#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mvg h PHE 2 N 0.00 0.00 -0.62 0.00 -1.00 -1.97 -3.45 116.94 109.91 1mvg h PHE 2 Ca 0.00 0.00 -0.76 0.00 2.81 0.00 0.00 57.97 60.02 1mvg h PHE 2 Cb 0.00 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.54 1mvg h PHE 2 CO 0.00 0.00 1.19 -1.13 -1.61 0.00 0.00 178.31 176.76 1mvg n SER 3 N -2.93 1.36 0.00 2.17 3.41 -1.26 -4.68 113.62 111.69 1mvg n SER 3 Ca 0.02 0.75 0.00 0.00 -0.26 0.00 0.00 58.87 59.38 1mvg n SER 3 Cb 0.35 -1.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.29 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 6.29 -2.08 3.32 5.00 0.00 -0.46 -4.96 105.19 112.30 1mvg n GLY 4 Ca 0.44 -1.22 -0.30 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.42 2.06 -0.04 2.61 2.01 -1.26 -0.91 115.64 117.68 1mvg s THR 5 Ca 0.00 -1.26 -0.03 0.00 0.31 0.00 0.00 61.69 60.71 1mvg s THR 5 Cb 0.00 -1.74 0.01 0.00 0.01 0.00 0.00 72.50 70.78 1mvg s THR 5 CO 0.00 0.43 0.09 0.26 -0.69 0.00 0.00 174.62 174.72 1mvg s TRP 6 N -0.72 -0.10 -0.26 4.92 0.52 -0.26 -0.82 118.94 122.21 1mvg s TRP 6 Ca 0.11 0.26 0.03 0.00 0.02 0.00 0.00 56.10 56.51 1mvg s TRP 6 Cb -0.10 0.02 0.06 0.00 -1.15 0.00 0.00 33.47 32.31 1mvg s TRP 6 CO 0.01 -0.05 -0.10 -1.14 0.02 0.00 0.00 176.95 175.69 1mvg s GLN 7 N 0.12 2.14 0.29 4.98 2.00 -0.21 -1.22 119.66 127.76 1mvg s GLN 7 Ca -0.01 -1.34 -0.29 0.00 -2.00 0.00 0.00 55.36 51.72 1mvg s GLN 7 Cb -0.01 -2.87 -0.13 0.00 0.80 0.00 0.00 33.01 30.79 1mvg s GLN 7 CO -0.00 -0.59 1.34 1.55 -0.50 0.00 0.00 175.29 177.09 1mvg n VAL 8 N 4.45 1.51 0.02 1.34 3.14 -1.26 -1.70 118.33 125.82 1mvg n VAL 8 Ca -0.13 -0.38 0.00 0.00 -2.96 0.00 0.00 64.34 60.87 1mvg n VAL 8 Cb 0.42 -1.52 0.00 0.00 -1.06 0.00 0.00 33.84 31.68 1mvg n VAL 8 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1mvg n TYR 9 N 1.08 -0.18 -4.01 1.45 4.11 -0.62 -4.80 117.16 114.19 1mvg n TYR 9 Ca 0.08 0.03 -0.32 0.00 -0.00 0.00 0.00 57.90 57.70 1mvg n TYR 9 Cb 0.34 0.13 -0.06 0.00 -0.00 0.00 0.00 39.34 39.75 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 -2.00 3.73 -0.13 -3.48 0.00 -1.08 -5.01 121.76 113.79 1mvg s ALA 10 Ca 0.00 -0.90 -0.29 0.00 0.00 0.00 0.00 51.96 50.77 1mvg s ALA 10 Cb 0.00 -1.63 0.09 0.00 0.00 0.00 0.00 23.12 21.57 1mvg s ALA 10 CO 0.00 0.75 0.78 1.14 0.00 0.00 0.00 175.76 178.43 1mvg s GLN 11 N -2.19 0.88 -0.07 0.00 0.00 -1.26 -1.10 119.66 115.92 1mvg s GLN 11 Ca 0.29 0.38 -0.10 0.00 -0.00 0.00 0.00 55.36 55.93 1mvg s GLN 11 Cb -0.12 0.42 0.02 0.00 0.00 0.00 0.00 33.01 33.33 1mvg s GLN 11 CO 0.21 -0.24 0.26 -2.00 0.00 0.00 0.00 175.29 173.52 1mvg s GLU 12 N -0.81 0.41 -1.83 9.60 2.12 -0.42 -4.84 118.70 122.93 1mvg s GLU 12 Ca -0.06 0.15 0.00 0.00 0.36 0.00 0.00 54.97 55.41 1mvg s GLU 12 Cb -0.01 0.19 0.00 0.00 0.26 0.00 0.00 34.13 34.57 1mvg s GLU 12 CO 0.06 -0.08 0.00 -1.71 -0.54 0.00 0.00 175.26 172.99 1mvg n ASN 13 N 2.38 -5.78 -0.06 -1.70 2.85 -1.26 -1.71 115.26 109.97 1mvg n ASN 13 Ca -0.16 0.08 -0.04 0.00 -0.11 0.00 0.00 54.58 54.35 1mvg n ASN 13 Cb 0.57 -4.84 -0.01 0.00 1.24 0.00 0.00 39.78 36.74 1mvg n ASN 13 CO 0.00 0.00 0.00 0.22 -2.11 0.00 0.00 177.26 175.37 1mvg h TYR 14 N 0.00 0.00 -0.84 1.20 3.20 -1.86 -3.16 116.97 115.52 1mvg h TYR 14 Ca -0.48 0.00 0.12 0.00 3.14 0.00 0.00 58.73 61.51 1mvg h TYR 14 Cb 1.36 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 39.57 1mvg h TYR 14 CO 0.55 0.00 0.55 1.05 -1.64 0.00 0.00 178.16 178.67 1mvg h GLU 15 N -0.85 0.70 -0.29 1.82 -0.00 -1.91 -2.10 114.58 111.95 1mvg h GLU 15 Ca 0.00 -0.04 -0.19 0.00 -0.00 0.00 0.00 59.36 59.13 1mvg h GLU 15 Cb 0.41 -0.16 0.00 0.00 -0.00 0.00 0.00 28.75 29.00 1mvg h GLU 15 CO 0.00 0.46 -0.55 1.49 -0.00 0.00 0.00 179.01 180.41 1mvg h GLU 16 N 0.72 0.87 0.14 1.06 4.57 -1.97 -0.91 114.58 119.07 1mvg h GLU 16 Ca 0.40 -0.55 0.01 0.00 -1.18 0.00 0.00 59.36 58.03 1mvg h GLU 16 Cb 0.56 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.20 1mvg h GLU 16 CO -0.17 1.19 -0.17 0.35 -1.18 0.00 0.00 179.01 179.04 1mvg h PHE 17 N 0.67 -0.43 -0.81 0.92 3.57 -1.40 -0.46 116.94 118.99 1mvg h PHE 17 Ca 0.01 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.60 1mvg h PHE 17 Cb 1.16 0.17 -0.07 0.00 2.79 0.00 0.00 35.95 40.00 1mvg h PHE 17 CO 0.07 -0.25 0.47 -0.07 -2.23 0.00 0.00 178.31 176.30 1mvg h LEU 18 N -0.35 0.70 -0.63 0.59 3.38 -1.26 0.44 115.31 118.18 1mvg h LEU 18 Ca 0.01 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1mvg h LEU 18 Cb 0.34 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1mvg h LEU 18 CO -0.06 0.42 0.39 0.50 0.09 0.00 0.00 178.44 179.78 1mvg h LYS 19 N 0.82 0.86 0.00 1.13 3.11 -0.92 -2.18 116.57 119.39 1mvg h LYS 19 Ca 0.38 -0.08 0.00 0.00 -2.81 0.00 0.00 60.65 58.14 1mvg h LYS 19 Cb 0.29 -0.18 0.00 0.00 -1.00 0.00 0.00 32.23 31.34 1mvg h LYS 19 CO -0.22 0.61 0.00 0.00 -2.81 0.00 0.00 179.45 177.03 1mvg h ALA 20 N 1.20 1.00 -0.09 5.00 0.00 0.02 -3.40 119.26 122.99 1mvg h ALA 20 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1mvg h ALA 20 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1mvg h ALA 20 CO -0.04 0.00 0.00 -0.11 0.00 0.00 0.00 179.25 179.10 1mvg n LEU 21 N -2.65 0.04 0.09 0.00 7.94 0.04 -5.00 117.00 117.47 1mvg n LEU 21 Ca 0.02 0.75 0.00 0.00 -1.11 0.00 0.00 56.01 55.67 1mvg n LEU 21 Cb 0.31 -0.49 0.00 0.00 0.53 0.00 0.00 43.42 43.78 1mvg n LEU 21 CO 0.25 -0.49 0.00 0.00 -1.11 0.00 0.00 177.39 176.05 1mvg n ALA 22 N -1.96 0.00 -1.27 1.96 0.00 -1.25 -5.11 120.51 112.88 1mvg n ALA 22 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 1mvg n ALA 22 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.56 1mvg n ALA 22 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1mvg n LEU 23 N -3.03 4.65 -4.84 0.00 -0.00 -1.26 -4.99 117.00 107.54 1mvg n LEU 23 Ca 0.00 0.65 -0.30 0.00 -0.00 0.00 0.00 56.01 56.36 1mvg n LEU 23 Cb 0.00 -1.51 0.08 0.00 -0.00 0.00 0.00 43.42 41.99 1mvg n LEU 23 CO 0.00 -1.59 0.73 -2.16 -0.00 0.00 0.00 177.39 174.37 1mvg s PRO 24 N -3.86 2.29 0.61 1.47 0.04 -1.26 -4.76 135.00 129.52 1mvg s PRO 24 Ca 0.75 0.53 0.33 0.00 0.04 0.00 0.00 61.00 62.66 1mvg s PRO 24 Cb -0.32 -1.95 1.94 0.00 0.04 0.00 0.00 34.50 34.22 1mvg s PRO 24 CO 0.48 -1.45 2.25 0.93 0.04 0.00 0.00 177.00 179.25 1mvg h GLU 25 N -0.96 0.00 -0.71 4.56 5.08 -1.94 -0.47 114.58 120.14 1mvg h GLU 25 Ca -0.46 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.89 1mvg h GLU 25 Cb 1.27 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.49 1mvg h GLU 25 CO 0.61 0.00 0.41 0.22 -1.00 0.00 0.00 179.01 179.25 1mvg h ASP 26 N 0.00 0.86 0.81 1.42 1.82 -1.99 -0.17 116.42 119.18 1mvg h ASP 26 Ca 0.02 -0.06 -0.23 0.00 -0.39 0.00 0.00 57.03 56.36 1mvg h ASP 26 Cb 0.11 -0.22 -0.04 0.00 0.68 0.00 0.00 39.33 39.87 1mvg h ASP 26 CO -0.00 0.68 -1.27 -0.07 -1.61 0.00 0.00 179.24 176.97 1mvg h LEU 27 N 0.99 0.00 -0.75 2.28 3.38 -1.45 -2.73 115.31 117.03 1mvg h LEU 27 Ca 0.25 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.11 1mvg h LEU 27 Cb -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1mvg h LEU 27 CO -0.04 0.96 -0.26 0.16 0.09 0.00 0.00 178.44 179.34 1mvg h ILE 28 N 0.00 1.27 -0.89 1.22 -0.00 -1.34 -1.42 117.51 116.34 1mvg h ILE 28 Ca -0.12 -1.36 0.08 0.00 -0.00 0.00 0.00 64.86 63.45 1mvg h ILE 28 Cb 1.84 1.31 -0.07 0.00 -0.00 0.00 0.00 36.82 39.90 1mvg h ILE 28 CO 0.10 0.44 0.55 0.50 -0.00 0.00 0.00 178.15 179.75 1mvg h LYS 29 N 0.58 0.94 -0.41 0.16 3.64 -1.09 0.14 116.57 120.52 1mvg h LYS 29 Ca 0.08 -0.06 -0.14 0.00 -1.27 0.00 0.00 60.65 59.26 1mvg h LYS 29 Cb 0.75 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1mvg h LYS 29 CO 0.06 0.62 -0.28 1.98 -2.27 0.00 0.00 179.45 179.56 1mvg h MET 30 N 0.97 0.89 0.00 1.90 4.05 -1.03 -2.87 114.93 118.84 1mvg h MET 30 Ca 0.41 -0.40 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1mvg h MET 30 Cb 0.26 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.04 1mvg h MET 30 CO -0.20 1.05 -0.04 0.00 0.23 0.00 0.00 176.91 177.95 1mvg h ALA 31 N 0.92 0.98 -0.86 0.39 0.00 -1.09 -3.43 119.26 116.16 1mvg h ALA 31 Ca 0.09 0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.07 1mvg h ALA 31 Cb 0.84 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.53 1mvg h ALA 31 CO 0.07 0.00 -0.51 -2.13 0.00 0.00 0.00 179.25 176.69 1mvg n ARG 32 N -2.77 -0.38 -1.24 0.00 3.00 0.46 -2.03 116.66 113.71 1mvg n ARG 32 Ca 0.04 1.37 -0.08 0.00 -0.00 0.00 0.00 57.85 59.19 1mvg n ARG 32 Cb 0.49 -2.02 0.13 0.00 0.00 0.00 0.00 32.46 31.06 1mvg n ARG 32 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1mvg n ASP 33 N -4.99 3.24 -4.28 6.15 9.92 -1.26 -4.93 116.55 120.40 1mvg n ASP 33 Ca 0.02 -3.83 -0.33 0.00 -0.53 0.00 0.00 54.79 50.11 1mvg n ASP 33 Cb 0.22 -0.46 -0.15 0.00 -0.64 0.00 0.00 41.12 40.09 1mvg n ASP 33 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1mvg s ILE 34 N -3.86 2.65 -0.55 0.53 1.09 -0.86 -5.09 121.20 115.11 1mvg s ILE 34 Ca 0.44 -0.79 -0.12 0.00 -1.10 0.00 0.00 60.65 59.09 1mvg s ILE 34 Cb 0.39 -2.10 0.14 0.00 -1.06 0.00 0.00 42.46 39.83 1mvg s ILE 34 CO -0.02 0.52 0.45 -0.54 -0.10 0.00 0.00 174.94 175.26 1mvg s LYS 35 N 0.67 2.79 -0.02 2.79 1.02 -1.26 -4.97 119.74 120.75 1mvg s LYS 35 Ca -0.08 -1.88 -0.30 0.00 0.02 0.00 0.00 55.97 53.73 1mvg s LYS 35 Cb -0.16 -4.10 -0.05 0.00 -0.52 0.00 0.00 37.83 33.00 1mvg s LYS 35 CO 0.02 -1.25 1.39 -1.25 -0.92 0.00 0.00 175.35 173.34 1mvg s PRO 36 N 1.21 4.28 0.29 -1.68 0.04 -1.26 -4.85 135.00 133.03 1mvg s PRO 36 Ca 0.07 1.93 -0.28 0.00 0.04 0.00 0.00 61.00 62.75 1mvg s PRO 36 Cb -0.25 -3.62 -0.09 0.00 0.04 0.00 0.00 34.50 30.57 1mvg s PRO 36 CO -0.01 -0.59 1.01 -1.50 0.04 0.00 0.00 177.00 175.95 1mvg s ILE 37 N 2.60 3.84 0.05 0.56 -1.16 -0.75 -4.41 121.20 121.93 1mvg s ILE 37 Ca 0.63 1.73 0.08 0.00 -0.51 0.00 0.00 60.65 62.58 1mvg s ILE 37 Cb -0.30 -4.05 -0.03 0.00 0.61 0.00 0.00 42.46 38.69 1mvg s ILE 37 CO 0.25 0.32 -0.22 -0.69 -2.81 0.00 0.00 174.94 171.79 1mvg s VAL 38 N -1.32 1.75 -0.03 4.00 1.01 -0.35 -1.20 120.40 124.25 1mvg s VAL 38 Ca 0.46 -1.24 0.01 0.00 0.00 0.00 0.00 61.98 61.21 1mvg s VAL 38 Cb -0.26 -1.51 0.02 0.00 0.00 0.00 0.00 36.38 34.62 1mvg s VAL 38 CO 0.33 0.22 -0.03 -0.70 0.00 0.00 0.00 175.10 174.92 1mvg s GLU 39 N -1.21 0.57 -0.02 2.72 2.12 -0.19 -1.11 118.70 121.58 1mvg s GLU 39 Ca 0.08 -0.07 0.02 0.00 0.36 0.00 0.00 54.97 55.36 1mvg s GLU 39 Cb -0.09 -0.62 -0.03 0.00 0.26 0.00 0.00 34.13 33.65 1mvg s GLU 39 CO 0.02 -0.04 -0.06 0.42 -0.54 0.00 0.00 175.26 175.05 1mvg s ILE 40 N 0.66 3.69 -0.03 -3.70 -1.09 -0.09 -1.23 121.20 119.42 1mvg s ILE 40 Ca -0.08 -0.65 -0.06 0.00 -2.23 0.00 0.00 60.65 57.64 1mvg s ILE 40 Cb -0.11 -2.57 0.01 0.00 -1.58 0.00 0.00 42.46 38.21 1mvg s ILE 40 CO -0.00 0.47 0.13 -1.10 -1.23 0.00 0.00 174.94 173.21 1mvg s GLN 41 N -1.18 0.30 0.09 2.79 -0.21 -0.52 -1.35 119.66 119.57 1mvg s GLN 41 Ca 0.15 -0.10 -0.24 0.00 0.02 0.00 0.00 55.36 55.20 1mvg s GLN 41 Cb -0.11 0.13 0.08 0.00 1.00 0.00 0.00 33.01 34.11 1mvg s GLN 41 CO 0.05 -0.06 1.13 0.00 -2.12 0.00 0.00 175.29 174.29 1mvg n GLN 42 N 2.29 0.42 -2.70 2.91 0.00 -1.26 -1.69 117.38 117.35 1mvg n GLN 42 Ca -0.17 -1.13 -0.01 0.00 0.00 0.00 0.00 57.00 55.68 1mvg n GLN 42 Cb 0.57 1.64 0.10 0.00 0.00 0.00 0.00 30.24 32.55 1mvg n GLN 42 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.06 177.42 1mvg n LYS 43 N -0.80 1.47 0.00 2.61 2.85 -1.26 -4.75 118.16 118.28 1mvg n LYS 43 Ca 0.01 -2.04 0.00 0.00 -1.05 0.00 0.00 58.31 55.23 1mvg n LYS 43 Cb 0.57 -0.30 0.00 0.00 -0.65 0.00 0.00 35.03 34.65 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 -1.18 -0.46 0.23 2.58 0.00 -1.26 -4.96 105.19 100.13 1mvg n GLY 44 Ca -0.09 -0.29 0.03 0.00 0.00 0.00 0.00 46.02 45.67 1mvg n GLY 44 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1mvg h ASP 45 N 0.00 0.13 -4.25 1.61 2.03 -1.99 -3.44 116.42 110.51 1mvg h ASP 45 Ca 0.00 -0.03 -0.50 0.00 -0.73 0.00 0.00 57.03 55.77 1mvg h ASP 45 Cb 0.00 -0.03 0.09 0.00 -0.83 0.00 0.00 39.33 38.55 1mvg h ASP 45 CO 0.00 0.33 0.37 -0.62 -1.03 0.00 0.00 179.24 178.29 1mvg s ASP 46 N -6.92 5.39 -0.23 4.15 -1.08 -1.26 -1.39 116.67 115.33 1mvg s ASP 46 Ca -0.05 1.79 -0.03 0.00 -0.52 0.00 0.00 52.55 53.74 1mvg s ASP 46 Cb 0.15 -2.52 0.12 0.00 -1.46 0.00 0.00 42.92 39.21 1mvg s ASP 46 CO 0.72 -1.43 0.31 -0.36 0.52 0.00 0.00 175.17 174.93 1mvg s PHE 47 N -2.67 -0.59 -0.05 -5.34 0.08 0.09 -4.56 117.98 104.94 1mvg s PHE 47 Ca 0.62 0.58 0.01 0.00 0.12 0.00 0.00 56.93 58.25 1mvg s PHE 47 Cb -0.16 -0.14 -0.03 0.00 -0.57 0.00 0.00 43.02 42.11 1mvg s PHE 47 CO 0.45 -0.67 -0.04 0.54 -0.10 0.00 0.00 175.22 175.40 1mvg s VAL 48 N 2.45 3.89 -0.03 -0.44 0.11 -0.68 -1.41 120.40 124.29 1mvg s VAL 48 Ca 0.10 -0.50 0.02 0.00 -2.93 0.00 0.00 61.98 58.67 1mvg s VAL 48 Cb -0.16 -2.64 0.01 0.00 -1.53 0.00 0.00 36.38 32.07 1mvg s VAL 48 CO -0.14 0.53 -0.07 -0.69 -3.33 0.00 0.00 175.10 171.40 1mvg s VAL 49 N -0.90 0.66 0.02 2.04 1.01 -0.41 -1.44 120.40 121.38 1mvg s VAL 49 Ca 0.14 -0.25 0.06 0.00 0.00 0.00 0.00 61.98 61.94 1mvg s VAL 49 Cb -0.11 -0.62 -0.02 0.00 0.00 0.00 0.00 36.38 35.63 1mvg s VAL 49 CO 0.04 0.23 -0.18 -0.89 0.00 0.00 0.00 175.10 174.30 1mvg s THR 50 N 0.50 1.47 0.01 3.92 2.01 -0.37 -0.93 115.64 122.25 1mvg s THR 50 Ca -0.07 -1.00 0.06 0.00 0.31 0.00 0.00 61.69 60.99 1mvg s THR 50 Cb -0.11 -1.26 -0.02 0.00 0.01 0.00 0.00 72.50 71.12 1mvg s THR 50 CO 0.01 0.24 -0.20 -0.94 -0.69 0.00 0.00 174.62 173.03 1mvg s SER 51 N -0.90 2.36 -0.02 3.53 1.04 -0.55 -1.02 113.70 118.14 1mvg s SER 51 Ca 0.06 -0.41 0.02 0.00 0.48 0.00 0.00 55.95 56.10 1mvg s SER 51 Cb -0.08 -0.24 0.00 0.00 0.10 0.00 0.00 66.02 65.80 1mvg s SER 51 CO 0.01 0.21 -0.08 -0.75 0.98 0.00 0.00 173.24 173.61 1mvg s LYS 52 N -0.72 0.76 -0.05 4.02 2.47 -0.34 -2.70 119.74 123.19 1mvg s LYS 52 Ca 0.07 -0.26 -0.20 0.00 -1.56 0.00 0.00 55.97 54.02 1mvg s LYS 52 Cb -0.08 -0.73 0.04 0.00 -1.46 0.00 0.00 37.83 35.60 1mvg s LYS 52 CO 0.00 0.12 0.44 0.99 0.16 0.00 0.00 175.35 177.06 1mvg s THR 53 N 0.09 0.03 0.00 3.43 2.01 -0.04 -1.81 115.64 119.35 1mvg s THR 53 Ca -0.01 -0.26 0.00 0.00 0.31 0.00 0.00 61.69 61.73 1mvg s THR 53 Cb -0.06 -0.73 0.00 0.00 0.01 0.00 0.00 72.50 71.71 1mvg s THR 53 CO 0.00 -0.14 1.08 -0.81 -0.69 0.00 0.00 174.62 174.05 1mvg n PRO 54 N 1.41 0.86 -0.15 4.92 -0.04 -1.26 -2.73 135.00 138.02 1mvg n PRO 54 Ca -0.20 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.26 1mvg n PRO 54 Cb 0.56 -1.07 -0.00 0.00 -0.04 0.00 0.00 33.50 32.95 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 0.82 0.00 -3.64 0.54 1.85 -1.26 -5.15 116.66 109.82 1mvg n ARG 55 Ca 0.00 -0.01 -0.03 0.00 -1.00 0.00 0.00 57.85 56.81 1mvg n ARG 55 Cb 0.43 0.01 -0.05 0.00 -1.05 0.00 0.00 32.46 31.80 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 0.00 0.10 -0.15 2.89 -0.21 -1.10 -5.06 119.66 116.13 1mvg s GLN 56 Ca 0.00 0.05 -0.30 0.00 0.02 0.00 0.00 55.36 55.13 1mvg s GLN 56 Cb 0.00 0.05 0.13 0.00 1.00 0.00 0.00 33.01 34.19 1mvg s GLN 56 CO 0.00 -0.03 1.03 -0.08 -2.12 0.00 0.00 175.29 174.10 1mvg s THR 57 N -0.71 0.00 0.16 -0.19 -1.32 -1.26 -0.86 115.64 111.46 1mvg s THR 57 Ca 0.08 0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.32 1mvg s THR 57 Cb -0.02 -1.00 0.06 0.00 -1.51 0.00 0.00 72.50 70.03 1mvg s THR 57 CO -0.09 0.00 0.75 0.54 -2.21 0.00 0.00 174.62 173.60 1mvg s VAL 58 N -1.55 0.00 0.02 5.08 0.11 -1.10 -4.75 120.40 118.21 1mvg s VAL 58 Ca 0.01 -0.38 0.02 0.00 -2.93 0.00 0.00 61.98 58.70 1mvg s VAL 58 Cb -0.01 -1.43 -0.02 0.00 -1.53 0.00 0.00 36.38 33.39 1mvg s VAL 58 CO -0.02 0.00 -0.06 -0.89 -3.33 0.00 0.00 175.10 170.81 1mvg s THR 59 N -3.60 0.41 0.04 5.04 2.01 -1.26 -1.49 115.64 116.79 1mvg s THR 59 Ca 0.06 -0.71 -0.03 0.00 0.31 0.00 0.00 61.69 61.33 1mvg s THR 59 Cb -0.02 -0.44 -0.02 0.00 0.01 0.00 0.00 72.50 72.02 1mvg s THR 59 CO -0.04 -0.21 0.02 0.54 -0.69 0.00 0.00 174.62 174.24 1mvg s ASN 60 N -0.99 0.31 -0.05 3.53 2.20 -0.10 -4.63 114.94 115.21 1mvg s ASN 60 Ca -0.06 -0.71 -0.01 0.00 -0.94 0.00 0.00 52.86 51.14 1mvg s ASN 60 Cb -0.07 0.19 0.03 0.00 -2.00 0.00 0.00 41.25 39.40 1mvg s ASN 60 CO 0.00 -0.51 0.04 -0.94 -2.94 0.00 0.00 177.10 172.75 1mvg s SER 61 N -2.31 1.08 0.29 3.54 1.04 -1.21 -1.29 113.70 114.85 1mvg s SER 61 Ca -0.02 0.02 -0.01 0.00 0.48 0.00 0.00 55.95 56.42 1mvg s SER 61 Cb 0.01 -0.22 -0.02 0.00 0.10 0.00 0.00 66.02 65.89 1mvg s SER 61 CO -0.06 -0.21 0.34 0.72 0.98 0.00 0.00 173.24 175.01 1mvg s PHE 62 N 1.90 1.15 -0.05 5.02 -0.12 -0.50 -2.97 117.98 122.41 1mvg s PHE 62 Ca 0.02 -1.32 -0.20 0.00 -0.05 0.00 0.00 56.93 55.38 1mvg s PHE 62 Cb -0.12 -0.32 0.04 0.00 -0.63 0.00 0.00 43.02 41.98 1mvg s PHE 62 CO -0.03 -0.92 0.44 0.99 -0.05 0.00 0.00 175.22 175.65 1mvg s THR 63 N -3.59 0.03 -0.01 -4.49 2.01 -1.24 -0.73 115.64 107.63 1mvg s THR 63 Ca 0.34 -0.26 -0.30 0.00 0.31 0.00 0.00 61.69 61.78 1mvg s THR 63 Cb 0.02 -0.73 -0.06 0.00 0.01 0.00 0.00 72.50 71.74 1mvg s THR 63 CO 0.18 -0.14 1.51 -0.76 -0.69 0.00 0.00 174.62 174.72 1mvg s LEU 64 N -1.05 4.32 -1.03 4.42 1.43 -0.49 -3.31 118.68 122.97 1mvg s LEU 64 Ca -0.11 2.20 -0.05 0.00 -1.03 0.00 0.00 54.13 55.15 1mvg s LEU 64 Cb -0.03 -3.55 0.01 0.00 0.03 0.00 0.00 46.19 42.64 1mvg s LEU 64 CO 0.05 -0.81 0.62 0.61 0.23 0.00 0.00 176.35 177.05 1mvg n GLY 65 N 3.85 -0.14 3.83 -3.19 0.00 -0.17 -5.00 105.19 104.38 1mvg n GLY 65 Ca 0.15 -0.08 -0.08 0.00 0.00 0.00 0.00 46.02 46.01 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 -5.62 2.03 0.30 1.61 2.20 -1.21 -5.07 119.74 113.98 1mvg s LYS 66 Ca 0.31 -1.24 -0.28 0.00 -0.36 0.00 0.00 55.97 54.40 1mvg s LYS 66 Cb -0.14 0.61 -0.14 0.00 -1.51 0.00 0.00 37.83 36.66 1mvg s LYS 66 CO 0.38 -0.94 1.04 -0.85 -0.36 0.00 0.00 175.35 174.62 1mvg n GLU 67 N -0.51 1.45 -3.62 4.03 0.28 -1.26 -3.79 120.64 117.22 1mvg n GLU 67 Ca -0.07 0.51 -0.29 0.00 -0.16 0.00 0.00 57.16 57.15 1mvg n GLU 67 Cb 0.60 -1.91 -0.13 0.00 1.43 0.00 0.00 31.44 31.43 1mvg n GLU 67 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1mvg s ALA 68 N -1.07 1.63 0.10 -1.84 0.00 -0.05 -3.63 121.76 116.91 1mvg s ALA 68 Ca 0.58 -2.22 -0.31 0.00 0.00 0.00 0.00 51.96 50.01 1mvg s ALA 68 Cb -0.68 -1.76 -0.07 0.00 0.00 0.00 0.00 23.12 20.61 1mvg s ALA 68 CO 0.60 -2.04 1.28 0.34 0.00 0.00 0.00 175.76 175.95 1mvg s ASP 69 N 0.76 6.96 -0.00 0.00 2.15 -1.16 -1.08 116.67 124.31 1mvg s ASP 69 Ca 0.17 2.18 0.04 0.00 0.43 0.00 0.00 52.55 55.37 1mvg s ASP 69 Cb -0.23 -2.59 -0.01 0.00 -0.30 0.00 0.00 42.92 39.79 1mvg s ASP 69 CO -0.02 -0.54 -0.13 -0.63 -0.17 0.00 0.00 175.17 173.67 1mvg s ILE 70 N 0.94 1.06 0.02 4.11 1.01 -1.24 -3.28 121.20 123.82 1mvg s ILE 70 Ca 0.61 -0.64 0.00 0.00 0.00 0.00 0.00 60.65 60.62 1mvg s ILE 70 Cb -0.33 -0.89 0.00 0.00 0.01 0.00 0.00 42.46 41.24 1mvg s ILE 70 CO 0.31 0.25 0.00 1.07 0.00 0.00 0.00 174.94 176.56 1mvg n THR 71 N 2.61 0.00 0.00 2.92 5.66 -1.26 -0.41 114.28 123.80 1mvg n THR 71 Ca -0.15 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.85 1mvg n THR 71 Cb 0.55 -0.03 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 1mvg n THR 71 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 1mvg n THR 72 N -0.99 0.00 -2.14 1.09 5.66 -1.26 -4.24 114.28 112.40 1mvg n THR 72 Ca 0.00 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.59 1mvg n THR 72 Cb 0.04 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 68.82 1mvg n THR 72 CO 0.00 0.00 0.00 0.80 -3.05 0.00 0.00 175.07 172.82 1mvg n MET 73 N 0.00 4.50 0.02 1.09 0.00 -1.26 -3.98 117.12 117.49 1mvg n MET 73 Ca 0.00 -3.61 0.00 0.00 -0.00 0.00 0.00 57.70 54.09 1mvg n MET 73 Cb 0.00 -2.66 0.00 0.00 0.00 0.00 0.00 33.22 30.56 1mvg n MET 73 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1mvg n ASP 74 N 1.93 -0.30 0.00 6.12 8.00 -1.26 -4.74 116.55 126.30 1mvg n ASP 74 Ca 0.56 0.11 0.00 0.00 0.71 0.00 0.00 54.79 56.17 1mvg n ASP 74 Cb 0.27 0.50 0.00 0.00 -0.02 0.00 0.00 41.12 41.87 1mvg n ASP 74 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1mvg n GLY 75 N -1.46 0.73 3.54 0.44 0.00 -1.26 -5.07 105.19 102.11 1mvg n GLY 75 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.50 0.49 0.28 1.61 2.47 -1.26 -4.91 119.74 118.92 1mvg s LYS 76 Ca 0.00 1.20 -0.29 0.00 -1.56 0.00 0.00 55.97 55.32 1mvg s LYS 76 Cb 0.00 0.72 -0.14 0.00 -1.46 0.00 0.00 37.83 36.95 1mvg s LYS 76 CO 0.00 -0.20 1.10 1.17 0.16 0.00 0.00 175.35 177.59 1mvg n LYS 77 N 5.31 1.51 -4.75 4.03 4.81 -1.26 -4.54 118.16 123.27 1mvg n LYS 77 Ca -0.10 0.53 -0.33 0.00 -0.87 0.00 0.00 58.31 57.53 1mvg n LYS 77 Cb 0.50 -1.97 -0.07 0.00 0.02 0.00 0.00 35.03 33.51 1mvg n LYS 77 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1mvg n LEU 78 N 1.32 0.00 -3.66 3.14 4.77 0.46 -4.92 117.00 118.10 1mvg n LEU 78 Ca 0.10 -3.28 -0.07 0.00 -0.03 0.00 0.00 56.01 52.72 1mvg n LEU 78 Cb 0.32 0.39 -0.09 0.00 -2.33 0.00 0.00 43.42 41.71 1mvg n LEU 78 CO 0.61 -0.47 0.07 -1.59 -1.33 0.00 0.00 177.39 174.68 1mvg s LYS 79 N -3.88 0.37 0.08 3.23 -2.85 -1.26 -3.62 119.74 111.81 1mvg s LYS 79 Ca 0.01 1.09 0.01 0.00 -1.00 0.00 0.00 55.97 56.08 1mvg s LYS 79 Cb 0.00 0.40 -0.01 0.00 -2.06 0.00 0.00 37.83 36.16 1mvg s LYS 79 CO 0.00 -0.24 0.05 0.00 0.10 0.00 0.00 175.35 175.27 1mvg s THR 81 N -2.12 0.77 0.21 0.00 2.01 -1.26 -0.87 115.64 114.37 1mvg s THR 81 Ca 0.07 -2.49 -0.31 0.00 0.31 0.00 0.00 61.69 59.27 1mvg s THR 81 Cb 0.00 -1.54 -0.10 0.00 0.01 0.00 0.00 72.50 70.87 1mvg s THR 81 CO 0.05 -1.06 1.54 -0.69 -0.69 0.00 0.00 174.62 173.77 1mvg s VAL 82 N 0.29 2.53 0.02 3.82 1.01 -1.25 -4.65 120.40 122.17 1mvg s VAL 82 Ca 0.24 0.41 -0.07 0.00 0.00 0.00 0.00 61.98 62.56 1mvg s VAL 82 Cb -0.12 -3.26 -0.00 0.00 0.00 0.00 0.00 36.38 33.00 1mvg s VAL 82 CO -0.09 0.05 0.12 -1.38 0.00 0.00 0.00 175.10 173.80 1mvg s HIS 83 N 0.66 0.10 -0.01 5.22 -3.43 -1.02 -1.00 115.29 115.81 1mvg s HIS 83 Ca 0.66 -0.28 -0.16 0.00 -0.80 0.00 0.00 55.06 54.48 1mvg s HIS 83 Cb -0.44 -0.08 -0.06 0.00 -1.43 0.00 0.00 32.58 30.57 1mvg s HIS 83 CO 0.37 -0.32 0.45 -1.17 -2.00 0.00 0.00 174.74 172.07 1mvg s LEU 84 N -1.69 4.44 -0.53 5.38 2.96 -1.26 -1.05 118.68 126.94 1mvg s LEU 84 Ca -0.11 0.99 0.06 0.00 -0.22 0.00 0.00 54.13 54.85 1mvg s LEU 84 Cb -0.05 -2.67 0.23 0.00 0.50 0.00 0.00 46.19 44.21 1mvg s LEU 84 CO -0.01 0.25 0.59 0.00 -1.32 0.00 0.00 176.35 175.86 1mvg n ALA 85 N 2.19 3.25 -2.55 5.97 0.00 -0.06 -4.94 120.51 124.38 1mvg n ALA 85 Ca -0.12 -4.06 -0.03 0.00 0.00 0.00 0.00 53.44 49.24 1mvg n ALA 85 Cb 0.52 -0.86 0.00 0.00 0.00 0.00 0.00 19.45 19.11 1mvg n ALA 85 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1mvg n ASN 86 N 1.38 -6.29 -2.28 0.00 5.15 -1.26 -4.17 115.26 107.79 1mvg n ASN 86 Ca 0.25 0.19 -0.18 0.00 -0.60 0.00 0.00 54.58 54.24 1mvg n ASN 86 Cb 0.46 -4.17 0.01 0.00 -0.53 0.00 0.00 39.78 35.54 1mvg n ASN 86 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1mvg n GLY 87 N -0.91 -0.34 3.55 8.20 0.00 -1.26 -5.00 105.19 109.44 1mvg n GLY 87 Ca 0.05 -0.08 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 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 -5.20 0.75 0.37 1.61 -2.85 -1.26 -3.90 119.74 109.26 1mvg s LYS 88 Ca 0.13 0.89 -0.24 0.00 -1.00 0.00 0.00 55.97 55.75 1mvg s LYS 88 Cb -0.06 0.36 -0.10 0.00 -2.06 0.00 0.00 37.83 35.98 1mvg s LYS 88 CO 0.16 -0.09 0.98 -0.51 0.10 0.00 0.00 175.35 175.99 1mvg s LEU 89 N 0.35 4.19 -0.05 2.77 1.02 0.08 -0.88 118.68 126.17 1mvg s LEU 89 Ca -0.00 1.87 -0.04 0.00 0.02 0.00 0.00 54.13 55.98 1mvg s LEU 89 Cb -0.04 -4.19 0.02 0.00 0.02 0.00 0.00 46.19 41.99 1mvg s LEU 89 CO 0.01 -0.27 0.12 -0.69 0.02 0.00 0.00 176.35 175.54 1mvg s VAL 90 N -1.75 -0.01 0.22 -1.59 1.01 -0.22 -2.44 120.40 115.61 1mvg s VAL 90 Ca 0.55 0.03 -0.06 0.00 0.00 0.00 0.00 61.98 62.50 1mvg s VAL 90 Cb -0.18 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.00 1mvg s VAL 90 CO 0.23 0.01 0.27 0.42 0.00 0.00 0.00 175.10 176.03 1mvg s THR 91 N 0.23 0.00 -0.05 3.92 -4.23 -0.92 -2.43 115.64 112.17 1mvg s THR 91 Ca -0.01 -1.75 -0.06 0.00 -1.18 0.00 0.00 61.69 58.69 1mvg s THR 91 Cb -0.02 -2.35 0.01 0.00 1.34 0.00 0.00 72.50 71.48 1mvg s THR 91 CO -0.01 -0.02 0.16 -0.54 -0.54 0.00 0.00 174.62 173.67 1mvg s LYS 92 N -4.10 0.25 0.00 3.99 1.02 -1.26 -4.15 119.74 115.49 1mvg s LYS 92 Ca 0.32 0.11 0.00 0.00 0.02 0.00 0.00 55.97 56.41 1mvg s LYS 92 Cb 0.04 0.11 0.00 0.00 -0.52 0.00 0.00 37.83 37.46 1mvg s LYS 92 CO 0.10 -0.04 0.00 0.45 -0.92 0.00 0.00 175.35 174.94 1mvg n SER 93 N 2.70 1.80 0.02 2.83 2.88 0.53 -4.71 113.62 119.67 1mvg n SER 93 Ca -0.14 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.27 1mvg n SER 93 Cb 0.58 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.96 1mvg n SER 93 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1mvg h GLU 94 N 0.00 -0.02 0.00 -1.46 4.81 -2.02 -3.40 114.58 112.49 1mvg h GLU 94 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1mvg h GLU 94 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1mvg h GLU 94 CO 0.00 0.20 -0.62 1.63 -0.73 0.00 0.00 179.01 179.49 1mvg n LYS 95 N -5.00 2.40 -3.40 1.92 4.01 -1.26 -5.01 118.16 111.82 1mvg n LYS 95 Ca -0.08 0.00 -0.36 0.00 -0.51 0.00 0.00 58.31 57.37 1mvg n LYS 95 Cb 0.13 -0.81 -0.06 0.00 -0.51 0.00 0.00 35.03 33.79 1mvg n LYS 95 CO 0.00 0.00 0.00 0.12 -1.11 0.00 0.00 177.40 176.41 1mvg s PHE 96 N -1.46 3.63 -0.15 2.13 2.19 -1.26 -1.28 117.98 121.78 1mvg s PHE 96 Ca 0.00 1.03 -0.07 0.00 0.33 0.00 0.00 56.93 58.22 1mvg s PHE 96 Cb 0.00 -2.34 0.06 0.00 -1.31 0.00 0.00 43.02 39.43 1mvg s PHE 96 CO 0.00 0.48 0.34 -1.12 1.83 0.00 0.00 175.22 176.74 1mvg s SER 97 N -1.61 -0.18 -0.32 6.13 0.01 -1.22 -0.35 113.70 116.15 1mvg s SER 97 Ca 0.35 0.75 -0.07 0.00 1.31 0.00 0.00 55.95 58.29 1mvg s SER 97 Cb -0.15 0.79 0.03 0.00 0.21 0.00 0.00 66.02 66.89 1mvg s SER 97 CO 0.18 -0.21 0.09 -2.28 0.41 0.00 0.00 173.24 171.44 1mvg s HIS 98 N 1.88 3.21 -0.03 2.43 5.04 -1.26 -1.08 115.29 125.47 1mvg s HIS 98 Ca -0.05 -1.23 0.00 0.00 -1.54 0.00 0.00 55.06 52.24 1mvg s HIS 98 Cb -0.11 -2.27 0.03 0.00 0.04 0.00 0.00 32.58 30.27 1mvg s HIS 98 CO -0.11 -0.66 -0.00 -2.00 -2.34 0.00 0.00 174.74 169.62 1mvg s GLU 99 N 1.45 0.38 -0.09 2.88 2.12 -1.14 -2.16 118.70 122.14 1mvg s GLU 99 Ca 0.00 0.06 -0.30 0.00 0.36 0.00 0.00 54.97 55.09 1mvg s GLU 99 Cb -0.18 -0.56 0.08 0.00 0.26 0.00 0.00 34.13 33.73 1mvg s GLU 99 CO 0.03 -0.14 0.76 1.14 -0.54 0.00 0.00 175.26 176.50 1mvg s GLN 100 N 1.10 0.93 0.09 4.30 -2.07 -1.02 -1.57 119.66 121.42 1mvg s GLN 100 Ca -0.09 0.27 0.02 0.00 -1.82 0.00 0.00 55.36 53.75 1mvg s GLN 100 Cb -0.14 0.44 -0.04 0.00 -1.09 0.00 0.00 33.01 32.19 1mvg s GLN 100 CO -0.02 -0.28 -0.08 -1.83 -1.32 0.00 0.00 175.29 171.76 1mvg s GLU 101 N -1.07 0.81 -0.01 9.60 -1.05 -0.62 -0.74 118.70 125.63 1mvg s GLU 101 Ca -0.08 -1.22 0.06 0.00 -0.15 0.00 0.00 54.97 53.58 1mvg s GLU 101 Cb -0.00 -0.33 -0.02 0.00 -0.44 0.00 0.00 34.13 33.34 1mvg s GLU 101 CO 0.07 0.02 -0.20 0.08 0.95 0.00 0.00 175.26 176.19 1mvg s VAL 102 N -2.99 1.58 0.19 1.83 1.01 -1.25 -1.87 120.40 118.90 1mvg s VAL 102 Ca 0.08 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.20 1mvg s VAL 102 Cb 0.01 -1.33 -0.05 0.00 0.00 0.00 0.00 36.38 35.02 1mvg s VAL 102 CO -0.02 0.41 -0.07 -0.54 0.00 0.00 0.00 175.10 174.88 1mvg s LYS 103 N -0.57 1.20 0.00 2.72 -0.14 -0.50 -4.99 119.74 117.46 1mvg s LYS 103 Ca 0.08 -1.56 0.00 0.00 -1.36 0.00 0.00 55.97 53.13 1mvg s LYS 103 Cb -0.08 -0.67 0.00 0.00 -1.68 0.00 0.00 37.83 35.40 1mvg s LYS 103 CO -0.00 0.02 0.00 0.41 -0.76 0.00 0.00 175.35 175.01 1mvg n GLY 104 N -0.31 0.00 0.71 -3.33 0.00 -1.26 -1.45 105.19 99.55 1mvg n GLY 104 Ca -0.08 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.00 1mvg n GLY 104 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1mvg n ASN 105 N -0.27 1.61 -3.52 1.61 6.94 -1.26 -4.90 115.26 115.47 1mvg n ASN 105 Ca 0.00 -3.50 -0.08 0.00 -0.02 0.00 0.00 54.58 50.98 1mvg n ASN 105 Cb 0.00 -0.48 -0.09 0.00 -2.36 0.00 0.00 39.78 36.85 1mvg n ASN 105 CO 0.00 0.00 0.00 -0.70 -1.03 0.00 0.00 177.26 175.53 1mvg s GLU 106 N -2.62 0.34 -0.09 -3.83 2.12 -0.53 -3.58 118.70 110.52 1mvg s GLU 106 Ca 0.36 0.84 -0.05 0.00 0.36 0.00 0.00 54.97 56.48 1mvg s GLU 106 Cb 0.36 0.02 -0.04 0.00 0.26 0.00 0.00 34.13 34.73 1mvg s GLU 106 CO -0.08 -0.42 0.11 1.41 -0.54 0.00 0.00 175.26 175.75 1mvg s MET 107 N 2.59 3.30 -0.01 4.30 -2.45 -0.37 -1.42 119.30 125.24 1mvg s MET 107 Ca 0.05 -0.25 0.02 0.00 -1.25 0.00 0.00 55.69 54.26 1mvg s MET 107 Cb -0.13 -3.06 -0.00 0.00 1.25 0.00 0.00 34.83 32.89 1mvg s MET 107 CO -0.14 0.74 -0.08 0.54 1.05 0.00 0.00 175.02 177.12 1mvg s VAL 108 N -1.06 0.66 0.04 10.11 0.11 -0.78 -0.71 120.40 128.76 1mvg s VAL 108 Ca 0.17 -0.33 0.01 0.00 -2.93 0.00 0.00 61.98 58.90 1mvg s VAL 108 Cb -0.12 -0.57 -0.03 0.00 -1.53 0.00 0.00 36.38 34.13 1mvg s VAL 108 CO 0.07 0.20 -0.05 -1.83 -3.33 0.00 0.00 175.10 170.16 1mvg s GLU 109 N -0.03 0.45 0.06 1.54 -1.05 -0.58 -1.58 118.70 117.50 1mvg s GLU 109 Ca 0.01 -0.78 0.03 0.00 -0.15 0.00 0.00 54.97 54.07 1mvg s GLU 109 Cb -0.05 -0.02 -0.03 0.00 -0.44 0.00 0.00 34.13 33.59 1mvg s GLU 109 CO -0.00 -0.03 -0.08 -0.08 0.95 0.00 0.00 175.26 176.02 1mvg s THR 110 N -1.89 0.67 -0.04 1.83 -1.32 -0.61 -1.24 115.64 113.04 1mvg s THR 110 Ca -0.10 -1.32 -0.03 0.00 -1.21 0.00 0.00 61.69 59.03 1mvg s THR 110 Cb -0.07 -0.93 0.01 0.00 -1.51 0.00 0.00 72.50 70.00 1mvg s THR 110 CO -0.02 -0.48 0.09 0.27 -2.21 0.00 0.00 174.62 172.27 1mvg s ILE 111 N -1.90 -0.01 0.18 5.08 -4.36 -0.66 -2.86 121.20 116.66 1mvg s ILE 111 Ca -0.04 0.03 0.00 0.00 -0.26 0.00 0.00 60.65 60.39 1mvg s ILE 111 Cb -0.06 -0.14 -0.04 0.00 1.25 0.00 0.00 42.46 43.46 1mvg s ILE 111 CO -0.00 0.01 0.35 -0.89 0.24 0.00 0.00 174.94 174.65 1mvg s THR 112 N 0.23 5.25 -0.42 8.37 2.01 -0.24 -0.25 115.64 130.58 1mvg s THR 112 Ca -0.01 -0.46 0.08 0.00 0.31 0.00 0.00 61.69 61.60 1mvg s THR 112 Cb -0.02 -3.73 0.27 0.00 0.01 0.00 0.00 72.50 69.03 1mvg s THR 112 CO -0.01 -0.13 0.73 0.33 -0.69 0.00 0.00 174.62 174.86 1mvg n PHE 113 N -0.57 -1.47 0.00 4.92 7.35 0.08 -3.45 117.46 124.33 1mvg n PHE 113 Ca -0.05 -2.90 0.00 0.00 -0.76 0.00 0.00 57.45 53.74 1mvg n PHE 113 Cb 0.54 0.44 0.00 0.00 0.35 0.00 0.00 39.48 40.81 1mvg n PHE 113 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1mvg n GLY 114 N 1.18 2.97 0.41 7.13 0.00 -0.41 -1.79 105.19 114.68 1mvg n GLY 114 Ca 0.16 0.19 0.01 0.00 0.00 0.00 0.00 46.02 46.39 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 0.59 3.25 -0.02 0.00 -1.26 -4.76 105.19 102.99 1mvg n GLY 115 Ca 0.00 -0.09 -0.19 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.51 1.41 0.10 1.61 1.01 -0.74 -5.17 120.40 117.10 1mvg s VAL 116 Ca 0.05 -1.71 0.01 0.00 0.00 0.00 0.00 61.98 60.34 1mvg s VAL 116 Cb 0.04 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.83 1mvg s VAL 116 CO 0.02 -0.37 -0.05 -0.89 0.00 0.00 0.00 175.10 173.82 1mvg s THR 117 N -2.01 0.60 0.02 3.92 2.01 -1.26 -0.74 115.64 118.19 1mvg s THR 117 Ca 0.09 -1.92 0.04 0.00 0.31 0.00 0.00 61.69 60.21 1mvg s THR 117 Cb -0.06 -1.72 -0.02 0.00 0.01 0.00 0.00 72.50 70.72 1mvg s THR 117 CO 0.04 -0.84 -0.13 -0.76 -0.69 0.00 0.00 174.62 172.24 1mvg s LEU 118 N -3.04 2.11 0.03 4.42 1.02 0.65 -4.64 118.68 119.23 1mvg s LEU 118 Ca 0.13 -0.36 0.05 0.00 0.02 0.00 0.00 54.13 53.97 1mvg s LEU 118 Cb 0.06 -0.59 -0.02 0.00 0.02 0.00 0.00 46.19 45.65 1mvg s LEU 118 CO -0.04 0.07 -0.16 0.27 0.02 0.00 0.00 176.35 176.51 1mvg s ILE 119 N -0.63 1.28 0.08 -0.59 -5.25 -0.70 -1.66 121.20 113.73 1mvg s ILE 119 Ca 0.02 -0.95 -0.02 0.00 -0.99 0.00 0.00 60.65 58.71 1mvg s ILE 119 Cb -0.07 -1.12 -0.03 0.00 2.95 0.00 0.00 42.46 44.19 1mvg s ILE 119 CO 0.01 0.15 0.03 -0.13 -1.79 0.00 0.00 174.94 173.21 1mvg s ARG 120 N -0.92 0.75 -0.03 0.37 0.52 -0.38 -1.30 118.95 117.96 1mvg s ARG 120 Ca 0.04 -1.25 -0.02 0.00 -0.52 0.00 0.00 55.73 53.98 1mvg s ARG 120 Cb -0.07 0.24 0.01 0.00 0.52 0.00 0.00 34.95 35.65 1mvg s ARG 120 CO 0.01 -0.18 0.07 0.50 0.02 0.00 0.00 175.30 175.72 1mvg s ARG 121 N -3.95 0.07 0.11 3.54 3.52 -0.26 -1.53 118.95 120.45 1mvg s ARG 121 Ca 0.12 0.12 0.03 0.00 -0.13 0.00 0.00 55.73 55.87 1mvg s ARG 121 Cb 0.07 -0.00 -0.04 0.00 -1.56 0.00 0.00 34.95 33.42 1mvg s ARG 121 CO -0.06 -0.03 -0.08 -1.12 -0.81 0.00 0.00 175.30 173.19 1mvg s SER 122 N 0.20 1.36 0.10 -2.12 0.01 0.11 -1.58 113.70 111.78 1mvg s SER 122 Ca -0.01 -1.01 0.09 0.00 1.31 0.00 0.00 55.95 56.33 1mvg s SER 122 Cb -0.02 0.06 -0.04 0.00 0.21 0.00 0.00 66.02 66.23 1mvg s SER 122 CO -0.01 -0.42 -0.24 -0.54 0.41 0.00 0.00 173.24 172.45 1mvg s LYS 123 N -3.79 1.31 0.52 12.44 1.02 -0.69 -1.24 119.74 129.31 1mvg s LYS 123 Ca 0.13 -1.20 -0.21 0.00 0.02 0.00 0.00 55.97 54.70 1mvg s LYS 123 Cb 0.04 -1.64 -0.06 0.00 -0.52 0.00 0.00 37.83 35.65 1mvg s LYS 123 CO -0.03 0.39 1.23 0.50 -0.92 0.00 0.00 175.35 176.52 1mvg s ARG 124 N -1.83 3.38 0.00 1.68 3.52 -1.23 -1.05 118.95 123.42 1mvg s ARG 124 Ca 0.10 1.92 0.00 0.00 -0.13 0.00 0.00 55.73 57.62 1mvg s ARG 124 Cb -0.10 -2.24 0.00 0.00 -1.56 0.00 0.00 34.95 31.05 1mvg s ARG 124 CO 0.04 -0.90 0.47 0.28 -0.81 0.00 0.00 175.30 174.38