#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s7o s GLU 7 N 0.00 4.32 0.21 0.38 2.12 -1.26 -5.00 118.70 119.47 1s7o s GLU 7 Ca 0.00 1.96 -0.18 0.00 0.36 0.00 0.00 54.97 57.10 1s7o s GLU 7 Cb 0.00 -3.44 -0.08 0.00 0.26 0.00 0.00 34.13 30.87 1s7o s GLU 7 CO 0.00 -0.48 0.69 0.15 -0.54 0.00 0.00 175.26 175.08 1s7o s LYS 8 N 1.81 4.19 0.08 4.30 1.02 -1.26 -5.09 119.74 124.80 1s7o s LYS 8 Ca 0.63 0.79 0.02 0.00 0.02 0.00 0.00 55.97 57.43 1s7o s LYS 8 Cb -0.32 -2.89 -0.04 0.00 -0.52 0.00 0.00 37.83 34.06 1s7o s LYS 8 CO 0.28 0.41 -0.07 0.95 -0.92 0.00 0.00 175.35 176.00 1s7o s THR 9 N -1.52 0.63 0.24 2.17 -4.23 -1.26 -5.04 115.64 106.63 1s7o s THR 9 Ca 0.42 -1.65 -0.06 0.00 -1.18 0.00 0.00 61.69 59.21 1s7o s THR 9 Cb -0.16 -1.33 0.20 0.00 1.34 0.00 0.00 72.50 72.55 1s7o s THR 9 CO 0.21 -0.72 1.85 0.78 -0.54 0.00 0.00 174.62 176.19 1s7o h ASN 10 N 3.47 1.08 0.05 3.99 4.21 -1.99 -1.10 115.58 125.29 1s7o h ASN 10 Ca -0.35 -0.11 0.00 0.00 1.21 0.00 0.00 56.30 57.04 1s7o h ASN 10 Cb 1.18 -0.28 -0.00 0.00 -1.12 0.00 0.00 38.32 38.10 1s7o h ASN 10 CO 0.57 0.89 -0.04 -0.09 -1.29 0.00 0.00 177.43 177.47 1s7o h ARG 11 N 1.20 -0.09 -0.71 0.81 2.43 -1.98 0.57 114.38 116.60 1s7o h ARG 11 Ca 0.29 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.41 1s7o h ARG 11 Cb 0.08 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 1s7o h ARG 11 CO -0.04 -0.06 0.19 1.98 -1.51 0.00 0.00 179.97 180.52 1s7o h MET 12 N -0.10 1.13 -0.20 0.20 4.05 -1.94 0.18 114.93 118.25 1s7o h MET 12 Ca 0.00 -0.26 0.04 0.00 -0.28 0.00 0.00 59.70 59.20 1s7o h MET 12 Cb 0.09 -0.15 -0.04 0.00 -0.80 0.00 0.00 31.60 30.70 1s7o h MET 12 CO -0.01 0.98 -0.06 -0.97 0.23 0.00 0.00 176.91 177.08 1s7o h ASN 13 N 1.07 -0.22 -0.51 1.39 -1.24 -0.91 0.61 115.58 115.77 1s7o h ASN 13 Ca 0.23 0.06 -0.03 0.00 0.71 0.00 0.00 56.30 57.27 1s7o h ASN 13 Cb 0.35 0.14 -0.03 0.00 0.73 0.00 0.00 38.32 39.51 1s7o h ASN 13 CO -0.00 -0.08 0.23 0.00 -1.29 0.00 0.00 177.43 176.29 1s7o h ALA 14 N 1.18 1.37 -0.67 1.57 0.00 -0.13 0.31 119.26 122.90 1s7o h ALA 14 Ca 0.10 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1s7o h ALA 14 Cb 0.17 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1s7o h ALA 14 CO -0.22 0.48 0.19 -0.07 0.00 0.00 0.00 179.25 179.63 1s7o h LEU 15 N 0.78 0.96 -0.18 0.00 3.38 0.56 0.58 115.31 121.40 1s7o h LEU 15 Ca 0.19 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1s7o h LEU 15 Cb 0.14 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1s7o h LEU 15 CO -0.02 0.91 0.02 0.15 0.09 0.00 0.00 178.44 179.59 1s7o h PHE 16 N 0.99 0.31 -0.93 1.13 3.57 -0.31 -1.84 116.94 119.86 1s7o h PHE 16 Ca 0.22 -0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.69 1s7o h PHE 16 Cb 0.31 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 38.91 1s7o h PHE 16 CO 0.02 0.46 0.62 0.93 -2.23 0.00 0.00 178.31 178.11 1s7o h GLU 17 N 0.07 1.20 -0.12 1.11 5.08 -0.54 -0.86 114.58 120.53 1s7o h GLU 17 Ca 0.05 -0.07 -0.15 0.00 -1.00 0.00 0.00 59.36 58.19 1s7o h GLU 17 Cb 0.32 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1s7o h GLU 17 CO 0.00 0.80 -0.57 0.74 -1.00 0.00 0.00 179.01 178.98 1s7o h PHE 18 N 1.24 0.49 -0.06 4.33 -1.00 -0.67 -3.36 116.94 117.92 1s7o h PHE 18 Ca 0.35 -0.18 0.00 0.00 2.81 0.00 0.00 57.97 60.95 1s7o h PHE 18 Cb -0.10 -0.09 0.00 0.00 3.61 0.00 0.00 35.95 39.37 1s7o h PHE 18 CO -0.01 0.87 0.00 0.66 -1.61 0.00 0.00 178.31 178.22 1s7o n TYR 19 N -3.92 0.07 -0.15 -0.55 0.53 -0.71 -4.67 117.16 107.76 1s7o n TYR 19 Ca -0.03 -0.24 0.13 0.00 -1.02 0.00 0.00 57.90 56.75 1s7o n TYR 19 Cb 0.61 -0.02 0.48 0.00 -1.03 0.00 0.00 39.34 39.38 1s7o n TYR 19 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1s7o h ALA 20 N 0.70 2.03 0.00 -0.72 0.00 -1.31 0.15 119.26 120.11 1s7o h ALA 20 Ca 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1s7o h ALA 20 Cb 0.35 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1s7o h ALA 20 CO 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 179.25 179.02 1s7o h ALA 21 N 1.65 1.05 0.00 0.00 0.00 -1.85 -0.69 119.26 119.42 1s7o h ALA 21 Ca 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1s7o h ALA 21 Cb 0.70 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1s7o h ALA 21 CO -0.11 0.02 0.00 -0.07 0.00 0.00 0.00 179.25 179.10 1s7o h LEU 22 N 0.00 0.00 -9.91 0.00 3.38 -1.05 -3.46 115.31 104.27 1s7o h LEU 22 Ca -0.00 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 1s7o h LEU 22 Cb 0.26 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1s7o h LEU 22 CO 0.00 0.00 0.34 -0.76 0.09 0.00 0.00 178.44 178.11 1s7o s LEU 23 N -5.03 4.28 0.77 1.67 1.43 -0.27 -5.06 118.68 116.47 1s7o s LEU 23 Ca 0.09 1.80 -0.11 0.00 -1.03 0.00 0.00 54.13 54.88 1s7o s LEU 23 Cb 0.10 -4.08 0.05 0.00 0.03 0.00 0.00 46.19 42.29 1s7o s LEU 23 CO 0.61 -0.11 1.08 0.42 0.23 0.00 0.00 176.35 178.59 1s7o s THR 24 N -1.70 3.40 0.30 5.49 -4.23 -1.26 -4.83 115.64 112.81 1s7o s THR 24 Ca 0.52 0.46 0.01 0.00 -1.18 0.00 0.00 61.69 61.49 1s7o s THR 24 Cb -0.17 -3.08 0.28 0.00 1.34 0.00 0.00 72.50 70.87 1s7o s THR 24 CO 0.22 -0.60 1.91 0.44 -0.54 0.00 0.00 174.62 176.06 1s7o h ASP 25 N -1.05 0.90 0.37 3.99 3.32 -1.97 -0.02 116.42 121.95 1s7o h ASP 25 Ca -0.45 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.54 1s7o h ASP 25 Cb 1.24 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 1s7o h ASP 25 CO 0.55 0.57 -0.32 0.50 -1.72 0.00 0.00 179.24 178.83 1s7o h LYS 26 N 1.01 0.00 0.00 3.56 3.64 -2.01 0.47 116.57 123.24 1s7o h LYS 26 Ca 0.39 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.68 1s7o h LYS 26 Cb 0.21 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 1s7o h LYS 26 CO -0.15 0.32 -0.60 1.96 -2.27 0.00 0.00 179.45 178.71 1s7o h GLN 27 N 0.00 0.00 0.03 1.90 4.20 -1.46 -3.38 115.11 116.39 1s7o h GLN 27 Ca -0.00 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.35 1s7o h GLN 27 Cb 0.59 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.31 1s7o h GLN 27 CO 0.04 0.35 -2.19 -0.12 -0.67 0.00 0.00 178.83 176.24 1s7o n MET 28 N -3.11 0.68 -0.28 1.46 1.56 -0.19 -4.58 117.12 112.67 1s7o n MET 28 Ca 0.00 0.16 -0.10 0.00 -0.27 0.00 0.00 57.70 57.49 1s7o n MET 28 Cb 0.70 -1.62 -0.08 0.00 2.15 0.00 0.00 33.22 34.37 1s7o n MET 28 CO 0.00 0.00 0.00 -0.91 -0.73 0.00 0.00 175.97 174.33 1s7o h ASN 29 N 0.01 -1.72 -0.18 6.12 2.35 -0.27 -1.18 115.58 120.72 1s7o h ASN 29 Ca -0.48 0.25 -0.04 0.00 -0.55 0.00 0.00 56.30 55.49 1s7o h ASN 29 Cb 2.06 0.74 -0.01 0.00 0.05 0.00 0.00 38.32 41.17 1s7o h ASN 29 CO 0.02 -0.23 -0.03 1.88 -1.65 0.00 0.00 177.43 177.41 1s7o h TYR 30 N -0.10 0.39 -0.41 1.19 0.05 -1.85 -2.85 116.97 113.39 1s7o h TYR 30 Ca 0.11 -0.08 -0.05 0.00 0.05 0.00 0.00 58.73 58.76 1s7o h TYR 30 Cb 0.38 -0.10 -0.02 0.00 1.01 0.00 0.00 36.73 38.01 1s7o h TYR 30 CO -0.92 0.59 0.04 0.97 -1.05 0.00 0.00 178.16 177.79 1s7o h ILE 31 N 0.07 1.21 -0.27 -2.88 2.10 -1.72 0.59 117.51 116.61 1s7o h ILE 31 Ca 0.05 -0.81 0.04 0.00 1.08 0.00 0.00 64.86 65.22 1s7o h ILE 31 Cb 0.46 0.86 -0.04 0.00 -1.09 0.00 0.00 36.82 37.02 1s7o h ILE 31 CO 0.02 0.29 0.04 -0.08 -1.08 0.00 0.00 178.15 177.33 1s7o h GLU 32 N 0.61 0.13 -0.67 2.19 4.81 -1.20 0.17 114.58 120.62 1s7o h GLU 32 Ca 0.13 -0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.29 1s7o h GLU 32 Cb 0.33 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 1s7o h GLU 32 CO 0.01 0.09 0.15 -0.07 -0.73 0.00 0.00 179.01 178.46 1s7o h LEU 33 N 0.13 1.02 -0.07 1.64 3.38 -1.03 -0.36 115.31 120.02 1s7o h LEU 33 Ca 0.13 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1s7o h LEU 33 Cb 0.14 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 1s7o h LEU 33 CO -0.18 1.00 0.05 0.22 0.09 0.00 0.00 178.44 179.62 1s7o h TYR 34 N 1.00 0.10 0.01 1.13 3.20 -0.39 -1.27 116.97 120.75 1s7o h TYR 34 Ca 0.21 0.00 -0.23 0.00 3.14 0.00 0.00 58.73 61.85 1s7o h TYR 34 Cb 0.38 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.59 1s7o h TYR 34 CO 0.03 0.08 -1.27 1.88 -1.64 0.00 0.00 178.16 177.24 1s7o h TYR 35 N 0.08 0.04 0.02 -3.82 -1.99 -0.69 -3.07 116.97 107.54 1s7o h TYR 35 Ca 0.03 -0.03 -0.25 0.00 2.00 0.00 0.00 58.73 60.47 1s7o h TYR 35 Cb 0.01 -0.00 0.01 0.00 2.00 0.00 0.00 36.73 38.75 1s7o h TYR 35 CO -0.07 1.50 -1.03 0.00 -0.00 0.00 0.00 178.16 178.57 1s7o h ALA 36 N -0.43 0.22 -0.17 3.88 0.00 -1.22 -3.35 119.26 118.18 1s7o h ALA 36 Ca -0.34 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 53.85 1s7o h ALA 36 Cb 1.35 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1s7o h ALA 36 CO -0.18 0.75 0.00 -0.25 0.00 0.00 0.00 179.25 179.57 1s7o n ASP 37 N -3.79 2.47 -2.20 0.00 8.00 -0.87 -4.99 116.55 115.16 1s7o n ASP 37 Ca -0.09 -1.72 -0.20 0.00 0.71 0.00 0.00 54.79 53.49 1s7o n ASP 37 Cb 0.88 -0.11 -0.02 0.00 -0.02 0.00 0.00 41.12 41.85 1s7o n ASP 37 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1s7o n ASP 38 N 0.68 -5.65 -4.77 -2.24 -0.08 -0.58 -4.95 116.55 98.96 1s7o n ASP 38 Ca 0.10 0.02 -0.33 0.00 -1.51 0.00 0.00 54.79 53.06 1s7o n ASP 38 Cb 0.37 -4.70 0.04 0.00 2.34 0.00 0.00 41.12 39.17 1s7o n ASP 38 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 1s7o s TYR 39 N -2.97 2.64 0.71 -0.67 1.51 -0.60 -4.98 117.35 112.98 1s7o s TYR 39 Ca 0.00 1.55 -0.05 0.00 -1.01 0.00 0.00 57.07 57.56 1s7o s TYR 39 Cb 0.00 -3.20 0.08 0.00 -0.11 0.00 0.00 41.96 38.74 1s7o s TYR 39 CO 0.00 -1.66 1.00 -1.54 -1.11 0.00 0.00 175.55 172.24 1s7o s SER 40 N -2.40 4.63 0.31 2.29 1.04 -1.26 -4.55 113.70 113.77 1s7o s SER 40 Ca 0.68 0.19 0.01 0.00 0.48 0.00 0.00 55.95 57.31 1s7o s SER 40 Cb -0.21 -0.77 0.51 0.00 0.10 0.00 0.00 66.02 65.65 1s7o s SER 40 CO 0.38 -1.68 1.87 -0.07 0.98 0.00 0.00 173.24 174.72 1s7o h LEU 41 N -0.57 0.68 -0.36 2.42 3.38 -1.98 -1.85 115.31 117.03 1s7o h LEU 41 Ca -0.42 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.40 1s7o h LEU 41 Cb 1.29 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 1s7o h LEU 41 CO 0.53 0.66 0.07 0.00 0.09 0.00 0.00 178.44 179.78 1s7o h ALA 42 N 1.44 0.48 -0.60 1.53 0.00 -1.95 -0.12 119.26 120.04 1s7o h ALA 42 Ca 0.16 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1s7o h ALA 42 Cb 0.24 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1s7o h ALA 42 CO -0.01 0.16 0.15 0.93 0.00 0.00 0.00 179.25 180.49 1s7o h GLU 43 N 0.43 0.95 -0.47 0.00 5.08 -1.89 0.80 114.58 119.48 1s7o h GLU 43 Ca 0.11 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 1s7o h GLU 43 Cb 0.33 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 1s7o h GLU 43 CO 0.00 0.87 0.30 0.82 -1.00 0.00 0.00 179.01 180.00 1s7o h ILE 44 N 0.86 1.13 -0.53 3.13 2.04 -1.14 -0.32 117.51 122.68 1s7o h ILE 44 Ca 0.19 -0.28 -0.03 0.00 1.00 0.00 0.00 64.86 65.74 1s7o h ILE 44 Cb 0.34 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 1s7o h ILE 44 CO 0.00 0.13 0.21 0.00 0.00 0.00 0.00 178.15 178.49 1s7o h ALA 45 N 1.15 0.69 -0.20 1.87 0.00 -0.54 -1.63 119.26 120.60 1s7o h ALA 45 Ca 0.17 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1s7o h ALA 45 Cb -0.04 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1s7o h ALA 45 CO -0.03 0.31 0.11 -0.44 0.00 0.00 0.00 179.25 179.19 1s7o h ASP 46 N 0.72 0.16 -0.91 0.00 3.32 -0.65 0.29 116.42 119.36 1s7o h ASP 46 Ca 0.18 0.01 0.09 0.00 0.02 0.00 0.00 57.03 57.32 1s7o h ASP 46 Cb 0.21 -0.03 -0.07 0.00 0.22 0.00 0.00 39.33 39.66 1s7o h ASP 46 CO -0.01 0.13 0.56 -0.08 -1.72 0.00 0.00 179.24 178.11 1s7o h GLU 47 N 0.23 0.91 -0.28 3.56 4.57 -0.69 -2.24 114.58 120.64 1s7o h GLU 47 Ca 0.08 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1s7o h GLU 47 Cb 0.01 -0.21 0.00 0.00 -0.16 0.00 0.00 28.75 28.40 1s7o h GLU 47 CO -0.05 0.60 0.00 1.19 -1.18 0.00 0.00 179.01 179.57 1s7o n PHE 48 N -4.65 0.35 -3.50 0.92 3.01 -0.65 -4.95 117.46 108.00 1s7o n PHE 48 Ca 0.15 -0.17 -0.18 0.00 1.01 0.00 0.00 57.45 58.26 1s7o n PHE 48 Cb 0.27 0.00 0.08 0.00 -0.01 0.00 0.00 39.48 39.81 1s7o n PHE 48 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1s7o n GLY 49 N 1.41 -0.34 2.73 1.37 0.00 0.82 -5.01 105.19 106.16 1s7o n GLY 49 Ca 0.18 0.11 -0.18 0.00 0.00 0.00 0.00 46.02 46.13 1s7o n GLY 49 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1s7o n VAL 50 N -4.18 0.00 -2.09 1.61 0.24 -0.12 -5.03 118.33 108.76 1s7o n VAL 50 Ca -0.29 -2.03 -0.31 0.00 -2.04 0.00 0.00 64.34 59.68 1s7o n VAL 50 Cb 0.67 0.93 0.00 0.00 -1.47 0.00 0.00 33.84 33.97 1s7o n VAL 50 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1s7o s SER 51 N -3.00 6.29 0.22 -1.34 1.04 -1.26 -4.40 113.70 111.25 1s7o s SER 51 Ca 0.29 1.35 -0.09 0.00 0.48 0.00 0.00 55.95 57.98 1s7o s SER 51 Cb 0.01 -2.43 0.18 0.00 0.10 0.00 0.00 66.02 63.88 1s7o s SER 51 CO 0.20 -0.78 1.86 0.03 0.98 0.00 0.00 173.24 175.53 1s7o h ARG 52 N -0.04 1.12 -0.80 4.02 3.08 -1.94 -2.86 114.38 116.97 1s7o h ARG 52 Ca -0.45 -0.11 0.04 0.00 0.07 0.00 0.00 59.98 59.53 1s7o h ARG 52 Cb 1.19 -0.23 -0.05 0.00 0.08 0.00 0.00 29.97 30.96 1s7o h ARG 52 CO 0.62 0.80 0.50 0.37 -1.07 0.00 0.00 179.97 181.19 1s7o h GLN 53 N 1.13 0.94 -0.97 0.04 5.75 -1.96 0.34 115.11 120.38 1s7o h GLN 53 Ca 0.29 -0.06 0.03 0.00 -0.15 0.00 0.00 58.65 58.77 1s7o h GLN 53 Cb -0.03 -0.21 -0.05 0.00 1.07 0.00 0.00 27.48 28.26 1s7o h GLN 53 CO -0.05 0.62 0.64 0.00 -2.65 0.00 0.00 178.83 177.39 1s7o h ALA 54 N 1.35 1.36 -0.08 3.38 0.00 -1.91 0.21 119.26 123.57 1s7o h ALA 54 Ca 0.33 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1s7o h ALA 54 Cb 0.05 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 1s7o h ALA 54 CO -0.13 0.56 -0.02 0.28 0.00 0.00 0.00 179.25 179.94 1s7o h VAL 55 N 1.25 1.29 -0.12 0.00 2.07 -0.89 -1.67 116.25 118.17 1s7o h VAL 55 Ca 0.38 -0.91 0.04 0.00 0.82 0.00 0.00 66.70 67.03 1s7o h VAL 55 Cb -0.03 1.73 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 1s7o h VAL 55 CO -0.11 0.26 -0.17 0.22 0.02 0.00 0.00 177.57 177.79 1s7o h TYR 56 N -0.17 -0.42 -0.52 1.57 3.20 -0.03 -1.71 116.97 118.89 1s7o h TYR 56 Ca 0.02 0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.97 1s7o h TYR 56 Cb 0.41 0.21 -0.05 0.00 1.54 0.00 0.00 36.73 38.84 1s7o h TYR 56 CO 0.05 -0.24 0.23 -0.44 -1.64 0.00 0.00 178.16 176.12 1s7o h ASP 57 N -0.21 0.29 -0.26 -2.11 3.32 -0.49 -2.17 116.42 114.79 1s7o h ASP 57 Ca 0.09 0.04 -0.08 0.00 0.02 0.00 0.00 57.03 57.10 1s7o h ASP 57 Cb 0.35 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 1s7o h ASP 57 CO -0.25 0.20 -0.11 -1.13 -1.72 0.00 0.00 179.24 176.23 1s7o h ASN 58 N 0.44 0.65 -0.21 6.45 -0.73 -1.07 -0.85 115.58 120.26 1s7o h ASN 58 Ca 0.24 -0.18 -0.13 0.00 1.87 0.00 0.00 56.30 58.09 1s7o h ASN 58 Cb 0.20 -0.17 0.00 0.00 0.27 0.00 0.00 38.32 38.62 1s7o h ASN 58 CO -0.20 0.79 -0.38 0.40 -0.37 0.00 0.00 177.43 177.68 1s7o h ILE 59 N 0.61 1.32 -0.79 2.57 2.04 -1.05 -1.71 117.51 120.51 1s7o h ILE 59 Ca 0.11 -1.60 0.02 0.00 1.00 0.00 0.00 64.86 64.39 1s7o h ILE 59 Cb 0.55 1.83 -0.04 0.00 -0.74 0.00 0.00 36.82 38.42 1s7o h ILE 59 CO 0.03 0.50 0.52 0.11 0.00 0.00 0.00 178.15 179.31 1s7o h LYS 60 N 0.31 1.00 -0.54 2.37 1.79 -1.24 0.28 116.57 120.53 1s7o h LYS 60 Ca 0.01 -0.06 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 1s7o h LYS 60 Cb 0.97 -0.22 -0.03 0.00 -1.58 0.00 0.00 32.23 31.37 1s7o h LYS 60 CO 0.08 0.66 0.29 0.00 -1.08 0.00 0.00 179.45 179.40 1s7o h ARG 61 N 1.03 0.77 -0.51 3.15 3.08 -1.03 -1.83 114.38 119.03 1s7o h ARG 61 Ca 0.30 -0.10 -0.09 0.00 0.07 0.00 0.00 59.98 60.16 1s7o h ARG 61 Cb -0.05 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 1s7o h ARG 61 CO -0.09 0.61 -0.05 1.15 -1.07 0.00 0.00 179.97 180.51 1s7o h THR 62 N 0.73 1.26 -0.94 2.04 2.02 -0.52 -1.46 112.91 116.04 1s7o h THR 62 Ca 0.19 -1.15 0.03 0.00 0.77 0.00 0.00 66.41 66.25 1s7o h THR 62 Cb 0.07 0.93 -0.05 0.00 -1.74 0.00 0.00 68.15 67.35 1s7o h THR 62 CO -0.03 0.40 0.61 -0.33 0.37 0.00 0.00 175.52 176.55 1s7o h GLU 63 N 0.82 1.18 -0.62 6.66 5.08 -0.08 0.20 114.58 127.81 1s7o h GLU 63 Ca 0.14 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.35 1s7o h GLU 63 Cb 0.56 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1s7o h GLU 63 CO 0.03 0.78 0.08 -0.22 -1.00 0.00 0.00 179.01 178.68 1s7o h LYS 64 N 1.21 1.04 -0.73 2.33 3.64 -0.73 0.02 116.57 123.34 1s7o h LYS 64 Ca 0.37 -0.28 -0.06 0.00 -1.27 0.00 0.00 60.65 59.41 1s7o h LYS 64 Cb -0.04 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.63 1s7o h LYS 64 CO -0.11 0.97 0.24 0.82 -2.27 0.00 0.00 179.45 179.10 1s7o h ILE 65 N 0.97 1.26 -0.66 2.00 2.04 -0.19 -1.74 117.51 121.18 1s7o h ILE 65 Ca 0.19 -0.88 -0.06 0.00 1.00 0.00 0.00 64.86 65.11 1s7o h ILE 65 Cb 0.45 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.95 1s7o h ILE 65 CO 0.02 0.35 0.20 -0.07 0.00 0.00 0.00 178.15 178.64 1s7o h LEU 66 N 1.08 0.98 -1.32 1.44 3.38 -0.12 -1.62 115.31 119.12 1s7o h LEU 66 Ca 0.24 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1s7o h LEU 66 Cb 0.29 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1s7o h LEU 66 CO -0.01 0.93 -0.06 -0.08 0.09 0.00 0.00 178.44 179.31 1s7o h GLU 67 N 0.97 0.38 -0.39 1.13 4.57 -0.78 -0.87 114.58 119.59 1s7o h GLU 67 Ca 0.21 -0.08 -0.08 0.00 -1.18 0.00 0.00 59.36 58.23 1s7o h GLU 67 Cb 0.31 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 1s7o h GLU 67 CO -0.00 0.46 -0.08 1.15 -1.18 0.00 0.00 179.01 179.35 1s7o h THR 68 N 0.37 1.27 -0.69 0.32 2.02 -0.75 -1.65 112.91 113.81 1s7o h THR 68 Ca 0.08 -1.16 0.02 0.00 0.77 0.00 0.00 66.41 66.12 1s7o h THR 68 Cb 0.34 1.23 -0.04 0.00 -1.74 0.00 0.00 68.15 67.94 1s7o h THR 68 CO 0.02 0.39 0.44 1.88 0.37 0.00 0.00 175.52 178.61 1s7o h TYR 69 N 0.56 0.83 -0.63 3.16 0.05 -0.62 -1.52 116.97 118.79 1s7o h TYR 69 Ca 0.10 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.87 1s7o h TYR 69 Cb 0.60 -0.27 -0.03 0.00 1.01 0.00 0.00 36.73 38.04 1s7o h TYR 69 CO 0.05 0.49 0.29 1.49 -1.05 0.00 0.00 178.16 179.42 1s7o h GLU 70 N 0.87 0.92 -0.15 4.88 4.57 -0.93 0.26 114.58 125.00 1s7o h GLU 70 Ca 0.27 -0.15 -0.06 0.00 -1.18 0.00 0.00 59.36 58.24 1s7o h GLU 70 Cb -0.02 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 1s7o h GLU 70 CO -0.09 0.75 -0.17 0.52 -1.18 0.00 0.00 179.01 178.84 1s7o h MET 71 N 0.88 0.24 0.14 1.92 2.86 -1.03 0.33 114.93 120.26 1s7o h MET 71 Ca 0.22 -0.06 -0.31 0.00 -2.06 0.00 0.00 59.70 57.48 1s7o h MET 71 Cb 0.15 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.78 1s7o h MET 71 CO -0.02 0.42 -1.50 0.87 1.06 0.00 0.00 176.91 177.74 1s7o h LYS 72 N 0.23 0.30 0.00 1.72 1.57 -0.42 -3.41 116.57 116.56 1s7o h LYS 72 Ca 0.04 -0.52 -0.16 0.00 -1.87 0.00 0.00 60.65 58.15 1s7o h LYS 72 Cb 0.44 0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.92 1s7o h LYS 72 CO 0.03 1.19 -1.79 1.28 -0.57 0.00 0.00 179.45 179.59 1s7o n LEU 73 N -3.51 0.00 -1.99 2.94 4.77 0.82 -5.02 117.00 115.00 1s7o n LEU 73 Ca -0.16 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.62 1s7o n LEU 73 Cb 1.05 0.21 -0.05 0.00 -2.33 0.00 0.00 43.42 42.31 1s7o n LEU 73 CO 0.52 0.21 -0.23 1.41 -1.33 0.00 0.00 177.39 177.97 1s7o n HIS 74 N -2.31 -0.53 -0.13 -1.77 8.25 0.11 -4.87 115.22 113.97 1s7o n HIS 74 Ca -0.15 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.29 1s7o n HIS 74 Cb 0.73 -3.70 0.20 0.00 1.12 0.00 0.00 29.99 28.34 1s7o n HIS 74 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 1s7o h MET 75 N 0.00 0.83 0.02 -0.41 2.86 -1.89 -0.45 114.93 115.89 1s7o h MET 75 Ca -0.46 -0.16 -0.12 0.00 -2.06 0.00 0.00 59.70 56.91 1s7o h MET 75 Cb 1.35 -0.13 0.01 0.00 0.06 0.00 0.00 31.60 32.89 1s7o h MET 75 CO 0.59 0.73 -0.48 -0.92 1.06 0.00 0.00 176.91 177.89 1s7o h TYR 76 N 0.81 0.46 -0.48 -0.22 3.20 -1.90 -1.89 116.97 116.94 1s7o h TYR 76 Ca 0.18 -0.26 -0.06 0.00 3.14 0.00 0.00 58.73 61.73 1s7o h TYR 76 Cb 0.25 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 1s7o h TYR 76 CO 0.02 1.09 0.06 0.66 -1.64 0.00 0.00 178.16 178.34 1s7o h SER 77 N -0.30 0.71 -0.24 -2.11 4.64 -1.91 0.37 113.55 114.71 1s7o h SER 77 Ca -0.06 -0.14 -0.03 0.00 -0.47 0.00 0.00 61.79 61.08 1s7o h SER 77 Cb 1.23 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 63.12 1s7o h SER 77 CO 0.09 0.75 0.07 0.44 -0.87 0.00 0.00 176.83 177.32 1s7o h ASP 78 N 0.72 0.41 -0.06 4.97 3.32 -1.06 -1.02 116.42 123.70 1s7o h ASP 78 Ca 0.15 -0.05 -0.17 0.00 0.02 0.00 0.00 57.03 56.98 1s7o h ASP 78 Cb 0.36 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 1s7o h ASP 78 CO 0.01 0.42 -0.56 0.22 -1.72 0.00 0.00 179.24 177.61 1s7o h TYR 79 N 0.45 0.81 -0.32 4.55 3.20 -0.44 -1.16 116.97 124.07 1s7o h TYR 79 Ca 0.11 -0.29 -0.14 0.00 3.14 0.00 0.00 58.73 61.54 1s7o h TYR 79 Cb 0.18 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 1s7o h TYR 79 CO 0.01 1.06 -0.37 0.28 -1.64 0.00 0.00 178.16 177.49 1s7o h VAL 80 N 0.49 1.29 -0.12 1.81 2.07 -0.45 -1.92 116.25 119.42 1s7o h VAL 80 Ca 0.01 -1.54 -0.10 0.00 0.82 0.00 0.00 66.70 65.89 1s7o h VAL 80 Cb 1.12 1.44 0.00 0.00 -1.52 0.00 0.00 31.29 32.34 1s7o h VAL 80 CO 0.11 0.50 -0.32 0.58 0.02 0.00 0.00 177.57 178.46 1s7o h VAL 81 N 0.61 1.38 -0.70 2.57 2.07 -1.08 -2.47 116.25 118.63 1s7o h VAL 81 Ca 0.06 -1.62 0.03 0.00 0.82 0.00 0.00 66.70 65.99 1s7o h VAL 81 Cb 0.91 2.10 -0.04 0.00 -1.52 0.00 0.00 31.29 32.74 1s7o h VAL 81 CO 0.08 0.48 0.44 0.03 0.02 0.00 0.00 177.57 178.62 1s7o h ARG 82 N 0.02 0.84 -0.89 1.57 3.08 -1.25 -1.68 114.38 116.07 1s7o h ARG 82 Ca -0.00 -0.05 0.10 0.00 0.07 0.00 0.00 59.98 60.09 1s7o h ARG 82 Cb 0.93 -0.19 -0.07 0.00 0.08 0.00 0.00 29.97 30.72 1s7o h ARG 82 CO 0.07 0.56 0.58 0.77 -1.07 0.00 0.00 179.97 180.87 1s7o h SER 83 N 0.87 0.80 -0.34 7.04 0.02 -1.19 0.67 113.55 121.42 1s7o h SER 83 Ca 0.28 0.02 -0.16 0.00 -0.84 0.00 0.00 61.79 61.09 1s7o h SER 83 Cb -0.00 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.40 1s7o h SER 83 CO -0.10 0.47 -0.42 -0.08 -1.14 0.00 0.00 176.83 175.55 1s7o h GLU 84 N 0.88 0.88 -0.33 3.45 4.81 -0.89 0.14 114.58 123.52 1s7o h GLU 84 Ca 0.42 -0.50 -0.09 0.00 -0.13 0.00 0.00 59.36 59.06 1s7o h GLU 84 Cb 0.42 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 1s7o h GLU 84 CO -0.18 1.14 -0.18 0.82 -0.73 0.00 0.00 179.01 179.88 1s7o h ILE 85 N 0.67 1.26 -0.22 2.32 2.04 -0.32 -0.92 117.51 122.34 1s7o h ILE 85 Ca 0.04 -1.19 -0.04 0.00 1.00 0.00 0.00 64.86 64.67 1s7o h ILE 85 Cb 1.02 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 1s7o h ILE 85 CO 0.10 0.39 -0.03 -0.26 0.00 0.00 0.00 178.15 178.35 1s7o h PHE 86 N 0.54 0.45 -0.79 1.37 0.04 0.65 -2.15 116.94 117.05 1s7o h PHE 86 Ca 0.09 -0.09 0.09 0.00 2.80 0.00 0.00 57.97 60.86 1s7o h PHE 86 Cb 0.61 -0.11 -0.07 0.00 2.20 0.00 0.00 35.95 38.58 1s7o h PHE 86 CO 0.02 0.62 0.44 -0.44 -0.60 0.00 0.00 178.31 178.35 1s7o h ASP 87 N 0.15 0.62 -0.70 2.17 3.32 -0.46 -0.95 116.42 120.57 1s7o h ASP 87 Ca 0.06 0.05 0.04 0.00 0.02 0.00 0.00 57.03 57.20 1s7o h ASP 87 Cb 0.46 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.89 1s7o h ASP 87 CO 0.02 0.36 0.42 0.44 -1.72 0.00 0.00 179.24 178.75 1s7o h ASP 88 N 0.75 0.66 -0.18 6.45 3.32 -0.89 -0.90 116.42 125.63 1s7o h ASP 88 Ca 0.38 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.43 1s7o h ASP 88 Cb 0.35 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1s7o h ASP 88 CO -0.25 0.44 0.05 0.24 -1.72 0.00 0.00 179.24 178.01 1s7o h MET 89 N 0.80 0.27 -0.68 3.56 2.86 -0.63 -1.00 114.93 120.12 1s7o h MET 89 Ca 0.30 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 57.82 1s7o h MET 89 Cb 0.10 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.69 1s7o h MET 89 CO -0.14 0.39 0.21 0.82 1.06 0.00 0.00 176.91 179.25 1s7o h ILE 90 N 0.11 1.25 -0.20 -1.22 2.04 -1.10 0.09 117.51 118.48 1s7o h ILE 90 Ca 0.06 -0.85 -0.04 0.00 1.00 0.00 0.00 64.86 65.03 1s7o h ILE 90 Cb 0.23 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 1s7o h ILE 90 CO -0.00 0.33 -0.04 0.00 0.00 0.00 0.00 178.15 178.44 1s7o h ALA 91 N 1.22 1.56 -0.08 1.87 0.00 -0.85 -2.64 119.26 120.35 1s7o h ALA 91 Ca 0.22 -0.16 -0.21 0.00 0.00 0.00 0.00 54.91 54.76 1s7o h ALA 91 Cb 0.28 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1s7o h ALA 91 CO -0.01 0.32 -0.81 1.25 0.00 0.00 0.00 179.25 180.00 1s7o h HIS 92 N 0.30 0.80 -2.62 0.00 -0.00 0.27 -3.36 115.15 110.53 1s7o h HIS 92 Ca 0.07 -0.37 -0.60 0.00 -0.00 0.00 0.00 60.37 59.46 1s7o h HIS 92 Cb 0.27 -0.11 -0.41 0.00 -0.00 0.00 0.00 27.41 27.16 1s7o h HIS 92 CO 0.01 1.18 -0.73 0.66 -0.00 0.00 0.00 177.93 179.04 1s7o n TYR 93 N -3.86 1.89 0.28 5.26 4.02 -0.15 -4.97 117.16 119.63 1s7o n TYR 93 Ca -0.06 -3.95 0.17 0.00 -0.01 0.00 0.00 57.90 54.05 1s7o n TYR 93 Cb 0.76 -0.36 0.69 0.00 -0.02 0.00 0.00 39.34 40.41 1s7o n TYR 93 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1s7o h PRO 94 N 5.08 0.00 -0.30 -0.72 0.11 -1.65 -2.97 132.00 131.55 1s7o h PRO 94 Ca 0.18 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 66.15 1s7o h PRO 94 Cb 0.79 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 31.81 1s7o h PRO 94 CO 0.63 0.01 -0.12 0.72 -0.21 0.00 0.00 178.00 179.03 1s7o n HIS 95 N -3.11 0.93 -3.57 0.65 8.25 -1.26 -4.88 115.22 112.23 1s7o n HIS 95 Ca 0.00 -1.53 -0.40 0.00 -0.26 0.00 0.00 57.72 55.53 1s7o n HIS 95 Cb 0.31 -0.45 -0.07 0.00 1.12 0.00 0.00 29.99 30.90 1s7o n HIS 95 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1s7o s ASP 96 N -2.58 5.76 0.24 0.41 -1.08 -1.13 -4.95 116.67 113.35 1s7o s ASP 96 Ca 0.43 -2.49 -0.06 0.00 -0.52 0.00 0.00 52.55 49.91 1s7o s ASP 96 Cb 0.40 -1.99 0.28 0.00 -1.46 0.00 0.00 42.92 40.14 1s7o s ASP 96 CO -0.00 -0.53 1.89 -0.33 0.52 0.00 0.00 175.17 176.71 1s7o h GLU 97 N 7.71 1.11 -0.97 4.34 5.08 -1.90 -1.29 114.58 128.65 1s7o h GLU 97 Ca -0.05 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1s7o h GLU 97 Cb 1.02 -0.25 -0.05 0.00 0.50 0.00 0.00 28.75 29.97 1s7o h GLU 97 CO 0.77 0.73 0.64 -0.92 -1.00 0.00 0.00 179.01 179.23 1s7o h TYR 98 N 1.14 1.21 0.11 4.33 3.20 -1.99 0.17 116.97 125.14 1s7o h TYR 98 Ca 0.36 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.25 1s7o h TYR 98 Cb -0.01 -0.41 0.00 0.00 1.54 0.00 0.00 36.73 37.86 1s7o h TYR 98 CO -0.01 0.75 -0.05 1.25 -1.64 0.00 0.00 178.16 178.45 1s7o h LEU 99 N 1.29 -0.13 -0.77 2.82 5.85 -1.75 -1.70 115.31 120.92 1s7o h LEU 99 Ca 0.36 -0.22 0.17 0.00 0.84 0.00 0.00 57.88 59.03 1s7o h LEU 99 Cb -0.12 0.03 -0.11 0.00 0.37 0.00 0.00 40.66 40.84 1s7o h LEU 99 CO -0.09 0.15 0.24 -0.61 -0.34 0.00 0.00 178.44 177.80 1s7o h GLN 100 N -0.42 0.32 -0.33 1.25 4.15 -1.04 -0.06 115.11 118.98 1s7o h GLN 100 Ca -0.02 -0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.35 1s7o h GLN 100 Cb 0.34 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 1s7o h GLN 100 CO 0.03 0.21 0.05 1.49 -1.93 0.00 0.00 178.83 178.68 1s7o h GLU 101 N 0.33 0.55 -0.57 1.69 4.57 -0.76 -0.91 114.58 119.48 1s7o h GLU 101 Ca 0.44 -0.15 0.08 0.00 -1.18 0.00 0.00 59.36 58.56 1s7o h GLU 101 Cb 0.76 -0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 29.22 1s7o h GLU 101 CO -0.49 0.64 0.23 0.87 -1.18 0.00 0.00 179.01 179.07 1s7o h LYS 102 N 0.38 0.41 -0.56 1.92 1.79 -0.46 -1.69 116.57 118.37 1s7o h LYS 102 Ca 0.10 -0.02 -0.10 0.00 -2.18 0.00 0.00 60.65 58.44 1s7o h LYS 102 Cb 0.35 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 30.89 1s7o h LYS 102 CO 0.01 0.27 -0.05 0.82 -1.08 0.00 0.00 179.45 179.42 1s7o h ILE 103 N 0.43 1.26 -0.48 1.86 2.04 -0.65 -0.39 117.51 121.57 1s7o h ILE 103 Ca 0.28 -1.19 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 1s7o h ILE 103 Cb 0.31 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 1s7o h ILE 103 CO -0.26 0.43 0.24 0.28 0.00 0.00 0.00 178.15 178.83 1s7o h SER 104 N 0.91 0.60 -0.07 1.72 0.02 -0.71 -0.28 113.55 115.75 1s7o h SER 104 Ca 0.15 -0.05 -0.05 0.00 -0.84 0.00 0.00 61.79 61.00 1s7o h SER 104 Cb 0.60 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.99 1s7o h SER 104 CO 0.04 0.50 -0.17 0.40 -1.14 0.00 0.00 176.83 176.47 1s7o h ILE 105 N 0.67 1.43 -0.78 3.27 2.04 -0.58 -1.66 117.51 121.90 1s7o h ILE 105 Ca 0.17 -1.52 0.10 0.00 1.00 0.00 0.00 64.86 64.61 1s7o h ILE 105 Cb 0.06 2.26 -0.07 0.00 -0.74 0.00 0.00 36.82 38.32 1s7o h ILE 105 CO -0.02 0.43 0.42 -0.07 0.00 0.00 0.00 178.15 178.90 1s7o h LEU 106 N -0.27 0.58 -0.68 1.44 -0.00 -0.83 -0.12 115.31 115.42 1s7o h LEU 106 Ca -0.00 0.05 -0.11 0.00 -0.00 0.00 0.00 57.88 57.82 1s7o h LEU 106 Cb 0.77 -0.05 -0.02 0.00 -0.00 0.00 0.00 40.66 41.36 1s7o h LEU 106 CO 0.04 0.33 -0.16 0.74 -0.00 0.00 0.00 178.44 179.38 1s7o h THR 107 N 0.70 1.27 -0.01 0.22 2.02 -0.99 -3.02 112.91 113.10 1s7o h THR 107 Ca 0.38 -1.27 -0.16 0.00 0.77 0.00 0.00 66.41 66.12 1s7o h THR 107 Cb 0.38 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.86 1s7o h THR 107 CO -0.26 0.44 -0.75 0.77 0.37 0.00 0.00 175.52 176.09 1s7o h SER 108 N 0.76 0.08 -0.74 4.18 4.64 -0.27 -2.88 113.55 119.31 1s7o h SER 108 Ca 0.11 -0.06 0.08 0.00 -0.47 0.00 0.00 61.79 61.46 1s7o h SER 108 Cb 0.68 -0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 62.68 1s7o h SER 108 CO 0.05 0.79 0.41 0.40 -0.87 0.00 0.00 176.83 177.62 1s7o h ILE 109 N 0.04 0.93 0.00 0.95 2.04 -0.95 -3.51 117.51 117.01 1s7o h ILE 109 Ca -0.01 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.60 1s7o h ILE 109 Cb 1.31 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.53 1s7o h ILE 109 CO 0.10 0.13 0.00 -0.67 0.00 0.00 0.00 178.15 177.72