#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mvg n PHE 2 N 0.00 -0.08 -1.46 0.00 3.72 -1.26 -4.96 117.46 113.42 1mvg n PHE 2 Ca 0.00 0.01 -0.54 0.00 -0.05 0.00 0.00 57.45 56.88 1mvg n PHE 2 Cb 0.00 0.39 -0.08 0.00 -0.94 0.00 0.00 39.48 38.85 1mvg n PHE 2 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1mvg n SER 3 N -2.64 1.93 0.00 4.37 3.41 -1.26 -4.64 113.62 114.79 1mvg n SER 3 Ca 0.00 0.60 0.00 0.00 -0.26 0.00 0.00 58.87 59.21 1mvg n SER 3 Cb 0.11 -1.17 0.00 0.00 -0.26 0.00 0.00 64.21 62.89 1mvg n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1mvg n GLY 4 N 6.26 -2.07 3.34 5.00 0.00 -0.55 -4.98 105.19 112.18 1mvg n GLY 4 Ca 0.41 -1.19 -0.31 0.00 0.00 0.00 0.00 46.02 44.93 1mvg n GLY 4 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mvg s THR 5 N -2.27 2.19 0.01 2.61 2.01 -1.26 -1.10 115.64 117.83 1mvg s THR 5 Ca 0.00 -1.10 -0.04 0.00 0.31 0.00 0.00 61.69 60.86 1mvg s THR 5 Cb 0.00 -1.78 -0.01 0.00 0.01 0.00 0.00 72.50 70.72 1mvg s THR 5 CO 0.00 0.55 0.05 0.26 -0.69 0.00 0.00 174.62 174.79 1mvg s TRP 6 N -0.65 0.16 -0.05 4.92 0.52 -0.10 -1.29 118.94 122.44 1mvg s TRP 6 Ca 0.10 -0.35 -0.01 0.00 0.02 0.00 0.00 56.10 55.86 1mvg s TRP 6 Cb -0.10 -0.13 0.03 0.00 -1.15 0.00 0.00 33.47 32.12 1mvg s TRP 6 CO -0.00 -0.24 0.02 -1.14 0.02 0.00 0.00 176.95 175.60 1mvg s GLN 7 N -1.49 0.34 -0.19 4.98 2.00 -0.37 -1.19 119.66 123.73 1mvg s GLN 7 Ca -0.15 0.19 -0.35 0.00 -2.00 0.00 0.00 55.36 53.05 1mvg s GLN 7 Cb -0.08 -0.74 -0.12 0.00 0.80 0.00 0.00 33.01 32.86 1mvg s GLN 7 CO -0.00 -0.28 1.95 0.28 -0.50 0.00 0.00 175.29 176.73 1mvg n VAL 8 N 5.03 0.44 -0.11 1.34 0.31 -1.25 -1.01 118.33 123.08 1mvg n VAL 8 Ca -0.09 -0.15 -0.13 0.00 -0.01 0.00 0.00 64.34 63.96 1mvg n VAL 8 Cb 0.50 -1.76 -0.13 0.00 -0.91 0.00 0.00 33.84 31.54 1mvg n VAL 8 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1mvg n TYR 9 N 7.43 0.00 -3.95 3.52 0.18 -0.60 -4.86 117.16 118.89 1mvg n TYR 9 Ca 0.28 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.96 1mvg n TYR 9 Cb 0.26 -0.94 -0.12 0.00 -0.38 0.00 0.00 39.34 38.16 1mvg n TYR 9 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1mvg s ALA 10 N -2.48 0.07 -0.09 -3.48 0.00 -1.12 -5.06 121.76 109.61 1mvg s ALA 10 Ca -0.21 -0.41 -0.23 0.00 0.00 0.00 0.00 51.96 51.11 1mvg s ALA 10 Cb 0.07 0.10 0.05 0.00 0.00 0.00 0.00 23.12 23.35 1mvg s ALA 10 CO 0.67 -0.11 0.54 1.14 0.00 0.00 0.00 175.76 178.00 1mvg s GLN 11 N -1.03 0.83 0.06 0.00 0.00 -1.26 -1.19 119.66 117.07 1mvg s GLN 11 Ca -0.11 0.28 -0.18 0.00 -0.00 0.00 0.00 55.36 55.35 1mvg s GLN 11 Cb -0.07 0.39 0.04 0.00 0.00 0.00 0.00 33.01 33.37 1mvg s GLN 11 CO -0.01 -0.22 0.43 -2.00 0.00 0.00 0.00 175.29 173.49 1mvg s GLU 12 N -0.80 0.97 -1.46 9.60 2.12 0.17 -4.85 118.70 124.44 1mvg s GLU 12 Ca -0.09 -0.41 -0.06 0.00 0.36 0.00 0.00 54.97 54.77 1mvg s GLU 12 Cb -0.03 0.43 0.03 0.00 0.26 0.00 0.00 34.13 34.82 1mvg s GLU 12 CO 0.06 -0.34 0.55 -1.71 -0.54 0.00 0.00 175.26 173.27 1mvg n ASN 13 N 0.35 -5.29 -0.13 -1.70 5.15 -1.26 -1.79 115.26 110.58 1mvg n ASN 13 Ca -0.18 -0.31 -0.24 0.00 -0.60 0.00 0.00 54.58 53.25 1mvg n ASN 13 Cb 0.61 -4.30 -0.11 0.00 -0.53 0.00 0.00 39.78 35.44 1mvg n ASN 13 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1mvg n TYR 14 N -4.30 0.01 -0.35 1.20 9.36 -1.26 -4.06 117.16 117.77 1mvg n TYR 14 Ca -0.08 0.00 0.15 0.00 3.32 0.00 0.00 57.90 61.29 1mvg n TYR 14 Cb 0.60 -1.00 0.34 0.00 -0.63 0.00 0.00 39.34 38.65 1mvg n TYR 14 CO 0.00 0.00 0.00 1.49 0.22 0.00 0.00 176.86 178.57 1mvg h GLU 15 N -0.54 0.68 -0.20 2.98 4.22 -1.97 -0.92 114.58 118.84 1mvg h GLU 15 Ca -0.65 -0.04 0.01 0.00 0.08 0.00 0.00 59.36 58.76 1mvg h GLU 15 Cb 1.75 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.83 1mvg h GLU 15 CO -0.27 0.45 0.11 0.93 -2.18 0.00 0.00 179.01 178.04 1mvg h GLU 16 N 0.70 0.22 -0.34 1.92 3.07 -1.96 -1.59 114.58 116.59 1mvg h GLU 16 Ca 0.60 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.45 1mvg h GLU 16 Cb 1.01 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.86 1mvg h GLU 16 CO -0.42 0.14 0.22 0.35 -1.40 0.00 0.00 179.01 177.90 1mvg h PHE 17 N 0.22 0.44 -0.53 4.33 3.57 -1.34 0.09 116.94 123.72 1mvg h PHE 17 Ca 0.08 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.62 1mvg h PHE 17 Cb 0.01 -0.15 -0.04 0.00 2.79 0.00 0.00 35.95 38.56 1mvg h PHE 17 CO -0.09 0.30 0.29 -0.07 -2.23 0.00 0.00 178.31 176.51 1mvg h LEU 18 N 0.45 0.43 -1.10 0.59 3.38 -1.11 -0.83 115.31 117.12 1mvg h LEU 18 Ca 0.12 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 1mvg h LEU 18 Cb -0.02 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1mvg h LEU 18 CO -0.03 0.29 -0.12 0.11 0.09 0.00 0.00 178.44 178.79 1mvg h LYS 19 N 0.56 0.50 0.00 1.13 1.57 -1.08 -2.16 116.57 117.09 1mvg h LYS 19 Ca 0.23 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 1mvg h LYS 19 Cb 0.11 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.36 1mvg h LYS 19 CO -0.14 0.62 -0.15 0.00 -0.57 0.00 0.00 179.45 179.20 1mvg h ALA 20 N 1.42 1.28 -2.50 3.86 0.00 0.11 -3.44 119.26 119.99 1mvg h ALA 20 Ca 0.09 -0.14 -0.46 0.00 0.00 0.00 0.00 54.91 54.40 1mvg h ALA 20 Cb 0.49 -0.02 0.12 0.00 0.00 0.00 0.00 17.79 18.38 1mvg h ALA 20 CO 0.03 0.19 0.33 -0.51 0.00 0.00 0.00 179.25 179.29 1mvg s LEU 21 N -7.36 2.15 0.23 0.00 1.43 -0.42 -4.98 118.68 109.72 1mvg s LEU 21 Ca -0.02 0.88 -0.07 0.00 -1.03 0.00 0.00 54.13 53.88 1mvg s LEU 21 Cb 0.13 -3.22 0.20 0.00 0.03 0.00 0.00 46.19 43.33 1mvg s LEU 21 CO 0.61 -2.41 1.87 0.00 0.23 0.00 0.00 176.35 176.64 1mvg h ALA 22 N -1.41 1.13 -2.92 4.21 0.00 -1.85 -3.45 119.26 114.99 1mvg h ALA 22 Ca -0.49 -0.11 -0.53 0.00 0.00 0.00 0.00 54.91 53.78 1mvg h ALA 22 Cb 1.33 -0.36 0.09 0.00 0.00 0.00 0.00 17.79 18.85 1mvg h ALA 22 CO 0.62 0.61 0.73 -0.48 0.00 0.00 0.00 179.25 180.73 1mvg s LEU 23 N -9.98 4.36 0.78 0.00 2.34 -1.26 -5.00 118.68 109.92 1mvg s LEU 23 Ca -0.13 2.92 -0.11 0.00 0.06 0.00 0.00 54.13 56.87 1mvg s LEU 23 Cb 0.17 -3.66 0.07 0.00 -0.56 0.00 0.00 46.19 42.20 1mvg s LEU 23 CO 0.82 -0.76 1.15 -2.16 -1.06 0.00 0.00 176.35 174.34 1mvg s PRO 24 N -1.95 2.14 0.30 1.48 0.04 -1.26 -4.72 135.00 131.04 1mvg s PRO 24 Ca 0.52 0.14 0.07 0.00 0.04 0.00 0.00 61.00 61.76 1mvg s PRO 24 Cb -0.44 -1.98 0.80 0.00 0.04 0.00 0.00 34.50 32.91 1mvg s PRO 24 CO 0.59 -1.47 1.73 1.49 0.04 0.00 0.00 177.00 179.38 1mvg h GLU 25 N -0.95 0.53 -0.95 4.56 4.81 -1.95 0.64 114.58 121.28 1mvg h GLU 25 Ca -0.46 -0.03 0.14 0.00 -0.13 0.00 0.00 59.36 58.88 1mvg h GLU 25 Cb 1.32 -0.12 -0.08 0.00 0.63 0.00 0.00 28.75 30.49 1mvg h GLU 25 CO 0.65 0.35 0.60 0.22 -0.73 0.00 0.00 179.01 180.11 1mvg h ASP 26 N 0.55 0.77 0.67 1.04 1.82 -2.01 -1.08 116.42 118.17 1mvg h ASP 26 Ca 0.60 0.05 -0.12 0.00 -0.39 0.00 0.00 57.03 57.16 1mvg h ASP 26 Cb 1.10 -0.10 -0.02 0.00 0.68 0.00 0.00 39.33 40.99 1mvg h ASP 26 CO -0.47 0.38 -1.43 0.18 -1.61 0.00 0.00 179.24 176.29 1mvg n LEU 27 N -4.61 0.73 0.09 2.28 4.77 0.10 -3.68 117.00 116.68 1mvg n LEU 27 Ca 0.19 0.31 0.01 0.00 -0.03 0.00 0.00 56.01 56.49 1mvg n LEU 27 Cb 0.45 0.06 0.34 0.00 -2.33 0.00 0.00 43.42 41.94 1mvg n LEU 27 CO 0.28 0.07 0.85 0.16 -1.33 0.00 0.00 177.39 177.42 1mvg h ILE 28 N 0.00 1.21 -0.82 -0.08 -0.00 -0.69 -2.70 117.51 114.43 1mvg h ILE 28 Ca -0.13 -0.92 0.16 0.00 -0.00 0.00 0.00 64.86 63.97 1mvg h ILE 28 Cb 1.43 1.25 -0.10 0.00 -0.00 0.00 0.00 36.82 39.40 1mvg h ILE 28 CO 0.03 0.29 0.37 0.50 -0.00 0.00 0.00 178.15 179.34 1mvg h LYS 29 N 0.27 0.49 0.11 0.16 3.11 -1.29 0.06 116.57 119.48 1mvg h LYS 29 Ca 0.05 -0.03 -0.01 0.00 -2.81 0.00 0.00 60.65 57.86 1mvg h LYS 29 Cb 0.45 -0.11 0.00 0.00 -1.00 0.00 0.00 32.23 31.57 1mvg h LYS 29 CO 0.03 0.32 -0.06 0.52 -2.81 0.00 0.00 179.45 177.46 1mvg h MET 30 N 0.50 -0.15 -0.68 1.90 2.86 -1.63 -3.26 114.93 114.47 1mvg h MET 30 Ca 0.47 0.01 0.07 0.00 -2.06 0.00 0.00 59.70 58.18 1mvg h MET 30 Cb 0.74 0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.39 1mvg h MET 30 CO -0.42 0.28 0.45 0.00 1.06 0.00 0.00 176.91 178.28 1mvg h ALA 31 N 0.15 1.76 -0.37 6.32 0.00 -1.19 -1.10 119.26 124.81 1mvg h ALA 31 Ca -0.02 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.93 1mvg h ALA 31 Cb 0.50 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1mvg h ALA 31 CO 0.03 0.13 0.25 0.00 0.00 0.00 0.00 179.25 179.66 1mvg h ARG 32 N 0.68 0.24 -1.46 0.00 2.47 -1.04 -2.79 114.38 112.48 1mvg h ARG 32 Ca 0.30 -0.01 -0.59 0.00 -1.26 0.00 0.00 59.98 58.41 1mvg h ARG 32 Cb 0.29 -0.06 -0.42 0.00 -1.65 0.00 0.00 29.97 28.14 1mvg h ARG 32 CO -0.10 0.16 -0.68 -3.47 0.56 0.00 0.00 179.97 176.44 1mvg n ASP 33 N -4.48 4.82 -4.19 7.04 4.64 -0.43 -4.96 116.55 119.00 1mvg n ASP 33 Ca 0.05 -3.73 -0.21 0.00 -1.38 0.00 0.00 54.79 49.52 1mvg n ASP 33 Cb 0.26 -0.47 -0.13 0.00 -1.04 0.00 0.00 41.12 39.74 1mvg n ASP 33 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1mvg s ILE 34 N -5.44 1.30 -0.46 5.18 1.01 -1.06 -5.00 121.20 116.74 1mvg s ILE 34 Ca 0.48 -1.14 -0.16 0.00 0.00 0.00 0.00 60.65 59.83 1mvg s ILE 34 Cb 0.40 -1.17 0.06 0.00 0.01 0.00 0.00 42.46 41.76 1mvg s ILE 34 CO -0.17 0.01 0.39 -1.59 0.00 0.00 0.00 174.94 173.58 1mvg s LYS 35 N -1.31 2.99 -0.35 2.79 0.00 -1.26 -5.00 119.74 117.59 1mvg s LYS 35 Ca 0.03 -1.23 -0.29 0.00 0.00 0.00 0.00 55.97 54.48 1mvg s LYS 35 Cb -0.09 -4.09 0.01 0.00 0.00 0.00 0.00 37.83 33.66 1mvg s LYS 35 CO 0.02 -0.97 1.26 -1.25 0.00 0.00 0.00 175.35 174.41 1mvg s PRO 36 N 1.73 3.84 0.13 1.78 0.04 -1.26 -4.86 135.00 136.40 1mvg s PRO 36 Ca 0.05 1.05 -0.24 0.00 0.04 0.00 0.00 61.00 61.90 1mvg s PRO 36 Cb -0.22 -3.89 -0.07 0.00 0.04 0.00 0.00 34.50 30.35 1mvg s PRO 36 CO 0.08 -1.21 0.73 -1.50 0.04 0.00 0.00 177.00 175.14 1mvg s ILE 37 N 4.47 4.49 0.09 0.56 -1.16 -0.98 -3.90 121.20 124.77 1mvg s ILE 37 Ca 0.54 1.59 0.08 0.00 -0.51 0.00 0.00 60.65 62.35 1mvg s ILE 37 Cb -0.14 -4.08 -0.03 0.00 0.61 0.00 0.00 42.46 38.82 1mvg s ILE 37 CO 0.25 0.51 -0.22 -0.69 -2.81 0.00 0.00 174.94 171.98 1mvg s VAL 38 N -1.00 1.79 -0.16 4.00 1.01 -0.34 -1.26 120.40 124.44 1mvg s VAL 38 Ca 0.35 -1.47 -0.09 0.00 0.00 0.00 0.00 61.98 60.77 1mvg s VAL 38 Cb -0.22 -1.60 0.06 0.00 0.00 0.00 0.00 36.38 34.62 1mvg s VAL 38 CO 0.24 0.05 0.39 -0.70 0.00 0.00 0.00 175.10 175.08 1mvg s GLU 39 N -1.70 0.37 -0.16 2.72 2.12 0.15 -0.93 118.70 121.27 1mvg s GLU 39 Ca 0.08 0.75 -0.04 0.00 0.36 0.00 0.00 54.97 56.12 1mvg s GLU 39 Cb -0.10 -0.04 -0.03 0.00 0.26 0.00 0.00 34.13 34.23 1mvg s GLU 39 CO 0.04 -0.16 -0.03 0.42 -0.54 0.00 0.00 175.26 174.98 1mvg s ILE 40 N 1.37 3.88 -0.34 -3.70 -1.09 -0.26 -0.89 121.20 120.17 1mvg s ILE 40 Ca -0.09 -0.36 0.03 0.00 -2.23 0.00 0.00 60.65 58.00 1mvg s ILE 40 Cb -0.09 -2.71 0.10 0.00 -1.58 0.00 0.00 42.46 38.18 1mvg s ILE 40 CO -0.12 0.48 0.05 -1.58 -1.23 0.00 0.00 174.94 172.54 1mvg s GLN 41 N 0.45 1.65 0.01 2.79 2.00 -0.37 -1.48 119.66 124.71 1mvg s GLN 41 Ca -0.03 -1.80 0.06 0.00 -2.00 0.00 0.00 55.36 51.59 1mvg s GLN 41 Cb -0.14 -3.21 -0.02 0.00 0.80 0.00 0.00 33.01 30.44 1mvg s GLN 41 CO 0.03 -0.90 -0.18 -1.14 -0.50 0.00 0.00 175.29 172.59 1mvg s GLN 42 N 0.96 1.39 -0.43 1.67 -0.44 -1.26 -1.25 119.66 120.30 1mvg s GLN 42 Ca 0.08 -0.73 0.07 0.00 -2.50 0.00 0.00 55.36 52.28 1mvg s GLN 42 Cb -0.20 -1.39 0.22 0.00 -1.64 0.00 0.00 33.01 30.01 1mvg s GLN 42 CO -0.07 0.37 0.58 0.36 0.50 0.00 0.00 175.29 177.03 1mvg n LYS 43 N 2.37 0.59 0.00 1.67 2.85 -0.80 -4.67 118.16 120.17 1mvg n LYS 43 Ca -0.16 -2.79 0.00 0.00 -1.05 0.00 0.00 58.31 54.31 1mvg n LYS 43 Cb 0.54 -1.39 0.00 0.00 -0.65 0.00 0.00 35.03 33.53 1mvg n LYS 43 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1mvg n GLY 44 N 1.92 1.86 0.24 2.58 0.00 -1.26 -3.77 105.19 106.76 1mvg n GLY 44 Ca 0.20 -0.44 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 1mvg n GLY 44 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1mvg h ASP 45 N 0.00 0.78 -3.38 1.61 5.19 -1.98 -3.43 116.42 115.21 1mvg h ASP 45 Ca 0.00 -0.31 -0.53 0.00 -0.62 0.00 0.00 57.03 55.57 1mvg h ASP 45 Cb 0.00 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.29 1mvg h ASP 45 CO 0.00 0.90 0.47 -1.81 -3.12 0.00 0.00 179.24 175.68 1mvg s ASP 46 N -6.29 7.25 -0.11 6.45 1.11 -1.25 -1.79 116.67 122.04 1mvg s ASP 46 Ca -0.13 1.91 -0.00 0.00 0.18 0.00 0.00 52.55 54.51 1mvg s ASP 46 Cb 0.11 -2.58 0.02 0.00 1.07 0.00 0.00 42.92 41.54 1mvg s ASP 46 CO 0.81 -0.31 -0.08 -0.36 1.18 0.00 0.00 175.17 176.41 1mvg s PHE 47 N 0.63 1.43 -0.14 4.23 0.40 -0.53 -1.90 117.98 122.11 1mvg s PHE 47 Ca 0.53 -0.69 -0.03 0.00 -0.60 0.00 0.00 56.93 56.15 1mvg s PHE 47 Cb -0.26 -1.19 -0.03 0.00 0.51 0.00 0.00 43.02 42.05 1mvg s PHE 47 CO 0.30 -0.48 -0.05 0.08 0.70 0.00 0.00 175.22 175.77 1mvg s VAL 48 N 1.64 3.82 -0.10 -0.44 1.01 -0.38 -2.14 120.40 123.80 1mvg s VAL 48 Ca 0.03 -0.39 -0.00 0.00 0.00 0.00 0.00 61.98 61.62 1mvg s VAL 48 Cb -0.13 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.58 1mvg s VAL 48 CO -0.07 0.52 -0.08 -0.69 0.00 0.00 0.00 175.10 174.78 1mvg s VAL 49 N 0.12 3.58 0.01 2.92 1.01 -0.48 -1.24 120.40 126.32 1mvg s VAL 49 Ca -0.01 -0.50 0.02 0.00 0.00 0.00 0.00 61.98 61.49 1mvg s VAL 49 Cb -0.14 -2.50 -0.01 0.00 0.00 0.00 0.00 36.38 33.74 1mvg s VAL 49 CO 0.03 0.55 -0.08 -0.89 0.00 0.00 0.00 175.10 174.72 1mvg s THR 50 N -0.25 0.60 -0.07 3.92 2.01 -0.07 -0.70 115.64 121.08 1mvg s THR 50 Ca 0.03 -0.49 -0.05 0.00 0.31 0.00 0.00 61.69 61.49 1mvg s THR 50 Cb -0.13 -0.53 0.02 0.00 0.01 0.00 0.00 72.50 71.87 1mvg s THR 50 CO 0.03 0.05 0.16 -0.55 -0.69 0.00 0.00 174.62 173.62 1mvg s SER 51 N -0.48 -0.16 0.16 3.53 0.15 -0.41 -0.67 113.70 115.81 1mvg s SER 51 Ca 0.01 0.34 0.09 0.00 0.70 0.00 0.00 55.95 57.08 1mvg s SER 51 Cb -0.04 0.31 -0.04 0.00 -1.71 0.00 0.00 66.02 64.53 1mvg s SER 51 CO -0.00 -0.08 -0.20 -0.54 1.20 0.00 0.00 173.24 173.62 1mvg s LYS 52 N 0.40 1.29 0.14 5.44 1.02 -0.39 -1.23 119.74 126.41 1mvg s LYS 52 Ca -0.03 -1.37 -0.23 0.00 0.02 0.00 0.00 55.97 54.36 1mvg s LYS 52 Cb -0.04 -1.44 0.06 0.00 -0.52 0.00 0.00 37.83 35.89 1mvg s LYS 52 CO -0.02 0.31 0.58 0.99 -0.92 0.00 0.00 175.35 176.29 1mvg s THR 53 N -1.78 0.01 -0.02 2.17 2.01 -0.68 -2.32 115.64 115.02 1mvg s THR 53 Ca 0.15 -0.08 -0.00 0.00 0.31 0.00 0.00 61.69 62.06 1mvg s THR 53 Cb -0.07 -1.02 0.02 0.00 0.01 0.00 0.00 72.50 71.44 1mvg s THR 53 CO 0.07 -0.04 1.99 -0.81 -0.69 0.00 0.00 174.62 175.14 1mvg n PRO 54 N -0.25 1.06 0.00 4.92 -0.04 -1.26 -3.11 135.00 136.31 1mvg n PRO 54 Ca -0.17 -0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.17 1mvg n PRO 54 Cb 0.64 -1.05 0.00 0.00 -0.04 0.00 0.00 33.50 33.06 1mvg n PRO 54 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1mvg n ARG 55 N 1.41 0.00 -3.90 0.54 1.74 -1.26 -5.15 116.66 110.03 1mvg n ARG 55 Ca 0.02 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.02 1mvg n ARG 55 Cb 0.51 -0.32 -0.03 0.00 -1.02 0.00 0.00 32.46 31.59 1mvg n ARG 55 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 1mvg s GLN 56 N -1.16 1.69 -0.10 5.56 1.03 -1.18 -5.19 119.66 120.31 1mvg s GLN 56 Ca 0.00 -1.08 -0.14 0.00 0.04 0.00 0.00 55.36 54.18 1mvg s GLN 56 Cb 0.00 0.56 0.03 0.00 0.03 0.00 0.00 33.01 33.63 1mvg s GLN 56 CO 0.00 -0.75 0.36 0.99 -2.54 0.00 0.00 175.29 173.35 1mvg s THR 57 N -3.95 0.02 0.03 3.63 2.01 -1.26 -1.69 115.64 114.42 1mvg s THR 57 Ca 0.15 -0.15 0.02 0.00 0.31 0.00 0.00 61.69 62.03 1mvg s THR 57 Cb -0.04 -0.57 -0.02 0.00 0.01 0.00 0.00 72.50 71.89 1mvg s THR 57 CO 0.07 -0.08 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.15 1mvg s VAL 58 N -0.31 0.58 0.03 3.82 1.01 -0.36 -5.02 120.40 120.15 1mvg s VAL 58 Ca -0.04 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.14 1mvg s VAL 58 Cb -0.03 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.74 1mvg s VAL 58 CO 0.02 -0.19 -0.09 -0.89 0.00 0.00 0.00 175.10 173.95 1mvg s THR 59 N -0.95 0.67 -0.03 3.92 2.01 -1.26 -1.28 115.64 118.72 1mvg s THR 59 Ca -0.05 -0.79 -0.01 0.00 0.31 0.00 0.00 61.69 61.15 1mvg s THR 59 Cb -0.07 -0.65 0.03 0.00 0.01 0.00 0.00 72.50 71.82 1mvg s THR 59 CO 0.00 -0.11 0.06 0.20 -0.69 0.00 0.00 174.62 174.08 1mvg s ASN 60 N -1.00 0.02 -0.10 3.53 0.01 0.12 -4.76 114.94 112.77 1mvg s ASN 60 Ca -0.03 0.10 0.02 0.00 -0.71 0.00 0.00 52.86 52.24 1mvg s ASN 60 Cb -0.07 -0.00 0.01 0.00 0.41 0.00 0.00 41.25 41.60 1mvg s ASN 60 CO 0.00 -0.13 -0.16 -0.94 -1.51 0.00 0.00 177.10 174.36 1mvg s SER 61 N 1.05 2.41 0.19 -1.22 1.04 -1.26 -1.38 113.70 114.53 1mvg s SER 61 Ca -0.09 -0.43 -0.12 0.00 0.48 0.00 0.00 55.95 55.80 1mvg s SER 61 Cb -0.12 -1.09 0.04 0.00 0.10 0.00 0.00 66.02 64.95 1mvg s SER 61 CO -0.04 0.05 0.60 2.22 0.98 0.00 0.00 173.24 177.05 1mvg n PHE 62 N 3.99 -1.48 -3.96 5.02 1.16 -0.91 -4.61 117.46 116.67 1mvg n PHE 62 Ca -0.20 -1.02 -0.10 0.00 -1.87 0.00 0.00 57.45 54.26 1mvg n PHE 62 Cb 0.52 0.50 -0.11 0.00 -1.61 0.00 0.00 39.48 38.78 1mvg n PHE 62 CO 0.00 0.00 0.00 0.99 -1.87 0.00 0.00 176.76 175.88 1mvg s THR 63 N -2.32 0.09 0.83 1.97 2.01 -1.26 -1.45 115.64 115.51 1mvg s THR 63 Ca 0.13 -0.74 -0.12 0.00 0.31 0.00 0.00 61.69 61.27 1mvg s THR 63 Cb -0.03 -0.23 0.09 0.00 0.01 0.00 0.00 72.50 72.35 1mvg s THR 63 CO 0.06 -0.41 1.10 -1.48 -0.69 0.00 0.00 174.62 173.20 1mvg s LEU 64 N -1.20 2.47 0.00 4.42 0.05 -0.74 -4.16 118.68 119.53 1mvg s LEU 64 Ca -0.13 1.28 0.00 0.00 0.05 0.00 0.00 54.13 55.33 1mvg s LEU 64 Cb -0.08 -3.83 0.00 0.00 -2.05 0.00 0.00 46.19 40.23 1mvg s LEU 64 CO -0.01 -2.13 0.00 0.61 -0.55 0.00 0.00 176.35 174.27 1mvg n GLY 65 N -2.00 2.73 2.63 -3.48 0.00 0.37 -4.95 105.19 100.50 1mvg n GLY 65 Ca 0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.86 1mvg n GLY 65 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1mvg n LYS 66 N -0.19 1.03 -1.85 1.61 3.00 -1.25 -4.96 118.16 115.54 1mvg n LYS 66 Ca 0.00 -2.69 -0.40 0.00 -0.00 0.00 0.00 58.31 55.23 1mvg n LYS 66 Cb 0.00 0.84 0.01 0.00 0.00 0.00 0.00 35.03 35.88 1mvg n LYS 66 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 1mvg s GLU 67 N -3.31 3.78 -0.06 1.64 -1.05 -1.26 -3.28 118.70 115.15 1mvg s GLU 67 Ca 0.03 2.37 -0.02 0.00 -0.15 0.00 0.00 54.97 57.20 1mvg s GLU 67 Cb 0.00 -2.70 0.04 0.00 -0.44 0.00 0.00 34.13 31.03 1mvg s GLU 67 CO 0.02 -0.73 0.12 0.00 0.95 0.00 0.00 175.26 175.62 1mvg s ALA 68 N -1.21 -0.11 0.14 -0.84 0.00 -0.26 -4.70 121.76 114.79 1mvg s ALA 68 Ca 0.59 0.51 -0.25 0.00 0.00 0.00 0.00 51.96 52.82 1mvg s ALA 68 Cb -0.43 -0.55 -0.08 0.00 0.00 0.00 0.00 23.12 22.07 1mvg s ALA 68 CO 0.55 -0.32 0.77 0.16 0.00 0.00 0.00 175.76 176.92 1mvg s ASP 69 N 1.63 7.36 0.01 0.00 -4.77 -1.26 -1.69 116.67 117.94 1mvg s ASP 69 Ca -0.04 1.61 0.02 0.00 -3.30 0.00 0.00 52.55 50.84 1mvg s ASP 69 Cb -0.12 -2.49 -0.01 0.00 -1.09 0.00 0.00 42.92 39.21 1mvg s ASP 69 CO -0.05 0.18 -0.07 -0.63 0.70 0.00 0.00 175.17 175.31 1mvg s ILE 70 N -0.98 0.50 -0.26 2.11 1.01 -0.65 -4.51 121.20 118.42 1mvg s ILE 70 Ca 0.36 -0.43 -0.09 0.00 0.00 0.00 0.00 60.65 60.49 1mvg s ILE 70 Cb -0.23 -0.45 -0.04 0.00 0.01 0.00 0.00 42.46 41.75 1mvg s ILE 70 CO 0.26 0.03 0.13 -0.89 0.00 0.00 0.00 174.94 174.47 1mvg s THR 71 N -0.39 4.86 0.55 2.92 2.01 -1.26 -1.12 115.64 123.20 1mvg s THR 71 Ca -0.00 0.01 -0.18 0.00 0.31 0.00 0.00 61.69 61.83 1mvg s THR 71 Cb -0.04 -3.29 -0.06 0.00 0.01 0.00 0.00 72.50 69.13 1mvg s THR 71 CO -0.00 0.30 1.07 -0.89 -0.69 0.00 0.00 174.62 174.41 1mvg s THR 72 N 1.61 3.66 -0.93 -0.82 2.01 -0.03 -4.93 115.64 116.22 1mvg s THR 72 Ca 0.07 0.91 -0.08 0.00 0.31 0.00 0.00 61.69 62.90 1mvg s THR 72 Cb -0.15 -3.37 -0.16 0.00 0.01 0.00 0.00 72.50 68.82 1mvg s THR 72 CO 0.07 -0.34 3.22 0.23 -0.69 0.00 0.00 174.62 177.12 1mvg n MET 73 N -1.54 2.95 -0.70 4.92 2.81 -1.26 -2.78 117.12 121.52 1mvg n MET 73 Ca 0.09 -1.67 -0.02 0.00 -1.81 0.00 0.00 57.70 54.29 1mvg n MET 73 Cb 0.52 -2.45 -0.02 0.00 -0.71 0.00 0.00 33.22 30.56 1mvg n MET 73 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1mvg n ASP 74 N 3.13 -0.34 -3.44 7.83 2.03 -1.26 -5.02 116.55 119.48 1mvg n ASP 74 Ca 0.63 -1.41 -0.18 0.00 0.52 0.00 0.00 54.79 54.35 1mvg n ASP 74 Cb 0.52 0.10 0.07 0.00 -0.72 0.00 0.00 41.12 41.08 1mvg n ASP 74 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1mvg n GLY 75 N 0.01 -0.65 2.91 0.27 0.00 -1.12 -5.03 105.19 101.59 1mvg n GLY 75 Ca -0.10 0.28 -0.15 0.00 0.00 0.00 0.00 46.02 46.05 1mvg n GLY 75 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1mvg s LYS 76 N -5.20 0.12 0.46 1.61 2.47 -1.25 -5.02 119.74 112.93 1mvg s LYS 76 Ca 0.18 0.61 -0.02 0.00 -1.56 0.00 0.00 55.97 55.18 1mvg s LYS 76 Cb -0.03 -0.29 -0.01 0.00 -1.46 0.00 0.00 37.83 36.04 1mvg s LYS 76 CO 0.76 -0.35 0.71 0.15 0.16 0.00 0.00 175.35 176.78 1mvg s LYS 77 N 2.37 3.20 0.21 4.03 1.02 -1.26 -0.85 119.74 128.45 1mvg s LYS 77 Ca 0.03 -0.25 -0.10 0.00 0.02 0.00 0.00 55.97 55.66 1mvg s LYS 77 Cb -0.13 -2.49 -0.01 0.00 -0.52 0.00 0.00 37.83 34.68 1mvg s LYS 77 CO -0.08 -0.26 0.37 -0.48 -0.92 0.00 0.00 175.35 173.98 1mvg s LEU 78 N -4.63 0.62 0.04 3.17 2.34 -0.27 -4.91 118.68 115.03 1mvg s LEU 78 Ca 0.48 -0.94 0.08 0.00 0.06 0.00 0.00 54.13 53.81 1mvg s LEU 78 Cb -0.10 1.42 -0.03 0.00 -0.56 0.00 0.00 46.19 46.92 1mvg s LEU 78 CO 0.40 -1.01 -0.22 -0.54 -1.06 0.00 0.00 176.35 173.91 1mvg s LYS 79 N -4.01 1.96 -0.04 1.48 3.01 -1.26 -1.64 119.74 119.24 1mvg s LYS 79 Ca 0.22 -1.03 -0.28 0.00 -1.01 0.00 0.00 55.97 53.87 1mvg s LYS 79 Cb 0.02 -2.09 0.06 0.00 -1.01 0.00 0.00 37.83 34.81 1mvg s LYS 79 CO 0.06 0.53 0.60 0.00 0.51 0.00 0.00 175.35 177.05 1mvg s THR 81 N -1.25 4.68 0.18 0.00 2.01 -1.25 -1.10 115.64 118.91 1mvg s THR 81 Ca -0.11 -1.74 -0.31 0.00 0.31 0.00 0.00 61.69 59.83 1mvg s THR 81 Cb -0.01 -4.86 -0.09 0.00 0.01 0.00 0.00 72.50 67.55 1mvg s THR 81 CO 0.09 -1.60 1.47 -0.69 -0.69 0.00 0.00 174.62 173.19 1mvg s VAL 82 N 2.75 2.83 0.17 3.82 1.01 -1.21 -4.48 120.40 125.29 1mvg s VAL 82 Ca 0.37 0.63 -0.12 0.00 0.00 0.00 0.00 61.98 62.87 1mvg s VAL 82 Cb -0.03 -3.41 0.01 0.00 0.00 0.00 0.00 36.38 32.95 1mvg s VAL 82 CO -0.07 0.07 0.36 -1.38 0.00 0.00 0.00 175.10 174.08 1mvg s HIS 83 N 0.67 0.19 -0.12 5.22 -3.43 -0.96 -0.48 115.29 116.38 1mvg s HIS 83 Ca 0.64 -0.55 0.03 0.00 -0.80 0.00 0.00 55.06 54.38 1mvg s HIS 83 Cb -0.41 0.10 0.01 0.00 -1.43 0.00 0.00 32.58 30.85 1mvg s HIS 83 CO 0.35 -0.77 -0.23 -1.17 -2.00 0.00 0.00 174.74 170.93 1mvg s LEU 84 N -2.92 2.12 -0.10 5.38 0.20 -1.26 -1.11 118.68 120.99 1mvg s LEU 84 Ca 0.13 -0.58 -0.12 0.00 0.69 0.00 0.00 54.13 54.25 1mvg s LEU 84 Cb 0.02 -1.44 0.03 0.00 -0.43 0.00 0.00 46.19 44.37 1mvg s LEU 84 CO -0.02 0.11 0.32 0.00 -0.29 0.00 0.00 176.35 176.48 1mvg s ALA 85 N 0.61 -0.81 -1.47 5.97 0.00 -0.16 -4.93 121.76 120.98 1mvg s ALA 85 Ca -0.12 0.78 -0.11 0.00 0.00 0.00 0.00 51.96 52.51 1mvg s ALA 85 Cb -0.17 -0.39 0.06 0.00 0.00 0.00 0.00 23.12 22.63 1mvg s ALA 85 CO 0.03 -0.18 0.99 -1.71 0.00 0.00 0.00 175.76 174.88 1mvg n ASN 86 N 2.49 -4.56 -2.27 0.00 4.05 -1.26 -2.02 115.26 111.69 1mvg n ASN 86 Ca -0.15 -0.74 -0.19 0.00 0.45 0.00 0.00 54.58 53.95 1mvg n ASN 86 Cb 0.57 -4.14 0.00 0.00 1.23 0.00 0.00 39.78 37.44 1mvg n ASN 86 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1mvg n GLY 87 N -1.73 -0.39 3.37 8.20 0.00 -1.26 -4.99 105.19 108.39 1mvg n GLY 87 Ca -0.02 -0.07 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 1mvg n GLY 87 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mvg s LYS 88 N -5.10 0.90 0.33 1.61 -2.85 -0.86 -4.27 119.74 109.51 1mvg s LYS 88 Ca 0.07 -0.08 -0.28 0.00 -1.00 0.00 0.00 55.97 54.69 1mvg s LYS 88 Cb -0.03 0.41 -0.09 0.00 -2.06 0.00 0.00 37.83 36.06 1mvg s LYS 88 CO 0.09 -0.29 1.17 -0.51 0.10 0.00 0.00 175.35 175.91 1mvg s LEU 89 N -1.51 4.40 -0.04 2.77 2.01 -0.25 -0.99 118.68 125.07 1mvg s LEU 89 Ca -0.10 2.38 0.01 0.00 0.01 0.00 0.00 54.13 56.43 1mvg s LEU 89 Cb -0.02 -3.77 0.02 0.00 0.01 0.00 0.00 46.19 42.44 1mvg s LEU 89 CO 0.04 -0.40 -0.03 -0.69 1.01 0.00 0.00 176.35 176.28 1mvg s VAL 90 N -1.25 0.42 -0.06 -1.59 1.01 -0.26 -2.58 120.40 116.09 1mvg s VAL 90 Ca 0.50 -0.06 -0.11 0.00 0.00 0.00 0.00 61.98 62.30 1mvg s VAL 90 Cb -0.33 -0.47 0.02 0.00 0.00 0.00 0.00 36.38 35.60 1mvg s VAL 90 CO 0.43 0.20 0.27 0.42 0.00 0.00 0.00 175.10 176.42 1mvg s THR 91 N 0.94 0.03 -0.17 3.92 -4.23 -0.02 -2.27 115.64 113.84 1mvg s THR 91 Ca -0.11 -0.28 -0.23 0.00 -1.18 0.00 0.00 61.69 59.88 1mvg s THR 91 Cb -0.14 -0.49 0.06 0.00 1.34 0.00 0.00 72.50 73.27 1mvg s THR 91 CO -0.00 -0.16 0.62 -0.75 -0.54 0.00 0.00 174.62 173.79 1mvg s LYS 92 N -0.64 0.81 0.00 3.99 2.20 -1.26 -1.49 119.74 123.35 1mvg s LYS 92 Ca -0.07 0.64 0.00 0.00 -0.36 0.00 0.00 55.97 56.18 1mvg s LYS 92 Cb -0.04 0.39 0.00 0.00 -1.51 0.00 0.00 37.83 36.67 1mvg s LYS 92 CO 0.02 -0.15 0.00 -1.13 -0.36 0.00 0.00 175.35 173.73 1mvg n SER 93 N 2.19 0.00 -0.13 1.43 3.41 -0.23 -3.96 113.62 116.32 1mvg n SER 93 Ca -0.16 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.19 1mvg n SER 93 Cb 0.56 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.40 1mvg n SER 93 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1mvg n GLU 94 N 0.00 0.60 0.00 4.33 2.13 -1.26 -4.88 120.64 121.56 1mvg n GLU 94 Ca 0.00 0.27 0.00 0.00 0.66 0.00 0.00 57.16 58.09 1mvg n GLU 94 Cb 0.00 -1.53 0.00 0.00 0.27 0.00 0.00 31.44 30.18 1mvg n GLU 94 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 1mvg n LYS 95 N -4.06 0.00 -2.30 5.31 0.00 -1.26 -5.06 118.16 110.79 1mvg n LYS 95 Ca -0.50 0.00 -0.40 0.00 -0.00 0.00 0.00 58.31 57.40 1mvg n LYS 95 Cb 0.89 -0.70 -0.03 0.00 -0.00 0.00 0.00 35.03 35.19 1mvg n LYS 95 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.40 177.52 1mvg s PHE 96 N -1.90 3.32 0.10 5.58 2.19 -1.26 -4.46 117.98 121.56 1mvg s PHE 96 Ca 0.00 1.56 -0.02 0.00 0.33 0.00 0.00 56.93 58.79 1mvg s PHE 96 Cb 0.00 -3.48 -0.04 0.00 -1.31 0.00 0.00 43.02 38.20 1mvg s PHE 96 CO 0.00 -1.20 0.05 -1.12 1.83 0.00 0.00 175.22 174.78 1mvg s SER 97 N -0.66 0.35 -0.19 6.13 0.01 -0.86 -1.07 113.70 117.40 1mvg s SER 97 Ca 0.47 -1.07 -0.08 0.00 1.31 0.00 0.00 55.95 56.59 1mvg s SER 97 Cb -0.36 0.27 0.08 0.00 0.21 0.00 0.00 66.02 66.23 1mvg s SER 97 CO 0.47 -0.69 0.42 -1.00 0.41 0.00 0.00 173.24 172.84 1mvg s HIS 98 N -3.98 -0.74 -0.17 2.43 3.76 -0.56 -1.57 115.29 114.45 1mvg s HIS 98 Ca 0.16 1.46 -0.03 0.00 -0.15 0.00 0.00 55.06 56.49 1mvg s HIS 98 Cb 0.07 0.29 0.06 0.00 1.11 0.00 0.00 32.58 34.11 1mvg s HIS 98 CO -0.04 -0.44 0.05 -1.21 -0.85 0.00 0.00 174.74 172.25 1mvg s GLU 99 N 2.25 0.42 -0.18 1.40 2.02 -0.48 -0.84 118.70 123.29 1mvg s GLU 99 Ca -0.04 -0.25 0.00 0.00 0.02 0.00 0.00 54.97 54.70 1mvg s GLU 99 Cb -0.11 -1.91 0.02 0.00 0.10 0.00 0.00 34.13 32.23 1mvg s GLU 99 CO -0.13 -0.62 -0.18 -0.65 0.02 0.00 0.00 175.26 173.70 1mvg s GLN 100 N 1.97 3.04 0.14 1.61 1.11 -1.06 -1.49 119.66 124.98 1mvg s GLN 100 Ca 0.01 -0.80 0.11 0.00 0.01 0.00 0.00 55.36 54.68 1mvg s GLN 100 Cb -0.16 -2.62 -0.04 0.00 -1.01 0.00 0.00 33.01 29.18 1mvg s GLN 100 CO -0.08 -0.20 -0.25 -2.00 0.01 0.00 0.00 175.29 172.77 1mvg s GLU 101 N 1.29 1.37 -0.05 2.91 -6.30 -0.01 -1.10 118.70 116.82 1mvg s GLU 101 Ca 0.05 -1.35 0.06 0.00 -2.50 0.00 0.00 54.97 51.22 1mvg s GLU 101 Cb -0.13 -1.79 -0.01 0.00 0.00 0.00 0.00 34.13 32.20 1mvg s GLU 101 CO -0.11 0.41 -0.24 0.08 0.02 0.00 0.00 175.26 175.42 1mvg s VAL 102 N -1.22 2.15 -0.28 3.70 1.01 -1.26 -1.64 120.40 122.85 1mvg s VAL 102 Ca 0.14 -1.04 0.01 0.00 0.00 0.00 0.00 61.98 61.09 1mvg s VAL 102 Cb -0.09 -1.78 0.16 0.00 0.00 0.00 0.00 36.38 34.67 1mvg s VAL 102 CO 0.06 0.57 0.45 -1.59 0.00 0.00 0.00 175.10 174.59 1mvg s LYS 103 N -0.26 0.44 5.17 2.72 -2.85 -1.02 -4.98 119.74 118.95 1mvg s LYS 103 Ca -0.01 0.38 0.00 0.00 -1.00 0.00 0.00 55.97 55.34 1mvg s LYS 103 Cb -0.13 -0.18 0.00 0.00 -2.06 0.00 0.00 37.83 35.46 1mvg s LYS 103 CO 0.03 -0.90 0.00 0.41 0.10 0.00 0.00 175.35 174.99 1mvg n GLY 104 N 5.37 1.01 0.40 0.59 0.00 -1.26 -1.91 105.19 109.39 1mvg n GLY 104 Ca 0.00 0.42 0.07 0.00 0.00 0.00 0.00 46.02 46.51 1mvg n GLY 104 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1mvg n ASN 105 N 10.12 1.85 -3.78 1.61 3.02 -1.26 -4.97 115.26 121.84 1mvg n ASN 105 Ca 0.00 -3.28 -0.13 0.00 -0.03 0.00 0.00 54.58 51.14 1mvg n ASN 105 Cb 0.00 -0.45 -0.13 0.00 -0.61 0.00 0.00 39.78 38.59 1mvg n ASN 105 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 1mvg s GLU 106 N -2.65 0.13 -0.20 3.52 -1.05 -0.80 -1.51 118.70 116.13 1mvg s GLU 106 Ca 0.32 0.29 -0.10 0.00 -0.15 0.00 0.00 54.97 55.34 1mvg s GLU 106 Cb 0.30 -0.05 -0.05 0.00 -0.44 0.00 0.00 34.13 33.90 1mvg s GLU 106 CO -0.02 -0.09 0.12 -1.64 0.95 0.00 0.00 175.26 174.57 1mvg s MET 107 N 0.63 4.13 -0.24 -4.83 -1.94 0.00 -2.43 119.30 114.62 1mvg s MET 107 Ca -0.05 -0.25 -0.09 0.00 -1.71 0.00 0.00 55.69 53.60 1mvg s MET 107 Cb -0.06 -3.40 -0.04 0.00 2.01 0.00 0.00 34.83 33.34 1mvg s MET 107 CO -0.03 0.26 0.11 0.08 -0.01 0.00 0.00 175.02 175.43 1mvg s VAL 108 N 0.47 4.84 0.00 -6.03 1.01 -0.65 -1.15 120.40 118.88 1mvg s VAL 108 Ca 0.07 -0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.07 1mvg s VAL 108 Cb -0.12 -3.25 -0.01 0.00 0.00 0.00 0.00 36.38 33.01 1mvg s VAL 108 CO -0.01 0.35 -0.06 -1.83 0.00 0.00 0.00 175.10 173.56 1mvg s GLU 109 N 1.22 0.46 0.01 2.72 -1.05 -0.60 -0.83 118.70 120.63 1mvg s GLU 109 Ca 0.06 -0.30 0.02 0.00 -0.15 0.00 0.00 54.97 54.60 1mvg s GLU 109 Cb -0.14 -0.40 -0.01 0.00 -0.44 0.00 0.00 34.13 33.14 1mvg s GLU 109 CO 0.05 0.10 -0.07 -0.08 0.95 0.00 0.00 175.26 176.21 1mvg s THR 110 N -0.37 0.56 0.01 1.83 -1.32 -0.56 -1.57 115.64 114.22 1mvg s THR 110 Ca -0.00 -0.55 0.04 0.00 -1.21 0.00 0.00 61.69 59.97 1mvg s THR 110 Cb -0.04 -0.52 -0.02 0.00 -1.51 0.00 0.00 72.50 70.42 1mvg s THR 110 CO -0.00 -0.01 -0.13 -0.63 -2.21 0.00 0.00 174.62 171.64 1mvg s ILE 111 N -0.54 1.03 0.02 5.08 1.09 -0.57 -1.38 121.20 125.93 1mvg s ILE 111 Ca -0.01 -0.75 0.05 0.00 -1.10 0.00 0.00 60.65 58.84 1mvg s ILE 111 Cb -0.05 -0.90 -0.03 0.00 -1.06 0.00 0.00 42.46 40.42 1mvg s ILE 111 CO 0.00 0.14 -0.13 -0.89 -0.10 0.00 0.00 174.94 173.96 1mvg s THR 112 N -0.57 3.20 -0.21 2.92 2.01 -0.61 -0.89 115.64 121.50 1mvg s THR 112 Ca 0.03 -0.99 -0.04 0.00 0.31 0.00 0.00 61.69 61.00 1mvg s THR 112 Cb -0.06 -2.37 0.09 0.00 0.01 0.00 0.00 72.50 70.16 1mvg s THR 112 CO 0.00 0.36 0.19 0.12 -0.69 0.00 0.00 174.62 174.60 1mvg s PHE 113 N -0.96 -0.13 0.00 4.92 2.19 -0.15 -2.03 117.98 121.82 1mvg s PHE 113 Ca 0.16 -0.03 0.00 0.00 0.33 0.00 0.00 56.93 57.38 1mvg s PHE 113 Cb -0.11 -0.50 0.00 0.00 -1.31 0.00 0.00 43.02 41.11 1mvg s PHE 113 CO 0.06 -0.63 0.00 0.41 1.83 0.00 0.00 175.22 176.90 1mvg n GLY 114 N 5.30 3.94 2.10 13.12 0.00 -1.26 -1.27 105.19 127.13 1mvg n GLY 114 Ca -0.06 0.03 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 1mvg n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mvg n GLY 115 N 0.00 4.41 3.23 -0.02 0.00 -1.26 -4.82 105.19 106.73 1mvg n GLY 115 Ca 0.00 -1.09 -0.24 0.00 0.00 0.00 0.00 46.02 44.69 1mvg n GLY 115 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mvg s VAL 116 N -3.25 1.54 0.11 1.61 1.01 -0.40 -5.16 120.40 115.87 1mvg s VAL 116 Ca 0.56 -1.17 0.09 0.00 0.00 0.00 0.00 61.98 61.45 1mvg s VAL 116 Cb 0.47 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 1mvg s VAL 116 CO 0.10 0.14 -0.23 -0.89 0.00 0.00 0.00 175.10 174.23 1mvg s THR 117 N -0.83 1.87 -0.06 3.92 2.01 -1.26 -0.98 115.64 120.31 1mvg s THR 117 Ca 0.06 -1.59 0.04 0.00 0.31 0.00 0.00 61.69 60.51 1mvg s THR 117 Cb -0.09 -1.68 -0.00 0.00 0.01 0.00 0.00 72.50 70.74 1mvg s THR 117 CO 0.02 -0.00 -0.19 -0.76 -0.69 0.00 0.00 174.62 172.99 1mvg s LEU 118 N -1.92 1.94 -0.09 4.42 1.02 -0.07 -4.67 118.68 119.31 1mvg s LEU 118 Ca 0.09 -0.42 0.03 0.00 0.02 0.00 0.00 54.13 53.85 1mvg s LEU 118 Cb -0.10 -1.12 0.01 0.00 0.02 0.00 0.00 46.19 45.00 1mvg s LEU 118 CO 0.05 0.16 -0.17 0.27 0.02 0.00 0.00 176.35 176.67 1mvg s ILE 119 N 0.13 1.57 0.25 -0.59 -5.25 -0.74 -1.52 121.20 115.05 1mvg s ILE 119 Ca -0.08 -0.72 -0.20 0.00 -0.99 0.00 0.00 60.65 58.66 1mvg s ILE 119 Cb -0.14 -1.40 0.02 0.00 2.95 0.00 0.00 42.46 43.90 1mvg s ILE 119 CO 0.04 0.45 0.66 0.00 -1.79 0.00 0.00 174.94 174.30 1mvg s ARG 120 N 0.63 1.65 -0.02 0.37 1.70 -0.61 -0.66 118.95 122.01 1mvg s ARG 120 Ca -0.14 -0.94 0.00 0.00 -0.47 0.00 0.00 55.73 54.19 1mvg s ARG 120 Cb -0.16 0.58 0.02 0.00 -0.57 0.00 0.00 34.95 34.82 1mvg s ARG 120 CO 0.04 -0.74 0.00 1.03 -1.08 0.00 0.00 175.30 174.55 1mvg s ARG 121 N -3.90 0.20 0.30 3.89 0.52 -0.33 -1.55 118.95 118.07 1mvg s ARG 121 Ca 0.11 0.05 0.09 0.00 -0.52 0.00 0.00 55.73 55.46 1mvg s ARG 121 Cb -0.04 -0.34 -0.04 0.00 0.52 0.00 0.00 34.95 35.04 1mvg s ARG 121 CO 0.04 -0.09 0.07 -1.12 0.02 0.00 0.00 175.30 174.21 1mvg s SER 122 N 0.72 4.64 0.07 0.23 0.01 -0.30 -1.55 113.70 117.51 1mvg s SER 122 Ca -0.07 -0.69 0.07 0.00 1.31 0.00 0.00 55.95 56.57 1mvg s SER 122 Cb -0.10 -0.82 -0.03 0.00 0.21 0.00 0.00 66.02 65.29 1mvg s SER 122 CO -0.01 -0.13 -0.19 -0.54 0.41 0.00 0.00 173.24 172.78 1mvg s LYS 123 N -3.75 1.14 -0.37 12.44 1.02 -0.18 -0.82 119.74 129.22 1mvg s LYS 123 Ca 0.34 -0.99 -0.27 0.00 0.02 0.00 0.00 55.97 55.07 1mvg s LYS 123 Cb -0.05 -1.28 -0.04 0.00 -0.52 0.00 0.00 37.83 35.94 1mvg s LYS 123 CO 0.21 0.31 2.14 0.50 -0.92 0.00 0.00 175.35 177.59 1mvg s ARG 124 N -1.51 2.82 0.00 1.68 3.52 -0.57 -1.23 118.95 123.66 1mvg s ARG 124 Ca 0.05 1.55 0.00 0.00 -0.13 0.00 0.00 55.73 57.19 1mvg s ARG 124 Cb -0.09 -4.40 0.00 0.00 -1.56 0.00 0.00 34.95 28.90 1mvg s ARG 124 CO 0.03 -2.46 0.00 0.28 -0.81 0.00 0.00 175.30 172.33