#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mav s LYS 3 N 0.00 4.35 -0.07 -2.82 1.02 -1.26 -4.88 119.74 116.08 1mav s LYS 3 Ca 0.00 1.06 0.04 0.00 0.02 0.00 0.00 55.97 57.09 1mav s LYS 3 Cb 0.00 -2.70 -0.01 0.00 -0.52 0.00 0.00 37.83 34.59 1mav s LYS 3 CO 0.00 0.27 -0.21 -1.59 -0.92 0.00 0.00 175.35 172.90 1mav s LYS 4 N -2.28 2.71 -0.15 1.68 0.00 -1.26 -1.20 119.74 119.24 1mav s LYS 4 Ca 0.50 -0.82 0.00 0.00 0.00 0.00 0.00 55.97 55.65 1mav s LYS 4 Cb -0.16 -2.30 -0.00 0.00 0.00 0.00 0.00 37.83 35.37 1mav s LYS 4 CO 0.21 0.39 -0.15 0.08 0.00 0.00 0.00 175.35 175.88 1mav s VAL 5 N -0.17 2.67 -0.29 1.79 1.01 -0.54 -0.13 120.40 124.76 1mav s VAL 5 Ca -0.02 -0.77 -0.18 0.00 0.00 0.00 0.00 61.98 61.00 1mav s VAL 5 Cb -0.14 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.10 1mav s VAL 5 CO 0.04 0.52 0.54 -0.22 0.00 0.00 0.00 175.10 175.97 1mav s LEU 6 N 0.75 4.12 -0.25 3.92 2.96 -0.28 -0.95 118.68 128.94 1mav s LEU 6 Ca -0.06 0.41 -0.10 0.00 -0.22 0.00 0.00 54.13 54.16 1mav s LEU 6 Cb -0.15 -2.68 -0.05 0.00 0.50 0.00 0.00 46.19 43.81 1mav s LEU 6 CO 0.01 -0.36 0.15 -0.63 -1.32 0.00 0.00 176.35 174.20 1mav s ILE 7 N 2.39 5.13 -0.37 6.68 1.01 0.76 -0.61 121.20 136.18 1mav s ILE 7 Ca 0.22 0.10 -0.02 0.00 0.00 0.00 0.00 60.65 60.95 1mav s ILE 7 Cb -0.15 -3.41 0.09 0.00 0.01 0.00 0.00 42.46 39.00 1mav s ILE 7 CO 0.10 0.32 0.14 -0.69 0.00 0.00 0.00 174.94 174.81 1mav s VAL 8 N 1.34 3.17 -0.22 2.92 1.01 0.33 -1.79 120.40 127.15 1mav s VAL 8 Ca 0.07 -1.88 -0.10 0.00 0.00 0.00 0.00 61.98 60.07 1mav s VAL 8 Cb -0.15 -3.08 0.08 0.00 0.00 0.00 0.00 36.38 33.23 1mav s VAL 8 CO 0.06 -0.52 0.51 -0.70 0.00 0.00 0.00 175.10 174.45 1mav s GLU 9 N 1.16 0.47 0.28 2.72 2.56 -0.53 -1.40 118.70 123.97 1mav s GLU 9 Ca 0.05 1.02 0.18 0.00 0.00 0.00 0.00 54.97 56.22 1mav s GLU 9 Cb -0.22 0.19 0.09 0.00 2.00 0.00 0.00 34.13 36.20 1mav s GLU 9 CO -0.03 -0.18 1.36 0.22 -0.56 0.00 0.00 175.26 176.06 1mav h ASP 10 N 7.42 0.00 -3.23 -1.70 1.82 -1.82 -3.35 116.42 115.56 1mav h ASP 10 Ca -0.28 0.00 -0.58 0.00 -0.39 0.00 0.00 57.03 55.77 1mav h ASP 10 Cb 1.17 0.00 -0.07 0.00 0.68 0.00 0.00 39.33 41.11 1mav h ASP 10 CO 0.20 0.35 0.55 0.21 -1.61 0.00 0.00 179.24 178.94 1mav s ASN 11 N -6.20 7.00 0.18 2.28 3.84 -1.26 -4.96 114.94 115.80 1mav s ASN 11 Ca 0.03 1.24 -0.14 0.00 0.21 0.00 0.00 52.86 54.20 1mav s ASN 11 Cb 0.07 -2.49 0.15 0.00 -0.55 0.00 0.00 41.25 38.44 1mav s ASN 11 CO 0.74 -0.51 1.72 -0.08 -2.79 0.00 0.00 177.10 176.18 1mav h GLU 12 N 7.43 0.23 -0.37 0.43 4.81 -1.99 -0.04 114.58 125.08 1mav h GLU 12 Ca -0.25 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.97 1mav h GLU 12 Cb 1.10 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.41 1mav h GLU 12 CO 0.89 0.15 0.24 -0.07 -0.73 0.00 0.00 179.01 179.50 1mav h LEU 13 N 0.24 0.42 -0.44 1.64 3.38 -1.99 -0.88 115.31 117.67 1mav h LEU 13 Ca 0.22 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.11 1mav h LEU 13 Cb 0.27 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1mav h LEU 13 CO -0.28 0.30 0.01 0.78 0.09 0.00 0.00 178.44 179.34 1mav h ASN 14 N 0.50 0.76 -0.66 -0.43 2.35 -1.91 -1.72 115.58 114.47 1mav h ASN 14 Ca 0.14 -0.30 0.04 0.00 -0.55 0.00 0.00 56.30 55.62 1mav h ASN 14 Cb -0.05 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.07 1mav h ASN 14 CO -0.03 0.88 0.39 -0.03 -1.65 0.00 0.00 177.43 176.99 1mav h MET 15 N 0.62 0.74 -0.56 0.81 4.05 -0.79 -0.93 114.93 118.87 1mav h MET 15 Ca 0.13 -0.04 -0.11 0.00 -0.28 0.00 0.00 59.70 59.39 1mav h MET 15 Cb 0.48 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 31.10 1mav h MET 15 CO 0.02 0.49 -0.08 0.87 0.23 0.00 0.00 176.91 178.44 1mav h LYS 16 N 0.76 1.04 -0.01 0.39 1.57 -0.99 -0.67 116.57 118.66 1mav h LYS 16 Ca 0.27 -0.36 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1mav h LYS 16 Cb 0.07 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1mav h LYS 16 CO -0.13 1.06 0.00 1.25 -0.57 0.00 0.00 179.45 181.06 1mav h LEU 17 N 0.93 0.01 -0.48 2.94 5.85 -0.88 0.22 115.31 123.90 1mav h LEU 17 Ca 0.15 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.74 1mav h LEU 17 Cb 0.64 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 1mav h LEU 17 CO 0.04 0.15 0.30 -0.26 -0.34 0.00 0.00 178.44 178.33 1mav h PHE 18 N -0.14 0.56 -0.11 1.25 0.05 -1.12 -1.03 116.94 116.41 1mav h PHE 18 Ca 0.00 0.02 -0.00 0.00 3.82 0.00 0.00 57.97 61.81 1mav h PHE 18 Cb 0.15 -0.18 -0.01 0.00 2.00 0.00 0.00 35.95 37.91 1mav h PHE 18 CO -0.03 0.34 0.07 1.25 -0.18 0.00 0.00 178.31 179.76 1mav h HIS 19 N 0.60 0.15 -0.33 -0.55 2.76 -0.98 -1.23 115.15 115.56 1mav h HIS 19 Ca 0.18 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.36 1mav h HIS 19 Cb -0.03 -0.05 -0.02 0.00 1.55 0.00 0.00 27.41 28.87 1mav h HIS 19 CO -0.06 0.14 0.21 -0.44 -1.30 0.00 0.00 177.93 176.49 1mav h ASP 20 N 0.11 0.36 -0.61 3.26 3.32 -0.68 0.20 116.42 122.38 1mav h ASP 20 Ca 0.04 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 1mav h ASP 20 Cb 0.04 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 1mav h ASP 20 CO -0.01 0.26 0.29 -0.07 -1.72 0.00 0.00 179.24 177.99 1mav h LEU 21 N 0.43 0.80 -0.42 1.55 3.38 -1.10 -1.66 115.31 118.29 1mav h LEU 21 Ca 0.12 -0.13 -0.16 0.00 0.09 0.00 0.00 57.88 57.80 1mav h LEU 21 Cb -0.03 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1mav h LEU 21 CO -0.04 0.71 -0.36 -0.07 0.09 0.00 0.00 178.44 178.77 1mav h LEU 22 N 0.84 1.00 -1.02 1.67 3.38 -1.00 -3.05 115.31 117.12 1mav h LEU 22 Ca 0.21 -0.45 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 1mav h LEU 22 Cb 0.12 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1mav h LEU 22 CO -0.03 1.25 0.19 -0.08 0.09 0.00 0.00 178.44 179.86 1mav h GLU 23 N 0.77 0.89 0.00 1.13 4.81 -0.81 -1.82 114.58 119.55 1mav h GLU 23 Ca 0.07 -0.17 -0.02 0.00 -0.13 0.00 0.00 59.36 59.11 1mav h GLU 23 Cb 0.96 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 30.19 1mav h GLU 23 CO 0.09 0.77 -0.10 0.00 -0.73 0.00 0.00 179.01 179.04 1mav h ALA 24 N 1.34 1.57 -0.00 2.92 0.00 -1.20 -0.53 119.26 123.35 1mav h ALA 24 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1mav h ALA 24 Cb 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1mav h ALA 24 CO -0.01 0.13 -0.12 1.04 0.00 0.00 0.00 179.25 180.28 1mav n GLN 25 N -4.03 0.39 -0.28 0.00 1.13 -0.72 -4.91 117.38 108.96 1mav n GLN 25 Ca -0.02 -0.11 0.00 0.00 -1.94 0.00 0.00 57.00 54.93 1mav n GLN 25 Cb 0.19 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.04 1mav n GLN 25 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1mav n GLY 26 N 1.36 0.84 3.90 1.08 0.00 -0.21 -5.08 105.19 107.09 1mav n GLY 26 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1mav n GLY 26 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mav s TYR 27 N -2.05 3.50 0.19 1.61 1.51 -0.98 -4.74 117.35 116.39 1mav s TYR 27 Ca 0.00 0.81 0.03 0.00 -1.01 0.00 0.00 57.07 56.90 1mav s TYR 27 Cb 0.00 -2.26 -0.03 0.00 -0.11 0.00 0.00 41.96 39.55 1mav s TYR 27 CO 0.00 -0.05 0.34 -1.21 -1.11 0.00 0.00 175.55 173.52 1mav s GLU 28 N -4.01 3.45 0.10 -0.62 2.02 -0.34 -4.15 118.70 115.15 1mav s GLU 28 Ca 0.47 -0.60 0.04 0.00 0.02 0.00 0.00 54.97 54.90 1mav s GLU 28 Cb -0.10 -2.91 -0.04 0.00 0.10 0.00 0.00 34.13 31.18 1mav s GLU 28 CO 0.34 0.46 -0.10 0.95 0.02 0.00 0.00 175.26 176.93 1mav s THR 29 N -1.86 0.94 0.02 3.63 -4.23 -1.26 -1.46 115.64 111.41 1mav s THR 29 Ca 0.35 -1.66 0.08 0.00 -1.18 0.00 0.00 61.69 59.28 1mav s THR 29 Cb -0.10 -1.38 -0.02 0.00 1.34 0.00 0.00 72.50 72.33 1mav s THR 29 CO 0.29 -0.57 -0.23 -0.76 -0.54 0.00 0.00 174.62 172.81 1mav s LEU 30 N -2.48 2.12 0.01 4.79 1.43 -0.13 -4.90 118.68 119.51 1mav s LEU 30 Ca 0.06 -0.49 0.03 0.00 -1.03 0.00 0.00 54.13 52.70 1mav s LEU 30 Cb -0.02 -1.13 -0.01 0.00 0.03 0.00 0.00 46.19 45.06 1mav s LEU 30 CO -0.00 0.23 -0.09 -1.10 0.23 0.00 0.00 176.35 175.62 1mav s GLN 31 N -0.92 0.69 -0.02 1.70 -0.21 -1.26 -0.17 119.66 119.46 1mav s GLN 31 Ca 0.09 -0.42 -0.29 0.00 0.02 0.00 0.00 55.36 54.77 1mav s GLN 31 Cb -0.09 -0.64 0.07 0.00 1.00 0.00 0.00 33.01 33.34 1mav s GLN 31 CO 0.01 0.17 0.64 -0.08 -2.12 0.00 0.00 175.29 173.91 1mav s THR 32 N -0.43 0.00 -1.69 -0.19 -1.32 -0.74 -4.97 115.64 106.30 1mav s THR 32 Ca 0.01 -0.04 0.23 0.00 -1.21 0.00 0.00 61.69 60.68 1mav s THR 32 Cb -0.05 -0.98 -0.05 0.00 -1.51 0.00 0.00 72.50 69.92 1mav s THR 32 CO 0.00 -0.02 1.09 0.54 -2.21 0.00 0.00 174.62 174.02 1mav n ARG 33 N 0.75 0.80 -5.23 7.08 1.74 -1.26 -1.45 116.66 119.10 1mav n ARG 33 Ca -0.19 -0.65 -0.30 0.00 -0.77 0.00 0.00 57.85 55.94 1mav n ARG 33 Cb 0.58 -1.49 -0.16 0.00 -1.02 0.00 0.00 32.46 30.37 1mav n ARG 33 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 1mav s GLU 34 N -2.64 2.08 0.12 5.56 2.02 -1.26 -4.13 118.70 120.44 1mav s GLU 34 Ca 0.16 -0.88 -0.20 0.00 0.02 0.00 0.00 54.97 54.07 1mav s GLU 34 Cb 0.18 -1.96 -0.06 0.00 0.10 0.00 0.00 34.13 32.39 1mav s GLU 34 CO 0.65 0.50 1.76 0.78 0.02 0.00 0.00 175.26 178.97 1mav h GLY 35 N 5.63 0.23 1.01 -1.39 0.00 -1.94 -1.89 103.07 104.73 1mav h GLY 35 Ca -0.40 -0.06 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 1mav h GLY 35 CO 0.47 0.05 0.53 1.41 0.00 0.00 0.00 176.54 179.01 1mav h LEU 36 N 0.19 1.02 -1.29 3.11 3.38 -2.00 -1.86 115.31 117.85 1mav h LEU 36 Ca 0.07 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1mav h LEU 36 Cb 0.02 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1mav h LEU 36 CO -0.05 0.77 0.03 0.28 0.09 0.00 0.00 178.44 179.56 1mav h SER 37 N 1.17 0.47 -0.93 -0.43 0.02 -1.95 -2.27 113.55 109.64 1mav h SER 37 Ca 0.31 -0.08 0.07 0.00 -0.84 0.00 0.00 61.79 61.25 1mav h SER 37 Cb -0.07 -0.12 -0.07 0.00 0.14 0.00 0.00 62.40 62.28 1mav h SER 37 CO -0.06 0.52 0.59 0.00 -1.14 0.00 0.00 176.83 176.74 1mav h ALA 38 N 1.54 1.30 -0.28 3.77 0.00 -0.50 0.14 119.26 125.23 1mav h ALA 38 Ca 0.11 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1mav h ALA 38 Cb 0.28 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1mav h ALA 38 CO 0.00 0.33 0.05 -0.07 0.00 0.00 0.00 179.25 179.56 1mav h LEU 39 N 1.05 0.44 -0.20 0.00 3.38 -1.26 -0.67 115.31 118.05 1mav h LEU 39 Ca 0.41 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1mav h LEU 39 Cb 0.21 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1mav h LEU 39 CO -0.19 0.58 0.12 0.28 0.09 0.00 0.00 178.44 179.32 1mav h SER 40 N 0.28 0.24 -0.92 -0.43 0.02 -1.14 -2.56 113.55 109.04 1mav h SER 40 Ca 0.08 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 1mav h SER 40 Cb 0.33 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.76 1mav h SER 40 CO 0.00 0.23 0.55 0.40 -1.14 0.00 0.00 176.83 176.87 1mav h ILE 41 N 0.23 1.26 -0.55 3.27 2.04 -0.70 -2.29 117.51 120.77 1mav h ILE 41 Ca 0.07 -0.57 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 1mav h ILE 41 Cb 0.03 -0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.05 1mav h ILE 41 CO -0.01 0.27 0.25 0.00 0.00 0.00 0.00 178.15 178.66 1mav h ALA 42 N 1.32 1.41 0.00 1.87 0.00 -0.86 -0.05 119.26 122.95 1mav h ALA 42 Ca 0.33 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1mav h ALA 42 Cb -0.04 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 1mav h ALA 42 CO -0.06 0.46 -0.11 0.00 0.00 0.00 0.00 179.25 179.54 1mav h ARG 43 N 0.77 0.00 0.00 0.00 3.08 -1.03 -1.63 114.38 115.57 1mav h ARG 43 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1mav h ARG 43 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.16 1mav h ARG 43 CO -0.02 0.11 -1.69 -1.91 -1.07 0.00 0.00 179.97 175.39 1mav n GLU 44 N -3.15 0.61 0.00 0.04 4.07 -0.84 -4.62 120.64 116.75 1mav n GLU 44 Ca 0.02 -0.11 0.00 0.00 -0.06 0.00 0.00 57.16 57.02 1mav n GLU 44 Cb 0.50 -1.60 0.00 0.00 -0.06 0.00 0.00 31.44 30.29 1mav n GLU 44 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1mav n ASN 45 N -2.33 0.61 -3.46 4.31 3.02 -0.09 -5.08 115.26 112.23 1mav n ASN 45 Ca -0.03 -1.09 -0.31 0.00 -0.03 0.00 0.00 54.58 53.13 1mav n ASN 45 Cb 0.55 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.74 1mav n ASN 45 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 1mav n LYS 46 N -0.04 -1.61 -1.45 3.52 2.85 -0.61 -4.92 118.16 115.90 1mav n LYS 46 Ca 0.00 1.03 -0.31 0.00 -1.05 0.00 0.00 58.31 57.98 1mav n LYS 46 Cb 0.16 -1.90 0.07 0.00 -0.65 0.00 0.00 35.03 32.72 1mav n LYS 46 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 1mav s PRO 47 N -3.30 2.52 0.18 -1.58 0.04 -1.26 -4.92 135.00 126.67 1mav s PRO 47 Ca 0.20 0.97 0.23 0.00 0.04 0.00 0.00 61.00 62.44 1mav s PRO 47 Cb -0.02 -1.94 0.08 0.00 0.04 0.00 0.00 34.50 32.66 1mav s PRO 47 CO 0.81 -1.40 1.10 -0.44 0.04 0.00 0.00 177.00 177.11 1mav h ASP 48 N -0.94 0.00 -4.81 6.66 3.32 -0.88 -3.48 116.42 116.29 1mav h ASP 48 Ca -0.44 -0.07 -0.06 0.00 0.02 0.00 0.00 57.03 56.47 1mav h ASP 48 Cb 1.23 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.58 1mav h ASP 48 CO 0.55 0.04 0.14 -0.22 -1.72 0.00 0.00 179.24 178.03 1mav s LEU 49 N -5.01 -0.55 -0.14 1.55 0.20 -1.16 -4.24 118.68 109.32 1mav s LEU 49 Ca 0.01 0.80 0.02 0.00 0.69 0.00 0.00 54.13 55.66 1mav s LEU 49 Cb 0.11 2.42 0.01 0.00 -0.43 0.00 0.00 46.19 48.30 1mav s LEU 49 CO 0.78 -0.53 -0.22 -0.63 -0.29 0.00 0.00 176.35 175.46 1mav s ILE 50 N -0.90 2.04 -0.45 6.68 1.01 -0.34 -1.13 121.20 128.11 1mav s ILE 50 Ca -0.09 -0.97 -0.14 0.00 0.00 0.00 0.00 60.65 59.45 1mav s ILE 50 Cb -0.01 -1.80 0.06 0.00 0.01 0.00 0.00 42.46 40.71 1mav s ILE 50 CO 0.08 0.55 0.35 -0.22 0.00 0.00 0.00 174.94 175.69 1mav s LEU 51 N 0.83 5.40 -0.29 2.97 2.96 0.22 -0.48 118.68 130.30 1mav s LEU 51 Ca -0.07 -1.25 -0.06 0.00 -0.22 0.00 0.00 54.13 52.53 1mav s LEU 51 Cb -0.15 -2.14 0.01 0.00 0.50 0.00 0.00 46.19 44.40 1mav s LEU 51 CO -0.02 -0.58 0.07 -0.32 -1.32 0.00 0.00 176.35 174.18 1mav s MET 52 N 1.61 3.11 0.03 1.98 -2.45 0.26 -0.52 119.30 123.33 1mav s MET 52 Ca 0.04 -0.84 -0.30 0.00 -1.25 0.00 0.00 55.69 53.34 1mav s MET 52 Cb -0.23 -3.33 -0.06 0.00 1.25 0.00 0.00 34.83 32.47 1mav s MET 52 CO 0.07 -0.42 1.32 0.34 1.05 0.00 0.00 175.02 177.38 1mav s ASP 53 N 1.49 6.93 0.15 1.11 -1.08 -0.49 -0.52 116.67 124.26 1mav s ASP 53 Ca 0.03 2.09 -0.01 0.00 -0.52 0.00 0.00 52.55 54.14 1mav s ASP 53 Cb -0.17 -2.57 -0.03 0.00 -1.46 0.00 0.00 42.92 38.69 1mav s ASP 53 CO 0.02 -0.63 1.36 0.40 0.52 0.00 0.00 175.17 176.84 1mav h ILE 54 N 4.69 1.44 -1.15 4.11 1.08 -1.54 -3.36 117.51 122.77 1mav h ILE 54 Ca -0.39 -2.46 -0.58 0.00 -0.39 0.00 0.00 64.86 61.03 1mav h ILE 54 Cb 1.19 2.38 -0.17 0.00 -3.07 0.00 0.00 36.82 37.16 1mav h ILE 54 CO 0.87 0.73 1.00 0.00 -0.69 0.00 0.00 178.15 180.06 1mav n GLN 55 N -3.73 3.12 -2.38 2.37 3.00 -1.26 -1.61 117.38 116.89 1mav n GLN 55 Ca -0.05 -2.76 -0.34 0.00 -0.01 0.00 0.00 57.00 53.83 1mav n GLN 55 Cb 0.80 -2.29 -0.01 0.00 0.00 0.00 0.00 30.24 28.73 1mav n GLN 55 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1mav s LEU 56 N -2.29 3.78 0.41 1.08 1.43 -1.23 -4.95 118.68 116.90 1mav s LEU 56 Ca 0.57 2.04 0.19 0.00 -1.03 0.00 0.00 54.13 55.90 1mav s LEU 56 Cb 0.32 -4.57 0.87 0.00 0.03 0.00 0.00 46.19 42.85 1mav s LEU 56 CO -0.19 -1.02 1.84 1.55 0.23 0.00 0.00 176.35 178.76 1mav h PRO 57 N 1.32 0.00 0.00 1.29 0.13 -1.94 -3.30 132.00 129.50 1mav h PRO 57 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1mav h PRO 57 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1mav h PRO 57 CO 0.58 0.31 -1.76 -0.85 -0.23 0.00 0.00 178.00 176.05 1mav n GLU 58 N -3.70 0.56 -3.48 0.86 0.00 -1.26 -5.03 120.64 108.59 1mav n GLU 58 Ca -0.01 -0.15 -0.14 0.00 0.00 0.00 0.00 57.16 56.86 1mav n GLU 58 Cb 0.42 -1.49 -0.04 0.00 0.00 0.00 0.00 31.44 30.33 1mav n GLU 58 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.13 175.63 1mav s ILE 59 N -3.35 0.01 -0.01 3.84 2.07 -1.24 -5.11 121.20 117.41 1mav s ILE 59 Ca -0.05 -0.06 -0.30 0.00 -1.41 0.00 0.00 60.65 58.83 1mav s ILE 59 Cb 0.14 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.69 1mav s ILE 59 CO 0.87 -0.04 1.01 -0.55 -1.91 0.00 0.00 174.94 174.32 1mav s SER 60 N -2.22 7.32 0.58 4.50 0.15 -1.26 -3.58 113.70 119.19 1mav s SER 60 Ca -0.03 1.68 0.29 0.00 0.70 0.00 0.00 55.95 58.59 1mav s SER 60 Cb -0.01 -2.57 1.74 0.00 -1.71 0.00 0.00 66.02 63.47 1mav s SER 60 CO -0.05 -0.31 2.22 1.23 1.20 0.00 0.00 173.24 177.53 1mav h GLY 61 N 6.97 0.00 1.70 9.45 0.00 -1.46 -1.18 103.07 118.55 1mav h GLY 61 Ca -0.40 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 46.81 1mav h GLY 61 CO 0.77 0.00 -0.45 1.41 0.00 0.00 0.00 176.54 178.27 1mav h LEU 62 N 0.00 0.35 -0.55 3.11 3.38 -1.89 -0.58 115.31 119.13 1mav h LEU 62 Ca -0.00 -0.16 -0.16 0.00 0.09 0.00 0.00 57.88 57.65 1mav h LEU 62 Cb 0.07 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1mav h LEU 62 CO 0.00 0.76 -0.56 -0.33 0.09 0.00 0.00 178.44 178.40 1mav h GLU 63 N 0.27 0.48 -0.53 1.13 5.08 -1.62 -2.19 114.58 117.20 1mav h GLU 63 Ca 0.02 -0.31 -0.09 0.00 -1.00 0.00 0.00 59.36 57.98 1mav h GLU 63 Cb 0.90 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.16 1mav h GLU 63 CO 0.07 0.91 -0.02 0.28 -1.00 0.00 0.00 179.01 179.26 1mav h VAL 64 N 0.37 1.26 -0.29 3.13 2.07 -1.17 -2.35 116.25 119.26 1mav h VAL 64 Ca 0.00 -1.11 -0.04 0.00 0.82 0.00 0.00 66.70 66.38 1mav h VAL 64 Cb 1.10 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 1mav h VAL 64 CO 0.10 0.39 0.00 0.74 0.02 0.00 0.00 177.57 178.83 1mav h THR 65 N 0.84 1.18 -0.55 2.57 2.02 -0.82 -1.90 112.91 116.24 1mav h THR 65 Ca 0.15 -0.69 -0.05 0.00 0.77 0.00 0.00 66.41 66.59 1mav h THR 65 Cb 0.53 0.95 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 1mav h THR 65 CO 0.03 0.24 0.15 0.11 0.37 0.00 0.00 175.52 176.42 1mav h LYS 66 N 0.43 0.86 -0.80 6.66 1.57 -0.87 -1.56 116.57 122.86 1mav h LYS 66 Ca 0.10 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 1mav h LYS 66 Cb 0.28 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.44 1mav h LYS 66 CO 0.01 0.80 0.42 -1.49 -0.57 0.00 0.00 179.45 178.62 1mav h TRP 67 N 0.77 1.10 -0.60 -1.35 6.55 -1.09 -1.83 115.95 119.49 1mav h TRP 67 Ca 0.17 -0.03 -0.01 0.00 0.95 0.00 0.00 58.89 59.97 1mav h TRP 67 Cb 0.31 -0.35 -0.03 0.00 -0.86 0.00 0.00 29.16 28.23 1mav h TRP 67 CO 0.02 0.77 0.33 -0.07 -1.05 0.00 0.00 178.44 178.44 1mav h LEU 68 N 1.12 0.76 -0.79 -4.49 3.38 -0.88 -2.37 115.31 112.03 1mav h LEU 68 Ca 0.28 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1mav h LEU 68 Cb 0.05 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1mav h LEU 68 CO -0.04 0.64 0.00 0.11 0.09 0.00 0.00 178.44 179.23 1mav h LYS 69 N 0.82 0.00 -0.00 1.13 1.79 -0.80 -2.66 116.57 116.85 1mav h LYS 69 Ca 0.21 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.68 1mav h LYS 69 Cb 0.05 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.70 1mav h LYS 69 CO -0.03 0.00 -0.31 0.39 -1.08 0.00 0.00 179.45 178.42 1mav n GLU 70 N -2.60 0.11 -3.63 3.15 1.02 -0.74 -4.70 120.64 113.26 1mav n GLU 70 Ca 0.02 -0.05 -0.37 0.00 -0.02 0.00 0.00 57.16 56.74 1mav n GLU 70 Cb 0.31 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.12 1mav n GLU 70 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1mav s ASP 71 N -2.92 5.97 0.58 1.62 2.15 -1.03 -4.98 116.67 118.07 1mav s ASP 71 Ca 0.14 0.01 0.28 0.00 0.43 0.00 0.00 52.55 53.41 1mav s ASP 71 Cb 0.18 -2.10 1.64 0.00 -0.30 0.00 0.00 42.92 42.35 1mav s ASP 71 CO 0.62 -0.01 2.12 -2.24 -0.17 0.00 0.00 175.17 175.49 1mav h ASP 72 N 8.09 0.00 0.96 -0.34 3.04 -1.86 0.79 116.42 127.09 1mav h ASP 72 Ca -0.36 0.00 -0.06 0.00 -3.24 0.00 0.00 57.03 53.37 1mav h ASP 72 Cb 1.18 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.46 1mav h ASP 72 CO 0.58 0.00 -1.08 0.44 -2.04 0.00 0.00 179.24 177.15 1mav h ASP 73 N 0.00 0.00 0.00 4.15 3.32 -1.93 -3.39 116.42 118.57 1mav h ASP 73 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1mav h ASP 73 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 1mav h ASP 73 CO -0.00 0.20 -1.40 0.18 -1.72 0.00 0.00 179.24 176.51 1mav n LEU 74 N -2.78 0.21 -0.09 1.55 4.77 -0.67 -4.64 117.00 115.35 1mav n LEU 74 Ca -0.03 -0.15 0.18 0.00 -0.03 0.00 0.00 56.01 55.98 1mav n LEU 74 Cb 0.65 0.00 0.59 0.00 -2.33 0.00 0.00 43.42 42.33 1mav n LEU 74 CO 0.41 0.05 1.20 0.00 -1.33 0.00 0.00 177.39 177.72 1mav h ALA 75 N 1.61 2.29 0.00 -1.18 0.00 -0.56 -1.93 119.26 119.49 1mav h ALA 75 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1mav h ALA 75 Cb 0.59 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1mav h ALA 75 CO 0.00 -0.47 0.00 1.12 0.00 0.00 0.00 179.25 179.90 1mav h HIS 76 N 0.23 0.00 -2.75 0.00 2.07 -1.85 -3.45 115.15 109.39 1mav h HIS 76 Ca 0.31 0.00 -0.56 0.00 -2.85 0.00 0.00 60.37 57.27 1mav h HIS 76 Cb 0.92 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.87 1mav h HIS 76 CO -0.00 0.00 1.05 0.42 -3.07 0.00 0.00 177.93 176.33 1mav s ILE 77 N -3.16 3.81 0.28 6.12 1.01 -0.73 -4.96 121.20 123.56 1mav s ILE 77 Ca 0.09 0.95 -0.30 0.00 0.00 0.00 0.00 60.65 61.40 1mav s ILE 77 Cb 0.11 -3.70 -0.11 0.00 0.01 0.00 0.00 42.46 38.78 1mav s ILE 77 CO 0.58 -0.17 1.48 -2.16 0.00 0.00 0.00 174.94 174.67 1mav s PRO 78 N 4.13 4.22 -0.17 2.79 0.04 -1.26 -4.81 135.00 139.94 1mav s PRO 78 Ca 0.68 2.40 -0.01 0.00 0.04 0.00 0.00 61.00 64.10 1mav s PRO 78 Cb -0.27 -3.07 -0.01 0.00 0.04 0.00 0.00 34.50 31.19 1mav s PRO 78 CO 0.26 -0.48 -0.11 0.08 0.04 0.00 0.00 177.00 176.79 1mav s VAL 79 N -0.15 3.06 -0.23 -0.36 1.01 -1.26 -1.20 120.40 121.28 1mav s VAL 79 Ca 0.59 -0.63 -0.05 0.00 0.00 0.00 0.00 61.98 61.89 1mav s VAL 79 Cb -0.44 -2.33 -0.02 0.00 0.00 0.00 0.00 36.38 33.59 1mav s VAL 79 CO 0.47 0.49 0.01 -0.69 0.00 0.00 0.00 175.10 175.37 1mav s VAL 80 N 0.86 3.83 0.21 2.92 1.01 0.37 -0.49 120.40 129.11 1mav s VAL 80 Ca -0.03 -0.34 -0.22 0.00 0.00 0.00 0.00 61.98 61.40 1mav s VAL 80 Cb -0.15 -2.76 -0.08 0.00 0.00 0.00 0.00 36.38 33.39 1mav s VAL 80 CO 0.00 0.39 0.75 0.00 0.00 0.00 0.00 175.10 176.24 1mav s ALA 81 N 1.43 3.41 -0.28 5.51 0.00 -0.53 -0.58 121.76 130.73 1mav s ALA 81 Ca 0.05 0.24 -0.02 0.00 0.00 0.00 0.00 51.96 52.22 1mav s ALA 81 Cb -0.15 -2.87 0.04 0.00 0.00 0.00 0.00 23.12 20.14 1mav s ALA 81 CO 0.00 0.31 -0.01 0.08 0.00 0.00 0.00 175.76 176.15 1mav s VAL 82 N -1.42 3.09 0.12 0.00 1.01 0.32 0.32 120.40 123.84 1mav s VAL 82 Ca 0.41 -1.17 0.10 0.00 0.00 0.00 0.00 61.98 61.32 1mav s VAL 82 Cb -0.18 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.47 1mav s VAL 82 CO 0.22 0.02 -0.25 0.42 0.00 0.00 0.00 175.10 175.51 1mav s THR 83 N 1.31 2.35 -0.81 3.92 -4.23 -0.44 -1.29 115.64 116.46 1mav s THR 83 Ca -0.02 -1.66 0.11 0.00 -1.18 0.00 0.00 61.69 58.94 1mav s THR 83 Cb -0.18 -2.03 0.56 0.00 1.34 0.00 0.00 72.50 72.18 1mav s THR 83 CO -0.02 0.13 1.38 0.00 -0.54 0.00 0.00 174.62 175.58 1mav n ALA 84 N 1.01 3.25 0.00 3.99 0.00 -1.26 -1.77 120.51 125.73 1mav n ALA 84 Ca -0.17 -1.26 0.00 0.00 0.00 0.00 0.00 53.44 52.01 1mav n ALA 84 Cb 0.53 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.92 1mav n ALA 84 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1mav n GLU 91 N 0.57 0.00 0.40 0.00 -0.58 -1.26 -4.86 120.64 114.92 1mav n GLU 91 Ca 0.19 0.00 -0.16 0.00 -0.42 0.00 0.00 57.16 56.77 1mav n GLU 91 Cb 0.82 -0.13 -0.08 0.00 -0.57 0.00 0.00 31.44 31.48 1mav n GLU 91 CO 0.00 0.00 0.00 1.05 -0.48 0.00 0.00 177.13 177.70 1mav h GLU 92 N 0.00 -1.01 -0.39 3.49 -0.00 -2.03 -0.78 114.58 113.86 1mav h GLU 92 Ca 0.00 0.07 0.02 0.00 -0.00 0.00 0.00 59.36 59.45 1mav h GLU 92 Cb 0.00 0.23 -0.03 0.00 -0.00 0.00 0.00 28.75 28.95 1mav h GLU 92 CO 0.00 -0.67 0.21 0.07 -0.00 0.00 0.00 179.01 178.62 1mav h ARG 93 N -1.23 0.42 -0.16 1.06 -0.00 -2.04 -1.23 114.38 111.21 1mav h ARG 93 Ca -0.11 -0.03 0.01 0.00 -0.00 0.00 0.00 59.98 59.86 1mav h ARG 93 Cb 0.80 -0.10 -0.02 0.00 -0.00 0.00 0.00 29.97 30.66 1mav h ARG 93 CO 0.18 0.28 0.06 0.82 -0.00 0.00 0.00 179.97 181.30 1mav h ILE 94 N 0.43 0.97 -0.52 0.08 5.03 -1.96 0.11 117.51 121.65 1mav h ILE 94 Ca 0.16 -0.05 -0.03 0.00 -0.12 0.00 0.00 64.86 64.82 1mav h ILE 94 Cb 0.03 0.82 -0.02 0.00 -3.03 0.00 0.00 36.82 34.62 1mav h ILE 94 CO -0.09 0.03 0.22 0.03 -0.68 0.00 0.00 178.15 177.65 1mav h ARG 95 N 0.14 0.77 -0.08 2.37 -0.00 -0.98 -2.13 114.38 114.46 1mav h ARG 95 Ca 0.07 -0.13 -0.05 0.00 -0.50 0.00 0.00 59.98 59.36 1mav h ARG 95 Cb 0.03 -0.13 -0.01 0.00 0.00 0.00 0.00 29.97 29.87 1mav h ARG 95 CO -0.06 0.67 -0.17 1.05 0.00 0.00 0.00 179.97 181.45 1mav h GLU 96 N 0.70 0.13 0.00 0.04 4.11 -0.93 -2.31 114.58 116.32 1mav h GLU 96 Ca 0.17 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.57 1mav h GLU 96 Cb 0.18 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1mav h GLU 96 CO -0.02 0.31 0.00 0.41 0.07 0.00 0.00 179.01 179.78 1mav n GLY 97 N -0.88 -1.12 0.00 1.06 0.00 0.36 -4.85 105.19 99.74 1mav n GLY 97 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1mav n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mav n GLY 98 N 0.13 1.05 3.77 -0.02 0.00 -0.87 -4.50 105.19 104.74 1mav n GLY 98 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 1mav n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mav h GLU 100 N 4.58 0.10 -2.93 0.00 4.39 -1.11 -3.39 114.58 116.22 1mav h GLU 100 Ca -0.47 -0.08 0.02 0.00 0.34 0.00 0.00 59.36 59.18 1mav h GLU 100 Cb 1.21 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.86 1mav h GLU 100 CO 0.67 0.72 0.31 0.00 -1.16 0.00 0.00 179.01 179.55 1mav s ALA 101 N -3.58 -0.93 -0.01 3.43 0.00 -1.24 -5.06 121.76 114.38 1mav s ALA 101 Ca -0.02 -0.62 -0.05 0.00 0.00 0.00 0.00 51.96 51.27 1mav s ALA 101 Cb 0.12 0.71 -0.00 0.00 0.00 0.00 0.00 23.12 23.95 1mav s ALA 101 CO 0.78 -1.00 0.09 1.52 0.00 0.00 0.00 175.76 177.15 1mav s TYR 102 N -2.55 0.04 -0.12 0.00 -0.85 -1.26 -1.45 117.35 111.16 1mav s TYR 102 Ca 0.15 -0.09 0.00 0.00 -0.52 0.00 0.00 57.07 56.61 1mav s TYR 102 Cb -0.05 -0.05 0.02 0.00 0.38 0.00 0.00 41.96 42.26 1mav s TYR 102 CO 0.10 -0.20 -0.10 0.42 -1.52 0.00 0.00 175.55 174.25 1mav s ILE 103 N -0.97 1.17 0.20 -3.49 1.01 0.15 -4.93 121.20 114.35 1mav s ILE 103 Ca -0.11 -0.39 -0.06 0.00 0.00 0.00 0.00 60.65 60.09 1mav s ILE 103 Cb -0.06 -1.15 -0.06 0.00 0.01 0.00 0.00 42.46 41.20 1mav s ILE 103 CO 0.01 0.39 0.46 -0.94 0.00 0.00 0.00 174.94 174.86 1mav s SER 104 N 1.56 6.52 -0.07 3.58 1.04 -1.26 -1.32 113.70 123.74 1mav s SER 104 Ca 0.03 0.70 -0.01 0.00 0.48 0.00 0.00 55.95 57.15 1mav s SER 104 Cb -0.13 -2.14 -0.03 0.00 0.10 0.00 0.00 66.02 63.82 1mav s SER 104 CO -0.08 -0.03 -0.00 -0.54 0.98 0.00 0.00 173.24 173.57 1mav s LYS 105 N -2.89 2.94 0.14 4.02 -0.14 -0.73 -2.42 119.74 120.67 1mav s LYS 105 Ca 0.43 -0.44 -0.31 0.00 -1.36 0.00 0.00 55.97 54.29 1mav s LYS 105 Cb -0.12 -2.76 -0.10 0.00 -1.68 0.00 0.00 37.83 33.17 1mav s LYS 105 CO 0.25 0.69 1.75 -1.25 -0.76 0.00 0.00 175.35 176.03 1mav s PRO 106 N -0.96 4.15 0.50 -1.68 0.04 -1.26 -4.78 135.00 131.01 1mav s PRO 106 Ca 0.14 2.54 -0.19 0.00 0.04 0.00 0.00 61.00 63.52 1mav s PRO 106 Cb -0.11 -3.43 -0.08 0.00 0.04 0.00 0.00 34.50 30.92 1mav s PRO 106 CO 0.03 -0.78 1.03 0.96 0.04 0.00 0.00 177.00 178.28 1mav s ILE 107 N 2.19 3.93 -0.25 0.56 -0.00 -1.01 -5.04 121.20 121.58 1mav s ILE 107 Ca 0.77 1.13 -0.13 0.00 -0.00 0.00 0.00 60.65 62.42 1mav s ILE 107 Cb -0.46 -3.48 -0.04 0.00 -0.00 0.00 0.00 42.46 38.48 1mav s ILE 107 CO 0.34 -0.34 0.30 -0.55 -0.00 0.00 0.00 174.94 174.69 1mav s SER 108 N -2.24 6.22 0.13 4.36 0.15 -1.26 -5.00 113.70 116.06 1mav s SER 108 Ca 0.65 0.24 -0.20 0.00 0.70 0.00 0.00 55.95 57.35 1mav s SER 108 Cb -0.15 -2.18 -0.03 0.00 -1.71 0.00 0.00 66.02 61.96 1mav s SER 108 CO 0.23 -0.08 1.71 0.58 1.20 0.00 0.00 173.24 176.88 1mav h VAL 109 N 5.23 0.83 -0.61 4.45 2.07 -1.99 0.39 116.25 126.62 1mav h VAL 109 Ca -0.35 -0.01 -0.07 0.00 0.82 0.00 0.00 66.70 67.09 1mav h VAL 109 Cb 1.17 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 1mav h VAL 109 CO 0.64 0.01 0.09 0.58 0.02 0.00 0.00 177.57 178.91 1mav h VAL 110 N 0.04 1.26 -0.61 2.57 2.07 -1.99 -0.37 116.25 119.22 1mav h VAL 110 Ca 0.10 -1.01 -0.03 0.00 0.82 0.00 0.00 66.70 66.57 1mav h VAL 110 Cb 0.13 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 1mav h VAL 110 CO -0.18 0.37 0.26 -0.74 0.02 0.00 0.00 177.57 177.30 1mav h HIS 111 N 0.92 0.93 0.26 1.57 -0.00 -1.92 0.97 115.15 117.88 1mav h HIS 111 Ca 0.18 -0.06 -0.01 0.00 -0.00 0.00 0.00 60.37 60.48 1mav h HIS 111 Cb 0.44 -0.28 0.00 0.00 -0.00 0.00 0.00 27.41 27.57 1mav h HIS 111 CO 0.03 0.73 -0.13 0.35 -0.00 0.00 0.00 177.93 178.91 1mav h PHE 112 N 0.85 -0.33 -0.67 5.26 3.04 -0.65 -1.38 116.94 123.06 1mav h PHE 112 Ca 0.21 -0.01 -0.08 0.00 3.98 0.00 0.00 57.97 62.07 1mav h PHE 112 Cb 0.18 0.11 -0.03 0.00 2.56 0.00 0.00 35.95 38.78 1mav h PHE 112 CO 0.01 -0.16 0.11 -0.07 -2.02 0.00 0.00 178.31 176.18 1mav h LEU 113 N -0.42 1.07 -0.52 0.59 3.38 -0.97 -2.22 115.31 116.23 1mav h LEU 113 Ca -0.04 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1mav h LEU 113 Cb 0.32 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1mav h LEU 113 CO 0.06 1.06 0.29 -0.08 0.09 0.00 0.00 178.44 179.86 1mav h GLU 114 N 1.04 0.72 -0.31 1.13 4.81 -0.73 0.02 114.58 121.26 1mav h GLU 114 Ca 0.20 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1mav h GLU 114 Cb 0.45 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1mav h GLU 114 CO 0.01 0.55 0.18 1.15 -0.73 0.00 0.00 179.01 180.18 1mav h THR 115 N 0.69 1.11 -0.38 0.32 2.02 -1.10 -0.64 112.91 114.93 1mav h THR 115 Ca 0.18 -0.26 -0.16 0.00 0.77 0.00 0.00 66.41 66.94 1mav h THR 115 Cb 0.04 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1mav h THR 115 CO -0.03 0.11 -0.40 0.40 0.37 0.00 0.00 175.52 175.97 1mav h ILE 116 N 0.39 1.27 -0.45 3.11 2.04 -1.22 -2.92 117.51 119.73 1mav h ILE 116 Ca 0.11 -1.57 -0.10 0.00 1.00 0.00 0.00 64.86 64.30 1mav h ILE 116 Cb 0.01 1.39 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 1mav h ILE 116 CO -0.02 0.53 -0.11 0.11 0.00 0.00 0.00 178.15 178.66 1mav h LYS 117 N 0.76 0.82 -0.95 2.37 1.57 -0.87 -0.57 116.57 119.70 1mav h LYS 117 Ca 0.06 -0.28 0.01 0.00 -1.87 0.00 0.00 60.65 58.58 1mav h LYS 117 Cb 0.99 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 33.19 1mav h LYS 117 CO 0.10 0.89 0.63 -0.09 -0.57 0.00 0.00 179.45 180.41 1mav h ARG 118 N 0.74 1.23 0.10 3.15 2.43 -1.05 0.48 114.38 121.46 1mav h ARG 118 Ca 0.12 -0.07 -0.27 0.00 -0.81 0.00 0.00 59.98 58.95 1mav h ARG 118 Cb 0.60 -0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1mav h ARG 118 CO 0.04 0.81 -1.26 -0.07 -1.51 0.00 0.00 179.97 177.98 1mav h LEU 119 N 1.27 0.32 0.11 3.80 3.38 -1.30 -3.38 115.31 119.51 1mav h LEU 119 Ca 0.35 -0.37 -0.32 0.00 0.09 0.00 0.00 57.88 57.64 1mav h LEU 119 Cb -0.12 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 1mav h LEU 119 CO -0.08 1.29 -1.63 -0.07 0.09 0.00 0.00 178.44 178.03 1mav h LEU 120 N 0.06 0.35 -6.92 1.67 3.38 -0.87 -3.42 115.31 109.56 1mav h LEU 120 Ca -0.13 -0.56 -0.77 0.00 0.09 0.00 0.00 57.88 56.51 1mav h LEU 120 Cb 1.94 -0.12 -0.30 0.00 0.09 0.00 0.00 40.66 42.27 1mav h LEU 120 CO 0.18 1.47 0.51 -0.62 0.09 0.00 0.00 178.44 180.07 1mav n GLU 121 N -3.41 4.00 -4.17 1.13 1.02 0.17 -4.99 120.64 114.38 1mav n GLU 121 Ca -0.19 -4.56 -0.16 0.00 -0.02 0.00 0.00 57.16 52.23 1mav n GLU 121 Cb 1.05 -2.48 -0.11 0.00 -0.02 0.00 0.00 31.44 29.88 1mav n GLU 121 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1mav s ARG 122 N -2.49 0.82 0.28 3.49 0.52 -1.26 -4.83 118.95 115.48 1mav s ARG 122 Ca 0.32 -1.06 -0.29 0.00 -0.52 0.00 0.00 55.73 54.18 1mav s ARG 122 Cb 0.04 -0.63 -0.13 0.00 0.52 0.00 0.00 34.95 34.74 1mav s ARG 122 CO 0.05 0.12 1.21 0.00 0.02 0.00 0.00 175.30 176.70 1mav n GLN 123 N 0.87 1.75 0.00 3.54 10.64 -1.26 -5.17 117.38 127.75 1mav n GLN 123 Ca -0.18 0.62 0.09 0.00 -1.83 0.00 0.00 57.00 55.70 1mav n GLN 123 Cb 0.56 -2.14 0.55 0.00 -0.86 0.00 0.00 30.24 28.35 1mav n GLN 123 CO 0.00 0.00 0.00 -0.35 -1.83 0.00 0.00 177.06 174.88