.98 0.00 0.00 57.97 61.42 1p7m h PHE 112 Cb 1.37 -0.22 -0.01 0.00 2.56 0.00 0.00 35.95 39.65 1p7m h PHE 112 CO 0.40 0.51 -0.47 0.00 -2.02 0.00 0.00 178.31 176.73 1p7m h ALA 113 N 1.11 0.99 -0.08 2.41 0.00 -1.85 -2.99 119.26 118.85 1p7m h ALA 113 Ca 0.17 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 1p7m h ALA 113 Cb 0.06 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1p7m h ALA 113 CO -0.03 0.59 0.04 0.22 0.00 0.00 0.00 179.25 180.07 1p7m h ASP 114 N 0.00 0.11 0.23 0.00 3.58 -1.83 -1.62 116.42 116.89 1p7m h ASP 114 Ca -0.00 -0.14 -0.16 0.00 0.42 0.00 0.00 57.03 57.14 1p7m h ASP 114 Cb 0.98 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.99 1p7m h ASP 114 CO 0.06 0.22 -0.61 2.19 -2.88 0.00 0.00 179.24 178.22 1p7m h PHE 115 N -0.01 0.49 0.42 0.28 -0.00 -1.60 -2.49 116.94 114.04 1p7m h PHE 115 Ca 0.03 -0.19 -0.02 0.00 -0.00 0.00 0.00 57.97 57.79 1p7m h PHE 115 Cb 0.15 -0.09 0.00 0.00 -0.00 0.00 0.00 35.95 36.01 1p7m h PHE 115 CO -0.02 0.89 -0.20 0.28 -0.00 0.00 0.00 178.31 179.26 1p7m h VAL 116 N 0.28 0.58 -0.01 0.88 2.07 -1.39 -1.49 116.25 117.16 1p7m h VAL 116 Ca -0.01 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.26 1p7m h VAL 116 Cb 1.15 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 31.62 1p7m h VAL 116 CO 0.10 0.05 0.04 -0.50 0.02 0.00 0.00 177.57 177.28 1p7m h TRP 117 N -0.72 0.00 -0.29 1.57 4.06 -1.34 -1.86 115.95 117.37 1p7m h TRP 117 Ca -0.06 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.84 1p7m h TRP 117 Cb 0.51 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.66 1p7m h TRP 117 CO -0.01 0.00 -0.03 1.03 -3.56 0.00 0.00 178.44 175.87 1p7m h SER 118 N 0.00 0.52 0.43 -3.49 0.87 -0.79 1.38 113.55 112.47 1p7m h SER 118 Ca 0.01 -0.33 -0.08 0.00 -1.23 0.00 0.00 61.79 60.16 1p7m h SER 118 Cb 0.08 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 1p7m h SER 118 CO -0.00 0.73 -0.36 -0.26 -0.53 0.00 0.00 176.83 176.41 1p7m h PHE 119 N 0.31 0.00 -0.22 2.24 0.04 -0.97 -2.09 116.94 116.26 1p7m h PHE 119 Ca 0.08 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.85 1p7m h PHE 119 Cb 0.48 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.63 1p7m h PHE 119 CO 0.04 0.36 0.00 0.28 -0.60 0.00 0.00 178.31 178.39 1p7m n VAL 120 N -3.98 0.94 -3.52 -0.55 0.31 -1.09 -4.73 118.33 105.69 1p7m n VAL 120 Ca -0.02 -0.49 -0.23 0.00 -0.01 0.00 0.00 64.34 63.59 1p7m n VAL 120 Cb 0.41 -0.35 0.07 0.00 -0.91 0.00 0.00 33.84 33.06 1p7m n VAL 120 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1p7m n ASN 121 N 0.24 -6.21 -1.78 4.52 3.02 -0.78 -2.14 115.26 112.12 1p7m n ASN 121 Ca 0.10 -0.50 -0.02 0.00 -0.03 0.00 0.00 54.58 54.12 1p7m n ASN 121 Cb 0.56 -4.84 -0.01 0.00 -0.61 0.00 0.00 39.78 34.88 1p7m n ASN 121 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 1p7m n HIS 122 N -4.89 -1.40 -3.84 3.10 -0.00 0.47 -4.84 115.22 103.82 1p7m n HIS 122 Ca 0.00 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.07 1p7m n HIS 122 Cb 0.56 -1.28 -0.10 0.00 -0.12 0.00 0.00 29.99 29.05 1p7m n HIS 122 CO 0.00 0.00 0.00 1.14 0.46 0.00 0.00 176.34 177.94 1p7m s GLN 123 N -3.61 0.47 0.53 1.57 -2.07 -0.91 -5.06 119.66 110.59 1p7m s GLN 123 Ca 0.00 -0.25 -0.22 0.00 -1.82 0.00 0.00 55.36 53.07 1p7m s GLN 123 Cb 0.00 0.20 -0.05 0.00 -1.09 0.00 0.00 33.01 32.07 1p7m s GLN 123 CO 0.00 -0.11 1.30 -1.25 -1.32 0.00 0.00 175.29 173.91 1p7m s PRO 124 N -1.13 3.24 -0.12 9.60 0.04 -1.26 -4.85 135.00 140.52 1p7m s PRO 124 Ca -0.12 2.10 -0.05 0.00 0.04 0.00 0.00 61.00 62.96 1p7m s PRO 124 Cb -0.06 -2.25 -0.04 0.00 0.04 0.00 0.00 34.50 32.19 1p7m s PRO 124 CO 0.02 -1.07 0.07 -1.14 0.04 0.00 0.00 177.00 174.92 1p7m s GLN 125 N -2.91 3.39 -0.26 4.56 2.00 0.54 -4.92 119.66 122.05 1p7m s GLN 125 Ca 0.71 -0.29 -0.17 0.00 -2.00 0.00 0.00 55.36 53.61 1p7m s GLN 125 Cb -0.37 -3.04 -0.03 0.00 0.80 0.00 0.00 33.01 30.37 1p7m s GLN 125 CO 0.43 0.63 0.49 -1.64 -0.50 0.00 0.00 175.29 174.70 1p7m s MET 126 N -0.64 4.06 -0.24 1.67 -1.94 -1.26 0.47 119.30 121.41 1p7m s MET 126 Ca 0.12 0.27 -0.22 0.00 -1.71 0.00 0.00 55.69 54.15 1p7m s MET 126 Cb -0.12 -3.65 -0.02 0.00 2.01 0.00 0.00 34.83 33.05 1p7m s MET 126 CO 0.02 -0.34 0.69 0.99 -0.01 0.00 0.00 175.02 176.37 1p7m s THR 127 N 2.26 4.95 -1.06 2.05 2.01 0.08 -4.91 115.64 121.01 1p7m s THR 127 Ca 0.20 1.26 0.09 0.00 0.31 0.00 0.00 61.69 63.56 1p7m s THR 127 Cb -0.16 -3.99 0.42 0.00 0.01 0.00 0.00 72.50 68.79 1p7m s THR 127 CO 0.09 0.01 1.23 0.00 -0.69 0.00 0.00 174.62 175.26 1p7m n GLN 128 N 5.72 2.76 -2.28 4.92 6.02 -1.26 -4.41 117.38 128.86 1p7m n GLN 128 Ca 0.01 -1.66 -0.41 0.00 -0.01 0.00 0.00 57.00 54.93 1p7m n GLN 128 Cb 0.49 -1.72 -0.03 0.00 1.02 0.00 0.00 30.24 29.99 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 -1.80 3.48 -0.08 -1.58 0.00 -1.26 -4.90 121.76 115.62 1p7m s ALA 129 Ca 0.29 1.07 0.21 0.00 0.00 0.00 0.00 51.96 53.53 1p7m s ALA 129 Cb 0.20 -3.44 -0.29 0.00 0.00 0.00 0.00 23.12 19.59 1p7m s ALA 129 CO 0.12 -0.46 0.44 0.25 0.00 0.00 0.00 175.76 176.12 1p7m n THR 130 N 2.03 0.36 -4.22 0.00 -2.24 -1.26 -2.62 114.28 106.32 1p7m n THR 130 Ca 0.03 -0.58 -0.13 0.00 -2.27 0.00 0.00 64.05 61.10 1p7m n THR 130 Cb 0.43 -0.14 -0.10 0.00 -2.10 0.00 0.00 70.33 68.42 1p7m n THR 130 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1p7m s THR 131 N -3.28 0.48 0.40 4.28 -4.23 -1.26 -4.74 115.64 107.28 1p7m s THR 131 Ca -0.08 -1.96 0.08 0.00 -1.18 0.00 0.00 61.69 58.54 1p7m s THR 131 Cb 0.12 -2.18 0.28 0.00 1.34 0.00 0.00 72.50 72.06 1p7m s THR 131 CO 0.88 -0.39 2.04 -0.07 -0.54 0.00 0.00 174.62 176.54 1p7m h LEU 132 N 2.70 0.50 -0.30 4.79 3.38 -1.94 0.20 115.31 124.64 1p7m h LEU 132 Ca -0.36 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1p7m h LEU 132 Cb 1.21 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1p7m h LEU 132 CO 0.61 0.35 0.00 -1.20 0.09 0.00 0.00 178.44 178.29 1p7m n SER 133 N -4.47 0.28 -1.11 -0.43 7.64 -1.26 -1.36 113.62 112.91 1p7m n SER 133 Ca 0.05 0.57 0.11 0.00 1.01 0.00 0.00 58.87 60.61 1p7m n SER 133 Cb 0.12 -0.63 0.26 0.00 -1.01 0.00 0.00 64.21 62.94 1p7m n SER 133 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1p7m n GLU 134 N -1.81 2.44 -3.44 1.43 -0.58 0.69 -4.85 120.64 114.52 1p7m n GLU 134 Ca 0.03 -2.19 -0.40 0.00 -0.42 0.00 0.00 57.16 54.18 1p7m n GLU 134 Cb 0.19 -1.50 -0.10 0.00 -0.57 0.00 0.00 31.44 29.46 1p7m n GLU 134 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1p7m s ILE 135 N -1.42 5.20 0.22 -3.67 -1.09 -0.46 -4.57 121.20 115.42 1p7m s ILE 135 Ca 0.40 0.26 -0.30 0.00 -2.23 0.00 0.00 60.65 58.78 1p7m s ILE 135 Cb 0.22 -3.71 -0.08 0.00 -1.58 0.00 0.00 42.46 37.31 1p7m s ILE 135 CO 0.31 0.08 1.06 -2.16 -1.23 0.00 0.00 174.94 173.00 1p7m s PRO 136 N 1.97 4.67 0.00 2.79 0.04 -1.26 -4.93 135.00 138.28 1p7m s PRO 136 Ca 0.12 1.69 0.22 0.00 0.04 0.00 0.00 61.00 63.07 1p7m s PRO 136 Cb -0.16 -3.25 0.54 0.00 0.04 0.00 0.00 34.50 31.67 1p7m s PRO 136 CO 0.11 0.21 1.45 0.25 0.04 0.00 0.00 177.00 179.07 1p7m n THR 137 N 1.83 0.33 -3.56 1.26 -2.24 -1.26 -4.67 114.28 105.97 1p7m n THR 137 Ca 0.00 -0.56 -0.29 0.00 -2.27 0.00 0.00 64.05 60.93 1p7m n THR 137 Cb 0.46 0.79 -0.14 0.00 -2.10 0.00 0.00 70.33 69.34 1p7m n THR 137 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1p7m s SER 138 N -1.58 3.41 0.11 3.42 0.15 -1.26 -4.34 113.70 113.60 1p7m s SER 138 Ca 0.35 -1.80 0.05 0.00 0.70 0.00 0.00 55.95 55.25 1p7m s SER 138 Cb 0.20 -0.51 -0.04 0.00 -1.71 0.00 0.00 66.02 63.97 1p7m s SER 138 CO 0.29 -0.37 -0.00 0.42 1.20 0.00 0.00 173.24 174.78 1p7m s THR 139 N 1.48 3.94 0.39 6.45 -4.23 -1.26 -4.95 115.64 117.46 1p7m s THR 139 Ca 0.13 -1.08 0.13 0.00 -1.18 0.00 0.00 61.69 59.69 1p7m s THR 139 Cb -0.20 -2.90 0.35 0.00 1.34 0.00 0.00 72.50 71.09 1p7m s THR 139 CO -0.17 0.08 1.87 1.55 -0.54 0.00 0.00 174.62 177.40 1p7m h PRO 140 N 3.30 0.54 -0.08 3.99 0.13 -1.99 0.44 132.00 138.33 1p7m h PRO 140 Ca -0.48 -0.03 -0.16 0.00 -0.87 0.00 0.00 66.00 64.46 1p7m h PRO 140 Cb 1.17 -0.12 0.01 0.00 0.13 0.00 0.00 31.00 32.19 1p7m h PRO 140 CO 0.59 0.35 -0.58 0.00 -0.23 0.00 0.00 178.00 178.13 1p7m h ALA 141 N 1.61 0.17 -0.68 -0.56 0.00 -1.95 -2.69 119.26 115.17 1p7m h ALA 141 Ca 0.44 -0.54 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1p7m h ALA 141 Cb 0.89 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1p7m h ALA 141 CO -0.19 0.42 0.11 0.66 0.00 0.00 0.00 179.25 180.25 1p7m h SER 142 N 0.11 1.07 -0.65 0.00 4.64 -1.46 -2.54 113.55 114.72 1p7m h SER 142 Ca -0.05 -0.26 -0.02 0.00 -0.47 0.00 0.00 61.79 60.99 1p7m h SER 142 Cb 1.24 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 63.01 1p7m h SER 142 CO 0.12 1.06 0.33 0.44 -0.87 0.00 0.00 176.83 177.91 1p7m h ASP 143 N 1.05 0.86 -0.40 4.97 3.32 -0.21 -2.18 116.42 123.83 1p7m h ASP 143 Ca 0.21 -0.09 -0.08 0.00 0.02 0.00 0.00 57.03 57.09 1p7m h ASP 143 Cb 0.44 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 1p7m h ASP 143 CO 0.01 0.72 -0.03 0.00 -1.72 0.00 0.00 179.24 178.23 1p7m h ALA 144 N 1.41 1.06 -0.41 3.45 0.00 -1.11 -2.36 119.26 121.30 1p7m h ALA 144 Ca 0.24 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1p7m h ALA 144 Cb 0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1p7m h ALA 144 CO -0.03 0.59 0.23 -0.07 0.00 0.00 0.00 179.25 179.96 1p7m h LEU 145 N 0.75 0.35 -0.60 0.00 3.38 -1.04 -0.33 115.31 117.83 1p7m h LEU 145 Ca 0.14 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1p7m h LEU 145 Cb 0.49 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 1p7m h LEU 145 CO 0.02 0.25 0.30 -1.28 0.09 0.00 0.00 178.44 177.83 1p7m h SER 146 N 0.46 0.77 -0.39 -0.43 0.87 -1.31 0.34 113.55 113.85 1p7m h SER 146 Ca 0.17 -0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.59 1p7m h SER 146 Cb 0.03 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 61.78 1p7m h SER 146 CO -0.09 0.67 0.18 0.11 -0.53 0.00 0.00 176.83 177.17 1p7m h LYS 147 N 0.81 0.56 -0.18 2.24 1.57 -0.90 0.87 116.57 121.54 1p7m h LYS 147 Ca 0.21 -0.09 -0.09 0.00 -1.87 0.00 0.00 60.65 58.81 1p7m h LYS 147 Cb 0.09 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.30 1p7m h LYS 147 CO -0.03 0.50 -0.24 0.00 -0.57 0.00 0.00 179.45 179.11 1p7m h ALA 148 N 1.03 0.28 -0.33 3.86 0.00 -0.84 -2.72 119.26 120.52 1p7m h ALA 148 Ca 0.13 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.55 1p7m h ALA 148 Cb 0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1p7m h ALA 148 CO -0.02 0.25 -0.26 -0.07 0.00 0.00 0.00 179.25 179.15 1p7m h LEU 149 N 0.14 0.69 -1.11 0.00 3.38 -0.20 -1.11 115.31 117.10 1p7m h LEU 149 Ca 0.02 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1p7m h LEU 149 Cb 0.81 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 1p7m h LEU 149 CO 0.06 0.93 0.53 0.50 0.09 0.00 0.00 178.44 180.55 1p7m h LYS 150 N 0.59 1.14 0.00 1.13 3.64 0.81 0.10 116.57 123.97 1p7m h LYS 150 Ca 0.08 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1p7m h LYS 150 Cb 0.75 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 1p7m h LYS 150 CO 0.06 0.78 0.00 0.87 -2.27 0.00 0.00 179.45 178.89 1p7m h LYS 151 N 1.16 0.00 0.00 1.90 1.57 -1.16 -2.89 116.57 117.16 1p7m h LYS 151 Ca 0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 1p7m h LYS 151 Cb -0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.22 1p7m h LYS 151 CO -0.06 0.00 0.00 -2.13 -0.57 0.00 0.00 179.45 176.69 1p7m n ARG 152 N -3.09 0.95 -1.13 3.15 3.00 -0.11 -4.83 116.66 114.61 1p7m n ARG 152 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.88 1p7m n ARG 152 Cb 0.48 -1.45 0.00 0.00 0.00 0.00 0.00 32.46 31.48 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 0.86 0.79 3.48 5.14 0.00 -1.08 -4.39 105.19 109.99 1p7m n GLY 153 Ca 0.21 -0.65 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 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 0.65 1.61 0.08 -0.44 -4.42 117.98 116.69 1p7m s PHE 154 Ca 0.00 -0.44 -0.01 0.00 0.12 0.00 0.00 56.93 56.61 1p7m s PHE 154 Cb 0.00 -2.48 0.08 0.00 -0.57 0.00 0.00 43.02 40.05 1p7m s PHE 154 CO 0.00 -0.46 0.91 0.15 -0.10 0.00 0.00 175.22 175.72 1p7m s LYS 155 N 1.68 2.07 -1.37 0.44 1.02 -1.26 -4.26 119.74 118.05 1p7m s LYS 155 Ca 0.05 -0.90 -0.06 0.00 0.02 0.00 0.00 55.97 55.08 1p7m s LYS 155 Cb -0.18 -2.38 0.03 0.00 -0.52 0.00 0.00 37.83 34.78 1p7m s LYS 155 CO 0.09 -1.14 0.92 1.19 -0.92 0.00 0.00 175.35 175.49 1p7m n PHE 156 N -2.65 -2.25 -2.58 3.18 3.01 -1.26 -4.89 117.46 110.02 1p7m n PHE 156 Ca 0.12 0.91 -0.16 0.00 1.01 0.00 0.00 57.45 59.33 1p7m n PHE 156 Cb 0.60 -4.49 0.02 0.00 -0.01 0.00 0.00 39.48 35.60 1p7m n PHE 156 CO 0.00 0.00 0.00 1.55 1.01 0.00 0.00 176.76 179.32 1p7m n VAL 157 N -4.51 1.56 -0.48 -4.37 3.14 -1.26 -4.14 118.33 108.27 1p7m n VAL 157 Ca -0.14 -3.76 -0.30 0.00 -2.96 0.00 0.00 64.34 57.17 1p7m n VAL 157 Cb 0.61 -0.06 0.28 0.00 -1.06 0.00 0.00 33.84 33.61 1p7m n VAL 157 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1p7m s GLY 158 N -3.33 1.45 0.45 7.55 0.00 -1.26 -4.63 107.32 107.56 1p7m s GLY 158 Ca 0.35 -0.73 0.12 0.00 0.00 0.00 0.00 44.72 44.47 1p7m s GLY 158 CO -0.05 0.23 2.06 -0.84 0.00 0.00 0.00 173.10 174.49 1p7m h THR 159 N -3.21 0.99 0.00 0.90 2.02 -1.94 0.02 112.91 111.69 1p7m h THR 159 Ca -0.47 -0.12 -0.11 0.00 0.77 0.00 0.00 66.41 66.49 1p7m h THR 159 Cb 1.33 0.62 -0.02 0.00 -1.74 0.00 0.00 68.15 68.35 1p7m h THR 159 CO 0.33 0.06 -0.53 0.71 0.37 0.00 0.00 175.52 176.46 1p7m h THR 160 N 0.34 1.21 -0.23 3.16 1.35 -1.89 -2.86 112.91 113.98 1p7m h THR 160 Ca 0.16 -1.93 -0.06 0.00 -0.55 0.00 0.00 66.41 64.03 1p7m h THR 160 Cb 0.20 2.09 -0.01 0.00 -1.73 0.00 0.00 68.15 68.70 1p7m h THR 160 CO -0.03 0.52 -0.09 0.40 -0.25 0.00 0.00 175.52 176.06 1p7m h ILE 161 N 0.00 1.30 -0.44 6.82 1.08 -1.28 -2.09 117.51 122.90 1p7m h ILE 161 Ca -0.01 -1.14 -0.08 0.00 -0.39 0.00 0.00 64.86 63.24 1p7m h ILE 161 Cb 1.05 1.55 -0.02 0.00 -3.07 0.00 0.00 36.82 36.33 1p7m h ILE 161 CO 0.07 0.35 -0.07 0.00 -0.69 0.00 0.00 178.15 177.81 1p7m h TYR 163 N 0.69 0.48 -0.80 0.00 3.20 -1.42 -2.36 116.97 116.76 1p7m h TYR 163 Ca 0.13 -0.08 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 1p7m h TYR 163 Cb 0.53 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.63 1p7m h TYR 163 CO 0.03 0.60 0.41 0.77 -1.64 0.00 0.00 178.16 178.32 1p7m h SER 164 N 0.22 1.03 -0.90 -2.11 0.02 -1.27 -2.15 113.55 108.38 1p7m h SER 164 Ca 0.07 -0.11 0.02 0.00 -0.84 0.00 0.00 61.79 60.94 1p7m h SER 164 Cb 0.40 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 62.63 1p7m h SER 164 CO 0.01 0.85 0.59 0.15 -1.14 0.00 0.00 176.83 177.30 1p7m h PHE 165 N 1.14 1.11 -0.83 3.45 3.57 -1.21 -2.04 116.94 122.13 1p7m h PHE 165 Ca 0.28 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.77 1p7m h PHE 165 Cb 0.08 -0.37 -0.04 0.00 2.79 0.00 0.00 35.95 38.41 1p7m h PHE 165 CO 0.01 0.66 0.39 0.52 -2.23 0.00 0.00 178.31 177.66 1p7m h MET 166 N 1.17 1.20 -0.09 1.11 2.86 -0.85 0.13 114.93 120.45 1p7m h MET 166 Ca 0.35 -0.18 -0.23 0.00 -2.06 0.00 0.00 59.70 57.57 1p7m h MET 166 Cb -0.05 -0.21 0.01 0.00 0.06 0.00 0.00 31.60 31.41 1p7m h MET 166 CO -0.10 0.93 -0.86 -0.56 1.06 0.00 0.00 176.91 177.38 1p7m h GLN 167 N 1.19 0.71 0.21 1.72 3.07 -1.25 -2.78 115.11 117.97 1p7m h GLN 167 Ca 0.28 -0.64 -0.32 0.00 0.09 0.00 0.00 58.65 58.06 1p7m h GLN 167 Cb 0.14 0.15 0.04 0.00 0.08 0.00 0.00 27.48 27.88 1p7m h GLN 167 CO -0.03 1.24 -1.38 0.00 0.09 0.00 0.00 178.83 178.75 1p7m h ALA 168 N 0.56 -0.11 0.00 0.06 0.00 -1.29 -3.28 119.26 115.19 1p7m h ALA 168 Ca -0.07 -0.82 -0.00 0.00 0.00 0.00 0.00 54.91 54.01 1p7m h ALA 168 Cb 1.49 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.44 1p7m h ALA 168 CO 0.17 0.68 -0.02 0.00 0.00 0.00 0.00 179.25 180.07 1p7m n GLY 170 N -1.41 0.75 0.26 0.00 0.00 -1.19 -3.90 105.19 99.71 1p7m n GLY 170 Ca -0.03 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.08 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 0.00 -8.63 0.99 3.38 -1.73 -3.42 115.31 105.90 1p7m h LEU 171 Ca 0.00 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.32 1p7m h LEU 171 Cb 0.00 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 40.48 1p7m h LEU 171 CO 0.00 0.05 -0.87 0.68 0.09 0.00 0.00 178.44 178.39 1p7m s VAL 172 N -4.85 1.94 0.32 1.22 -7.23 -1.18 -0.34 120.40 110.27 1p7m s VAL 172 Ca -0.05 -1.24 0.08 0.00 -1.81 0.00 0.00 61.98 58.97 1p7m s VAL 172 Cb 0.16 -1.65 -0.04 0.00 0.56 0.00 0.00 36.38 35.41 1p7m s VAL 172 CO 0.65 0.37 0.11 0.20 -0.31 0.00 0.00 175.10 176.12 1p7m s ASN 173 N -1.04 4.72 0.00 4.85 -0.87 0.18 -4.84 114.94 117.94 1p7m s ASN 173 Ca 0.10 -0.70 0.00 0.00 -1.57 0.00 0.00 52.86 50.69 1p7m s ASN 173 Cb -0.09 -0.81 0.00 0.00 -0.02 0.00 0.00 41.25 40.33 1p7m s ASN 173 CO 0.01 -0.21 0.00 0.47 -2.57 0.00 0.00 177.10 174.80 1p7m n ASP 174 N -1.10 -1.67 -0.26 -1.22 8.00 -1.26 -0.74 116.55 118.30 1p7m n ASP 174 Ca -0.04 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.52 1p7m n ASP 174 Cb 0.60 -0.84 0.19 0.00 -0.02 0.00 0.00 41.12 41.06 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 0.48 0.00 1.24 3.86 -1.90 -3.31 115.15 115.53 1p7m h HIS 175 Ca 0.00 0.04 -0.13 0.00 -1.16 0.00 0.00 60.37 59.12 1p7m h HIS 175 Cb 0.48 -0.10 -0.23 0.00 1.06 0.00 0.00 27.41 28.63 1p7m h HIS 175 CO 0.00 0.04 -0.62 1.33 0.86 0.00 0.00 177.93 179.54 1p7m n VAL 176 N -5.03 0.00 0.00 2.45 0.24 -1.26 -4.86 118.33 109.88 1p7m n VAL 176 Ca 0.15 -0.44 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 1p7m n VAL 176 Cb 0.43 0.69 0.00 0.00 -1.47 0.00 0.00 33.84 33.49 1p7m n VAL 176 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1p7m n VAL 177 N 0.22 0.00 -3.16 3.34 0.31 -1.08 -4.14 118.33 113.83 1p7m n VAL 177 Ca -0.09 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.05 1p7m n VAL 177 Cb 0.89 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.78 1p7m n VAL 177 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1p7m n GLY 178 N -0.85 3.88 3.53 2.92 0.00 -1.26 -4.49 105.19 108.92 1p7m n GLY 178 Ca 0.00 -1.84 -0.41 0.00 0.00 0.00 0.00 46.02 43.77 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 0.04 3.40 0.00 0.00 6.14 -1.12 -4.99 117.35 120.82 1p7m s TYR 182 Ca 0.20 1.12 0.00 0.00 0.64 0.00 0.00 57.07 59.03 1p7m s TYR 182 Cb 0.29 -2.92 0.00 0.00 0.42 0.00 0.00 41.96 39.75 1p7m s TYR 182 CO -0.19 -0.21 0.04 -0.35 0.64 0.00 0.00 175.55 175.47 1p7m n PRO 183 N 5.16 0.00 0.00 4.97 -0.04 -1.26 -4.63 135.00 139.20 1p7m n PRO 183 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1p7m n PRO 183 Cb 0.49 -0.41 0.00 0.00 -0.04 0.00 0.00 33.50 33.54 1p7m n PRO 183 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1p7m n GLY 184 N 2.28 2.82 0.20 0.55 0.00 -1.26 -4.75 105.19 105.04 1p7m n GLY 184 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 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 0.44 0.75 -4.92 1.61 3.02 -1.26 -4.85 115.26 110.06 1p7m n ASN 185 Ca 0.00 -0.83 -0.27 0.00 -0.03 0.00 0.00 54.58 53.45 1p7m n ASN 185 Cb 0.00 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.15 1p7m n ASN 185 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1p7m s LYS 186 N -2.38 3.57 0.00 3.52 3.01 -1.26 -5.35 119.74 120.86 1p7m s LYS 186 Ca 0.30 -0.12 0.00 0.00 -1.01 0.00 0.00 55.97 55.14 1p7m s LYS 186 Cb 0.20 -2.67 0.00 0.00 -1.01 0.00 0.00 37.83 34.35 1p7m s LYS 186 CO 0.46 0.21 0.00 -2.30 0.51 0.00 0.00 175.35 174.23