#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 0.00 -1.62 0.00 3.01 -1.26 -4.93 117.46 112.66 1mvg n PHE 2 Ca 0.00 0.00 -0.52 0.00 1.01 0.00 0.00 57.45 57.94 1mvg n PHE 2 Cb 0.00 -0.26 -0.06 0.00 -0.01 0.00 0.00 39.48 39.15 1mvg n PHE 2 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1mvg n SER 3 N -1.50 2.75 0.00 4.37 3.41 -1.26 -4.67 113.62 116.72 1mvg n SER 3 Ca 0.06 0.82 0.00 0.00 -0.26 0.00 0.00 58.87 59.48 1mvg n SER 3 Cb 0.34 -1.28 0.00 0.00 -0.26 0.00 0.00 64.21 63.01 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 5.02 -0.60 3.34 5.00 0.00 -0.42 -4.99 105.19 112.54 1mvg n GLY 4 Ca 0.29 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.00 2.33 0.04 2.61 2.01 -1.26 -1.19 115.64 118.17 1mvg s THR 5 Ca 0.00 -0.99 -0.05 0.00 0.31 0.00 0.00 61.69 60.96 1mvg s THR 5 Cb 0.00 -1.85 -0.01 0.00 0.01 0.00 0.00 72.50 70.65 1mvg s THR 5 CO 0.00 0.58 0.09 0.26 -0.69 0.00 0.00 174.62 174.85 1mvg s TRP 6 N -0.50 0.22 -0.05 4.92 0.52 -0.15 -1.14 118.94 122.76 1mvg s TRP 6 Ca 0.06 -0.54 -0.02 0.00 0.02 0.00 0.00 56.10 55.62 1mvg s TRP 6 Cb -0.11 -0.16 0.04 0.00 -1.15 0.00 0.00 33.47 32.09 1mvg s TRP 6 CO 0.01 -0.37 0.11 -1.14 0.02 0.00 0.00 176.95 175.58 1mvg s GLN 7 N -2.70 0.04 0.25 4.98 2.00 -0.52 -0.86 119.66 122.85 1mvg s GLN 7 Ca -0.04 0.35 -0.30 0.00 -2.00 0.00 0.00 55.36 53.36 1mvg s GLN 7 Cb -0.01 -0.23 -0.10 0.00 0.80 0.00 0.00 33.01 33.47 1mvg s GLN 7 CO -0.05 -0.19 1.51 0.08 -0.50 0.00 0.00 175.29 176.14 1mvg s VAL 8 N 1.35 2.46 -0.12 1.34 1.01 -1.24 -1.53 120.40 123.68 1mvg s VAL 8 Ca -0.07 0.38 0.06 0.00 0.00 0.00 0.00 61.98 62.35 1mvg s VAL 8 Cb -0.12 -3.24 -0.11 0.00 0.00 0.00 0.00 36.38 32.91 1mvg s VAL 8 CO -0.05 0.05 -0.03 0.00 0.00 0.00 0.00 175.10 175.08 1mvg n TYR 9 N 2.59 0.00 -4.11 5.22 4.11 -0.56 -4.82 117.16 119.58 1mvg n TYR 9 Ca 0.09 0.00 -0.14 0.00 -0.00 0.00 0.00 57.90 57.84 1mvg n TYR 9 Cb 0.39 -0.52 -0.13 0.00 -0.00 0.00 0.00 39.34 39.08 1mvg n TYR 9 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1mvg s ALA 10 N -2.26 0.53 -0.07 -3.48 0.00 -1.10 -5.03 121.76 110.34 1mvg s ALA 10 Ca -0.10 -0.53 -0.12 0.00 0.00 0.00 0.00 51.96 51.20 1mvg s ALA 10 Cb 0.04 -0.03 0.03 0.00 0.00 0.00 0.00 23.12 23.15 1mvg s ALA 10 CO 0.38 0.04 0.30 1.14 0.00 0.00 0.00 175.76 177.63 1mvg s GLN 11 N -0.93 0.49 -0.15 0.00 0.00 -1.26 -1.10 119.66 116.71 1mvg s GLN 11 Ca -0.04 0.15 -0.23 0.00 -0.00 0.00 0.00 55.36 55.24 1mvg s GLN 11 Cb -0.06 0.22 0.06 0.00 0.00 0.00 0.00 33.01 33.23 1mvg s GLN 11 CO 0.00 -0.10 0.58 -2.00 0.00 0.00 0.00 175.29 173.78 1mvg s GLU 12 N -0.48 0.80 -1.76 9.60 2.12 -0.21 -4.87 118.70 123.89 1mvg s GLU 12 Ca -0.06 0.54 0.00 0.00 0.36 0.00 0.00 54.97 55.81 1mvg s GLU 12 Cb -0.04 0.38 0.00 0.00 0.26 0.00 0.00 34.13 34.73 1mvg s GLU 12 CO 0.02 -0.17 0.00 -1.71 -0.54 0.00 0.00 175.26 172.86 1mvg n ASN 13 N 2.04 -5.25 -0.14 -1.70 5.15 -1.26 -1.65 115.26 112.46 1mvg n ASN 13 Ca -0.16 0.20 -0.28 0.00 -0.60 0.00 0.00 54.58 53.74 1mvg n ASN 13 Cb 0.56 -4.50 -0.10 0.00 -0.53 0.00 0.00 39.78 35.21 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 -3.22 0.00 -0.28 1.20 9.36 -1.26 -3.81 117.16 119.15 1mvg n TYR 14 Ca -0.21 0.00 0.08 0.00 3.32 0.00 0.00 57.90 61.10 1mvg n TYR 14 Cb 0.65 -1.00 0.23 0.00 -0.63 0.00 0.00 39.34 38.59 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 -0.84 0.42 0.03 2.98 4.22 -1.94 -1.49 114.58 117.96 1mvg h GLU 15 Ca -0.69 -0.03 -0.00 0.00 0.08 0.00 0.00 59.36 58.72 1mvg h GLU 15 Cb 1.66 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.82 1mvg h GLU 15 CO -0.38 0.28 -0.01 0.93 -2.18 0.00 0.00 179.01 177.65 1mvg h GLU 16 N 0.44 -0.04 -0.12 1.92 3.07 -1.97 0.14 114.58 118.02 1mvg h GLU 16 Ca 0.47 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 59.36 1mvg h GLU 16 Cb 0.80 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.69 1mvg h GLU 16 CO -0.46 -0.02 -0.03 0.35 -1.40 0.00 0.00 179.01 177.45 1mvg h PHE 17 N -0.05 -0.07 -0.45 4.33 3.57 -1.50 0.64 116.94 123.41 1mvg h PHE 17 Ca -0.00 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 1mvg h PHE 17 Cb 0.04 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 1mvg h PHE 17 CO -0.08 -0.05 0.17 -0.07 -2.23 0.00 0.00 178.31 176.05 1mvg h LEU 18 N -0.00 0.64 -1.66 0.59 3.38 -1.18 -2.07 115.31 115.00 1mvg h LEU 18 Ca 0.06 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1mvg h LEU 18 Cb 0.09 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1mvg h LEU 18 CO -0.12 0.64 -0.11 0.50 0.09 0.00 0.00 178.44 179.44 1mvg h LYS 19 N 0.59 0.07 0.00 1.13 3.64 -0.76 -0.85 116.57 120.40 1mvg h LYS 19 Ca 0.15 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.45 1mvg h LYS 19 Cb 0.21 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 1mvg h LYS 19 CO -0.01 0.19 -0.31 0.00 -2.27 0.00 0.00 179.45 177.05 1mvg h ALA 20 N 1.82 1.24 -3.58 5.00 0.00 -0.21 -3.44 119.26 120.09 1mvg h ALA 20 Ca 0.01 -0.28 -0.30 0.00 0.00 0.00 0.00 54.91 54.34 1mvg h ALA 20 Cb 0.25 -0.05 0.13 0.00 0.00 0.00 0.00 17.79 18.12 1mvg h ALA 20 CO 0.02 0.39 0.28 1.28 0.00 0.00 0.00 179.25 181.21 1mvg n LEU 21 N -3.81 0.00 -0.19 0.00 4.77 -0.32 -4.95 117.00 112.49 1mvg n LEU 21 Ca -0.01 -1.01 0.22 0.00 -0.03 0.00 0.00 56.01 55.17 1mvg n LEU 21 Cb 0.40 -0.72 0.59 0.00 -2.33 0.00 0.00 43.42 41.36 1mvg n LEU 21 CO 0.36 -1.24 1.23 0.00 -1.33 0.00 0.00 177.39 176.41 1mvg h ALA 22 N -1.92 2.41 -0.94 -1.18 0.00 -1.85 -3.43 119.26 112.36 1mvg h ALA 22 Ca -0.30 -0.00 -0.70 0.00 0.00 0.00 0.00 54.91 53.91 1mvg h ALA 22 Cb 0.84 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1mvg h ALA 22 CO 0.21 -0.67 1.33 1.28 0.00 0.00 0.00 179.25 181.40 1mvg n LEU 23 N -4.43 1.90 -4.85 0.00 4.77 -1.26 -4.95 117.00 108.20 1mvg n LEU 23 Ca 0.18 0.55 -0.29 0.00 -0.03 0.00 0.00 56.01 56.42 1mvg n LEU 23 Cb 0.75 -1.18 0.09 0.00 -2.33 0.00 0.00 43.42 40.76 1mvg n LEU 23 CO 0.34 -0.69 0.75 -2.16 -1.33 0.00 0.00 177.39 174.29 1mvg s PRO 24 N 5.82 1.96 0.41 3.23 0.04 -1.26 -4.38 135.00 140.81 1mvg s PRO 24 Ca 1.10 0.33 0.22 0.00 0.04 0.00 0.00 61.00 62.69 1mvg s PRO 24 Cb -1.01 -1.93 1.22 0.00 0.04 0.00 0.00 34.50 32.82 1mvg s PRO 24 CO 0.55 -1.64 1.71 1.05 0.04 0.00 0.00 177.00 178.70 1mvg h GLU 25 N -1.09 0.27 0.29 4.56 4.11 -1.92 -1.48 114.58 119.31 1mvg h GLU 25 Ca -0.47 -0.02 -0.01 0.00 0.07 0.00 0.00 59.36 58.93 1mvg h GLU 25 Cb 1.30 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1mvg h GLU 25 CO 0.63 0.18 -0.14 -0.44 0.07 0.00 0.00 179.01 179.31 1mvg h ASP 26 N 0.28 -0.33 0.41 3.06 5.19 -2.00 -2.92 116.42 120.10 1mvg h ASP 26 Ca 0.69 -0.15 -0.18 0.00 -0.62 0.00 0.00 57.03 56.77 1mvg h ASP 26 Cb 1.90 0.09 -0.01 0.00 0.18 0.00 0.00 39.33 41.49 1mvg h ASP 26 CO -0.38 0.15 -0.77 -0.07 -3.12 0.00 0.00 179.24 175.05 1mvg h LEU 27 N -1.01 0.35 -0.82 1.55 3.38 -1.86 -3.07 115.31 113.84 1mvg h LEU 27 Ca -0.04 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.63 1mvg h LEU 27 Cb 0.46 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1mvg h LEU 27 CO 0.07 1.00 0.25 -0.29 0.09 0.00 0.00 178.44 179.55 1mvg h ILE 28 N 0.19 1.26 -1.00 1.22 -0.00 -1.42 -2.78 117.51 114.97 1mvg h ILE 28 Ca -0.03 -0.87 0.26 0.00 -0.00 0.00 0.00 64.86 64.21 1mvg h ILE 28 Cb 1.36 0.43 -0.07 0.00 -0.00 0.00 0.00 36.82 38.53 1mvg h ILE 28 CO 0.12 0.35 0.68 0.50 -0.00 0.00 0.00 178.15 179.80 1mvg h LYS 29 N 1.09 0.25 0.11 2.19 3.64 -1.40 -0.04 116.57 122.40 1mvg h LYS 29 Ca 0.24 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.60 1mvg h LYS 29 Cb 0.28 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1mvg h LYS 29 CO -0.01 0.16 -0.05 1.98 -2.27 0.00 0.00 179.45 179.26 1mvg h MET 30 N 0.25 -0.14 -0.78 1.90 4.05 -1.60 -3.34 114.93 115.26 1mvg h MET 30 Ca 0.52 0.01 0.12 0.00 -0.28 0.00 0.00 59.70 60.07 1mvg h MET 30 Cb 1.59 0.03 -0.05 0.00 -0.80 0.00 0.00 31.60 32.37 1mvg h MET 30 CO -0.16 0.25 0.51 0.00 0.23 0.00 0.00 176.91 177.74 1mvg h ALA 31 N -0.54 1.89 -1.02 0.39 0.00 -1.31 -1.23 119.26 117.44 1mvg h ALA 31 Ca -0.02 -0.00 0.32 0.00 0.00 0.00 0.00 54.91 55.21 1mvg h ALA 31 Cb 0.46 -0.12 -0.14 0.00 0.00 0.00 0.00 17.79 17.99 1mvg h ALA 31 CO 0.03 -0.08 0.60 -0.09 0.00 0.00 0.00 179.25 179.70 1mvg h ARG 32 N 0.61 0.34 -1.35 0.00 2.43 -1.15 -2.46 114.38 112.79 1mvg h ARG 32 Ca 0.38 -0.02 -0.59 0.00 -0.81 0.00 0.00 59.98 58.93 1mvg h ARG 32 Cb 0.62 -0.08 -0.41 0.00 -0.42 0.00 0.00 29.97 29.69 1mvg h ARG 32 CO -0.14 0.22 -0.59 -3.47 -1.51 0.00 0.00 179.97 174.48 1mvg n ASP 33 N -4.98 5.02 -4.11 -3.80 2.03 -0.47 -4.94 116.55 105.31 1mvg n ASP 33 Ca 0.31 -3.74 -0.25 0.00 0.52 0.00 0.00 54.79 51.63 1mvg n ASP 33 Cb 0.97 -0.48 -0.16 0.00 -0.72 0.00 0.00 41.12 40.73 1mvg n ASP 33 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1mvg s ILE 34 N -5.27 1.31 -0.47 5.18 1.01 -0.93 -5.05 121.20 117.00 1mvg s ILE 34 Ca 0.49 -0.65 -0.06 0.00 0.00 0.00 0.00 60.65 60.43 1mvg s ILE 34 Cb 0.41 -1.14 0.12 0.00 0.01 0.00 0.00 42.46 41.86 1mvg s ILE 34 CO -0.15 0.38 0.31 -1.59 0.00 0.00 0.00 174.94 173.89 1mvg s LYS 35 N 0.09 2.32 0.37 2.79 -2.85 -1.26 -5.02 119.74 116.18 1mvg s LYS 35 Ca -0.04 -1.85 -0.25 0.00 -1.00 0.00 0.00 55.97 52.83 1mvg s LYS 35 Cb -0.11 -3.79 -0.09 0.00 -2.06 0.00 0.00 37.83 31.77 1mvg s LYS 35 CO 0.02 -1.15 1.02 -1.25 0.10 0.00 0.00 175.35 174.09 1mvg s PRO 36 N 1.16 4.31 0.16 1.78 0.04 -1.26 -4.87 135.00 136.32 1mvg s PRO 36 Ca 0.08 1.48 -0.29 0.00 0.04 0.00 0.00 61.00 62.30 1mvg s PRO 36 Cb -0.24 -2.65 -0.07 0.00 0.04 0.00 0.00 34.50 31.58 1mvg s PRO 36 CO -0.02 -0.00 0.92 -1.50 0.04 0.00 0.00 177.00 176.43 1mvg s ILE 37 N -1.63 4.35 0.09 0.56 1.10 -0.78 -3.65 121.20 121.24 1mvg s ILE 37 Ca 0.55 2.00 0.08 0.00 -0.51 0.00 0.00 60.65 62.78 1mvg s ILE 37 Cb -0.22 -4.29 -0.03 0.00 0.15 0.00 0.00 42.46 38.07 1mvg s ILE 37 CO 0.27 0.41 -0.22 -0.69 -2.11 0.00 0.00 174.94 172.60 1mvg s VAL 38 N -0.56 1.80 -0.21 4.00 1.01 -0.04 -1.10 120.40 125.31 1mvg s VAL 38 Ca 0.43 -1.46 -0.08 0.00 0.00 0.00 0.00 61.98 60.86 1mvg s VAL 38 Cb -0.24 -1.60 0.08 0.00 0.00 0.00 0.00 36.38 34.62 1mvg s VAL 38 CO 0.30 0.06 0.46 -0.70 0.00 0.00 0.00 175.10 175.22 1mvg s GLU 39 N -1.67 0.39 -0.06 2.72 -6.30 -0.12 -0.98 118.70 112.68 1mvg s GLU 39 Ca 0.08 1.02 0.01 0.00 -2.50 0.00 0.00 54.97 53.58 1mvg s GLU 39 Cb -0.10 0.27 -0.03 0.00 0.00 0.00 0.00 34.13 34.27 1mvg s GLU 39 CO 0.04 -0.21 -0.06 0.42 0.02 0.00 0.00 175.26 175.46 1mvg s ILE 40 N 2.23 3.75 -0.02 -3.70 1.09 -0.34 -1.19 121.20 123.02 1mvg s ILE 40 Ca -0.05 -0.48 0.04 0.00 -1.10 0.00 0.00 60.65 59.06 1mvg s ILE 40 Cb -0.10 -2.54 -0.00 0.00 -1.06 0.00 0.00 42.46 38.75 1mvg s ILE 40 CO -0.14 0.59 -0.13 -1.58 -0.10 0.00 0.00 174.94 173.58 1mvg s GLN 41 N -0.86 1.25 0.22 2.79 0.74 -0.50 -1.31 119.66 122.00 1mvg s GLN 41 Ca 0.13 -0.46 -0.17 0.00 0.05 0.00 0.00 55.36 54.90 1mvg s GLN 41 Cb -0.11 -1.15 0.02 0.00 1.10 0.00 0.00 33.01 32.87 1mvg s GLN 41 CO 0.02 0.22 0.55 1.14 -0.55 0.00 0.00 175.29 176.67 1mvg s GLN 42 N -0.05 1.49 -0.46 1.67 1.03 -1.26 -0.52 119.66 121.56 1mvg s GLN 42 Ca -0.00 -0.96 0.07 0.00 0.04 0.00 0.00 55.36 54.51 1mvg s GLN 42 Cb -0.08 0.53 0.28 0.00 0.03 0.00 0.00 33.01 33.76 1mvg s GLN 42 CO 0.01 -0.64 0.91 0.36 -2.54 0.00 0.00 175.29 173.39 1mvg n LYS 43 N -0.37 0.87 0.00 9.60 2.85 -1.07 -4.83 118.16 125.20 1mvg n LYS 43 Ca -0.07 -2.10 0.00 0.00 -1.05 0.00 0.00 58.31 55.09 1mvg n LYS 43 Cb 0.62 -1.31 0.00 0.00 -0.65 0.00 0.00 35.03 33.69 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 1.08 1.51 0.12 2.58 0.00 -1.26 -4.42 105.19 104.80 1mvg n GLY 44 Ca 0.11 -0.47 -0.24 0.00 0.00 0.00 0.00 46.02 45.42 1mvg n GLY 44 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1mvg n ASP 45 N 4.08 1.90 -4.79 1.61 9.92 -1.26 -4.92 116.55 123.09 1mvg n ASP 45 Ca 0.00 0.38 -0.38 0.00 -0.53 0.00 0.00 54.79 54.26 1mvg n ASP 45 Cb 0.00 -0.91 -0.06 0.00 -0.64 0.00 0.00 41.12 39.50 1mvg n ASP 45 CO 0.00 0.00 0.00 1.51 0.13 0.00 0.00 177.20 178.84 1mvg s ASP 46 N -7.04 7.31 0.01 -2.24 -4.77 -1.26 -2.68 116.67 106.00 1mvg s ASP 46 Ca -0.32 1.69 0.03 0.00 -3.30 0.00 0.00 52.55 50.65 1mvg s ASP 46 Cb 0.09 -2.52 -0.01 0.00 -1.09 0.00 0.00 42.92 39.39 1mvg s ASP 46 CO 0.57 0.06 -0.10 -0.36 0.70 0.00 0.00 175.17 176.04 1mvg s PHE 47 N -1.41 0.87 -0.07 2.11 0.40 -0.16 -2.61 117.98 117.10 1mvg s PHE 47 Ca 0.43 -0.23 0.01 0.00 -0.60 0.00 0.00 56.93 56.54 1mvg s PHE 47 Cb -0.20 -0.55 0.02 0.00 0.51 0.00 0.00 43.02 42.80 1mvg s PHE 47 CO 0.25 -0.01 -0.09 0.08 0.70 0.00 0.00 175.22 176.15 1mvg s VAL 48 N -0.48 0.96 -0.18 -0.44 1.01 0.32 -1.41 120.40 120.19 1mvg s VAL 48 Ca 0.02 -0.34 -0.03 0.00 0.00 0.00 0.00 61.98 61.62 1mvg s VAL 48 Cb -0.05 -0.93 -0.02 0.00 0.00 0.00 0.00 36.38 35.38 1mvg s VAL 48 CO 0.00 0.33 -0.05 -0.69 0.00 0.00 0.00 175.10 174.69 1mvg s VAL 49 N 1.03 3.65 -0.00 2.92 1.01 -0.03 -1.41 120.40 127.57 1mvg s VAL 49 Ca -0.08 -0.43 0.03 0.00 0.00 0.00 0.00 61.98 61.50 1mvg s VAL 49 Cb -0.15 -2.61 -0.01 0.00 0.00 0.00 0.00 36.38 33.61 1mvg s VAL 49 CO -0.00 0.47 -0.10 -0.89 0.00 0.00 0.00 175.10 174.57 1mvg s THR 50 N 0.75 0.81 -0.05 3.92 2.01 -0.34 -1.55 115.64 121.20 1mvg s THR 50 Ca -0.02 -0.52 -0.03 0.00 0.31 0.00 0.00 61.69 61.44 1mvg s THR 50 Cb -0.15 -0.69 0.03 0.00 0.01 0.00 0.00 72.50 71.70 1mvg s THR 50 CO 0.02 0.17 0.12 -0.44 -0.69 0.00 0.00 174.62 173.80 1mvg s SER 51 N -0.39 -0.09 0.07 3.53 0.01 -0.06 -0.95 113.70 115.82 1mvg s SER 51 Ca 0.03 0.23 0.08 0.00 1.31 0.00 0.00 55.95 57.61 1mvg s SER 51 Cb -0.05 0.17 -0.03 0.00 0.21 0.00 0.00 66.02 66.32 1mvg s SER 51 CO -0.00 -0.10 -0.22 -0.75 0.41 0.00 0.00 173.24 172.57 1mvg s LYS 52 N 0.70 1.38 0.02 12.44 2.20 -0.26 -1.08 119.74 135.14 1mvg s LYS 52 Ca -0.05 -1.08 -0.07 0.00 -0.36 0.00 0.00 55.97 54.41 1mvg s LYS 52 Cb -0.07 -1.59 -0.00 0.00 -1.51 0.00 0.00 37.83 34.65 1mvg s LYS 52 CO -0.03 0.39 0.13 0.99 -0.36 0.00 0.00 175.35 176.47 1mvg s THR 53 N -0.93 0.10 -0.51 3.43 2.01 0.51 -1.87 115.64 118.39 1mvg s THR 53 Ca 0.09 -0.82 0.17 0.00 0.31 0.00 0.00 61.69 61.44 1mvg s THR 53 Cb -0.09 -0.60 0.17 0.00 0.01 0.00 0.00 72.50 71.99 1mvg s THR 53 CO 0.03 -0.45 1.53 -0.81 -0.69 0.00 0.00 174.62 174.23 1mvg n PRO 54 N 1.19 0.11 -2.78 4.92 -0.04 -1.26 -2.91 135.00 134.23 1mvg n PRO 54 Ca -0.21 0.51 -0.02 0.00 -0.04 0.00 0.00 63.50 63.74 1mvg n PRO 54 Cb 0.57 -1.80 0.06 0.00 -0.04 0.00 0.00 33.50 32.29 1mvg n PRO 54 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1mvg n ARG 55 N -2.03 1.58 -3.62 0.54 1.85 -1.26 -5.10 116.66 108.61 1mvg n ARG 55 Ca 0.00 -3.03 -0.03 0.00 -1.00 0.00 0.00 57.85 53.79 1mvg n ARG 55 Cb 0.10 -1.16 -0.03 0.00 -1.05 0.00 0.00 32.46 30.31 1mvg n ARG 55 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 1mvg s GLN 56 N -2.92 0.16 -0.21 2.89 -1.52 -1.15 -5.13 119.66 111.79 1mvg s GLN 56 Ca 0.24 -0.01 -0.12 0.00 -1.95 0.00 0.00 55.36 53.51 1mvg s GLN 56 Cb 0.36 0.08 0.07 0.00 -0.22 0.00 0.00 33.01 33.29 1mvg s GLN 56 CO -0.05 -0.06 0.51 0.99 -0.25 0.00 0.00 175.29 176.43 1mvg s THR 57 N -1.63 -0.02 -0.06 -0.19 2.01 -1.26 -0.36 115.64 114.13 1mvg s THR 57 Ca 0.09 0.06 0.03 0.00 0.31 0.00 0.00 61.69 62.17 1mvg s THR 57 Cb -0.01 -0.75 0.01 0.00 0.01 0.00 0.00 72.50 71.76 1mvg s THR 57 CO -0.05 0.02 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.07 1mvg s VAL 58 N 1.39 1.30 -0.01 3.82 1.01 -0.24 -5.02 120.40 122.65 1mvg s VAL 58 Ca -0.09 -0.59 -0.00 0.00 0.00 0.00 0.00 61.98 61.30 1mvg s VAL 58 Cb -0.07 -1.16 0.02 0.00 0.00 0.00 0.00 36.38 35.17 1mvg s VAL 58 CO -0.14 0.39 0.02 -0.89 0.00 0.00 0.00 175.10 174.48 1mvg s THR 59 N 0.48 -0.04 0.12 3.92 2.01 -1.26 -0.88 115.64 119.99 1mvg s THR 59 Ca -0.13 0.14 -0.21 0.00 0.31 0.00 0.00 61.69 61.81 1mvg s THR 59 Cb -0.15 -0.06 0.05 0.00 0.01 0.00 0.00 72.50 72.36 1mvg s THR 59 CO 0.04 0.06 0.52 0.54 -0.69 0.00 0.00 174.62 175.09 1mvg s ASN 60 N 0.70 -0.43 0.12 3.53 6.03 -0.60 -4.57 114.94 119.72 1mvg s ASN 60 Ca -0.06 -0.06 -0.15 0.00 -1.03 0.00 0.00 52.86 51.56 1mvg s ASN 60 Cb -0.08 0.53 0.03 0.00 -3.03 0.00 0.00 41.25 38.70 1mvg s ASN 60 CO -0.02 -0.87 0.36 -0.94 -2.03 0.00 0.00 177.10 173.59 1mvg s SER 61 N -2.59 -0.16 0.15 3.54 1.04 -1.26 -0.85 113.70 113.57 1mvg s SER 61 Ca 0.00 -0.38 -0.25 0.00 0.48 0.00 0.00 55.95 55.80 1mvg s SER 61 Cb 0.00 0.45 0.07 0.00 0.10 0.00 0.00 66.02 66.63 1mvg s SER 61 CO -0.10 -0.83 0.99 0.72 0.98 0.00 0.00 173.24 175.01 1mvg s PHE 62 N -3.81 -0.09 0.04 5.02 -0.12 -0.50 -4.38 117.98 114.13 1mvg s PHE 62 Ca 0.03 -0.22 -0.00 0.00 -0.05 0.00 0.00 56.93 56.69 1mvg s PHE 62 Cb 0.02 0.64 -0.03 0.00 -0.63 0.00 0.00 43.02 43.03 1mvg s PHE 62 CO -0.12 -0.81 -0.03 0.99 -0.05 0.00 0.00 175.22 175.20 1mvg s THR 63 N -3.07 0.17 -0.17 -4.49 2.01 -1.26 -0.99 115.64 107.84 1mvg s THR 63 Ca 0.14 -1.37 -0.29 0.00 0.31 0.00 0.00 61.69 60.47 1mvg s THR 63 Cb -0.01 -0.91 -0.07 0.00 0.01 0.00 0.00 72.50 71.52 1mvg s THR 63 CO 0.02 -0.75 2.16 0.18 -0.69 0.00 0.00 174.62 175.54 1mvg n LEU 64 N 0.83 3.36 -2.70 4.42 4.77 -1.09 -1.69 117.00 124.89 1mvg n LEU 64 Ca -0.19 0.38 -0.17 0.00 -0.03 0.00 0.00 56.01 56.01 1mvg n LEU 64 Cb 0.58 -1.52 0.06 0.00 -2.33 0.00 0.00 43.42 40.21 1mvg n LEU 64 CO 0.24 -0.50 0.17 0.61 -1.33 0.00 0.00 177.39 176.58 1mvg n GLY 65 N 5.55 -0.11 3.00 -0.72 0.00 -0.21 -4.97 105.19 107.71 1mvg n GLY 65 Ca 0.29 -0.02 -0.22 0.00 0.00 0.00 0.00 46.02 46.07 1mvg n GLY 65 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1mvg s LYS 66 N -5.84 1.29 -0.04 1.61 2.36 -0.68 -4.91 119.74 113.52 1mvg s LYS 66 Ca 0.38 -0.32 -0.36 0.00 -2.55 0.00 0.00 55.97 53.11 1mvg s LYS 66 Cb -0.17 -1.13 -0.15 0.00 -1.05 0.00 0.00 37.83 35.34 1mvg s LYS 66 CO 0.52 0.05 1.64 -1.91 1.55 0.00 0.00 175.35 177.19 1mvg n GLU 67 N 3.65 1.63 -4.04 4.03 2.13 -1.26 -4.39 120.64 122.40 1mvg n GLU 67 Ca -0.22 0.59 -0.12 0.00 0.66 0.00 0.00 57.16 58.08 1mvg n GLU 67 Cb 0.52 -2.33 -0.05 0.00 0.27 0.00 0.00 31.44 29.86 1mvg n GLU 67 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1mvg s ALA 68 N 2.32 0.25 0.07 4.31 0.00 0.10 -4.91 121.76 123.90 1mvg s ALA 68 Ca 0.89 -1.19 0.08 0.00 0.00 0.00 0.00 51.96 51.73 1mvg s ALA 68 Cb -0.86 1.11 -0.03 0.00 0.00 0.00 0.00 23.12 23.33 1mvg s ALA 68 CO 0.51 -0.82 -0.18 0.16 0.00 0.00 0.00 175.76 175.43 1mvg s ASP 69 N -3.12 3.81 -0.03 0.00 -4.77 -1.26 -0.94 116.67 110.36 1mvg s ASP 69 Ca 0.27 -0.48 0.04 0.00 -3.30 0.00 0.00 52.55 49.08 1mvg s ASP 69 Cb -0.00 -0.58 -0.00 0.00 -1.09 0.00 0.00 42.92 41.25 1mvg s ASP 69 CO 0.14 0.23 -0.14 -0.63 0.70 0.00 0.00 175.17 175.46 1mvg s ILE 70 N -1.00 1.19 -0.61 2.11 1.01 -1.26 -4.19 121.20 118.45 1mvg s ILE 70 Ca 0.16 -0.60 -0.25 0.00 0.00 0.00 0.00 60.65 59.96 1mvg s ILE 70 Cb -0.10 -1.03 0.05 0.00 0.01 0.00 0.00 42.46 41.38 1mvg s ILE 70 CO 0.07 0.35 1.03 -0.89 0.00 0.00 0.00 174.94 175.49 1mvg s THR 71 N 0.02 4.23 0.69 2.92 2.01 -1.26 -3.82 115.64 120.42 1mvg s THR 71 Ca -0.02 0.21 -0.16 0.00 0.31 0.00 0.00 61.69 62.03 1mvg s THR 71 Cb -0.10 -4.65 0.02 0.00 0.01 0.00 0.00 72.50 67.77 1mvg s THR 71 CO 0.01 -1.34 1.18 -0.89 -0.69 0.00 0.00 174.62 172.89 1mvg s THR 72 N 4.36 2.64 -0.05 -0.82 2.01 0.16 -4.90 115.64 119.03 1mvg s THR 72 Ca 0.30 0.32 -0.06 0.00 0.31 0.00 0.00 61.69 62.57 1mvg s THR 72 Cb -0.12 -2.90 -0.25 0.00 0.01 0.00 0.00 72.50 69.24 1mvg s THR 72 CO 0.17 -0.16 3.39 0.23 -0.69 0.00 0.00 174.62 177.56 1mvg n MET 73 N -2.44 1.92 -2.28 4.92 2.81 -1.26 -2.98 117.12 117.81 1mvg n MET 73 Ca 0.13 -0.97 -0.02 0.00 -1.81 0.00 0.00 57.70 55.03 1mvg n MET 73 Cb 0.51 -1.99 0.06 0.00 -0.71 0.00 0.00 33.22 31.08 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 2.58 -0.35 -4.03 7.83 2.03 -1.26 -5.02 116.55 118.32 1mvg n ASP 74 Ca 0.41 -2.10 -0.29 0.00 0.52 0.00 0.00 54.79 53.33 1mvg n ASP 74 Cb 0.83 0.22 -0.02 0.00 -0.72 0.00 0.00 41.12 41.43 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 -0.81 -0.29 2.77 0.27 0.00 -1.16 -4.95 105.19 101.01 1mvg n GLY 75 Ca -0.11 0.15 -0.06 0.00 0.00 0.00 0.00 46.02 46.00 1mvg n GLY 75 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1mvg n LYS 76 N -4.42 0.81 -4.53 1.61 2.85 -1.26 -5.05 118.16 108.18 1mvg n LYS 76 Ca -0.19 -1.59 -0.25 0.00 -1.05 0.00 0.00 58.31 55.23 1mvg n LYS 76 Cb 0.63 2.00 -0.10 0.00 -0.65 0.00 0.00 35.03 36.90 1mvg n LYS 76 CO 0.00 0.00 0.00 -1.59 -0.05 0.00 0.00 177.40 175.76 1mvg s LYS 77 N -2.06 1.81 0.00 -1.58 0.00 -1.26 -0.67 119.74 115.98 1mvg s LYS 77 Ca 0.12 -2.03 0.00 0.00 0.00 0.00 0.00 55.97 54.06 1mvg s LYS 77 Cb -0.04 -1.11 0.00 0.00 0.00 0.00 0.00 37.83 36.68 1mvg s LYS 77 CO 0.08 -0.19 0.56 1.47 0.00 0.00 0.00 175.35 177.28 1mvg n LEU 78 N -0.83 0.00 -1.15 2.77 -0.00 -1.25 -4.94 117.00 111.60 1mvg n LEU 78 Ca -0.05 -0.44 0.00 0.00 -0.00 0.00 0.00 56.01 55.52 1mvg n LEU 78 Cb 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.09 1mvg n LEU 78 CO 0.43 0.24 -0.34 1.17 -0.00 0.00 0.00 177.39 178.89 1mvg n LYS 79 N 0.00 -3.20 -3.64 1.47 4.81 -1.26 -4.66 118.16 111.68 1mvg n LYS 79 Ca 0.00 2.42 -0.15 0.00 -0.87 0.00 0.00 58.31 59.71 1mvg n LYS 79 Cb 0.56 -2.82 -0.07 0.00 0.02 0.00 0.00 35.03 32.71 1mvg n LYS 79 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1mvg n THR 81 N 1.50 -0.15 -3.03 0.00 -1.04 -1.26 -0.72 114.28 109.58 1mvg n THR 81 Ca -0.18 -1.87 0.00 0.00 -2.04 0.00 0.00 64.05 59.95 1mvg n THR 81 Cb 0.56 0.78 0.00 0.00 -1.82 0.00 0.00 70.33 69.85 1mvg n THR 81 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1mvg n VAL 82 N 1.86 0.00 -3.47 12.58 0.31 -1.26 -4.73 118.33 123.62 1mvg n VAL 82 Ca 0.13 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.41 1mvg n VAL 82 Cb 0.60 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 33.54 1mvg n VAL 82 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1mvg n HIS 83 N 0.00 -1.54 -4.22 3.52 1.44 -1.26 -1.05 115.22 112.11 1mvg n HIS 83 Ca 0.00 -0.97 -0.35 0.00 -2.01 0.00 0.00 57.72 54.38 1mvg n HIS 83 Cb 0.00 0.42 -0.09 0.00 0.12 0.00 0.00 29.99 30.45 1mvg n HIS 83 CO 0.00 0.00 0.00 -1.17 -2.81 0.00 0.00 176.34 172.36 1mvg s LEU 84 N 0.00 3.81 -0.19 2.39 0.20 -1.26 -2.01 118.68 121.62 1mvg s LEU 84 Ca 0.09 0.23 -0.04 0.00 0.69 0.00 0.00 54.13 55.10 1mvg s LEU 84 Cb -0.02 -1.89 0.09 0.00 -0.43 0.00 0.00 46.19 43.94 1mvg s LEU 84 CO 0.07 0.38 0.27 0.00 -0.29 0.00 0.00 176.35 176.78 1mvg s ALA 85 N -0.87 -0.55 -0.92 5.97 0.00 -0.30 -4.98 121.76 120.10 1mvg s ALA 85 Ca 0.13 0.61 -0.06 0.00 0.00 0.00 0.00 51.96 52.65 1mvg s ALA 85 Cb -0.12 -1.32 -0.02 0.00 0.00 0.00 0.00 23.12 21.66 1mvg s ALA 85 CO 0.03 -1.06 0.78 0.09 0.00 0.00 0.00 175.76 175.60 1mvg n ASN 86 N 5.34 -6.76 -3.38 0.00 3.02 -1.26 -3.23 115.26 108.99 1mvg n ASN 86 Ca -0.05 -0.52 -0.24 0.00 -0.03 0.00 0.00 54.58 53.73 1mvg n ASN 86 Cb 0.50 -4.64 0.04 0.00 -0.61 0.00 0.00 39.78 35.06 1mvg n ASN 86 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mvg n GLY 87 N -1.57 -0.52 3.33 7.41 0.00 -1.26 -4.97 105.19 107.62 1mvg n GLY 87 Ca -0.07 0.17 -0.06 0.00 0.00 0.00 0.00 46.02 46.06 1mvg n GLY 87 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1mvg s LYS 88 N -6.07 0.41 -0.25 1.61 2.20 -1.20 -3.24 119.74 113.21 1mvg s LYS 88 Ca 0.45 1.10 -0.09 0.00 -0.36 0.00 0.00 55.97 57.08 1mvg s LYS 88 Cb -0.21 0.42 -0.04 0.00 -1.51 0.00 0.00 37.83 36.49 1mvg s LYS 88 CO 0.56 -0.30 0.11 -1.17 -0.36 0.00 0.00 175.35 174.19 1mvg s LEU 89 N 2.70 3.71 -0.63 5.43 0.20 -0.11 -1.15 118.68 128.82 1mvg s LEU 89 Ca 0.00 -0.08 0.06 0.00 0.69 0.00 0.00 54.13 54.80 1mvg s LEU 89 Cb -0.13 -2.00 0.25 0.00 -0.43 0.00 0.00 46.19 43.89 1mvg s LEU 89 CO -0.15 0.00 0.74 0.55 -0.29 0.00 0.00 176.35 177.20 1mvg n VAL 90 N 4.68 2.26 -2.37 1.68 3.14 -0.85 -1.39 118.33 125.47 1mvg n VAL 90 Ca -0.16 -5.18 -0.42 0.00 -2.96 0.00 0.00 64.34 55.62 1mvg n VAL 90 Cb 0.52 -2.10 -0.03 0.00 -1.06 0.00 0.00 33.84 31.17 1mvg n VAL 90 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 1mvg s THR 91 N -2.42 3.99 0.02 1.55 -4.23 -0.76 -4.46 115.64 109.32 1mvg s THR 91 Ca 0.40 1.38 -0.07 0.00 -1.18 0.00 0.00 61.69 62.21 1mvg s THR 91 Cb 0.15 -3.89 -0.00 0.00 1.34 0.00 0.00 72.50 70.10 1mvg s THR 91 CO -0.02 0.04 0.14 -0.75 -0.54 0.00 0.00 174.62 173.50 1mvg s LYS 92 N 1.78 0.56 0.00 3.99 2.20 -1.26 -0.20 119.74 126.81 1mvg s LYS 92 Ca 0.59 -0.53 0.00 0.00 -0.36 0.00 0.00 55.97 55.67 1mvg s LYS 92 Cb -0.29 0.23 0.00 0.00 -1.51 0.00 0.00 37.83 36.26 1mvg s LYS 92 CO 0.26 -0.14 0.00 0.43 -0.36 0.00 0.00 175.35 175.54 1mvg n SER 93 N 1.12 0.00 -0.12 1.43 7.64 0.07 -3.99 113.62 119.77 1mvg n SER 93 Ca -0.21 -0.49 -0.11 0.00 1.01 0.00 0.00 58.87 59.08 1mvg n SER 93 Cb 0.57 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.71 1mvg n SER 93 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1mvg h GLU 94 N 0.00 -0.33 0.00 1.43 4.57 -1.85 -3.37 114.58 115.03 1mvg h GLU 94 Ca 0.00 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 1mvg h GLU 94 Cb 0.00 0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.67 1mvg h GLU 94 CO 0.00 -0.22 -0.61 1.63 -1.18 0.00 0.00 179.01 178.63 1mvg n LYS 95 N -5.41 2.39 -2.42 1.92 5.02 -1.26 -5.09 118.16 113.31 1mvg n LYS 95 Ca -0.01 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.91 1mvg n LYS 95 Cb 0.35 -0.80 -0.03 0.00 -0.02 0.00 0.00 35.03 34.53 1mvg n LYS 95 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1mvg s PHE 96 N -1.40 3.12 0.06 2.13 5.36 -1.26 -4.26 117.98 121.74 1mvg s PHE 96 Ca 0.00 1.60 0.03 0.00 -0.96 0.00 0.00 56.93 57.60 1mvg s PHE 96 Cb 0.00 -3.24 -0.03 0.00 -0.34 0.00 0.00 43.02 39.41 1mvg s PHE 96 CO 0.00 -0.99 -0.09 -1.12 -1.46 0.00 0.00 175.22 171.56 1mvg s SER 97 N -1.45 1.12 -0.34 6.13 0.01 -0.59 -0.75 113.70 117.83 1mvg s SER 97 Ca 0.60 -0.66 0.01 0.00 1.31 0.00 0.00 55.95 57.21 1mvg s SER 97 Cb -0.25 0.03 0.14 0.00 0.21 0.00 0.00 66.02 66.15 1mvg s SER 97 CO 0.31 -0.23 0.31 -2.28 0.41 0.00 0.00 173.24 171.77 1mvg s HIS 98 N -1.83 -0.14 -0.41 2.43 2.46 0.72 -1.40 115.29 117.12 1mvg s HIS 98 Ca -0.03 -0.78 -0.09 0.00 0.47 0.00 0.00 55.06 54.62 1mvg s HIS 98 Cb -0.07 -0.53 0.07 0.00 -0.13 0.00 0.00 32.58 31.92 1mvg s HIS 98 CO -0.00 -0.93 0.24 -1.21 -2.47 0.00 0.00 174.74 170.37 1mvg s GLU 99 N 1.66 2.61 -0.14 2.88 2.02 0.18 -1.83 118.70 126.07 1mvg s GLU 99 Ca 0.15 -1.41 0.02 0.00 0.02 0.00 0.00 54.97 53.75 1mvg s GLU 99 Cb -0.16 -3.73 0.00 0.00 0.10 0.00 0.00 34.13 30.34 1mvg s GLU 99 CO -0.12 -0.90 -0.19 -1.14 0.02 0.00 0.00 175.26 172.92 1mvg s GLN 100 N 1.42 3.11 -0.09 1.61 2.00 -0.49 -1.34 119.66 125.90 1mvg s GLN 100 Ca 0.03 -0.81 0.04 0.00 -2.00 0.00 0.00 55.36 52.62 1mvg s GLN 100 Cb -0.22 -2.52 0.00 0.00 0.80 0.00 0.00 33.01 31.07 1mvg s GLN 100 CO 0.02 0.01 -0.21 -2.00 -0.50 0.00 0.00 175.29 172.62 1mvg s GLU 101 N 0.78 2.65 0.11 1.67 2.12 -0.34 -0.94 118.70 124.76 1mvg s GLU 101 Ca -0.07 -0.76 0.10 0.00 0.36 0.00 0.00 54.97 54.60 1mvg s GLU 101 Cb -0.16 -2.05 -0.04 0.00 0.26 0.00 0.00 34.13 32.15 1mvg s GLU 101 CO -0.00 0.15 -0.25 0.08 -0.54 0.00 0.00 175.26 174.70 1mvg s VAL 102 N 0.38 2.09 0.00 3.70 1.01 -1.20 -1.14 120.40 125.25 1mvg s VAL 102 Ca -0.17 -1.66 0.00 0.00 0.00 0.00 0.00 61.98 60.15 1mvg s VAL 102 Cb -0.17 -1.86 0.00 0.00 0.00 0.00 0.00 36.38 34.35 1mvg s VAL 102 CO 0.07 0.07 0.00 1.17 0.00 0.00 0.00 175.10 176.41 1mvg n LYS 103 N 1.04 0.00 0.05 2.72 3.00 -0.50 -4.88 118.16 119.59 1mvg n LYS 103 Ca -0.18 0.00 -0.03 0.00 -0.00 0.00 0.00 58.31 58.10 1mvg n LYS 103 Cb 0.53 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.55 1mvg n LYS 103 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 1mvg h GLY 104 N 0.00 -0.18 -2.06 3.14 0.00 -2.01 -3.41 103.07 98.56 1mvg h GLY 104 Ca 0.00 0.07 -0.12 0.00 0.00 0.00 0.00 47.33 47.28 1mvg h GLY 104 CO 0.00 -0.07 -0.72 0.70 0.00 0.00 0.00 176.54 176.46 1mvg n ASN 105 N -3.24 1.81 -3.66 0.19 3.02 -1.26 -4.79 115.26 107.33 1mvg n ASN 105 Ca -0.02 -3.25 -0.14 0.00 -0.03 0.00 0.00 54.58 51.13 1mvg n ASN 105 Cb 0.07 -0.44 -0.08 0.00 -0.61 0.00 0.00 39.78 38.71 1mvg n ASN 105 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1mvg s GLU 106 N -2.37 0.74 -0.12 3.52 2.56 -1.26 -3.80 118.70 117.97 1mvg s GLU 106 Ca 0.38 0.50 -0.05 0.00 0.00 0.00 0.00 54.97 55.80 1mvg s GLU 106 Cb 0.38 0.35 0.06 0.00 2.00 0.00 0.00 34.13 36.92 1mvg s GLU 106 CO -0.09 -0.15 0.25 1.41 -0.56 0.00 0.00 175.26 176.13 1mvg s MET 107 N -0.29 0.17 -0.11 4.30 -2.45 -0.19 -1.40 119.30 119.32 1mvg s MET 107 Ca -0.05 0.66 -0.04 0.00 -1.25 0.00 0.00 55.69 55.02 1mvg s MET 107 Cb -0.03 -0.08 -0.03 0.00 1.25 0.00 0.00 34.83 35.94 1mvg s MET 107 CO 0.03 -0.24 0.02 0.08 1.05 0.00 0.00 175.02 175.97 1mvg s VAL 108 N 1.95 4.50 -0.07 10.11 1.01 -0.29 -0.77 120.40 136.83 1mvg s VAL 108 Ca -0.03 -0.17 0.00 0.00 0.00 0.00 0.00 61.98 61.79 1mvg s VAL 108 Cb -0.11 -2.93 0.02 0.00 0.00 0.00 0.00 36.38 33.36 1mvg s VAL 108 CO -0.08 0.57 -0.06 -1.61 0.00 0.00 0.00 175.10 173.92 1mvg s GLU 109 N -0.57 1.08 -0.08 2.72 2.02 -0.20 -1.20 118.70 122.48 1mvg s GLU 109 Ca 0.10 -0.15 -0.00 0.00 0.02 0.00 0.00 54.97 54.94 1mvg s GLU 109 Cb -0.12 -1.12 0.02 0.00 0.10 0.00 0.00 34.13 33.02 1mvg s GLU 109 CO 0.02 -0.14 -0.04 0.99 0.02 0.00 0.00 175.26 176.11 1mvg s THR 110 N 1.24 0.69 0.23 3.63 2.01 -0.45 -1.45 115.64 121.54 1mvg s THR 110 Ca -0.05 -0.11 0.11 0.00 0.31 0.00 0.00 61.69 61.95 1mvg s THR 110 Cb -0.14 -0.76 -0.05 0.00 0.01 0.00 0.00 72.50 71.57 1mvg s THR 110 CO -0.02 0.30 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.38 1mvg s ILE 111 N 1.57 2.54 0.05 1.82 -1.09 -0.48 -0.65 121.20 124.96 1mvg s ILE 111 Ca 0.00 -2.15 0.03 0.00 -2.23 0.00 0.00 60.65 56.30 1mvg s ILE 111 Cb -0.13 -2.28 -0.02 0.00 -1.58 0.00 0.00 42.46 38.44 1mvg s ILE 111 CO -0.05 -0.25 -0.10 -0.89 -1.23 0.00 0.00 174.94 172.42 1mvg s THR 112 N -2.07 0.74 -0.20 2.92 2.01 -0.50 -1.12 115.64 117.42 1mvg s THR 112 Ca 0.26 -1.10 -0.04 0.00 0.31 0.00 0.00 61.69 61.12 1mvg s THR 112 Cb -0.07 -0.76 0.10 0.00 0.01 0.00 0.00 72.50 71.79 1mvg s THR 112 CO 0.13 -0.29 0.31 0.12 -0.69 0.00 0.00 174.62 174.20 1mvg s PHE 113 N -1.25 -0.57 0.00 4.92 5.36 -0.11 -1.54 117.98 124.78 1mvg s PHE 113 Ca -0.06 0.74 0.00 0.00 -0.96 0.00 0.00 56.93 56.64 1mvg s PHE 113 Cb -0.09 -0.08 0.00 0.00 -0.34 0.00 0.00 43.02 42.50 1mvg s PHE 113 CO 0.01 -0.59 0.00 0.41 -1.46 0.00 0.00 175.22 173.59 1mvg n GLY 114 N 5.35 1.06 2.42 13.12 0.00 -1.26 -0.99 105.19 124.89 1mvg n GLY 114 Ca -0.05 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.36 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 1.57 3.19 -0.02 0.00 -1.26 -4.93 105.19 103.75 1mvg n GLY 115 Ca 0.00 -0.85 -0.23 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.25 1.37 -0.06 1.61 1.01 -0.16 -5.15 120.40 116.77 1mvg s VAL 116 Ca 0.25 -1.06 0.05 0.00 0.00 0.00 0.00 61.98 61.22 1mvg s VAL 116 Cb 0.34 -1.21 -0.01 0.00 0.00 0.00 0.00 36.38 35.50 1mvg s VAL 116 CO -0.08 0.12 -0.23 -0.89 0.00 0.00 0.00 175.10 174.02 1mvg s THR 117 N -0.79 1.90 0.00 3.92 2.01 -1.26 -0.94 115.64 120.49 1mvg s THR 117 Ca 0.05 -0.98 0.08 0.00 0.31 0.00 0.00 61.69 61.15 1mvg s THR 117 Cb -0.08 -1.62 -0.02 0.00 0.01 0.00 0.00 72.50 70.79 1mvg s THR 117 CO 0.01 0.53 -0.26 -0.76 -0.69 0.00 0.00 174.62 173.46 1mvg s LEU 118 N -0.06 2.09 0.05 4.42 1.02 -0.28 -4.74 118.68 121.18 1mvg s LEU 118 Ca -0.05 -0.51 0.05 0.00 0.02 0.00 0.00 54.13 53.64 1mvg s LEU 118 Cb -0.14 -1.30 -0.02 0.00 0.02 0.00 0.00 46.19 44.75 1mvg s LEU 118 CO 0.04 0.29 -0.14 0.27 0.02 0.00 0.00 176.35 176.83 1mvg s ILE 119 N -0.67 1.08 0.14 -0.59 -5.25 -0.66 -1.38 121.20 113.87 1mvg s ILE 119 Ca 0.10 -1.12 -0.24 0.00 -0.99 0.00 0.00 60.65 58.40 1mvg s ILE 119 Cb -0.10 -1.01 0.07 0.00 2.95 0.00 0.00 42.46 44.37 1mvg s ILE 119 CO 0.00 -0.10 0.68 0.00 -1.79 0.00 0.00 174.94 173.73 1mvg s ARG 120 N -1.39 1.23 0.01 0.37 1.70 -0.53 -1.05 118.95 119.29 1mvg s ARG 120 Ca -0.00 -0.49 0.00 0.00 -0.47 0.00 0.00 55.73 54.77 1mvg s ARG 120 Cb -0.09 0.54 -0.01 0.00 -0.57 0.00 0.00 34.95 34.83 1mvg s ARG 120 CO 0.02 -0.54 -0.01 1.03 -1.08 0.00 0.00 175.30 174.71 1mvg s ARG 121 N -3.62 0.12 0.33 3.89 3.00 -0.26 -1.03 118.95 121.38 1mvg s ARG 121 Ca 0.03 -0.22 0.10 0.00 0.00 0.00 0.00 55.73 55.64 1mvg s ARG 121 Cb -0.01 0.03 -0.06 0.00 0.00 0.00 0.00 34.95 34.91 1mvg s ARG 121 CO -0.10 -0.02 -0.10 -1.12 0.00 0.00 0.00 175.30 173.97 1mvg s SER 122 N -0.53 3.81 0.13 0.23 0.01 0.05 -1.50 113.70 115.90 1mvg s SER 122 Ca -0.06 -1.11 0.09 0.00 1.31 0.00 0.00 55.95 56.19 1mvg s SER 122 Cb -0.04 -0.39 -0.04 0.00 0.21 0.00 0.00 66.02 65.77 1mvg s SER 122 CO -0.00 -0.15 -0.22 -0.54 0.41 0.00 0.00 173.24 172.73 1mvg s LYS 123 N -3.61 1.25 0.44 12.44 1.02 -0.58 -1.03 119.74 129.67 1mvg s LYS 123 Ca 0.32 -1.28 -0.23 0.00 0.02 0.00 0.00 55.97 54.80 1mvg s LYS 123 Cb 0.00 -1.55 -0.08 0.00 -0.52 0.00 0.00 37.83 35.68 1mvg s LYS 123 CO 0.17 0.35 1.12 0.50 -0.92 0.00 0.00 175.35 176.57 1mvg s ARG 124 N -2.14 3.91 0.00 1.68 3.52 -1.25 -1.44 118.95 123.23 1mvg s ARG 124 Ca 0.11 1.67 0.00 0.00 -0.13 0.00 0.00 55.73 57.37 1mvg s ARG 124 Cb -0.09 -2.45 0.00 0.00 -1.56 0.00 0.00 34.95 30.85 1mvg s ARG 124 CO 0.06 -0.40 0.44 0.28 -0.81 0.00 0.00 175.30 174.87