#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 -1.48 0.00 -1.00 -1.96 -3.46 116.94 109.04 1mvg h PHE 2 Ca 0.00 0.00 -0.69 0.00 2.81 0.00 0.00 57.97 60.09 1mvg h PHE 2 Cb 0.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.56 1mvg h PHE 2 CO 0.00 0.00 1.15 -1.13 -1.61 0.00 0.00 178.31 176.72 1mvg n SER 3 N -2.98 2.54 0.00 2.17 3.41 -1.26 -4.63 113.62 112.86 1mvg n SER 3 Ca 0.02 0.80 0.00 0.00 -0.26 0.00 0.00 58.87 59.43 1mvg n SER 3 Cb 0.36 -1.24 0.00 0.00 -0.26 0.00 0.00 64.21 63.07 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 5.16 -2.22 3.25 5.00 0.00 -0.42 -4.96 105.19 111.00 1mvg n GLY 4 Ca 0.31 -1.21 -0.32 0.00 0.00 0.00 0.00 46.02 44.81 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 -2.10 2.24 0.02 2.61 2.01 -1.26 -1.21 115.64 117.95 1mvg s THR 5 Ca 0.00 -0.96 0.03 0.00 0.31 0.00 0.00 61.69 61.07 1mvg s THR 5 Cb 0.00 -1.87 -0.01 0.00 0.01 0.00 0.00 72.50 70.63 1mvg s THR 5 CO 0.00 0.56 -0.08 0.26 -0.69 0.00 0.00 174.62 174.66 1mvg s TRP 6 N 0.28 0.74 -0.19 4.92 0.52 -0.30 -1.37 118.94 123.53 1mvg s TRP 6 Ca -0.16 -0.29 0.01 0.00 0.02 0.00 0.00 56.10 55.68 1mvg s TRP 6 Cb -0.17 -0.45 0.02 0.00 -1.15 0.00 0.00 33.47 31.72 1mvg s TRP 6 CO 0.08 -0.03 -0.18 -1.14 0.02 0.00 0.00 176.95 175.70 1mvg s GLN 7 N -0.85 2.93 -0.02 4.98 2.00 -0.18 -0.56 119.66 127.96 1mvg s GLN 7 Ca -0.02 -0.87 -0.36 0.00 -2.00 0.00 0.00 55.36 52.11 1mvg s GLN 7 Cb -0.06 -2.63 -0.14 0.00 0.80 0.00 0.00 33.01 30.98 1mvg s GLN 7 CO 0.00 -0.25 1.68 0.28 -0.50 0.00 0.00 175.29 176.51 1mvg n VAL 8 N 4.61 0.27 -0.11 1.34 0.31 -1.18 -1.08 118.33 122.49 1mvg n VAL 8 Ca -0.20 -0.05 -0.19 0.00 -0.01 0.00 0.00 64.34 63.89 1mvg n VAL 8 Cb 0.49 -1.50 -0.09 0.00 -0.91 0.00 0.00 33.84 31.83 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 4.82 0.00 -3.81 3.52 9.36 -0.09 -4.81 117.16 126.15 1mvg n TYR 9 Ca 0.21 0.00 -0.11 0.00 3.32 0.00 0.00 57.90 61.32 1mvg n TYR 9 Cb 0.25 -0.83 -0.08 0.00 -0.63 0.00 0.00 39.34 38.05 1mvg n TYR 9 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1mvg s ALA 10 N -2.43 -0.46 -0.18 2.98 0.00 -1.11 -5.03 121.76 115.53 1mvg s ALA 10 Ca -0.30 -0.22 -0.07 0.00 0.00 0.00 0.00 51.96 51.37 1mvg s ALA 10 Cb 0.09 0.32 0.08 0.00 0.00 0.00 0.00 23.12 23.62 1mvg s ALA 10 CO 0.46 -0.40 0.40 1.14 0.00 0.00 0.00 175.76 177.35 1mvg s GLN 11 N -2.73 0.32 -0.01 0.00 -2.07 -1.26 -1.25 119.66 112.65 1mvg s GLN 11 Ca -0.04 0.94 0.01 0.00 -1.82 0.00 0.00 55.36 54.45 1mvg s GLN 11 Cb -0.00 0.20 0.01 0.00 -1.09 0.00 0.00 33.01 32.13 1mvg s GLN 11 CO -0.05 -0.23 -0.03 -1.21 -1.32 0.00 0.00 175.29 172.45 1mvg s GLU 12 N 2.30 0.37 -0.79 9.60 2.02 -0.01 -4.68 118.70 127.50 1mvg s GLU 12 Ca -0.03 -0.09 0.00 0.00 0.02 0.00 0.00 54.97 54.87 1mvg s GLU 12 Cb -0.11 -0.41 0.00 0.00 0.10 0.00 0.00 34.13 33.71 1mvg s GLU 12 CO -0.12 0.02 0.00 -1.71 0.02 0.00 0.00 175.26 173.47 1mvg n ASN 13 N 3.36 -5.08 -0.07 -0.19 2.85 -1.26 -1.99 115.26 112.88 1mvg n ASN 13 Ca -0.17 0.18 -0.14 0.00 -0.11 0.00 0.00 54.58 54.34 1mvg n ASN 13 Cb 0.56 -3.24 -0.12 0.00 1.24 0.00 0.00 39.78 38.22 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 -0.40 1.20 3.20 -1.90 -2.10 116.97 116.98 1mvg h TYR 14 Ca -0.15 0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.77 1mvg h TYR 14 Cb 0.88 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 39.10 1mvg h TYR 14 CO 0.46 0.96 0.10 1.05 -1.64 0.00 0.00 178.16 179.09 1mvg h GLU 15 N -1.00 0.23 -0.27 1.82 4.11 -1.91 -1.18 114.58 116.39 1mvg h GLU 15 Ca -0.04 -0.01 0.01 0.00 0.07 0.00 0.00 59.36 59.38 1mvg h GLU 15 Cb 0.94 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.12 1mvg h GLU 15 CO -0.02 0.15 0.17 1.49 0.07 0.00 0.00 179.01 180.87 1mvg h GLU 16 N 0.24 0.34 -0.00 1.06 4.81 -1.98 -1.37 114.58 117.67 1mvg h GLU 16 Ca 0.19 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.43 1mvg h GLU 16 Cb 0.21 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.48 1mvg h GLU 16 CO -0.23 0.22 -0.20 0.35 -0.73 0.00 0.00 179.01 178.42 1mvg h PHE 17 N 0.35 -0.53 -0.89 0.92 3.57 -1.02 0.05 116.94 119.40 1mvg h PHE 17 Ca 0.10 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.67 1mvg h PHE 17 Cb -0.03 0.24 -0.06 0.00 2.79 0.00 0.00 35.95 38.89 1mvg h PHE 17 CO -0.07 -0.29 0.56 -0.07 -2.23 0.00 0.00 178.31 176.22 1mvg h LEU 18 N -0.32 0.92 -0.98 0.59 3.38 -0.98 -0.19 115.31 117.72 1mvg h LEU 18 Ca 0.06 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1mvg h LEU 18 Cb 0.40 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 1mvg h LEU 18 CO -0.19 0.61 0.36 0.50 0.09 0.00 0.00 178.44 179.81 1mvg h LYS 19 N 1.06 1.09 0.00 1.13 3.64 -0.89 -1.93 116.57 120.67 1mvg h LYS 19 Ca 0.37 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.59 1mvg h LYS 19 Cb 0.09 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 31.71 1mvg h LYS 19 CO -0.15 0.84 -0.01 0.00 -2.27 0.00 0.00 179.45 177.87 1mvg h ALA 20 N 1.31 1.00 0.22 5.00 0.00 0.23 -3.36 119.26 123.66 1mvg h ALA 20 Ca 0.26 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1mvg h ALA 20 Cb 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1mvg h ALA 20 CO -0.03 0.01 -0.11 1.25 0.00 0.00 0.00 179.25 180.37 1mvg h LEU 21 N 0.00 -0.25 0.00 0.00 5.85 -0.25 -3.48 115.31 117.17 1mvg h LEU 21 Ca -0.00 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1mvg h LEU 21 Cb 0.60 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.70 1mvg h LEU 21 CO 0.00 0.23 0.00 0.00 -0.34 0.00 0.00 178.44 178.33 1mvg n ALA 22 N -2.74 0.00 -1.69 1.25 0.00 -1.21 -5.12 120.51 111.01 1mvg n ALA 22 Ca -0.04 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 52.96 1mvg n ALA 22 Cb 0.14 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.57 1mvg n ALA 22 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1mvg n LEU 23 N -1.61 3.36 -4.88 0.00 4.77 -1.24 -5.00 117.00 112.40 1mvg n LEU 23 Ca 0.00 1.15 -0.29 0.00 -0.03 0.00 0.00 56.01 56.84 1mvg n LEU 23 Cb 0.00 -1.46 0.09 0.00 -2.33 0.00 0.00 43.42 39.72 1mvg n LEU 23 CO 0.00 -0.39 0.78 -2.16 -1.33 0.00 0.00 177.39 174.29 1mvg s PRO 24 N -0.63 1.88 0.38 3.23 0.04 -1.26 -4.20 135.00 134.44 1mvg s PRO 24 Ca 0.66 0.15 0.20 0.00 0.04 0.00 0.00 61.00 62.05 1mvg s PRO 24 Cb -0.61 -1.94 1.20 0.00 0.04 0.00 0.00 34.50 33.19 1mvg s PRO 24 CO 0.51 -1.66 1.67 1.49 0.04 0.00 0.00 177.00 179.05 1mvg h GLU 25 N -1.11 0.25 -0.17 4.56 4.81 -1.94 -1.70 114.58 119.27 1mvg h GLU 25 Ca -0.47 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 58.69 1mvg h GLU 25 Cb 1.33 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.65 1mvg h GLU 25 CO 0.65 0.16 -0.12 -0.44 -0.73 0.00 0.00 179.01 178.53 1mvg h ASP 26 N 0.25 0.41 0.62 1.04 5.19 -2.01 -2.89 116.42 119.02 1mvg h ASP 26 Ca 0.74 -0.45 -0.28 0.00 -0.62 0.00 0.00 57.03 56.43 1mvg h ASP 26 Cb 1.94 -0.11 -0.00 0.00 0.18 0.00 0.00 39.33 41.33 1mvg h ASP 26 CO -0.50 0.77 -1.30 -0.07 -3.12 0.00 0.00 179.24 175.02 1mvg h LEU 27 N 0.05 0.38 -2.08 1.55 3.38 -1.74 -3.21 115.31 113.63 1mvg h LEU 27 Ca 0.03 -0.43 -0.01 0.00 0.09 0.00 0.00 57.88 57.56 1mvg h LEU 27 Cb 0.63 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 1mvg h LEU 27 CO 0.03 1.34 -0.06 0.16 0.09 0.00 0.00 178.44 180.01 1mvg h ILE 28 N 0.07 0.26 -0.97 1.22 -0.00 -1.41 -1.51 117.51 115.16 1mvg h ILE 28 Ca -0.15 -0.39 0.25 0.00 -0.00 0.00 0.00 64.86 64.58 1mvg h ILE 28 Cb 1.97 1.30 -0.06 0.00 -0.00 0.00 0.00 36.82 40.03 1mvg h ILE 28 CO 0.19 0.05 0.66 0.50 -0.00 0.00 0.00 178.15 179.55 1mvg h LYS 29 N 0.00 0.22 -0.05 0.16 3.64 -1.51 0.21 116.57 119.23 1mvg h LYS 29 Ca -0.00 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1mvg h LYS 29 Cb 0.29 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1mvg h LYS 29 CO 0.01 0.15 -0.01 1.98 -2.27 0.00 0.00 179.45 179.30 1mvg h MET 30 N 0.23 0.07 0.00 1.90 4.05 -1.46 -3.15 114.93 116.58 1mvg h MET 30 Ca 0.50 -0.01 -0.38 0.00 -0.28 0.00 0.00 59.70 59.53 1mvg h MET 30 Cb 1.56 -0.02 -0.07 0.00 -0.80 0.00 0.00 31.60 32.28 1mvg h MET 30 CO -0.13 0.09 -2.44 0.00 0.23 0.00 0.00 176.91 174.65 1mvg n ALA 31 N -2.52 1.46 -0.30 0.39 0.00 -0.31 -4.40 120.51 114.82 1mvg n ALA 31 Ca -0.02 -1.20 0.24 0.00 0.00 0.00 0.00 53.44 52.46 1mvg n ALA 31 Cb 0.12 -0.13 0.56 0.00 0.00 0.00 0.00 19.45 20.00 1mvg n ALA 31 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1mvg h ARG 32 N 0.00 0.31 0.00 0.00 1.12 -0.98 -1.86 114.38 112.98 1mvg h ARG 32 Ca -0.57 -0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.28 1mvg h ARG 32 Cb 2.03 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 31.93 1mvg h ARG 32 CO -0.04 0.20 0.00 -3.47 -3.11 0.00 0.00 179.97 173.55 1mvg n ASP 33 N -4.52 1.68 -4.22 -3.80 4.64 -1.25 -4.93 116.55 104.15 1mvg n ASP 33 Ca 0.24 -1.69 -0.33 0.00 -1.38 0.00 0.00 54.79 51.63 1mvg n ASP 33 Cb 0.90 0.00 -0.15 0.00 -1.04 0.00 0.00 41.12 40.83 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 -0.69 2.56 -0.47 5.18 1.09 -0.70 -5.08 121.20 123.09 1mvg s ILE 34 Ca 0.00 -0.79 -0.10 0.00 -1.10 0.00 0.00 60.65 58.66 1mvg s ILE 34 Cb 0.00 -2.09 0.11 0.00 -1.06 0.00 0.00 42.46 39.42 1mvg s ILE 34 CO 0.00 0.51 0.34 -1.59 -0.10 0.00 0.00 174.94 174.10 1mvg s LYS 35 N 1.06 2.53 0.64 2.79 -2.85 -1.26 -4.84 119.74 117.82 1mvg s LYS 35 Ca -0.01 -1.72 -0.14 0.00 -1.00 0.00 0.00 55.97 53.11 1mvg s LYS 35 Cb -0.14 -3.93 -0.01 0.00 -2.06 0.00 0.00 37.83 31.68 1mvg s LYS 35 CO -0.05 -1.17 1.07 -1.25 0.10 0.00 0.00 175.35 174.06 1mvg s PRO 36 N 1.39 3.04 0.33 1.78 0.04 -1.26 -4.76 135.00 135.55 1mvg s PRO 36 Ca 0.05 1.19 -0.19 0.00 0.04 0.00 0.00 61.00 62.09 1mvg s PRO 36 Cb -0.26 -2.00 -0.09 0.00 0.04 0.00 0.00 34.50 32.19 1mvg s PRO 36 CO -0.00 -1.03 0.82 -1.50 0.04 0.00 0.00 177.00 175.33 1mvg s ILE 37 N -2.59 4.51 0.08 0.56 2.07 -0.81 -3.09 121.20 121.92 1mvg s ILE 37 Ca 0.63 1.29 0.04 0.00 -1.41 0.00 0.00 60.65 61.20 1mvg s ILE 37 Cb -0.17 -3.72 -0.03 0.00 0.13 0.00 0.00 42.46 38.67 1mvg s ILE 37 CO 0.43 -0.08 -0.12 -0.69 -1.91 0.00 0.00 174.94 172.56 1mvg s VAL 38 N -1.88 1.00 -0.21 4.00 1.01 0.28 -1.09 120.40 123.51 1mvg s VAL 38 Ca 0.53 -1.36 -0.11 0.00 0.00 0.00 0.00 61.98 61.04 1mvg s VAL 38 Cb -0.13 -1.08 0.07 0.00 0.00 0.00 0.00 36.38 35.24 1mvg s VAL 38 CO 0.18 -0.33 0.50 -0.70 0.00 0.00 0.00 175.10 174.76 1mvg s GLU 39 N -1.98 0.48 0.09 2.72 2.12 -0.30 -1.15 118.70 120.68 1mvg s GLU 39 Ca -0.01 0.99 0.07 0.00 0.36 0.00 0.00 54.97 56.38 1mvg s GLU 39 Cb -0.08 0.13 -0.04 0.00 0.26 0.00 0.00 34.13 34.40 1mvg s GLU 39 CO 0.02 -0.17 -0.14 0.42 -0.54 0.00 0.00 175.26 174.84 1mvg s ILE 40 N 1.74 3.10 0.00 -3.70 1.09 -0.35 -0.92 121.20 122.17 1mvg s ILE 40 Ca -0.08 -1.30 0.00 0.00 -1.10 0.00 0.00 60.65 58.17 1mvg s ILE 40 Cb -0.08 -2.41 -0.00 0.00 -1.06 0.00 0.00 42.46 38.91 1mvg s ILE 40 CO -0.15 0.17 -0.01 -1.58 -0.10 0.00 0.00 174.94 173.27 1mvg s GLN 41 N -1.99 0.09 0.00 2.79 0.74 -0.45 -1.31 119.66 119.53 1mvg s GLN 41 Ca 0.19 -0.09 0.00 0.00 0.05 0.00 0.00 55.36 55.51 1mvg s GLN 41 Cb -0.11 -0.04 0.00 0.00 1.10 0.00 0.00 33.01 33.96 1mvg s GLN 41 CO 0.10 0.01 0.00 0.00 -0.55 0.00 0.00 175.29 174.85 1mvg n GLN 42 N 2.91 0.00 -3.05 1.67 -0.00 -1.26 -1.62 117.38 116.03 1mvg n GLN 42 Ca -0.13 0.00 -0.19 0.00 -0.00 0.00 0.00 57.00 56.68 1mvg n GLN 42 Cb 0.59 0.00 -0.02 0.00 -0.00 0.00 0.00 30.24 30.81 1mvg n GLN 42 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1mvg n LYS 43 N -0.06 1.54 0.00 2.61 5.02 -1.26 -4.13 118.16 121.88 1mvg n LYS 43 Ca 0.00 -3.70 0.00 0.00 -2.02 0.00 0.00 58.31 52.59 1mvg n LYS 43 Cb 0.00 -1.78 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 1mvg n LYS 43 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mvg n GLY 44 N 0.10 0.43 0.25 0.72 0.00 -1.26 -4.90 105.19 100.55 1mvg n GLY 44 Ca 0.25 -1.19 -0.00 0.00 0.00 0.00 0.00 46.02 45.07 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 0.42 -4.04 1.61 3.32 -1.97 -3.45 116.42 112.31 1mvg h ASP 45 Ca 0.00 -0.09 -0.45 0.00 0.02 0.00 0.00 57.03 56.51 1mvg h ASP 45 Cb 0.00 -0.11 0.15 0.00 0.22 0.00 0.00 39.33 39.59 1mvg h ASP 45 CO 0.00 0.55 0.27 -1.81 -1.72 0.00 0.00 179.24 176.53 1mvg s ASP 46 N -6.79 2.90 -0.27 6.45 1.01 -1.26 -1.76 116.67 116.95 1mvg s ASP 46 Ca -0.07 0.88 -0.10 0.00 0.71 0.00 0.00 52.55 53.98 1mvg s ASP 46 Cb 0.15 -1.37 0.11 0.00 1.01 0.00 0.00 42.92 42.82 1mvg s ASP 46 CO 0.76 -2.92 0.58 -0.36 0.21 0.00 0.00 175.17 173.44 1mvg s PHE 47 N -3.24 -1.14 -0.13 4.23 0.08 0.28 -4.69 117.98 113.38 1mvg s PHE 47 Ca 0.66 2.06 0.00 0.00 0.12 0.00 0.00 56.93 59.77 1mvg s PHE 47 Cb -0.14 0.63 -0.01 0.00 -0.57 0.00 0.00 43.02 42.93 1mvg s PHE 47 CO 0.54 -0.59 -0.14 0.54 -0.10 0.00 0.00 175.22 175.47 1mvg s VAL 48 N 2.62 2.93 -0.09 -0.44 0.11 -0.64 -0.99 120.40 123.89 1mvg s VAL 48 Ca -0.05 -0.70 0.04 0.00 -2.93 0.00 0.00 61.98 58.33 1mvg s VAL 48 Cb -0.11 -2.22 0.00 0.00 -1.53 0.00 0.00 36.38 32.52 1mvg s VAL 48 CO -0.17 0.53 -0.22 -0.69 -3.33 0.00 0.00 175.10 171.21 1mvg s VAL 49 N 0.36 1.91 0.04 2.04 1.01 -0.37 -1.34 120.40 124.05 1mvg s VAL 49 Ca -0.12 -0.94 0.06 0.00 0.00 0.00 0.00 61.98 60.98 1mvg s VAL 49 Cb -0.16 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 1mvg s VAL 49 CO 0.06 0.53 -0.16 -0.89 0.00 0.00 0.00 175.10 174.64 1mvg s THR 50 N 0.35 1.26 -0.01 3.92 2.01 -0.09 -1.21 115.64 121.87 1mvg s THR 50 Ca -0.17 -1.07 0.00 0.00 0.31 0.00 0.00 61.69 60.76 1mvg s THR 50 Cb -0.17 -1.13 0.01 0.00 0.01 0.00 0.00 72.50 71.22 1mvg s THR 50 CO 0.08 0.04 0.01 -0.55 -0.69 0.00 0.00 174.62 173.51 1mvg s SER 51 N -1.19 0.05 -0.05 3.53 0.15 -0.52 -1.15 113.70 114.50 1mvg s SER 51 Ca 0.03 0.01 0.05 0.00 0.70 0.00 0.00 55.95 56.74 1mvg s SER 51 Cb -0.08 -0.03 -0.01 0.00 -1.71 0.00 0.00 66.02 64.19 1mvg s SER 51 CO 0.01 -0.05 -0.21 -0.54 1.20 0.00 0.00 173.24 173.66 1mvg s LYS 52 N 0.41 2.19 0.08 5.44 1.02 -0.25 -1.33 119.74 127.30 1mvg s LYS 52 Ca -0.03 -0.74 0.05 0.00 0.02 0.00 0.00 55.97 55.27 1mvg s LYS 52 Cb -0.05 -1.85 -0.03 0.00 -0.52 0.00 0.00 37.83 35.38 1mvg s LYS 52 CO -0.01 0.28 -0.14 0.99 -0.92 0.00 0.00 175.35 175.55 1mvg s THR 53 N 0.01 1.15 0.52 2.17 2.01 0.51 -1.93 115.64 120.09 1mvg s THR 53 Ca -0.06 -1.43 0.40 0.00 0.31 0.00 0.00 61.69 60.91 1mvg s THR 53 Cb -0.13 -1.20 0.40 0.00 0.01 0.00 0.00 72.50 71.57 1mvg s THR 53 CO 0.03 -0.30 2.22 1.55 -0.69 0.00 0.00 174.62 177.44 1mvg h PRO 54 N 4.05 0.00 -0.11 4.92 0.13 -1.97 -2.93 132.00 136.10 1mvg h PRO 54 Ca -0.40 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.54 1mvg h PRO 54 Cb 1.19 0.00 -0.37 0.00 0.13 0.00 0.00 31.00 31.95 1mvg h PRO 54 CO 0.44 0.00 -1.03 0.54 -0.23 0.00 0.00 178.00 177.72 1mvg n ARG 55 N -2.92 0.52 -3.57 0.86 1.74 -1.26 -5.09 116.66 106.94 1mvg n ARG 55 Ca -0.03 -2.43 -0.07 0.00 -0.77 0.00 0.00 57.85 54.55 1mvg n ARG 55 Cb 0.09 -0.47 -0.03 0.00 -1.02 0.00 0.00 32.46 31.03 1mvg n ARG 55 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1mvg s GLN 56 N -1.06 0.52 -0.07 5.56 0.74 -1.11 -5.17 119.66 119.07 1mvg s GLN 56 Ca 0.33 -0.08 -0.11 0.00 0.05 0.00 0.00 55.36 55.54 1mvg s GLN 56 Cb 0.37 0.24 0.02 0.00 1.10 0.00 0.00 33.01 34.75 1mvg s GLN 56 CO -0.13 -0.21 0.28 0.99 -0.55 0.00 0.00 175.29 175.67 1mvg s THR 57 N -2.12 0.03 0.02 -0.34 2.01 -1.26 -0.36 115.64 113.61 1mvg s THR 57 Ca 0.05 -0.21 -0.04 0.00 0.31 0.00 0.00 61.69 61.80 1mvg s THR 57 Cb -0.01 -0.47 -0.01 0.00 0.01 0.00 0.00 72.50 72.02 1mvg s THR 57 CO -0.04 -0.12 0.05 0.54 -0.69 0.00 0.00 174.62 174.36 1mvg s VAL 58 N -0.44 0.11 -0.05 3.82 0.11 -0.44 -5.03 120.40 118.49 1mvg s VAL 58 Ca -0.06 -0.92 -0.12 0.00 -2.93 0.00 0.00 61.98 57.95 1mvg s VAL 58 Cb -0.04 -0.51 0.02 0.00 -1.53 0.00 0.00 36.38 34.32 1mvg s VAL 58 CO 0.02 -0.51 0.28 -0.89 -3.33 0.00 0.00 175.10 170.67 1mvg s THR 59 N -1.80 0.04 0.04 5.04 2.01 -1.26 -1.44 115.64 118.27 1mvg s THR 59 Ca -0.12 -0.33 -0.09 0.00 0.31 0.00 0.00 61.69 61.46 1mvg s THR 59 Cb -0.06 -0.51 0.00 0.00 0.01 0.00 0.00 72.50 71.93 1mvg s THR 59 CO -0.01 -0.18 0.18 0.54 -0.69 0.00 0.00 174.62 174.45 1mvg s ASN 60 N -0.79 0.06 0.02 3.53 2.20 -0.35 -4.65 114.94 114.96 1mvg s ASN 60 Ca -0.09 -0.41 0.01 0.00 -0.94 0.00 0.00 52.86 51.43 1mvg s ASN 60 Cb -0.04 0.28 -0.01 0.00 -2.00 0.00 0.00 41.25 39.48 1mvg s ASN 60 CO 0.02 -0.56 -0.03 -0.94 -2.94 0.00 0.00 177.10 172.65 1mvg s SER 61 N -2.14 0.35 0.25 3.54 1.04 -1.26 -1.24 113.70 114.24 1mvg s SER 61 Ca -0.04 -0.31 -0.21 0.00 0.48 0.00 0.00 55.95 55.86 1mvg s SER 61 Cb -0.01 0.03 0.05 0.00 0.10 0.00 0.00 66.02 66.19 1mvg s SER 61 CO -0.04 -0.14 0.85 0.72 0.98 0.00 0.00 173.24 175.60 1mvg s PHE 62 N -0.83 -0.08 -0.06 5.02 -0.71 -0.16 -4.50 117.98 116.65 1mvg s PHE 62 Ca -0.08 -0.37 -0.06 0.00 -1.04 0.00 0.00 56.93 55.39 1mvg s PHE 62 Cb -0.06 0.71 0.02 0.00 -1.21 0.00 0.00 43.02 42.48 1mvg s PHE 62 CO -0.00 -1.14 0.17 0.99 -1.34 0.00 0.00 175.22 173.89 1mvg s THR 63 N -3.21 -0.00 0.61 -4.49 2.01 -1.26 -0.56 115.64 108.74 1mvg s THR 63 Ca 0.13 0.01 -0.17 0.00 0.31 0.00 0.00 61.69 61.98 1mvg s THR 63 Cb -0.04 -0.24 -0.03 0.00 0.01 0.00 0.00 72.50 72.20 1mvg s THR 63 CO 0.06 0.01 1.13 -1.48 -0.69 0.00 0.00 174.62 173.65 1mvg s LEU 64 N 0.19 3.56 -0.91 4.42 0.05 -0.72 -3.35 118.68 121.91 1mvg s LEU 64 Ca -0.01 2.11 0.00 0.00 0.05 0.00 0.00 54.13 56.28 1mvg s LEU 64 Cb -0.02 -4.57 0.00 0.00 -2.05 0.00 0.00 46.19 39.55 1mvg s LEU 64 CO -0.00 -1.48 0.00 0.61 -0.55 0.00 0.00 176.35 174.93 1mvg n GLY 65 N -0.13 0.47 3.44 -3.48 0.00 0.73 -4.91 105.19 101.31 1mvg n GLY 65 Ca 0.11 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 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 -3.76 1.23 0.41 1.61 2.20 -0.99 -4.98 119.74 115.46 1mvg s LYS 66 Ca 0.00 -0.30 -0.25 0.00 -0.36 0.00 0.00 55.97 55.06 1mvg s LYS 66 Cb 0.00 0.57 -0.08 0.00 -1.51 0.00 0.00 37.83 36.81 1mvg s LYS 66 CO 0.00 -0.51 1.16 -1.83 -0.36 0.00 0.00 175.35 173.81 1mvg s GLU 67 N -3.16 4.02 0.14 4.03 -1.05 -1.26 -1.57 118.70 119.86 1mvg s GLU 67 Ca -0.02 1.80 -0.15 0.00 -0.15 0.00 0.00 54.97 56.46 1mvg s GLU 67 Cb -0.01 -2.63 0.03 0.00 -0.44 0.00 0.00 34.13 31.08 1mvg s GLU 67 CO -0.08 -0.34 0.40 0.00 0.95 0.00 0.00 175.26 176.19 1mvg s ALA 68 N -1.45 -0.77 0.16 -0.84 0.00 -0.02 -4.83 121.76 114.01 1mvg s ALA 68 Ca 0.58 -0.23 -0.15 0.00 0.00 0.00 0.00 51.96 52.16 1mvg s ALA 68 Cb -0.30 0.73 -0.07 0.00 0.00 0.00 0.00 23.12 23.49 1mvg s ALA 68 CO 0.37 -0.67 0.57 0.16 0.00 0.00 0.00 175.76 176.19 1mvg s ASP 69 N -2.84 6.85 -0.03 0.00 -4.77 -1.26 -0.83 116.67 113.79 1mvg s ASP 69 Ca 0.06 1.12 0.03 0.00 -3.30 0.00 0.00 52.55 50.47 1mvg s ASP 69 Cb 0.02 -2.30 -0.00 0.00 -1.09 0.00 0.00 42.92 39.54 1mvg s ASP 69 CO -0.08 0.09 -0.13 -0.63 0.70 0.00 0.00 175.17 175.12 1mvg s ILE 70 N -1.47 1.09 -1.03 2.11 1.01 -1.26 -4.42 121.20 117.22 1mvg s ILE 70 Ca 0.38 -0.54 -0.22 0.00 0.00 0.00 0.00 60.65 60.27 1mvg s ILE 70 Cb -0.15 -0.94 0.06 0.00 0.01 0.00 0.00 42.46 41.43 1mvg s ILE 70 CO 0.19 0.32 1.44 -0.89 0.00 0.00 0.00 174.94 176.01 1mvg s THR 71 N 0.06 4.00 0.49 2.92 2.01 -1.26 -4.19 115.64 119.67 1mvg s THR 71 Ca -0.02 -0.90 -0.15 0.00 0.31 0.00 0.00 61.69 60.93 1mvg s THR 71 Cb -0.09 -5.05 -0.07 0.00 0.01 0.00 0.00 72.50 67.30 1mvg s THR 71 CO 0.01 -1.91 0.93 -0.89 -0.69 0.00 0.00 174.62 172.07 1mvg s THR 72 N 4.75 4.60 0.69 -0.82 2.01 0.05 -4.90 115.64 122.02 1mvg s THR 72 Ca 0.45 1.06 -0.17 0.00 0.31 0.00 0.00 61.69 63.35 1mvg s THR 72 Cb -0.00 -3.73 -0.02 0.00 0.01 0.00 0.00 72.50 68.75 1mvg s THR 72 CO -0.09 -0.67 0.81 0.23 -0.69 0.00 0.00 174.62 174.21 1mvg n MET 73 N -1.57 0.52 -2.70 4.92 2.81 -1.26 -2.16 117.12 117.69 1mvg n MET 73 Ca 0.06 0.22 -0.18 0.00 -1.81 0.00 0.00 57.70 55.99 1mvg n MET 73 Cb 0.54 -2.06 0.02 0.00 -0.71 0.00 0.00 33.22 31.01 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 -0.95 -5.26 -3.47 7.83 2.03 -1.26 -4.32 116.55 111.16 1mvg n ASP 74 Ca 0.12 -0.16 -0.14 0.00 0.52 0.00 0.00 54.79 55.13 1mvg n ASP 74 Cb 0.49 -4.18 0.00 0.00 -0.72 0.00 0.00 41.12 36.71 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 -1.27 -1.28 3.22 0.27 0.00 -1.07 -5.03 105.19 100.03 1mvg n GLY 75 Ca -0.13 0.54 -0.09 0.00 0.00 0.00 0.00 46.02 46.34 1mvg n GLY 75 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mvg s LYS 76 N -4.10 0.87 -0.05 1.61 -2.85 -0.92 -5.01 119.74 109.30 1mvg s LYS 76 Ca 0.01 -0.99 0.05 0.00 -1.00 0.00 0.00 55.97 54.03 1mvg s LYS 76 Cb -0.00 0.34 -0.02 0.00 -2.06 0.00 0.00 37.83 36.09 1mvg s LYS 76 CO 0.83 -0.28 -0.18 -1.59 0.10 0.00 0.00 175.35 174.23 1mvg s LYS 77 N -3.88 2.48 0.00 1.78 -2.85 -1.26 -0.77 119.74 115.24 1mvg s LYS 77 Ca 0.06 -0.78 0.00 0.00 -1.00 0.00 0.00 55.97 54.26 1mvg s LYS 77 Cb 0.05 -2.29 0.00 0.00 -2.06 0.00 0.00 37.83 33.53 1mvg s LYS 77 CO -0.10 0.55 0.27 1.47 0.10 0.00 0.00 175.35 177.65 1mvg n LEU 78 N 2.51 0.25 -0.96 2.77 -0.00 -1.26 -5.03 117.00 115.28 1mvg n LEU 78 Ca -0.17 -0.25 0.00 0.00 -0.00 0.00 0.00 56.01 55.59 1mvg n LEU 78 Cb 0.52 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.94 1mvg n LEU 78 CO 0.25 0.06 -0.26 0.29 -0.00 0.00 0.00 177.39 177.74 1mvg n LYS 79 N -0.03 -2.71 -3.70 1.47 5.02 -1.26 -4.56 118.16 112.38 1mvg n LYS 79 Ca 0.00 1.98 -0.14 0.00 -2.02 0.00 0.00 58.31 58.14 1mvg n LYS 79 Cb 0.30 -2.21 -0.14 0.00 -0.02 0.00 0.00 35.03 32.96 1mvg n LYS 79 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1mvg s THR 81 N 1.77 4.69 0.25 0.00 2.01 0.37 -0.84 115.64 123.90 1mvg s THR 81 Ca -0.04 -0.35 -0.10 0.00 0.31 0.00 0.00 61.69 61.51 1mvg s THR 81 Cb -0.11 -4.42 -0.07 0.00 0.01 0.00 0.00 72.50 67.90 1mvg s THR 81 CO -0.08 -0.99 0.58 -0.69 -0.69 0.00 0.00 174.62 172.76 1mvg s VAL 82 N 3.11 4.90 0.20 3.82 1.01 -0.61 -1.51 120.40 131.33 1mvg s VAL 82 Ca 0.19 0.51 -0.12 0.00 0.00 0.00 0.00 61.98 62.56 1mvg s VAL 82 Cb -0.18 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1mvg s VAL 82 CO 0.13 -0.12 0.41 -2.28 0.00 0.00 0.00 175.10 173.24 1mvg s HIS 83 N -1.88 0.29 -0.16 5.22 2.46 0.02 -0.19 115.29 121.05 1mvg s HIS 83 Ca 0.48 -0.65 -0.01 0.00 0.47 0.00 0.00 55.06 55.36 1mvg s HIS 83 Cb -0.11 0.12 0.04 0.00 -0.13 0.00 0.00 32.58 32.51 1mvg s HIS 83 CO 0.22 -0.87 -0.04 -1.17 -2.47 0.00 0.00 174.74 170.40 1mvg s LEU 84 N -2.97 1.51 0.00 8.88 0.20 -1.26 -1.02 118.68 124.02 1mvg s LEU 84 Ca 0.18 -0.64 0.00 0.00 0.69 0.00 0.00 54.13 54.36 1mvg s LEU 84 Cb 0.01 -0.86 0.00 0.00 -0.43 0.00 0.00 46.19 44.91 1mvg s LEU 84 CO 0.03 -0.19 0.00 0.00 -0.29 0.00 0.00 176.35 175.90 1mvg n ALA 85 N 4.91 0.00 -1.45 5.97 0.00 -0.19 -4.86 120.51 124.89 1mvg n ALA 85 Ca -0.11 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.00 1mvg n ALA 85 Cb 0.48 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.87 1mvg n ALA 85 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1mvg n ASN 86 N 0.00 7.65 -2.78 0.00 6.94 -1.26 -4.41 115.26 121.40 1mvg n ASN 86 Ca 0.00 -2.78 -0.19 0.00 -0.02 0.00 0.00 54.58 51.59 1mvg n ASN 86 Cb 0.00 -1.44 0.05 0.00 -2.36 0.00 0.00 39.78 36.02 1mvg n ASN 86 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1mvg n GLY 87 N 2.57 -0.30 2.89 4.83 0.00 -1.26 -5.03 105.19 108.89 1mvg n GLY 87 Ca 0.64 0.03 -0.12 0.00 0.00 0.00 0.00 46.02 46.58 1mvg n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mvg s LYS 88 N -5.77 0.03 -0.48 1.61 1.02 -1.26 -4.76 119.74 110.13 1mvg s LYS 88 Ca 0.36 -0.02 -0.29 0.00 0.02 0.00 0.00 55.97 56.04 1mvg s LYS 88 Cb -0.16 0.01 0.03 0.00 -0.52 0.00 0.00 37.83 37.19 1mvg s LYS 88 CO 0.44 -0.00 1.18 -1.17 -0.92 0.00 0.00 175.35 174.88 1mvg s LEU 89 N -0.07 3.61 -0.21 3.17 0.20 0.13 -1.02 118.68 124.49 1mvg s LEU 89 Ca -0.01 0.48 0.01 0.00 0.69 0.00 0.00 54.13 55.31 1mvg s LEU 89 Cb -0.01 -3.52 0.03 0.00 -0.43 0.00 0.00 46.19 42.26 1mvg s LEU 89 CO -0.00 -1.30 -0.16 -0.69 -0.29 0.00 0.00 176.35 173.91 1mvg s VAL 90 N 4.65 2.21 0.14 1.68 1.01 -0.19 -1.00 120.40 128.90 1mvg s VAL 90 Ca 0.49 -1.09 0.09 0.00 0.00 0.00 0.00 61.98 61.47 1mvg s VAL 90 Cb -0.08 -2.04 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 1mvg s VAL 90 CO 0.32 0.37 -0.21 -0.89 0.00 0.00 0.00 175.10 174.69 1mvg s THR 91 N 1.26 1.88 -0.04 3.92 2.01 0.20 -0.80 115.64 124.07 1mvg s THR 91 Ca 0.01 -1.74 0.03 0.00 0.31 0.00 0.00 61.69 60.30 1mvg s THR 91 Cb -0.15 -1.77 0.00 0.00 0.01 0.00 0.00 72.50 70.59 1mvg s THR 91 CO -0.10 -0.13 -0.13 -0.54 -0.69 0.00 0.00 174.62 173.03 1mvg s LYS 92 N -2.29 1.40 0.39 4.92 -0.14 -0.57 -1.98 119.74 121.47 1mvg s LYS 92 Ca 0.12 -0.47 0.08 0.00 -1.36 0.00 0.00 55.97 54.34 1mvg s LYS 92 Cb -0.08 -1.25 -0.04 0.00 -1.68 0.00 0.00 37.83 34.78 1mvg s LYS 92 CO 0.06 0.18 0.25 0.45 -0.76 0.00 0.00 175.35 175.53 1mvg s SER 93 N 0.12 4.79 0.21 2.83 0.15 0.16 -0.48 113.70 121.48 1mvg s SER 93 Ca -0.04 -0.83 -0.09 0.00 0.70 0.00 0.00 55.95 55.69 1mvg s SER 93 Cb -0.10 -0.62 0.23 0.00 -1.71 0.00 0.00 66.02 63.82 1mvg s SER 93 CO 0.01 -0.50 1.83 -0.33 1.20 0.00 0.00 173.24 175.45 1mvg h GLU 94 N 1.30 0.76 0.00 5.44 5.08 -1.80 -3.21 114.58 122.14 1mvg h GLU 94 Ca -0.43 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 57.76 1mvg h GLU 94 Cb 1.26 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 1mvg h GLU 94 CO 0.63 0.50 -1.85 1.63 -1.00 0.00 0.00 179.01 178.92 1mvg n LYS 95 N -4.72 0.65 -1.13 2.33 5.02 -1.26 -5.07 118.16 113.99 1mvg n LYS 95 Ca 0.09 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.35 1mvg n LYS 95 Cb 0.14 -1.62 0.00 0.00 -0.02 0.00 0.00 35.03 33.53 1mvg n LYS 95 CO 0.00 0.00 0.00 1.97 -0.52 0.00 0.00 177.40 178.85 1mvg n PHE 96 N -2.57 -0.54 -4.00 2.13 1.16 -1.21 -4.16 117.46 108.28 1mvg n PHE 96 Ca -0.12 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.37 1mvg n PHE 96 Cb 0.77 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 38.56 1mvg n PHE 96 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1mvg s SER 97 N -0.55 0.24 -0.16 5.98 0.15 -1.26 -0.67 113.70 117.42 1mvg s SER 97 Ca 0.00 -0.90 -0.06 0.00 0.70 0.00 0.00 55.95 55.69 1mvg s SER 97 Cb 0.00 0.32 0.08 0.00 -1.71 0.00 0.00 66.02 64.70 1mvg s SER 97 CO 0.00 -0.73 0.34 -2.28 1.20 0.00 0.00 173.24 171.77 1mvg s HIS 98 N -3.94 -0.60 -0.05 3.44 5.04 -0.84 -1.63 115.29 116.72 1mvg s HIS 98 Ca 0.12 1.24 0.03 0.00 -1.54 0.00 0.00 55.06 54.91 1mvg s HIS 98 Cb 0.06 0.14 0.00 0.00 0.04 0.00 0.00 32.58 32.82 1mvg s HIS 98 CO -0.06 -0.41 -0.13 -1.83 -2.34 0.00 0.00 174.74 169.97 1mvg s GLU 99 N 2.41 1.55 -0.17 2.88 -1.05 -0.26 -0.63 118.70 123.43 1mvg s GLU 99 Ca -0.01 -0.47 -0.13 0.00 -0.15 0.00 0.00 54.97 54.22 1mvg s GLU 99 Cb -0.12 -1.34 0.05 0.00 -0.44 0.00 0.00 34.13 32.28 1mvg s GLU 99 CO -0.11 0.14 0.43 -1.14 0.95 0.00 0.00 175.26 175.53 1mvg s GLN 100 N 0.30 0.47 0.01 -4.83 0.74 -0.17 -1.49 119.66 114.69 1mvg s GLN 100 Ca -0.07 0.69 -0.20 0.00 0.05 0.00 0.00 55.36 55.82 1mvg s GLN 100 Cb -0.12 0.14 0.04 0.00 1.10 0.00 0.00 33.01 34.17 1mvg s GLN 100 CO 0.02 -0.10 0.45 -1.83 -0.55 0.00 0.00 175.29 173.28 1mvg s GLU 101 N 0.71 0.90 -0.03 1.67 1.03 -0.67 -0.69 118.70 121.62 1mvg s GLU 101 Ca -0.04 -0.19 0.07 0.00 0.03 0.00 0.00 54.97 54.84 1mvg s GLU 101 Cb -0.05 0.41 -0.02 0.00 -0.80 0.00 0.00 34.13 33.67 1mvg s GLU 101 CO -0.05 -0.30 -0.24 0.08 -1.33 0.00 0.00 175.26 173.42 1mvg s VAL 102 N -1.98 2.17 -0.29 1.83 1.01 -1.26 -1.10 120.40 120.78 1mvg s VAL 102 Ca -0.08 -1.06 -0.02 0.00 0.00 0.00 0.00 61.98 60.82 1mvg s VAL 102 Cb -0.02 -1.76 0.09 0.00 0.00 0.00 0.00 36.38 34.69 1mvg s VAL 102 CO 0.01 0.58 0.09 -0.54 0.00 0.00 0.00 175.10 175.25 1mvg s LYS 103 N -0.56 0.62 4.37 2.72 1.02 0.07 -5.01 119.74 122.97 1mvg s LYS 103 Ca 0.08 -0.87 0.00 0.00 0.02 0.00 0.00 55.97 55.20 1mvg s LYS 103 Cb -0.11 -1.86 0.00 0.00 -0.52 0.00 0.00 37.83 35.35 1mvg s LYS 103 CO -0.00 -0.94 0.00 0.41 -0.92 0.00 0.00 175.35 173.90 1mvg n GLY 104 N 4.95 0.84 0.01 -3.33 0.00 -1.26 -1.28 105.19 105.12 1mvg n GLY 104 Ca -0.04 0.43 0.01 0.00 0.00 0.00 0.00 46.02 46.42 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 8.46 1.91 -4.50 1.61 0.23 -1.26 -5.00 115.26 116.72 1mvg n ASN 105 Ca 0.00 -2.06 -0.31 0.00 -0.53 0.00 0.00 54.58 51.68 1mvg n ASN 105 Cb 0.00 -0.05 -0.12 0.00 -2.08 0.00 0.00 39.78 37.53 1mvg n ASN 105 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 1mvg s GLU 106 N -1.14 2.15 -0.05 -3.83 2.12 -0.41 -1.35 118.70 116.20 1mvg s GLU 106 Ca 0.03 -0.95 0.03 0.00 0.36 0.00 0.00 54.97 54.45 1mvg s GLU 106 Cb 0.03 -2.25 0.00 0.00 0.26 0.00 0.00 34.13 32.17 1mvg s GLU 106 CO 0.00 0.54 -0.14 1.41 -0.54 0.00 0.00 175.26 176.53 1mvg s MET 107 N -1.55 1.67 -0.07 4.30 -2.45 -0.07 -0.75 119.30 120.38 1mvg s MET 107 Ca 0.16 -0.50 0.04 0.00 -1.25 0.00 0.00 55.69 54.13 1mvg s MET 107 Cb -0.11 -1.42 -0.02 0.00 1.25 0.00 0.00 34.83 34.53 1mvg s MET 107 CO 0.07 0.15 -0.17 0.08 1.05 0.00 0.00 175.02 176.20 1mvg s VAL 108 N 0.29 2.81 -0.11 10.11 1.01 -0.26 -0.93 120.40 133.33 1mvg s VAL 108 Ca -0.08 -0.80 -0.01 0.00 0.00 0.00 0.00 61.98 61.10 1mvg s VAL 108 Cb -0.13 -2.10 0.03 0.00 0.00 0.00 0.00 36.38 34.18 1mvg s VAL 108 CO 0.03 0.57 -0.05 -1.61 0.00 0.00 0.00 175.10 174.04 1mvg s GLU 109 N -0.38 1.21 -0.17 2.72 2.02 -0.18 -1.67 118.70 122.24 1mvg s GLU 109 Ca 0.04 -0.17 -0.01 0.00 0.02 0.00 0.00 54.97 54.85 1mvg s GLU 109 Cb -0.12 -1.46 0.04 0.00 0.10 0.00 0.00 34.13 32.70 1mvg s GLU 109 CO 0.02 -0.30 -0.05 0.99 0.02 0.00 0.00 175.26 175.94 1mvg s THR 110 N 1.79 1.09 -0.00 3.63 2.01 -0.56 -1.38 115.64 122.22 1mvg s THR 110 Ca 0.04 -0.66 0.02 0.00 0.31 0.00 0.00 61.69 61.40 1mvg s THR 110 Cb -0.13 -1.29 -0.00 0.00 0.01 0.00 0.00 72.50 71.08 1mvg s THR 110 CO -0.07 0.09 -0.05 -0.51 -0.69 0.00 0.00 174.62 173.38 1mvg s ILE 111 N 1.64 0.43 0.44 1.82 2.07 -0.72 -1.11 121.20 125.77 1mvg s ILE 111 Ca 0.00 -0.25 0.05 0.00 -1.41 0.00 0.00 60.65 59.04 1mvg s ILE 111 Cb -0.16 -0.37 -0.06 0.00 0.13 0.00 0.00 42.46 42.01 1mvg s ILE 111 CO -0.08 0.11 0.02 0.28 -1.91 0.00 0.00 174.94 173.36 1mvg s THR 112 N -0.16 1.79 -0.29 4.00 -1.32 -0.65 -0.50 115.64 118.52 1mvg s THR 112 Ca 0.02 -1.98 0.03 0.00 -1.21 0.00 0.00 61.69 58.54 1mvg s THR 112 Cb -0.02 -2.78 0.19 0.00 -1.51 0.00 0.00 72.50 68.38 1mvg s THR 112 CO -0.00 0.00 0.55 0.12 -2.21 0.00 0.00 174.62 173.08 1mvg s PHE 113 N -2.75 -1.59 0.00 9.09 5.36 0.36 -4.27 117.98 124.18 1mvg s PHE 113 Ca 0.28 1.10 0.00 0.00 -0.96 0.00 0.00 56.93 57.35 1mvg s PHE 113 Cb 0.08 0.28 0.00 0.00 -0.34 0.00 0.00 43.02 43.04 1mvg s PHE 113 CO 0.14 -1.00 0.00 0.41 -1.46 0.00 0.00 175.22 173.32 1mvg n GLY 114 N 5.41 2.43 1.60 13.12 0.00 -1.26 -1.30 105.19 125.19 1mvg n GLY 114 Ca 0.02 0.33 -0.10 0.00 0.00 0.00 0.00 46.02 46.27 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 4.56 2.95 -0.02 0.00 -1.26 -4.90 105.19 106.52 1mvg n GLY 115 Ca 0.00 -1.14 -0.29 0.00 0.00 0.00 0.00 46.02 44.59 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 -3.21 1.29 -0.11 1.61 1.01 -0.42 -5.13 120.40 115.45 1mvg s VAL 116 Ca 0.50 -0.52 0.03 0.00 0.00 0.00 0.00 61.98 61.99 1mvg s VAL 116 Cb 0.43 -1.29 0.00 0.00 0.00 0.00 0.00 36.38 35.52 1mvg s VAL 116 CO 0.06 0.36 -0.23 -0.89 0.00 0.00 0.00 175.10 174.39 1mvg s THR 117 N 1.59 2.03 -0.06 3.92 2.01 -1.26 -0.49 115.64 123.38 1mvg s THR 117 Ca 0.04 -0.99 0.04 0.00 0.31 0.00 0.00 61.69 61.09 1mvg s THR 117 Cb -0.13 -1.76 -0.02 0.00 0.01 0.00 0.00 72.50 70.59 1mvg s THR 117 CO -0.09 0.55 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.47 1mvg s LEU 118 N 0.50 2.64 -0.05 4.42 1.02 0.35 -4.80 118.68 122.76 1mvg s LEU 118 Ca -0.15 -0.25 0.02 0.00 0.02 0.00 0.00 54.13 53.77 1mvg s LEU 118 Cb -0.17 -1.53 0.01 0.00 0.02 0.00 0.00 46.19 44.52 1mvg s LEU 118 CO 0.05 0.32 -0.10 -0.51 0.02 0.00 0.00 176.35 176.14 1mvg s ILE 119 N -0.59 0.92 0.18 -0.59 -1.16 -0.84 -1.76 121.20 117.36 1mvg s ILE 119 Ca 0.08 -0.36 -0.14 0.00 -0.51 0.00 0.00 60.65 59.73 1mvg s ILE 119 Cb -0.11 -0.86 0.01 0.00 0.61 0.00 0.00 42.46 42.11 1mvg s ILE 119 CO 0.01 0.30 0.41 0.00 -2.81 0.00 0.00 174.94 172.85 1mvg s ARG 120 N 0.68 1.26 0.06 3.50 1.70 -0.48 -0.83 118.95 124.84 1mvg s ARG 120 Ca -0.13 -0.99 -0.16 0.00 -0.47 0.00 0.00 55.73 53.99 1mvg s ARG 120 Cb -0.15 0.45 0.03 0.00 -0.57 0.00 0.00 34.95 34.71 1mvg s ARG 120 CO 0.02 -0.50 0.36 -0.98 -1.08 0.00 0.00 175.30 173.12 1mvg s ARG 121 N -3.91 0.90 0.18 3.89 1.70 -0.38 -1.01 118.95 120.32 1mvg s ARG 121 Ca 0.12 -0.50 0.01 0.00 -0.47 0.00 0.00 55.73 54.89 1mvg s ARG 121 Cb 0.01 0.39 -0.05 0.00 -0.57 0.00 0.00 34.95 34.74 1mvg s ARG 121 CO -0.02 -0.31 0.04 -1.12 -1.08 0.00 0.00 175.30 172.81 1mvg s SER 122 N -2.20 0.96 -0.02 -2.89 0.01 -0.10 -0.91 113.70 108.55 1mvg s SER 122 Ca -0.03 -1.24 0.03 0.00 1.31 0.00 0.00 55.95 56.02 1mvg s SER 122 Cb -0.00 0.18 -0.00 0.00 0.21 0.00 0.00 66.02 66.41 1mvg s SER 122 CO -0.05 -0.65 -0.09 -0.75 0.41 0.00 0.00 173.24 172.11 1mvg s LYS 123 N -3.98 0.88 0.23 12.44 2.20 -0.24 -0.89 119.74 130.38 1mvg s LYS 123 Ca 0.28 -0.32 -0.32 0.00 -0.36 0.00 0.00 55.97 55.25 1mvg s LYS 123 Cb 0.07 -0.83 -0.12 0.00 -1.51 0.00 0.00 37.83 35.43 1mvg s LYS 123 CO 0.06 0.15 1.60 -2.13 -0.36 0.00 0.00 175.35 174.67 1mvg n ARG 124 N 3.12 2.52 0.00 4.03 0.63 -0.46 -1.01 116.66 125.49 1mvg n ARG 124 Ca -0.16 0.90 0.00 0.00 -0.92 0.00 0.00 57.85 57.67 1mvg n ARG 124 Cb 0.55 -2.68 0.00 0.00 0.45 0.00 0.00 32.46 30.78 1mvg n ARG 124 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67