#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vm6 s MET 1 N 0.00 0.99 -0.13 1.57 1.00 -1.26 -5.03 119.30 116.44 1vm6 s MET 1 Ca 0.00 -1.02 -0.12 0.00 0.00 0.00 0.00 55.69 54.55 1vm6 s MET 1 Cb 0.00 -1.11 -0.05 0.00 0.00 0.00 0.00 34.83 33.67 1vm6 s MET 1 CO 0.00 0.26 0.25 0.15 0.00 0.00 0.00 175.02 175.68 1vm6 s LYS 2 N -1.71 3.98 0.07 2.03 1.02 -1.26 -0.47 119.74 123.39 1vm6 s LYS 2 Ca 0.02 0.05 -0.03 0.00 0.02 0.00 0.00 55.97 56.03 1vm6 s LYS 2 Cb -0.10 -3.33 -0.03 0.00 -0.52 0.00 0.00 37.83 33.86 1vm6 s LYS 2 CO 0.03 0.47 0.04 1.52 -0.92 0.00 0.00 175.35 176.49 1vm6 s TYR 3 N -0.20 0.43 0.26 3.18 1.13 -0.05 0.23 117.35 122.32 1vm6 s TYR 3 Ca 0.16 -0.93 0.11 0.00 -1.41 0.00 0.00 57.07 55.00 1vm6 s TYR 3 Cb -0.13 -0.29 -0.05 0.00 -1.10 0.00 0.00 41.96 40.39 1vm6 s TYR 3 CO 0.05 -0.44 -0.10 0.20 -2.51 0.00 0.00 175.55 172.75 1vm6 s GLY 4 N -2.91 1.76 -0.10 5.49 0.00 -0.42 -0.74 107.32 110.40 1vm6 s GLY 4 Ca 0.07 -1.73 -0.00 0.00 0.00 0.00 0.00 44.72 43.06 1vm6 s GLY 4 CO -0.10 -1.80 -0.07 -0.42 0.00 0.00 0.00 173.10 170.71 1vm6 s ILE 5 N -2.32 0.95 -0.21 0.90 1.01 -0.60 -1.04 121.20 119.90 1vm6 s ILE 5 Ca 0.30 -0.27 -0.18 0.00 0.00 0.00 0.00 60.65 60.50 1vm6 s ILE 5 Cb -0.06 -0.97 -0.03 0.00 0.01 0.00 0.00 42.46 41.41 1vm6 s ILE 5 CO 0.17 0.35 0.52 -0.69 0.00 0.00 0.00 174.94 175.29 1vm6 s VAL 6 N 1.53 5.10 0.00 2.92 1.01 0.36 -1.30 120.40 130.03 1vm6 s VAL 6 Ca 0.01 0.95 0.00 0.00 0.00 0.00 0.00 61.98 62.94 1vm6 s VAL 6 Cb -0.13 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.41 1vm6 s VAL 6 CO -0.06 0.16 0.00 0.61 0.00 0.00 0.00 175.10 175.81 1vm6 n GLY 7 N 3.96 1.34 0.23 4.51 0.00 0.12 -1.95 105.19 113.40 1vm6 n GLY 7 Ca -0.05 -0.36 0.06 0.00 0.00 0.00 0.00 46.02 45.67 1vm6 n GLY 7 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1vm6 h TYR 8 N 0.00 0.00 0.00 1.61 -0.00 -1.61 -2.10 116.97 114.87 1vm6 h TYR 8 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1vm6 h TYR 8 Cb 0.40 -0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.13 1vm6 h TYR 8 CO 0.00 0.14 -0.34 0.66 -0.00 0.00 0.00 178.16 178.62 1vm6 h SER 9 N 0.00 0.00 -3.76 0.10 4.64 -1.88 -3.10 113.55 109.55 1vm6 h SER 9 Ca -0.00 -0.08 -0.43 0.00 -0.47 0.00 0.00 61.79 60.81 1vm6 h SER 9 Cb 0.24 0.00 0.19 0.00 -0.31 0.00 0.00 62.40 62.52 1vm6 h SER 9 CO 0.02 0.04 0.35 -0.83 -0.87 0.00 0.00 176.83 175.53 1vm6 s GLY 10 N -3.81 1.77 0.11 -0.77 0.00 -0.79 -4.75 107.32 99.07 1vm6 s GLY 10 Ca 0.07 -1.28 -0.26 0.00 0.00 0.00 0.00 44.72 43.25 1vm6 s GLY 10 CO 0.68 -0.41 1.65 3.21 0.00 0.00 0.00 173.10 178.23 1vm6 h ARG 11 N -2.05 -0.39 -0.63 2.90 3.08 -1.92 -1.49 114.38 113.89 1vm6 h ARG 11 Ca -0.43 0.03 -0.09 0.00 0.07 0.00 0.00 59.98 59.55 1vm6 h ARG 11 Cb 1.23 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 31.34 1vm6 h ARG 11 CO 0.30 -0.26 0.05 0.52 -1.07 0.00 0.00 179.97 179.51 1vm6 h MET 12 N -0.41 1.08 -0.84 0.04 2.86 -1.88 -2.90 114.93 112.89 1vm6 h MET 12 Ca 0.04 -0.32 0.08 0.00 -2.06 0.00 0.00 59.70 57.43 1vm6 h MET 12 Cb 0.44 -0.11 -0.07 0.00 0.06 0.00 0.00 31.60 31.92 1vm6 h MET 12 CO -0.15 1.03 0.50 0.78 1.06 0.00 0.00 176.91 180.14 1vm6 h GLY 13 N 0.99 1.29 1.84 8.32 0.00 -1.48 -0.05 103.07 113.97 1vm6 h GLY 13 Ca 0.18 -0.35 -0.16 0.00 0.00 0.00 0.00 47.33 47.01 1vm6 h GLY 13 CO 0.02 0.19 -0.70 1.46 0.00 0.00 0.00 176.54 177.51 1vm6 h GLN 14 N 0.88 0.16 -0.62 4.80 4.20 -1.20 -2.41 115.11 120.92 1vm6 h GLN 14 Ca 0.39 -0.13 -0.09 0.00 0.06 0.00 0.00 58.65 58.88 1vm6 h GLN 14 Cb 0.28 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 1vm6 h GLN 14 CO -0.21 0.80 0.05 0.93 -0.67 0.00 0.00 178.83 179.72 1vm6 h GLU 15 N 0.11 1.06 -0.48 1.46 4.39 -1.20 -2.81 114.58 117.12 1vm6 h GLU 15 Ca -0.02 -0.32 -0.06 0.00 0.34 0.00 0.00 59.36 59.31 1vm6 h GLU 15 Cb 1.25 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.77 1vm6 h GLU 15 CO 0.10 1.02 0.08 0.82 -1.16 0.00 0.00 179.01 179.87 1vm6 h ILE 16 N 0.97 1.25 -0.88 3.13 2.04 -0.90 -2.18 117.51 120.94 1vm6 h ILE 16 Ca 0.18 -0.91 0.04 0.00 1.00 0.00 0.00 64.86 65.18 1vm6 h ILE 16 Cb 0.51 0.91 -0.06 0.00 -0.74 0.00 0.00 36.82 37.44 1vm6 h ILE 16 CO 0.02 0.32 0.56 1.56 0.00 0.00 0.00 178.15 180.61 1vm6 h GLN 17 N 0.66 1.04 -0.02 2.37 4.20 -1.42 -0.37 115.11 121.57 1vm6 h GLN 17 Ca 0.15 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 1vm6 h GLN 17 Cb 0.38 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 27.93 1vm6 h GLN 17 CO 0.01 0.68 0.00 0.87 -0.67 0.00 0.00 178.83 179.73 1vm6 h LYS 18 N 1.07 0.03 -0.39 1.46 1.57 -1.32 -1.13 116.57 117.86 1vm6 h LYS 18 Ca 0.36 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 59.06 1vm6 h LYS 18 Cb 0.06 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1vm6 h LYS 18 CO -0.14 0.30 -0.05 0.28 -0.57 0.00 0.00 179.45 179.27 1vm6 h VAL 19 N -0.24 1.27 -0.24 0.50 2.07 -1.20 -1.91 116.25 116.50 1vm6 h VAL 19 Ca 0.01 -1.11 -0.12 0.00 0.82 0.00 0.00 66.70 66.29 1vm6 h VAL 19 Cb 0.28 1.20 -0.00 0.00 -1.52 0.00 0.00 31.29 31.25 1vm6 h VAL 19 CO 0.00 0.37 -0.34 -0.26 0.02 0.00 0.00 177.57 177.37 1vm6 h PHE 20 N 0.54 0.79 -0.29 1.57 -1.00 -1.11 -3.00 116.94 114.44 1vm6 h PHE 20 Ca 0.10 -0.26 -0.07 0.00 2.81 0.00 0.00 57.97 60.55 1vm6 h PHE 20 Cb 0.56 -0.16 -0.02 0.00 3.61 0.00 0.00 35.95 39.94 1vm6 h PHE 20 CO 0.05 1.01 -0.12 0.66 -1.61 0.00 0.00 178.31 178.29 1vm6 h SER 21 N 0.35 0.47 0.08 2.17 4.64 -1.20 -1.23 113.55 118.82 1vm6 h SER 21 Ca 0.02 -0.12 -0.02 0.00 -0.47 0.00 0.00 61.79 61.20 1vm6 h SER 21 Cb 0.92 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1vm6 h SER 21 CO 0.08 0.63 -0.09 -0.33 -0.87 0.00 0.00 176.83 176.24 1vm6 h GLU 22 N 0.45 0.04 -0.20 4.77 5.08 -1.30 -1.26 114.58 122.15 1vm6 h GLU 22 Ca 0.08 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1vm6 h GLU 22 Cb 0.49 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.73 1vm6 h GLU 22 CO 0.03 0.13 0.00 1.63 -1.00 0.00 0.00 179.01 179.80 1vm6 n LYS 23 N -4.41 1.70 -1.53 2.33 4.76 -0.92 -4.93 118.16 115.16 1vm6 n LYS 23 Ca -0.02 -1.06 -0.01 0.00 -2.87 0.00 0.00 58.31 54.35 1vm6 n LYS 23 Cb 0.18 -1.35 -0.00 0.00 -1.84 0.00 0.00 35.03 32.02 1vm6 n LYS 23 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1vm6 n GLY 24 N 1.08 0.38 3.90 0.72 0.00 -0.48 -4.90 105.19 105.90 1vm6 n GLY 24 Ca 0.15 -0.97 -0.29 0.00 0.00 0.00 0.00 46.02 44.91 1vm6 n GLY 24 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1vm6 s HIS 25 N -2.02 3.47 -0.20 1.61 3.76 -0.51 -4.55 115.29 116.85 1vm6 s HIS 25 Ca 0.00 0.76 -0.03 0.00 -0.15 0.00 0.00 55.06 55.64 1vm6 s HIS 25 Cb 0.00 -2.20 -0.01 0.00 1.11 0.00 0.00 32.58 31.47 1vm6 s HIS 25 CO 0.00 0.09 -0.05 -2.00 -0.85 0.00 0.00 174.74 171.93 1vm6 s GLU 26 N -3.65 3.43 -0.34 1.40 2.12 0.37 -4.17 118.70 117.87 1vm6 s GLU 26 Ca 0.46 -0.61 -0.27 0.00 0.36 0.00 0.00 54.97 54.91 1vm6 s GLU 26 Cb -0.11 -2.96 0.01 0.00 0.26 0.00 0.00 34.13 31.34 1vm6 s GLU 26 CO 0.30 -0.08 0.98 -1.17 -0.54 0.00 0.00 175.26 174.75 1vm6 s LEU 27 N 1.17 3.97 0.00 2.70 2.96 -1.26 -0.87 118.68 127.35 1vm6 s LEU 27 Ca 0.02 0.82 0.01 0.00 -0.22 0.00 0.00 54.13 54.76 1vm6 s LEU 27 Cb -0.14 -3.37 0.01 0.00 0.50 0.00 0.00 46.19 43.19 1vm6 s LEU 27 CO -0.01 -0.83 0.66 1.33 -1.32 0.00 0.00 176.35 176.18 1vm6 n VAL 28 N 5.87 0.25 -3.66 1.68 0.24 0.08 -4.94 118.33 117.86 1vm6 n VAL 28 Ca 0.09 -0.63 -0.07 0.00 -2.04 0.00 0.00 64.34 61.70 1vm6 n VAL 28 Cb 0.48 0.89 -0.08 0.00 -1.47 0.00 0.00 33.84 33.66 1vm6 n VAL 28 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1vm6 s LEU 29 N -0.32 -0.74 -0.10 1.34 2.96 -1.23 -0.20 118.68 120.39 1vm6 s LEU 29 Ca 0.02 1.28 0.02 0.00 -0.22 0.00 0.00 54.13 55.22 1vm6 s LEU 29 Cb 0.01 1.92 0.02 0.00 0.50 0.00 0.00 46.19 48.63 1vm6 s LEU 29 CO 0.01 -0.22 -0.13 -0.54 -1.32 0.00 0.00 176.35 174.15 1vm6 s LYS 30 N 2.10 1.98 -0.04 1.98 1.02 -0.30 -1.56 119.74 124.92 1vm6 s LYS 30 Ca -0.07 -0.48 0.03 0.00 0.02 0.00 0.00 55.97 55.47 1vm6 s LYS 30 Cb -0.09 -1.72 0.01 0.00 -0.52 0.00 0.00 37.83 35.51 1vm6 s LYS 30 CO -0.17 -0.07 -0.11 0.08 -0.92 0.00 0.00 175.35 174.16 1vm6 s VAL 31 N 1.00 0.99 0.05 3.17 1.01 -0.42 -0.19 120.40 126.02 1vm6 s VAL 31 Ca -0.07 -0.45 -0.01 0.00 0.00 0.00 0.00 61.98 61.45 1vm6 s VAL 31 Cb -0.15 -0.89 0.00 0.00 0.00 0.00 0.00 36.38 35.35 1vm6 s VAL 31 CO -0.01 0.31 0.08 -0.90 0.00 0.00 0.00 175.10 174.58 1vm6 n ASP 32 N 3.45 -0.23 0.32 3.32 5.75 -0.82 0.14 116.55 128.48 1vm6 n ASP 32 Ca -0.20 -1.28 0.21 0.00 -0.01 0.00 0.00 54.79 53.51 1vm6 n ASP 32 Cb 0.53 0.42 1.02 0.00 -1.03 0.00 0.00 41.12 42.06 1vm6 n ASP 32 CO 0.00 0.00 0.00 1.62 -0.11 0.00 0.00 177.20 178.71 1vm6 h VAL 33 N 1.15 0.02 0.00 2.12 3.04 -2.00 -2.67 116.25 117.92 1vm6 h VAL 33 Ca -0.04 -0.20 0.00 0.00 -1.01 0.00 0.00 66.70 65.45 1vm6 h VAL 33 Cb 0.18 1.19 0.00 0.00 -2.01 0.00 0.00 31.29 30.65 1vm6 h VAL 33 CO 0.06 0.00 -0.82 0.59 -1.01 0.00 0.00 177.57 176.39 1vm6 n ASN 34 N -3.11 0.65 0.00 3.17 4.13 -1.26 -5.04 115.26 113.80 1vm6 n ASN 34 Ca -0.02 -0.37 0.00 0.00 1.68 0.00 0.00 54.58 55.87 1vm6 n ASN 34 Cb 0.16 0.62 0.00 0.00 -1.54 0.00 0.00 39.78 39.01 1vm6 n ASN 34 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1vm6 n GLY 35 N 1.44 -1.74 3.31 7.41 0.00 -1.01 -5.13 105.19 109.48 1vm6 n GLY 35 Ca 0.04 -1.24 -0.31 0.00 0.00 0.00 0.00 46.02 44.50 1vm6 n GLY 35 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vm6 s VAL 36 N -2.77 2.04 -0.25 1.61 1.01 -1.26 -1.95 120.40 118.83 1vm6 s VAL 36 Ca 0.00 -1.11 -0.02 0.00 0.00 0.00 0.00 61.98 60.86 1vm6 s VAL 36 Cb 0.00 -1.70 0.08 0.00 0.00 0.00 0.00 36.38 34.76 1vm6 s VAL 36 CO 0.00 0.58 0.05 -0.70 0.00 0.00 0.00 175.10 175.03 1vm6 s GLU 37 N -0.61 0.80 -0.36 2.72 2.12 0.74 -5.00 118.70 119.10 1vm6 s GLU 37 Ca 0.10 -0.78 -0.12 0.00 0.36 0.00 0.00 54.97 54.54 1vm6 s GLU 37 Cb -0.10 -2.11 0.01 0.00 0.26 0.00 0.00 34.13 32.20 1vm6 s GLU 37 CO -0.01 -0.79 0.21 -1.21 -0.54 0.00 0.00 175.26 172.93 1vm6 s GLU 38 N 1.70 3.06 -0.21 4.30 2.02 -1.26 -1.15 118.70 127.15 1vm6 s GLU 38 Ca 0.03 -0.93 0.08 0.00 0.02 0.00 0.00 54.97 54.17 1vm6 s GLU 38 Cb -0.17 -3.75 -0.19 0.00 0.10 0.00 0.00 34.13 30.13 1vm6 s GLU 38 CO -0.16 -0.61 -0.09 1.28 0.02 0.00 0.00 175.26 175.71 1vm6 n LEU 39 N 5.04 1.68 -3.83 1.80 4.77 0.72 -5.01 117.00 122.18 1vm6 n LEU 39 Ca -0.12 -0.07 -0.07 0.00 -0.03 0.00 0.00 56.01 55.71 1vm6 n LEU 39 Cb 0.47 -0.27 0.01 0.00 -2.33 0.00 0.00 43.42 41.31 1vm6 n LEU 39 CO 0.37 0.70 0.56 -0.62 -1.33 0.00 0.00 177.39 177.07 1vm6 s ASP 40 N -5.83 -0.08 -0.26 -1.43 -1.08 -0.93 -5.06 116.67 102.01 1vm6 s ASP 40 Ca -0.22 -0.90 -0.23 0.00 -0.52 0.00 0.00 52.55 50.68 1vm6 s ASP 40 Cb 0.07 0.76 -0.01 0.00 -1.46 0.00 0.00 42.92 42.28 1vm6 s ASP 40 CO 0.63 -1.47 0.77 -0.94 0.52 0.00 0.00 175.17 174.69 1vm6 s SER 41 N -3.06 6.73 0.39 -0.34 1.04 -1.26 -4.65 113.70 112.56 1vm6 s SER 41 Ca 0.15 0.87 -0.23 0.00 0.48 0.00 0.00 55.95 57.22 1vm6 s SER 41 Cb -0.05 -2.41 -0.10 0.00 0.10 0.00 0.00 66.02 63.56 1vm6 s SER 41 CO 0.09 -0.50 0.97 -2.16 0.98 0.00 0.00 173.24 172.61 1vm6 s PRO 42 N 2.79 4.32 0.08 4.02 0.04 -1.26 -4.84 135.00 140.14 1vm6 s PRO 42 Ca 0.32 1.27 0.01 0.00 0.04 0.00 0.00 61.00 62.65 1vm6 s PRO 42 Cb -0.15 -2.45 -0.25 0.00 0.04 0.00 0.00 34.50 31.69 1vm6 s PRO 42 CO 0.09 0.04 1.14 -0.44 0.04 0.00 0.00 177.00 177.87 1vm6 h ASP 43 N 2.43 0.22 -4.57 6.66 3.32 -0.58 -3.41 116.42 120.49 1vm6 h ASP 43 Ca -0.48 -0.25 -0.16 0.00 0.02 0.00 0.00 57.03 56.16 1vm6 h ASP 43 Cb 1.19 -0.07 -0.23 0.00 0.22 0.00 0.00 39.33 40.44 1vm6 h ASP 43 CO 0.62 1.20 -0.54 -0.69 -1.72 0.00 0.00 179.24 178.11 1vm6 s VAL 44 N -2.67 0.06 -0.05 -1.35 1.01 -1.17 -2.31 120.40 113.93 1vm6 s VAL 44 Ca -0.02 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 61.51 1vm6 s VAL 44 Cb 0.08 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 36.11 1vm6 s VAL 44 CO 0.85 -0.27 -0.16 -0.69 0.00 0.00 0.00 175.10 174.83 1vm6 s VAL 45 N -0.90 2.89 -0.20 2.92 1.01 0.33 -1.30 120.40 125.15 1vm6 s VAL 45 Ca -0.10 -0.79 -0.02 0.00 0.00 0.00 0.00 61.98 61.07 1vm6 s VAL 45 Cb -0.06 -2.12 0.00 0.00 0.00 0.00 0.00 36.38 34.21 1vm6 s VAL 45 CO 0.01 0.59 -0.10 -0.63 0.00 0.00 0.00 175.10 174.96 1vm6 s ILE 46 N -0.68 2.92 -0.29 2.22 -1.09 -0.20 -0.49 121.20 123.59 1vm6 s ILE 46 Ca 0.10 -0.65 0.03 0.00 -2.23 0.00 0.00 60.65 57.90 1vm6 s ILE 46 Cb -0.11 -2.29 0.08 0.00 -1.58 0.00 0.00 42.46 38.56 1vm6 s ILE 46 CO 0.00 0.47 -0.03 -0.62 -1.23 0.00 0.00 174.94 173.54 1vm6 s ASP 47 N 1.31 4.44 -0.51 3.58 -1.08 0.17 -0.48 116.67 124.09 1vm6 s ASP 47 Ca 0.04 -1.66 0.03 0.00 -0.52 0.00 0.00 52.55 50.44 1vm6 s ASP 47 Cb -0.14 -1.47 0.14 0.00 -1.46 0.00 0.00 42.92 39.99 1vm6 s ASP 47 CO -0.05 -0.28 0.29 -0.36 0.52 0.00 0.00 175.17 175.28 1vm6 s PHE 48 N 1.11 2.62 0.00 -5.34 0.40 -0.82 -0.73 117.98 115.22 1vm6 s PHE 48 Ca 0.00 -2.83 0.00 0.00 -0.60 0.00 0.00 56.93 53.50 1vm6 s PHE 48 Cb -0.19 -2.31 0.00 0.00 0.51 0.00 0.00 43.02 41.02 1vm6 s PHE 48 CO -0.08 -0.74 0.00 -1.13 0.70 0.00 0.00 175.22 173.98 1vm6 n SER 49 N 3.13 0.00 -3.66 1.36 3.41 -1.26 -4.37 113.62 112.23 1vm6 n SER 49 Ca 0.10 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.56 1vm6 n SER 49 Cb 0.34 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.21 1vm6 n SER 49 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1vm6 s SER 50 N 1.00 -0.44 0.50 4.04 0.15 -1.26 -4.92 113.70 112.78 1vm6 s SER 50 Ca 0.00 0.53 0.23 0.00 0.70 0.00 0.00 55.95 57.40 1vm6 s SER 50 Cb 0.00 0.56 1.31 0.00 -1.71 0.00 0.00 66.02 66.18 1vm6 s SER 50 CO 0.00 -0.45 1.98 -0.65 1.20 0.00 0.00 173.24 175.32 1vm6 h PRO 51 N 3.87 0.10 0.00 5.44 0.11 -1.88 -1.45 132.00 138.19 1vm6 h PRO 51 Ca -0.28 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1vm6 h PRO 51 Cb 1.16 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1vm6 h PRO 51 CO 0.35 0.07 0.00 0.93 -0.21 0.00 0.00 178.00 179.14 1vm6 h GLU 52 N 0.11 0.00 0.00 1.05 3.07 -1.97 -2.35 114.58 114.49 1vm6 h GLU 52 Ca 0.28 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.14 1vm6 h GLU 52 Cb 0.96 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.87 1vm6 h GLU 52 CO -0.03 0.00 -0.10 0.00 -1.40 0.00 0.00 179.01 177.48 1vm6 h ALA 53 N 2.01 0.95 -0.74 3.43 0.00 -1.68 -3.39 119.26 119.84 1vm6 h ALA 53 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.99 1vm6 h ALA 53 Cb 0.37 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.10 1vm6 h ALA 53 CO 0.00 0.00 0.40 1.25 0.00 0.00 0.00 179.25 180.90 1vm6 h LEU 54 N 0.00 0.57 -0.77 0.00 5.85 -1.47 -2.07 115.31 117.42 1vm6 h LEU 54 Ca 0.00 0.05 0.15 0.00 0.84 0.00 0.00 57.88 58.91 1vm6 h LEU 54 Cb 0.90 -0.06 -0.10 0.00 0.37 0.00 0.00 40.66 41.77 1vm6 h LEU 54 CO 0.00 0.34 0.31 -0.65 -0.34 0.00 0.00 178.44 178.10 1vm6 h PRO 55 N 0.70 0.43 -0.31 5.25 0.11 -1.79 0.32 132.00 136.71 1vm6 h PRO 55 Ca 0.35 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 66.34 1vm6 h PRO 55 Cb 0.30 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.30 1vm6 h PRO 55 CO -0.23 0.29 -0.17 -0.22 -0.21 0.00 0.00 178.00 177.45 1vm6 h LYS 56 N 0.44 0.67 -0.28 1.05 1.63 -1.69 -2.22 116.57 116.16 1vm6 h LYS 56 Ca 0.43 -0.30 0.06 0.00 -0.85 0.00 0.00 60.65 59.99 1vm6 h LYS 56 Cb 0.66 -0.01 -0.06 0.00 -0.60 0.00 0.00 32.23 32.22 1vm6 h LYS 56 CO -0.41 0.89 -0.09 1.15 -3.45 0.00 0.00 179.45 177.54 1vm6 h THR 57 N 0.43 0.67 -0.21 1.00 2.02 -0.79 -0.45 112.91 115.57 1vm6 h THR 57 Ca 0.07 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.27 1vm6 h THR 57 Cb 0.70 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 1vm6 h THR 57 CO 0.05 0.00 0.07 0.58 0.37 0.00 0.00 175.52 176.58 1vm6 h VAL 58 N -0.03 0.94 -0.69 3.16 2.07 -0.91 -1.47 116.25 119.32 1vm6 h VAL 58 Ca 0.14 -0.06 0.03 0.00 0.82 0.00 0.00 66.70 67.63 1vm6 h VAL 58 Cb 0.24 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 1vm6 h VAL 58 CO -0.31 0.03 0.43 0.44 0.02 0.00 0.00 177.57 178.18 1vm6 h ASP 59 N 0.16 0.71 -0.36 0.57 3.32 -1.02 -0.94 116.42 118.87 1vm6 h ASP 59 Ca 0.09 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.11 1vm6 h ASP 59 Cb 0.07 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 1vm6 h ASP 59 CO -0.10 0.50 0.11 -0.07 -1.72 0.00 0.00 179.24 177.96 1vm6 h LEU 60 N 0.85 0.52 -0.93 1.55 3.38 -0.90 -0.36 115.31 119.42 1vm6 h LEU 60 Ca 0.27 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1vm6 h LEU 60 Cb 0.00 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 1vm6 h LEU 60 CO -0.10 0.58 0.53 0.00 0.09 0.00 0.00 178.44 179.54 1vm6 h LYS 62 N 1.29 0.58 -0.56 0.00 1.57 -1.03 0.72 116.57 119.14 1vm6 h LYS 62 Ca 0.33 -0.12 0.07 0.00 -1.87 0.00 0.00 60.65 59.05 1vm6 h LYS 62 Cb -0.01 -0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.16 1vm6 h LYS 62 CO -0.06 0.59 0.25 -0.22 -0.57 0.00 0.00 179.45 179.44 1vm6 h LYS 63 N 0.46 0.46 -0.50 3.15 3.64 -0.54 -2.99 116.57 120.26 1vm6 h LYS 63 Ca 0.12 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1vm6 h LYS 63 Cb 0.25 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1vm6 h LYS 63 CO -0.00 0.30 0.00 0.66 -2.27 0.00 0.00 179.45 178.14 1vm6 n TYR 64 N -4.93 0.65 -4.17 1.91 4.01 -0.57 -4.95 117.16 109.11 1vm6 n TYR 64 Ca 0.06 -0.33 -0.31 0.00 -0.16 0.00 0.00 57.90 57.16 1vm6 n TYR 64 Cb 0.20 -0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.15 1vm6 n TYR 64 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1vm6 n ARG 65 N 1.52 -0.82 -3.85 -0.72 1.74 0.04 -4.89 116.66 109.68 1vm6 n ARG 65 Ca 0.21 0.07 -0.37 0.00 -0.77 0.00 0.00 57.85 56.99 1vm6 n ARG 65 Cb 0.61 -3.12 -0.06 0.00 -1.02 0.00 0.00 32.46 28.87 1vm6 n ARG 65 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1vm6 s ALA 66 N -4.17 3.86 0.99 7.54 0.00 -0.03 -4.99 121.76 124.96 1vm6 s ALA 66 Ca 0.08 -0.62 -0.11 0.00 0.00 0.00 0.00 51.96 51.31 1vm6 s ALA 66 Cb -0.05 -2.00 0.19 0.00 0.00 0.00 0.00 23.12 21.26 1vm6 s ALA 66 CO 0.92 0.58 1.11 0.20 0.00 0.00 0.00 175.76 178.57 1vm6 s GLY 67 N -0.94 1.64 -0.06 0.00 0.00 -0.98 -4.73 107.32 102.26 1vm6 s GLY 67 Ca 0.15 0.34 0.02 0.00 0.00 0.00 0.00 44.72 45.23 1vm6 s GLY 67 CO 0.04 0.86 -0.10 -2.27 0.00 0.00 0.00 173.10 171.62 1vm6 s LEU 68 N -6.77 1.55 -0.35 0.66 2.96 -0.75 -0.51 118.68 115.47 1vm6 s LEU 68 Ca 0.67 -0.26 -0.09 0.00 -0.22 0.00 0.00 54.13 54.23 1vm6 s LEU 68 Cb -0.23 -0.74 0.03 0.00 0.50 0.00 0.00 46.19 45.75 1vm6 s LEU 68 CO 0.60 0.01 0.15 -0.69 -1.32 0.00 0.00 176.35 175.10 1vm6 s VAL 69 N 0.76 4.24 -0.21 1.68 1.01 0.36 -0.74 120.40 127.51 1vm6 s VAL 69 Ca -0.13 -0.91 -0.02 0.00 0.00 0.00 0.00 61.98 60.92 1vm6 s VAL 69 Cb -0.15 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.89 1vm6 s VAL 69 CO 0.02 -0.16 -0.10 -0.22 0.00 0.00 0.00 175.10 174.64 1vm6 s LEU 70 N 1.50 2.61 -0.00 3.92 2.96 -0.03 -0.66 118.68 128.98 1vm6 s LEU 70 Ca 0.01 -0.48 0.09 0.00 -0.22 0.00 0.00 54.13 53.53 1vm6 s LEU 70 Cb -0.19 -1.64 -0.11 0.00 0.50 0.00 0.00 46.19 44.75 1vm6 s LEU 70 CO 0.05 -0.01 0.34 0.61 -1.32 0.00 0.00 176.35 176.01 1vm6 n GLY 71 N 4.72 -0.01 3.57 7.98 0.00 0.09 -1.70 105.19 119.84 1vm6 n GLY 71 Ca -0.19 -0.25 -0.49 0.00 0.00 0.00 0.00 46.02 45.09 1vm6 n GLY 71 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1vm6 n THR 72 N -1.38 0.95 -3.31 2.61 -1.04 -1.11 -4.71 114.28 106.29 1vm6 n THR 72 Ca 0.01 -0.24 -0.22 0.00 -2.04 0.00 0.00 64.05 61.56 1vm6 n THR 72 Cb 0.17 -0.78 0.04 0.00 -1.82 0.00 0.00 70.33 67.94 1vm6 n THR 72 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1vm6 s THR 73 N -0.26 1.98 -1.31 12.58 -4.23 -1.26 -4.66 115.64 118.48 1vm6 s THR 73 Ca 0.73 -1.16 -0.01 0.00 -1.18 0.00 0.00 61.69 60.07 1vm6 s THR 73 Cb -0.87 -2.13 0.00 0.00 1.34 0.00 0.00 72.50 70.84 1vm6 s THR 73 CO 0.53 0.00 0.17 0.00 -0.54 0.00 0.00 174.62 174.78 1vm6 n ALA 74 N -2.10 -0.57 -1.77 3.99 0.00 -1.26 -4.47 120.51 114.32 1vm6 n ALA 74 Ca 0.10 0.16 -0.38 0.00 0.00 0.00 0.00 53.44 53.33 1vm6 n ALA 74 Cb 0.62 -2.28 -0.02 0.00 0.00 0.00 0.00 19.45 17.77 1vm6 n ALA 74 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1vm6 s LEU 75 N -4.85 4.14 0.45 0.00 1.43 -1.26 -4.84 118.68 113.75 1vm6 s LEU 75 Ca 0.08 2.29 0.07 0.00 -1.03 0.00 0.00 54.13 55.54 1vm6 s LEU 75 Cb -0.04 -4.10 -0.01 0.00 0.03 0.00 0.00 46.19 42.07 1vm6 s LEU 75 CO 0.10 -0.71 0.34 -0.54 0.23 0.00 0.00 176.35 175.78 1vm6 s LYS 76 N -2.43 2.37 0.24 1.70 1.02 -1.26 -4.96 119.74 116.42 1vm6 s LYS 76 Ca 0.59 -1.75 -0.04 0.00 0.02 0.00 0.00 55.97 54.78 1vm6 s LYS 76 Cb -0.29 -2.20 0.45 0.00 -0.52 0.00 0.00 37.83 35.27 1vm6 s LYS 76 CO 0.36 -0.31 1.73 1.49 -0.92 0.00 0.00 175.35 177.70 1vm6 h GLU 77 N 1.03 0.41 -1.00 1.68 4.57 -1.99 0.51 114.58 119.79 1vm6 h GLU 77 Ca -0.40 -0.02 0.13 0.00 -1.18 0.00 0.00 59.36 57.88 1vm6 h GLU 77 Cb 1.27 -0.09 -0.09 0.00 -0.16 0.00 0.00 28.75 29.68 1vm6 h GLU 77 CO 0.60 0.27 0.63 0.93 -1.18 0.00 0.00 179.01 180.26 1vm6 h GLU 78 N 0.42 0.93 -0.35 1.92 3.07 -1.99 -0.82 114.58 117.76 1vm6 h GLU 78 Ca 0.41 -0.06 -0.17 0.00 -0.50 0.00 0.00 59.36 59.05 1vm6 h GLU 78 Cb 0.62 -0.21 -0.00 0.00 -0.84 0.00 0.00 28.75 28.32 1vm6 h GLU 78 CO -0.41 0.62 -0.44 0.45 -1.40 0.00 0.00 179.01 177.83 1vm6 h HIS 79 N 0.96 1.10 -0.64 4.33 3.86 -1.30 -2.44 115.15 121.01 1vm6 h HIS 79 Ca 0.51 -0.35 -0.06 0.00 -1.16 0.00 0.00 60.37 59.31 1vm6 h HIS 79 Cb 0.56 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.77 1vm6 h HIS 79 CO -0.00 1.17 0.17 -0.07 0.86 0.00 0.00 177.93 180.06 1vm6 h LEU 80 N 0.72 0.94 -0.42 2.43 3.38 -0.80 -1.95 115.31 119.62 1vm6 h LEU 80 Ca 0.05 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1vm6 h LEU 80 Cb 1.03 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 1vm6 h LEU 80 CO 0.10 0.91 0.17 1.56 0.09 0.00 0.00 178.44 181.27 1vm6 h GLN 81 N 0.96 0.62 -0.69 1.13 4.20 -1.05 -0.61 115.11 119.67 1vm6 h GLN 81 Ca 0.21 -0.11 -0.02 0.00 0.06 0.00 0.00 58.65 58.78 1vm6 h GLN 81 Cb 0.33 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.97 1vm6 h GLN 81 CO -0.00 0.58 0.34 0.52 -0.67 0.00 0.00 178.83 179.59 1vm6 h MET 82 N 0.53 0.98 -0.46 1.46 2.86 -1.24 -2.08 114.93 116.99 1vm6 h MET 82 Ca 0.14 -0.13 -0.13 0.00 -2.06 0.00 0.00 59.70 57.52 1vm6 h MET 82 Cb 0.18 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1vm6 h MET 82 CO -0.01 0.76 -0.22 1.25 1.06 0.00 0.00 176.91 179.75 1vm6 h LEU 83 N 0.98 0.99 -0.52 1.22 5.85 -1.05 -1.05 115.31 121.73 1vm6 h LEU 83 Ca 0.24 -0.40 0.00 0.00 0.84 0.00 0.00 57.88 58.56 1vm6 h LEU 83 Cb 0.09 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.83 1vm6 h LEU 83 CO -0.03 1.17 0.33 -0.09 -0.34 0.00 0.00 178.44 179.48 1vm6 h ARG 84 N 0.81 0.69 -0.55 1.25 9.65 -0.92 -0.88 114.38 124.42 1vm6 h ARG 84 Ca 0.10 -0.05 -0.01 0.00 -1.10 0.00 0.00 59.98 58.93 1vm6 h ARG 84 Cb 0.79 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 29.20 1vm6 h ARG 84 CO 0.07 0.47 0.32 1.49 2.80 0.00 0.00 179.97 185.11 1vm6 h GLU 85 N 0.70 0.76 -0.85 0.20 4.57 -1.13 -2.08 114.58 116.75 1vm6 h GLU 85 Ca 0.19 -0.08 0.00 0.00 -1.18 0.00 0.00 59.36 58.29 1vm6 h GLU 85 Cb -0.06 -0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 28.33 1vm6 h GLU 85 CO -0.04 0.57 0.54 1.25 -1.18 0.00 0.00 179.01 180.15 1vm6 h LEU 86 N 0.74 0.99 0.00 1.64 5.85 -0.95 -2.88 115.31 120.71 1vm6 h LEU 86 Ca 0.20 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1vm6 h LEU 86 Cb 0.02 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.80 1vm6 h LEU 86 CO -0.03 0.74 0.00 -1.54 -0.34 0.00 0.00 178.44 177.27 1vm6 n SER 87 N -4.47 0.00 0.23 1.25 3.41 -0.36 -0.71 113.62 112.98 1vm6 n SER 87 Ca 0.09 0.20 0.12 0.00 -0.26 0.00 0.00 58.87 59.02 1vm6 n SER 87 Cb 0.03 -0.35 0.37 0.00 -0.26 0.00 0.00 64.21 64.00 1vm6 n SER 87 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1vm6 h LYS 88 N 0.00 0.00 0.00 4.33 1.57 -1.37 -2.06 116.57 119.04 1vm6 h LYS 88 Ca 0.00 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.47 1vm6 h LYS 88 Cb 0.18 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.43 1vm6 h LYS 88 CO 0.00 0.11 -2.19 0.39 -0.57 0.00 0.00 179.45 177.19 1vm6 n GLU 89 N -3.17 0.74 -4.22 3.15 1.02 0.11 -4.90 120.64 113.37 1vm6 n GLU 89 Ca 0.02 0.09 -0.13 0.00 -0.02 0.00 0.00 57.16 57.12 1vm6 n GLU 89 Cb 0.46 -1.42 -0.10 0.00 -0.02 0.00 0.00 31.44 30.36 1vm6 n GLU 89 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1vm6 s VAL 90 N -2.42 0.78 0.26 2.62 -7.23 -0.93 -4.81 120.40 108.67 1vm6 s VAL 90 Ca -0.23 -1.98 -0.30 0.00 -1.81 0.00 0.00 61.98 57.66 1vm6 s VAL 90 Cb 0.07 -1.94 -0.09 0.00 0.56 0.00 0.00 36.38 34.97 1vm6 s VAL 90 CO 0.54 -0.64 1.03 -2.84 -0.31 0.00 0.00 175.10 172.88 1vm6 s PRO 91 N -3.86 4.73 -0.02 4.82 0.02 -1.26 -3.03 135.00 136.40 1vm6 s PRO 91 Ca 0.19 1.68 0.02 0.00 0.02 0.00 0.00 61.00 62.91 1vm6 s PRO 91 Cb 0.05 -3.23 0.00 0.00 0.02 0.00 0.00 34.50 31.35 1vm6 s PRO 91 CO 0.01 0.34 -0.09 0.08 -0.33 0.00 0.00 177.00 177.01 1vm6 s VAL 92 N -1.17 0.76 -0.23 3.83 1.01 -0.46 -1.82 120.40 122.32 1vm6 s VAL 92 Ca 0.43 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 62.07 1vm6 s VAL 92 Cb -0.30 -0.67 0.05 0.00 0.00 0.00 0.00 36.38 35.47 1vm6 s VAL 92 CO 0.37 0.23 -0.12 -0.69 0.00 0.00 0.00 175.10 174.90 1vm6 s VAL 93 N 0.13 2.00 -0.12 2.92 1.01 0.08 -1.29 120.40 125.14 1vm6 s VAL 93 Ca -0.02 -1.38 -0.00 0.00 0.00 0.00 0.00 61.98 60.58 1vm6 s VAL 93 Cb -0.08 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.22 1vm6 s VAL 93 CO 0.00 0.09 -0.10 -1.58 0.00 0.00 0.00 175.10 173.51 1vm6 s GLN 94 N 1.21 3.25 -0.13 2.72 -0.44 -1.26 -0.85 119.66 124.16 1vm6 s GLN 94 Ca -0.05 -0.62 -0.18 0.00 -2.50 0.00 0.00 55.36 52.00 1vm6 s GLN 94 Cb -0.18 -2.66 0.04 0.00 -1.64 0.00 0.00 33.01 28.57 1vm6 s GLN 94 CO -0.07 0.34 0.47 0.00 0.50 0.00 0.00 175.29 176.53 1vm6 s ALA 95 N 0.05 -1.17 -1.62 1.58 0.00 -0.69 -4.61 121.76 115.29 1vm6 s ALA 95 Ca -0.03 1.13 0.28 0.00 0.00 0.00 0.00 51.96 53.34 1vm6 s ALA 95 Cb -0.14 -0.50 1.02 0.00 0.00 0.00 0.00 23.12 23.49 1vm6 s ALA 95 CO 0.04 -0.25 1.73 0.66 0.00 0.00 0.00 175.76 177.94 1vm6 n TYR 96 N 2.24 0.00 -3.67 0.00 4.01 -1.26 -4.22 117.16 114.26 1vm6 n TYR 96 Ca -0.16 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.49 1vm6 n TYR 96 Cb 0.57 -0.18 -0.10 0.00 -0.31 0.00 0.00 39.34 39.32 1vm6 n TYR 96 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1vm6 s ASN 97 N -2.54 -0.37 -0.41 7.72 3.84 -1.26 -4.21 114.94 117.71 1vm6 s ASN 97 Ca 0.26 0.99 0.05 0.00 0.21 0.00 0.00 52.86 54.37 1vm6 s ASN 97 Cb 0.20 1.19 0.66 0.00 -0.55 0.00 0.00 41.25 42.74 1vm6 s ASN 97 CO 0.51 -0.22 1.85 0.49 -2.79 0.00 0.00 177.10 176.94 1vm6 n PHE 98 N 5.01 2.75 -3.80 0.43 3.72 -1.26 -4.89 117.46 119.41 1vm6 n PHE 98 Ca -0.14 -1.73 -0.29 0.00 -0.05 0.00 0.00 57.45 55.24 1vm6 n PHE 98 Cb 0.52 -0.86 -0.04 0.00 -0.94 0.00 0.00 39.48 38.16 1vm6 n PHE 98 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1vm6 s SER 99 N -1.42 6.40 0.07 4.37 1.04 -1.26 -3.91 113.70 118.99 1vm6 s SER 99 Ca 0.55 0.37 -0.22 0.00 0.48 0.00 0.00 55.95 57.13 1vm6 s SER 99 Cb 0.47 -2.00 -0.13 0.00 0.10 0.00 0.00 66.02 64.46 1vm6 s SER 99 CO 0.10 0.07 1.61 0.40 0.98 0.00 0.00 173.24 176.40 1vm6 h ILE 100 N 1.86 1.15 -0.49 -1.02 1.08 -1.94 -3.28 117.51 114.87 1vm6 h ILE 100 Ca -0.47 -0.44 0.02 0.00 -0.39 0.00 0.00 64.86 63.59 1vm6 h ILE 100 Cb 1.17 1.24 -0.03 0.00 -3.07 0.00 0.00 36.82 36.14 1vm6 h ILE 100 CO 0.72 0.13 0.30 1.23 -0.69 0.00 0.00 178.15 179.84 1vm6 h GLY 101 N 0.01 0.69 1.05 5.37 0.00 -1.99 -0.66 103.07 107.55 1vm6 h GLY 101 Ca 0.03 -0.22 -0.07 0.00 0.00 0.00 0.00 47.33 47.07 1vm6 h GLY 101 CO -0.00 0.20 0.15 -2.22 0.00 0.00 0.00 176.54 174.66 1vm6 h ILE 102 N 0.60 1.26 0.00 2.60 1.08 -1.97 -0.44 117.51 120.64 1vm6 h ILE 102 Ca 0.20 -0.97 -0.09 0.00 -0.39 0.00 0.00 64.86 63.60 1vm6 h ILE 102 Cb 0.01 0.61 -0.01 0.00 -3.07 0.00 0.00 36.82 34.36 1vm6 h ILE 102 CO -0.08 0.37 -0.43 0.78 -0.69 0.00 0.00 178.15 178.09 1vm6 h ASN 103 N 1.00 0.00 -0.10 1.72 2.35 -1.46 -0.22 115.58 118.87 1vm6 h ASN 103 Ca 0.21 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.86 1vm6 h ASN 103 Cb 0.39 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.76 1vm6 h ASN 103 CO 0.01 0.43 -0.34 0.58 -1.65 0.00 0.00 177.43 176.46 1vm6 h VAL 104 N 0.00 1.40 -0.45 2.81 2.07 -0.99 -3.32 116.25 117.76 1vm6 h VAL 104 Ca -0.00 -1.68 -0.08 0.00 0.82 0.00 0.00 66.70 65.75 1vm6 h VAL 104 Cb 1.07 2.21 -0.02 0.00 -1.52 0.00 0.00 31.29 33.03 1vm6 h VAL 104 CO 0.06 0.49 -0.05 -0.07 0.02 0.00 0.00 177.57 178.02 1vm6 h LEU 105 N -0.05 0.74 -0.76 2.57 3.38 -0.79 -2.97 115.31 117.43 1vm6 h LEU 105 Ca -0.01 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 57.79 1vm6 h LEU 105 Cb 0.97 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.48 1vm6 h LEU 105 CO 0.07 0.84 0.48 0.07 0.09 0.00 0.00 178.44 179.99 1vm6 h LYS 106 N 0.71 0.93 -0.74 1.13 2.10 -1.14 0.37 116.57 119.93 1vm6 h LYS 106 Ca 0.13 -0.06 -0.06 0.00 -2.00 0.00 0.00 60.65 58.67 1vm6 h LYS 106 Cb 0.50 -0.21 -0.03 0.00 -0.90 0.00 0.00 32.23 31.59 1vm6 h LYS 106 CO 0.03 0.61 0.24 -0.09 -2.00 0.00 0.00 179.45 178.24 1vm6 h ARG 107 N 0.95 1.15 -0.23 0.07 2.43 -1.66 -2.27 114.38 114.82 1vm6 h ARG 107 Ca 0.30 -0.24 -0.11 0.00 -0.81 0.00 0.00 59.98 59.12 1vm6 h ARG 107 Cb -0.02 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.35 1vm6 h ARG 107 CO -0.10 0.97 -0.31 0.74 -1.51 0.00 0.00 179.97 179.76 1vm6 h PHE 108 N 1.09 0.54 -0.03 2.20 -1.00 -0.94 -3.01 116.94 115.80 1vm6 h PHE 108 Ca 0.24 -0.13 -0.12 0.00 2.81 0.00 0.00 57.97 60.77 1vm6 h PHE 108 Cb 0.30 -0.13 -0.01 0.00 3.61 0.00 0.00 35.95 39.71 1vm6 h PHE 108 CO 0.02 0.74 -0.53 -0.07 -1.61 0.00 0.00 178.31 176.86 1vm6 h LEU 109 N 0.41 0.10 -1.09 1.54 3.38 -0.13 -0.73 115.31 118.79 1vm6 h LEU 109 Ca 0.05 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1vm6 h LEU 109 Cb 0.75 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.43 1vm6 h LEU 109 CO 0.06 0.62 0.50 0.28 0.09 0.00 0.00 178.44 179.99 1vm6 h SER 110 N 0.07 0.99 0.17 -0.43 0.02 -1.28 -1.08 113.55 112.02 1vm6 h SER 110 Ca -0.00 -0.05 -0.22 0.00 -0.84 0.00 0.00 61.79 60.67 1vm6 h SER 110 Cb 0.96 -0.25 0.03 0.00 0.14 0.00 0.00 62.40 63.28 1vm6 h SER 110 CO 0.07 0.76 -0.97 -0.33 -1.14 0.00 0.00 176.83 175.23 1vm6 h GLU 111 N 1.15 0.36 -0.57 3.45 4.39 -1.47 -3.33 114.58 118.56 1vm6 h GLU 111 Ca 0.30 -0.61 -0.04 0.00 0.34 0.00 0.00 59.36 59.35 1vm6 h GLU 111 Cb -0.05 0.23 -0.03 0.00 -0.10 0.00 0.00 28.75 28.80 1vm6 h GLU 111 CO -0.06 1.29 0.20 1.25 -1.16 0.00 0.00 179.01 180.54 1vm6 h LEU 112 N -0.24 0.77 -1.51 1.33 5.85 -1.01 -2.48 115.31 118.02 1vm6 h LEU 112 Ca -0.17 -0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.39 1vm6 h LEU 112 Cb 1.76 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.59 1vm6 h LEU 112 CO 0.18 0.71 -0.23 1.62 -0.34 0.00 0.00 178.44 180.38 1vm6 h VAL 113 N 0.82 1.17 -0.28 1.05 3.04 -1.34 -0.87 116.25 119.84 1vm6 h VAL 113 Ca 0.19 -0.83 -0.11 0.00 -1.01 0.00 0.00 66.70 64.94 1vm6 h VAL 113 Cb 0.20 1.43 -0.01 0.00 -2.01 0.00 0.00 31.29 30.90 1vm6 h VAL 113 CO -0.01 0.24 -0.29 0.11 -1.01 0.00 0.00 177.57 176.61 1vm6 h LYS 114 N 0.02 0.58 0.07 4.17 1.57 -1.55 -1.99 116.57 119.43 1vm6 h LYS 114 Ca 0.00 -0.24 -0.24 0.00 -1.87 0.00 0.00 60.65 58.29 1vm6 h LYS 114 Cb 0.42 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 1vm6 h LYS 114 CO 0.03 0.81 -1.11 0.28 -0.57 0.00 0.00 179.45 178.89 1vm6 h VAL 115 N 0.50 1.56 -1.37 0.50 2.07 -1.35 -3.32 116.25 114.84 1vm6 h VAL 115 Ca 0.06 -3.07 -0.66 0.00 0.82 0.00 0.00 66.70 63.85 1vm6 h VAL 115 Cb 0.75 2.83 -0.34 0.00 -1.52 0.00 0.00 31.29 33.01 1vm6 h VAL 115 CO 0.06 0.89 0.23 0.18 0.02 0.00 0.00 177.57 178.95 1vm6 n LEU 116 N -3.51 6.42 -0.11 2.57 4.77 -0.37 -4.79 117.00 121.97 1vm6 n LEU 116 Ca -0.05 -4.76 0.01 0.00 -0.03 0.00 0.00 56.01 51.18 1vm6 n LEU 116 Cb 0.96 -0.76 0.30 0.00 -2.33 0.00 0.00 43.42 41.59 1vm6 n LEU 116 CO 0.51 1.86 1.14 1.05 -1.33 0.00 0.00 177.39 180.63 1vm6 h GLU 117 N 2.47 0.77 -0.52 3.23 4.11 -1.47 -2.28 114.58 120.88 1vm6 h GLU 117 Ca 0.48 -0.07 0.00 0.00 0.07 0.00 0.00 59.36 59.84 1vm6 h GLU 117 Cb 0.74 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.84 1vm6 h GLU 117 CO 1.21 0.56 0.00 -0.40 0.07 0.00 0.00 179.01 180.45 1vm6 n ASP 118 N -4.40 2.80 -4.85 3.06 5.75 -1.26 -4.88 116.55 112.77 1vm6 n ASP 118 Ca 0.05 -2.00 -0.36 0.00 -0.01 0.00 0.00 54.79 52.47 1vm6 n ASP 118 Cb 0.09 -0.35 -0.06 0.00 -1.03 0.00 0.00 41.12 39.78 1vm6 n ASP 118 CO 0.00 0.00 0.00 0.26 -0.11 0.00 0.00 177.20 177.35 1vm6 s TRP 119 N -1.30 3.64 0.40 2.11 0.52 -0.86 -4.94 118.94 118.50 1vm6 s TRP 119 Ca 0.35 0.96 -0.25 0.00 0.02 0.00 0.00 56.10 57.19 1vm6 s TRP 119 Cb 0.18 -2.28 -0.09 0.00 -1.15 0.00 0.00 33.47 30.13 1vm6 s TRP 119 CO 0.24 0.53 1.10 -0.51 0.02 0.00 0.00 176.95 178.32 1vm6 s ASP 120 N -1.53 6.67 -0.02 2.95 1.01 0.23 -4.75 116.67 121.24 1vm6 s ASP 120 Ca 0.32 2.17 0.01 0.00 0.71 0.00 0.00 52.55 55.76 1vm6 s ASP 120 Cb -0.15 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.19 1vm6 s ASP 120 CO 0.17 -0.56 -0.04 -0.69 0.21 0.00 0.00 175.17 174.27 1vm6 s VAL 121 N -1.54 0.39 0.11 -1.27 1.01 -1.26 -0.21 120.40 117.63 1vm6 s VAL 121 Ca 0.57 -0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.43 1vm6 s VAL 121 Cb -0.26 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 35.68 1vm6 s VAL 121 CO 0.32 0.16 0.02 -1.61 0.00 0.00 0.00 175.10 173.99 1vm6 s GLU 122 N 0.51 0.83 -0.06 2.72 2.02 -0.64 -4.35 118.70 119.73 1vm6 s GLU 122 Ca -0.06 -1.37 0.06 0.00 0.02 0.00 0.00 54.97 53.62 1vm6 s GLU 122 Cb -0.09 0.20 -0.01 0.00 0.10 0.00 0.00 34.13 34.32 1vm6 s GLU 122 CO -0.00 -0.20 -0.25 0.42 0.02 0.00 0.00 175.26 175.25 1vm6 s ILE 123 N -3.98 2.07 -0.18 -1.63 1.01 0.18 -0.85 121.20 117.82 1vm6 s ILE 123 Ca 0.18 -1.06 -0.00 0.00 0.00 0.00 0.00 60.65 59.77 1vm6 s ILE 123 Cb 0.08 -1.75 0.01 0.00 0.01 0.00 0.00 42.46 40.81 1vm6 s ILE 123 CO -0.02 0.57 -0.16 -0.69 0.00 0.00 0.00 174.94 174.64 1vm6 s VAL 124 N -0.14 2.48 0.01 2.92 1.01 -0.09 -0.59 120.40 126.00 1vm6 s VAL 124 Ca -0.04 -0.81 0.08 0.00 0.00 0.00 0.00 61.98 61.21 1vm6 s VAL 124 Cb -0.14 -2.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.16 1vm6 s VAL 124 CO 0.04 0.51 -0.23 -1.83 0.00 0.00 0.00 175.10 173.59 1vm6 s GLU 125 N 1.16 1.73 -0.06 2.72 4.04 0.33 -0.13 118.70 128.49 1vm6 s GLU 125 Ca 0.01 -0.92 0.01 0.00 0.04 0.00 0.00 54.97 54.12 1vm6 s GLU 125 Cb -0.14 -1.77 0.02 0.00 0.02 0.00 0.00 34.13 32.26 1vm6 s GLU 125 CO -0.07 0.47 -0.07 0.99 -1.84 0.00 0.00 175.26 174.74 1vm6 s THR 126 N -0.67 0.77 0.12 1.83 2.01 -0.08 -0.69 115.64 118.94 1vm6 s THR 126 Ca 0.09 -0.24 -0.00 0.00 0.31 0.00 0.00 61.69 61.85 1vm6 s THR 126 Cb -0.09 -0.76 -0.04 0.00 0.01 0.00 0.00 72.50 71.62 1vm6 s THR 126 CO 0.00 0.28 0.03 -1.00 -0.69 0.00 0.00 174.62 173.25 1vm6 s HIS 127 N 0.98 0.87 0.79 4.92 3.76 -0.69 -0.92 115.29 125.00 1vm6 s HIS 127 Ca -0.10 -1.16 -0.15 0.00 -0.15 0.00 0.00 55.06 53.50 1vm6 s HIS 127 Cb -0.14 -0.50 0.02 0.00 1.11 0.00 0.00 32.58 33.06 1vm6 s HIS 127 CO 0.00 -0.44 0.77 -2.39 -0.85 0.00 0.00 174.74 171.83 1vm6 n HIS 128 N -0.09 -0.10 0.25 1.40 1.44 0.10 -0.70 115.22 117.52 1vm6 n HIS 128 Ca -0.07 0.35 0.16 0.00 -2.01 0.00 0.00 57.72 56.15 1vm6 n HIS 128 Cb 0.63 -1.97 0.87 0.00 0.12 0.00 0.00 29.99 29.64 1vm6 n HIS 128 CO 0.00 0.00 0.00 0.07 -2.81 0.00 0.00 176.34 173.60 1vm6 h ARG 129 N -0.73 0.00 -0.01 -1.40 0.11 -1.34 -2.34 114.38 108.67 1vm6 h ARG 129 Ca -0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.62 1vm6 h ARG 129 Cb 1.32 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.40 1vm6 h ARG 129 CO 0.43 0.00 -0.14 1.19 0.10 0.00 0.00 179.97 181.55 1vm6 n PHE 130 N -3.78 0.00 -1.83 4.08 3.72 -1.26 -4.87 117.46 113.52 1vm6 n PHE 130 Ca -0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 1vm6 n PHE 130 Cb 0.23 -0.06 -0.03 0.00 -0.94 0.00 0.00 39.48 38.68 1vm6 n PHE 130 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1vm6 s LYS 131 N -2.26 4.17 0.15 -1.08 2.20 -0.88 -4.88 119.74 117.17 1vm6 s LYS 131 Ca 0.30 2.45 0.04 0.00 -0.36 0.00 0.00 55.97 58.41 1vm6 s LYS 131 Cb 0.20 -3.63 -0.06 0.00 -1.51 0.00 0.00 37.83 32.83 1vm6 s LYS 131 CO 0.43 -0.79 1.35 0.87 -0.36 0.00 0.00 175.35 176.84 1vm6 h LYS 132 N 8.55 0.12 -5.34 4.03 1.57 -1.91 -3.45 116.57 120.13 1vm6 h LYS 132 Ca -0.44 -0.15 -0.62 0.00 -1.87 0.00 0.00 60.65 57.57 1vm6 h LYS 132 Cb 1.21 0.05 -0.14 0.00 0.08 0.00 0.00 32.23 33.43 1vm6 h LYS 132 CO 0.94 0.96 -0.53 0.16 -0.57 0.00 0.00 179.45 180.40 1vm6 s ASP 133 N -6.87 5.89 -0.02 0.86 -4.77 -1.26 -5.09 116.67 105.40 1vm6 s ASP 133 Ca -0.02 0.17 0.01 0.00 -3.30 0.00 0.00 52.55 49.42 1vm6 s ASP 133 Cb 0.10 -2.00 0.01 0.00 -1.09 0.00 0.00 42.92 39.95 1vm6 s ASP 133 CO 0.82 0.21 -0.02 0.00 0.70 0.00 0.00 175.17 176.88 1vm6 s ALA 134 N 0.17 0.33 0.76 2.11 0.00 -1.26 -4.13 121.76 119.74 1vm6 s ALA 134 Ca 0.06 0.00 -0.11 0.00 0.00 0.00 0.00 51.96 51.92 1vm6 s ALA 134 Cb -0.12 -0.21 0.05 0.00 0.00 0.00 0.00 23.12 22.84 1vm6 s ALA 134 CO -0.00 0.00 1.08 -1.25 0.00 0.00 0.00 175.76 175.59 1vm6 s PRO 135 N 0.50 2.40 0.73 0.00 0.04 -1.26 -5.12 135.00 132.29 1vm6 s PRO 135 Ca -0.05 0.81 -0.16 0.00 0.04 0.00 0.00 61.00 61.64 1vm6 s PRO 135 Cb -0.08 -1.94 0.04 0.00 0.04 0.00 0.00 34.50 32.56 1vm6 s PRO 135 CO -0.01 -1.44 1.25 -1.13 0.04 0.00 0.00 177.00 175.71 1vm6 n SER 136 N -3.34 1.53 -0.27 6.66 3.41 -1.26 -4.86 113.62 115.48 1vm6 n SER 136 Ca 0.07 0.70 0.04 0.00 -0.26 0.00 0.00 58.87 59.42 1vm6 n SER 136 Cb 0.55 -1.53 0.26 0.00 -0.26 0.00 0.00 64.21 63.22 1vm6 n SER 136 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1vm6 h GLY 137 N -0.23 1.23 1.06 5.00 0.00 -1.90 -2.00 103.07 106.23 1vm6 h GLY 137 Ca -0.48 -0.40 -0.05 0.00 0.00 0.00 0.00 47.33 46.40 1vm6 h GLY 137 CO 0.49 0.31 0.29 -0.84 0.00 0.00 0.00 176.54 176.79 1vm6 h THR 138 N 0.99 1.26 -0.69 4.70 2.02 -1.92 0.56 112.91 119.85 1vm6 h THR 138 Ca 0.36 -0.85 -0.02 0.00 0.77 0.00 0.00 66.41 66.67 1vm6 h THR 138 Cb 0.16 0.35 -0.03 0.00 -1.74 0.00 0.00 68.15 66.88 1vm6 h THR 138 CO -0.13 0.35 0.35 0.00 0.37 0.00 0.00 175.52 176.46 1vm6 h ALA 139 N 1.16 0.88 -0.57 6.16 0.00 -1.76 0.24 119.26 125.38 1vm6 h ALA 139 Ca 0.26 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1vm6 h ALA 139 Cb 0.25 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1vm6 h ALA 139 CO -0.02 0.42 0.22 0.82 0.00 0.00 0.00 179.25 180.69 1vm6 h ILE 140 N 0.95 1.23 -0.42 0.00 2.04 -1.08 -1.02 117.51 119.21 1vm6 h ILE 140 Ca 0.24 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.38 1vm6 h ILE 140 Cb 0.08 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 36.78 1vm6 h ILE 140 CO -0.03 0.28 0.27 0.25 0.00 0.00 0.00 178.15 178.92 1vm6 h LEU 141 N 0.78 0.48 -0.58 1.44 5.85 -0.49 -1.77 115.31 121.03 1vm6 h LEU 141 Ca 0.19 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.84 1vm6 h LEU 141 Cb 0.22 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1vm6 h LEU 141 CO -0.01 0.35 0.16 -0.07 -0.34 0.00 0.00 178.44 178.53 1vm6 h LEU 142 N 0.56 0.86 -0.88 2.25 3.38 -0.83 -1.55 115.31 119.10 1vm6 h LEU 142 Ca 0.15 -0.22 0.06 0.00 0.09 0.00 0.00 57.88 57.96 1vm6 h LEU 142 Cb -0.06 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.40 1vm6 h LEU 142 CO -0.03 0.86 0.56 -0.08 0.09 0.00 0.00 178.44 179.83 1vm6 h GLU 143 N 0.83 1.00 -0.60 1.13 4.81 -1.04 -1.21 114.58 119.50 1vm6 h GLU 143 Ca 0.18 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.28 1vm6 h GLU 143 Cb 0.32 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 1vm6 h GLU 143 CO -0.00 0.66 0.08 1.03 -0.73 0.00 0.00 179.01 180.05 1vm6 h SER 144 N 1.03 0.96 -0.26 1.04 0.87 -0.94 -2.47 113.55 113.78 1vm6 h SER 144 Ca 0.38 -0.27 -0.01 0.00 -1.23 0.00 0.00 61.79 60.66 1vm6 h SER 144 Cb 0.14 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.83 1vm6 h SER 144 CO -0.16 0.99 0.14 0.00 -0.53 0.00 0.00 176.83 177.26 1vm6 h ALA 145 N 1.01 1.68 0.00 6.23 0.00 -0.68 -1.68 119.26 125.81 1vm6 h ALA 145 Ca 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1vm6 h ALA 145 Cb 0.45 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1vm6 h ALA 145 CO 0.01 0.26 0.00 1.28 0.00 0.00 0.00 179.25 180.81 1vm6 n LEU 146 N -4.43 0.14 -0.50 0.00 4.77 -0.51 -3.60 117.00 112.87 1vm6 n LEU 146 Ca 0.01 0.53 -0.07 0.00 -0.03 0.00 0.00 56.01 56.45 1vm6 n LEU 146 Cb 0.12 -0.50 -0.03 0.00 -2.33 0.00 0.00 43.42 40.68 1vm6 n LEU 146 CO 0.36 -0.21 -0.06 0.61 -1.33 0.00 0.00 177.39 176.76 1vm6 n GLY 147 N 0.56 0.86 3.57 -0.72 0.00 -0.63 -4.95 105.19 103.87 1vm6 n GLY 147 Ca 0.05 -0.43 -0.09 0.00 0.00 0.00 0.00 46.02 45.55 1vm6 n GLY 147 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vm6 s LYS 148 N -2.23 1.22 0.18 1.61 -2.85 -1.23 -5.08 119.74 111.37 1vm6 s LYS 148 Ca 0.00 -0.54 -0.30 0.00 -1.00 0.00 0.00 55.97 54.13 1vm6 s LYS 148 Cb 0.00 0.50 -0.08 0.00 -2.06 0.00 0.00 37.83 36.19 1vm6 s LYS 148 CO 0.00 -0.54 1.22 0.45 0.10 0.00 0.00 175.35 176.57 1vm6 s SER 149 N -2.73 7.05 0.01 0.03 0.15 -1.26 -4.67 113.70 112.28 1vm6 s SER 149 Ca 0.06 2.26 0.00 0.00 0.70 0.00 0.00 55.95 58.97 1vm6 s SER 149 Cb -0.02 -2.61 -0.01 0.00 -1.71 0.00 0.00 66.02 61.67 1vm6 s SER 149 CO -0.06 -0.40 -0.03 -0.69 1.20 0.00 0.00 173.24 173.26 1vm6 s VAL 150 N 0.01 0.16 0.11 4.45 1.01 -1.26 -5.10 120.40 119.77 1vm6 s VAL 150 Ca 0.54 -0.44 -0.33 0.00 0.00 0.00 0.00 61.98 61.74 1vm6 s VAL 150 Cb -0.33 -0.21 -0.13 0.00 0.00 0.00 0.00 36.38 35.72 1vm6 s VAL 150 CO 0.37 -0.18 1.71 -2.65 0.00 0.00 0.00 175.10 174.35 1vm6 n PRO 151 N 2.41 2.38 -4.37 2.72 -0.02 -1.26 -4.87 135.00 131.99 1vm6 n PRO 151 Ca -0.17 0.86 -0.34 0.00 -2.02 0.00 0.00 63.50 61.83 1vm6 n PRO 151 Cb 0.58 -2.68 -0.14 0.00 -0.02 0.00 0.00 33.50 31.23 1vm6 n PRO 151 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1vm6 s ILE 152 N 1.99 3.25 -0.21 4.25 1.01 -1.26 -0.65 121.20 129.58 1vm6 s ILE 152 Ca 0.82 -0.57 -0.05 0.00 0.00 0.00 0.00 60.65 60.85 1vm6 s ILE 152 Cb -0.62 -2.42 -0.02 0.00 0.01 0.00 0.00 42.46 39.42 1vm6 s ILE 152 CO 0.40 0.48 -0.01 -1.00 0.00 0.00 0.00 174.94 174.81 1vm6 s HIS 153 N 0.81 3.01 -0.27 3.97 3.76 0.25 -4.99 115.29 121.82 1vm6 s HIS 153 Ca -0.03 -0.60 -0.03 0.00 -0.15 0.00 0.00 55.06 54.25 1vm6 s HIS 153 Cb -0.15 -2.10 0.03 0.00 1.11 0.00 0.00 32.58 31.46 1vm6 s HIS 153 CO 0.01 -0.35 -0.01 -1.12 -0.85 0.00 0.00 174.74 172.43 1vm6 s SER 154 N 1.21 4.66 -0.08 1.40 0.01 -1.26 -0.52 113.70 119.12 1vm6 s SER 154 Ca 0.03 -0.90 -0.11 0.00 1.31 0.00 0.00 55.95 56.28 1vm6 s SER 154 Cb -0.15 -1.74 -0.05 0.00 0.21 0.00 0.00 66.02 64.30 1vm6 s SER 154 CO 0.01 -0.17 0.26 -0.76 0.41 0.00 0.00 173.24 172.98 1vm6 s LEU 155 N 1.36 4.40 -0.43 2.44 1.02 0.13 -5.01 118.68 122.59 1vm6 s LEU 155 Ca -0.00 0.66 0.03 0.00 0.02 0.00 0.00 54.13 54.83 1vm6 s LEU 155 Cb -0.17 -2.30 0.12 0.00 0.02 0.00 0.00 46.19 43.86 1vm6 s LEU 155 CO -0.02 0.34 0.20 -0.13 0.02 0.00 0.00 176.35 176.76 1vm6 s ARG 156 N -0.87 1.46 -0.05 1.70 1.81 -1.26 -1.71 118.95 120.03 1vm6 s ARG 156 Ca 0.18 -2.05 0.00 0.00 -1.72 0.00 0.00 55.73 52.14 1vm6 s ARG 156 Cb -0.14 -2.73 0.02 0.00 -0.45 0.00 0.00 34.95 31.65 1vm6 s ARG 156 CO 0.07 -1.09 -0.03 0.08 -0.68 0.00 0.00 175.30 173.66 1vm6 s VAL 157 N 0.41 0.47 0.00 3.52 1.01 0.12 -4.45 120.40 121.47 1vm6 s VAL 157 Ca 0.15 -0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.09 1vm6 s VAL 157 Cb -0.23 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 35.61 1vm6 s VAL 157 CO -0.04 0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.90 1vm6 n GLY 158 N 4.37 3.25 0.59 4.51 0.00 -1.26 -3.20 105.19 113.44 1vm6 n GLY 158 Ca -0.20 0.01 0.05 0.00 0.00 0.00 0.00 46.02 45.88 1vm6 n GLY 158 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vm6 n GLY 159 N 0.00 4.90 3.63 -0.02 0.00 -1.26 -1.38 105.19 111.05 1vm6 n GLY 159 Ca 0.00 -1.21 -0.43 0.00 0.00 0.00 0.00 46.02 44.37 1vm6 n GLY 159 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1vm6 n VAL 160 N -1.15 0.56 -0.36 1.61 0.31 -1.19 -4.71 118.33 113.41 1vm6 n VAL 160 Ca 0.21 -0.27 0.03 0.00 -0.01 0.00 0.00 64.34 64.31 1vm6 n VAL 160 Cb 0.77 -2.34 0.18 0.00 -0.91 0.00 0.00 33.84 31.54 1vm6 n VAL 160 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1vm6 h PRO 161 N 12.30 1.06 0.00 5.55 0.11 -1.89 0.32 132.00 149.45 1vm6 h PRO 161 Ca -0.45 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1vm6 h PRO 161 Cb 1.25 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 32.12 1vm6 h PRO 161 CO 0.95 0.70 0.00 0.41 -0.21 0.00 0.00 178.00 179.85 1vm6 n GLY 162 N -1.35 1.55 3.40 -0.55 0.00 -1.26 -4.78 105.19 102.20 1vm6 n GLY 162 Ca 0.16 0.43 -0.31 0.00 0.00 0.00 0.00 46.02 46.30 1vm6 n GLY 162 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vm6 s ASP 163 N 0.00 3.54 -0.03 1.61 1.01 -0.10 -1.30 116.67 121.41 1vm6 s ASP 163 Ca 0.00 -0.42 0.02 0.00 0.71 0.00 0.00 52.55 52.86 1vm6 s ASP 163 Cb 0.00 -0.53 0.01 0.00 1.01 0.00 0.00 42.92 43.41 1vm6 s ASP 163 CO 0.00 0.29 -0.05 -1.00 0.21 0.00 0.00 175.17 174.62 1vm6 s HIS 164 N -0.78 0.69 -0.10 4.23 3.76 -0.40 -0.90 115.29 121.79 1vm6 s HIS 164 Ca 0.12 -0.17 0.02 0.00 -0.15 0.00 0.00 55.06 54.88 1vm6 s HIS 164 Cb -0.10 -0.56 0.02 0.00 1.11 0.00 0.00 32.58 33.05 1vm6 s HIS 164 CO 0.02 -0.12 -0.14 0.08 -0.85 0.00 0.00 174.74 173.74 1vm6 s VAL 165 N 0.48 1.35 -0.27 -0.90 1.01 0.82 -0.36 120.40 122.53 1vm6 s VAL 165 Ca -0.06 -0.56 -0.09 0.00 0.00 0.00 0.00 61.98 61.27 1vm6 s VAL 165 Cb -0.10 -1.25 -0.03 0.00 0.00 0.00 0.00 36.38 35.00 1vm6 s VAL 165 CO 0.00 0.41 0.12 -0.69 0.00 0.00 0.00 175.10 174.94 1vm6 s VAL 166 N 0.99 4.63 -0.24 2.92 1.01 0.27 -0.91 120.40 129.06 1vm6 s VAL 166 Ca -0.07 -0.14 -0.07 0.00 0.00 0.00 0.00 61.98 61.70 1vm6 s VAL 166 Cb -0.15 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 1vm6 s VAL 166 CO -0.01 0.26 0.07 -0.69 0.00 0.00 0.00 175.10 174.73 1vm6 s VAL 167 N 1.65 4.35 -0.13 2.92 1.01 -0.03 -0.88 120.40 129.30 1vm6 s VAL 167 Ca 0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 61.98 61.86 1vm6 s VAL 167 Cb -0.16 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.17 1vm6 s VAL 167 CO 0.06 0.35 -0.05 -0.36 0.00 0.00 0.00 175.10 175.11 1vm6 s PHE 168 N 1.45 3.00 -0.02 5.22 0.40 0.57 -1.62 117.98 126.99 1vm6 s PHE 168 Ca 0.06 -0.20 0.01 0.00 -0.60 0.00 0.00 56.93 56.20 1vm6 s PHE 168 Cb -0.15 -1.88 0.01 0.00 0.51 0.00 0.00 43.02 41.51 1vm6 s PHE 168 CO 0.04 0.09 -0.05 0.20 0.70 0.00 0.00 175.22 176.19 1vm6 s GLY 169 N -0.04 0.33 0.45 4.36 0.00 0.70 -0.74 107.32 112.39 1vm6 s GLY 169 Ca 0.01 -0.14 0.05 0.00 0.00 0.00 0.00 44.72 44.63 1vm6 s GLY 169 CO 0.03 0.07 0.02 0.21 0.00 0.00 0.00 173.10 173.43 1vm6 s ASN 170 N 0.30 4.02 0.34 1.64 3.84 0.19 -0.60 114.94 124.67 1vm6 s ASN 170 Ca -0.03 -1.46 0.05 0.00 0.21 0.00 0.00 52.86 51.62 1vm6 s ASN 170 Cb -0.07 -0.03 0.69 0.00 -0.55 0.00 0.00 41.25 41.30 1vm6 s ASN 170 CO -0.00 -0.63 1.91 0.40 -2.79 0.00 0.00 177.10 175.99 1vm6 h ILE 171 N 1.57 0.97 -0.01 -5.21 1.08 -2.01 -3.10 117.51 110.80 1vm6 h ILE 171 Ca -0.44 -0.28 0.00 0.00 -0.39 0.00 0.00 64.86 63.75 1vm6 h ILE 171 Cb 1.27 0.08 0.00 0.00 -3.07 0.00 0.00 36.82 35.10 1vm6 h ILE 171 CO 0.77 0.15 -0.41 0.61 -0.69 0.00 0.00 178.15 178.59 1vm6 n GLY 172 N -1.42 -0.14 3.47 5.37 0.00 -1.26 -5.04 105.19 106.16 1vm6 n GLY 172 Ca 0.14 -0.42 -0.12 0.00 0.00 0.00 0.00 46.02 45.62 1vm6 n GLY 172 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1vm6 s GLU 173 N -1.93 1.08 0.04 1.61 -1.05 -1.17 -5.17 118.70 112.10 1vm6 s GLU 173 Ca 0.10 -0.28 0.04 0.00 -0.15 0.00 0.00 54.97 54.69 1vm6 s GLU 173 Cb 0.12 0.50 -0.02 0.00 -0.44 0.00 0.00 34.13 34.28 1vm6 s GLU 173 CO 0.43 -0.45 -0.12 0.99 0.95 0.00 0.00 175.26 177.06 1vm6 s THR 174 N -3.03 0.91 -0.06 1.83 2.01 -1.26 -0.64 115.64 115.39 1vm6 s THR 174 Ca 0.00 -0.99 0.02 0.00 0.31 0.00 0.00 61.69 61.03 1vm6 s THR 174 Cb -0.01 -0.86 0.01 0.00 0.01 0.00 0.00 72.50 71.66 1vm6 s THR 174 CO -0.08 -0.12 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.01 1vm6 s ILE 175 N -0.97 0.96 -0.11 1.82 1.01 0.08 -5.01 121.20 118.98 1vm6 s ILE 175 Ca -0.02 -0.38 0.03 0.00 0.00 0.00 0.00 60.65 60.28 1vm6 s ILE 175 Cb -0.08 -0.89 -0.00 0.00 0.01 0.00 0.00 42.46 41.49 1vm6 s ILE 175 CO 0.01 0.31 -0.21 -1.61 0.00 0.00 0.00 174.94 173.45 1vm6 s GLU 176 N 0.69 3.12 -0.31 2.79 2.02 -1.26 -0.32 118.70 125.43 1vm6 s GLU 176 Ca -0.13 -0.82 -0.02 0.00 0.02 0.00 0.00 54.97 54.01 1vm6 s GLU 176 Cb -0.15 -2.39 0.05 0.00 0.10 0.00 0.00 34.13 31.74 1vm6 s GLU 176 CO 0.03 0.20 0.02 0.42 0.02 0.00 0.00 175.26 175.95 1vm6 s ILE 177 N 0.31 3.07 -0.07 -1.63 -1.09 -0.06 -4.97 121.20 116.76 1vm6 s ILE 177 Ca -0.16 -1.41 0.03 0.00 -2.23 0.00 0.00 60.65 56.89 1vm6 s ILE 177 Cb -0.17 -2.79 -0.02 0.00 -1.58 0.00 0.00 42.46 37.90 1vm6 s ILE 177 CO 0.08 -0.15 -0.17 -0.75 -1.23 0.00 0.00 174.94 172.72 1vm6 s LYS 178 N 1.26 2.72 -0.04 2.79 2.20 -1.26 -0.56 119.74 126.85 1vm6 s LYS 178 Ca -0.04 -0.75 0.07 0.00 -0.36 0.00 0.00 55.97 54.89 1vm6 s LYS 178 Cb -0.20 -2.38 -0.01 0.00 -1.51 0.00 0.00 37.83 33.73 1vm6 s LYS 178 CO -0.01 0.46 -0.24 -1.58 -0.36 0.00 0.00 175.35 173.62 1vm6 s HIS 179 N -0.32 2.24 -0.11 4.03 5.65 0.52 -5.01 115.29 122.28 1vm6 s HIS 179 Ca 0.02 -0.54 0.01 0.00 0.25 0.00 0.00 55.06 54.80 1vm6 s HIS 179 Cb -0.13 -1.46 0.02 0.00 -1.18 0.00 0.00 32.58 29.84 1vm6 s HIS 179 CO 0.02 -0.12 -0.12 0.50 -0.65 0.00 0.00 174.74 174.38 1vm6 s ARG 180 N -0.36 1.88 -0.36 2.88 3.52 -1.26 -1.28 118.95 123.97 1vm6 s ARG 180 Ca 0.03 -0.42 -0.29 0.00 -0.13 0.00 0.00 55.73 54.93 1vm6 s ARG 180 Cb -0.11 -1.73 0.02 0.00 -1.56 0.00 0.00 34.95 31.57 1vm6 s ARG 180 CO 0.01 -0.16 1.07 0.00 -0.81 0.00 0.00 175.30 175.41 1vm6 s ALA 181 N 1.31 3.41 0.08 6.12 0.00 -0.42 -4.96 121.76 127.31 1vm6 s ALA 181 Ca -0.01 -0.19 -0.18 0.00 0.00 0.00 0.00 51.96 51.58 1vm6 s ALA 181 Cb -0.14 -3.71 -0.10 0.00 0.00 0.00 0.00 23.12 19.18 1vm6 s ALA 181 CO -0.05 -1.66 1.44 0.82 0.00 0.00 0.00 175.76 176.31 1vm6 h ILE 182 N 5.85 1.30 -4.43 0.00 2.04 -1.99 -3.37 117.51 116.91 1vm6 h ILE 182 Ca -0.21 -1.17 -0.20 0.00 1.00 0.00 0.00 64.86 64.27 1vm6 h ILE 182 Cb 1.06 1.55 -0.15 0.00 -0.74 0.00 0.00 36.82 38.55 1vm6 h ILE 182 CO 1.05 0.36 -0.58 -0.94 0.00 0.00 0.00 178.15 178.04 1vm6 s SER 183 N -6.17 0.19 0.60 1.72 1.04 -1.26 -4.85 113.70 104.98 1vm6 s SER 183 Ca -0.13 -1.26 0.39 0.00 0.48 0.00 0.00 55.95 55.43 1vm6 s SER 183 Cb 0.07 0.36 1.91 0.00 0.10 0.00 0.00 66.02 68.47 1vm6 s SER 183 CO 0.77 -0.81 2.18 0.03 0.98 0.00 0.00 173.24 176.38 1vm6 h ARG 184 N 2.69 0.00 -0.77 4.02 3.08 -1.93 -2.99 114.38 118.49 1vm6 h ARG 184 Ca -0.35 0.00 0.14 0.00 0.07 0.00 0.00 59.98 59.84 1vm6 h ARG 184 Cb 1.23 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.23 1vm6 h ARG 184 CO 0.54 0.00 0.51 1.15 -1.07 0.00 0.00 179.97 181.10 1vm6 h THR 185 N 0.00 0.83 -0.38 2.04 2.02 -1.95 -2.04 112.91 113.43 1vm6 h THR 185 Ca 0.00 -0.17 0.03 0.00 0.77 0.00 0.00 66.41 67.04 1vm6 h THR 185 Cb 0.24 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 1vm6 h THR 185 CO 0.00 0.09 0.25 1.62 0.37 0.00 0.00 175.52 177.85 1vm6 h VAL 186 N 0.50 1.03 0.01 3.16 3.04 -1.93 -0.37 116.25 121.69 1vm6 h VAL 186 Ca 0.37 -0.14 -0.22 0.00 -1.01 0.00 0.00 66.70 65.70 1vm6 h VAL 186 Cb 0.75 0.59 -0.00 0.00 -2.01 0.00 0.00 31.29 30.62 1vm6 h VAL 186 CO -0.13 0.08 -0.94 -0.26 -1.01 0.00 0.00 177.57 175.30 1vm6 h PHE 187 N 0.41 0.52 -0.50 3.17 0.04 -1.60 -2.29 116.94 116.70 1vm6 h PHE 187 Ca 0.15 -0.29 -0.12 0.00 2.80 0.00 0.00 57.97 60.51 1vm6 h PHE 187 Cb 0.10 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.17 1vm6 h PHE 187 CO -0.00 1.12 -0.15 0.00 -0.60 0.00 0.00 178.31 178.67 1vm6 h ALA 188 N 0.79 0.78 -0.65 2.45 0.00 -1.19 -0.95 119.26 120.49 1vm6 h ALA 188 Ca -0.07 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 1vm6 h ALA 188 Cb 1.58 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 19.17 1vm6 h ALA 188 CO 0.16 0.66 0.22 0.82 0.00 0.00 0.00 179.25 181.11 1vm6 h ILE 189 N 0.86 1.25 -0.39 0.00 2.04 -1.13 0.04 117.51 120.17 1vm6 h ILE 189 Ca 0.13 -0.82 0.01 0.00 1.00 0.00 0.00 64.86 65.18 1vm6 h ILE 189 Cb 0.71 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 1vm6 h ILE 189 CO 0.05 0.32 0.24 1.23 0.00 0.00 0.00 178.15 180.00 1vm6 h GLY 190 N 0.93 0.55 1.31 5.37 0.00 -1.25 -1.14 103.07 108.85 1vm6 h GLY 190 Ca 0.21 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 1vm6 h GLY 190 CO -0.01 0.17 0.38 0.00 0.00 0.00 0.00 176.54 177.09 1vm6 h ALA 191 N 1.16 1.42 -0.29 3.60 0.00 -0.86 0.07 119.26 124.36 1vm6 h ALA 191 Ca 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1vm6 h ALA 191 Cb -0.02 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1vm6 h ALA 191 CO -0.06 0.49 0.06 1.25 0.00 0.00 0.00 179.25 180.99 1vm6 h LEU 192 N 0.92 0.46 -0.76 0.00 5.85 -0.62 -0.53 115.31 120.62 1vm6 h LEU 192 Ca 0.24 -0.25 0.07 0.00 0.84 0.00 0.00 57.88 58.78 1vm6 h LEU 192 Cb -0.01 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 40.84 1vm6 h LEU 192 CO -0.04 0.58 0.45 0.11 -0.34 0.00 0.00 178.44 179.20 1vm6 h LYS 193 N 0.31 0.79 -0.52 1.25 1.57 -0.58 -0.94 116.57 118.44 1vm6 h LYS 193 Ca 0.09 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1vm6 h LYS 193 Cb 0.31 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 1vm6 h LYS 193 CO 0.00 0.52 0.22 0.00 -0.57 0.00 0.00 179.45 179.62 1vm6 h ALA 194 N 1.39 0.68 -0.66 3.86 0.00 -0.79 -0.79 119.26 122.94 1vm6 h ALA 194 Ca 0.34 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 1vm6 h ALA 194 Cb 0.21 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1vm6 h ALA 194 CO -0.19 0.28 0.14 0.00 0.00 0.00 0.00 179.25 179.48 1vm6 h ALA 195 N 1.06 0.99 -0.20 0.00 0.00 -0.58 -1.30 119.26 119.23 1vm6 h ALA 195 Ca 0.18 -0.25 -0.17 0.00 0.00 0.00 0.00 54.91 54.66 1vm6 h ALA 195 Cb 0.18 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1vm6 h ALA 195 CO -0.02 0.65 -0.57 0.93 0.00 0.00 0.00 179.25 180.25 1vm6 h GLU 196 N 1.01 0.63 -0.19 0.00 5.08 -1.04 -3.00 114.58 117.07 1vm6 h GLU 196 Ca 0.21 -0.41 0.04 0.00 -1.00 0.00 0.00 59.36 58.20 1vm6 h GLU 196 Cb 0.39 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 1vm6 h GLU 196 CO 0.01 1.02 -0.04 0.35 -1.00 0.00 0.00 179.01 179.35 1vm6 h PHE 197 N 0.48 -0.08 -0.20 4.33 3.57 -0.89 -3.11 116.94 121.04 1vm6 h PHE 197 Ca 0.01 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 1vm6 h PHE 197 Cb 1.13 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.92 1vm6 h PHE 197 CO 0.05 -0.07 0.07 -0.07 -2.23 0.00 0.00 178.31 176.06 1vm6 h LEU 198 N 0.01 0.25 -9.33 0.59 3.38 -1.18 -3.42 115.31 105.62 1vm6 h LEU 198 Ca 0.09 -0.02 -0.61 0.00 0.09 0.00 0.00 57.88 57.43 1vm6 h LEU 198 Cb 0.13 -0.06 0.03 0.00 0.09 0.00 0.00 40.66 40.84 1vm6 h LEU 198 CO -0.18 0.24 1.01 0.52 0.09 0.00 0.00 178.44 180.12 1vm6 n VAL 199 N -4.44 0.42 -0.82 1.22 0.31 -1.14 -1.36 118.33 112.52 1vm6 n VAL 199 Ca 0.00 -0.08 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 1vm6 n VAL 199 Cb 0.13 -1.75 0.00 0.00 -0.91 0.00 0.00 33.84 31.31 1vm6 n VAL 199 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1vm6 n GLY 200 N 4.12 1.21 3.84 2.92 0.00 -1.26 -5.02 105.19 110.99 1vm6 n GLY 200 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 1vm6 n GLY 200 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vm6 s LYS 201 N -0.06 3.82 0.74 1.61 -0.14 -0.47 -5.04 119.74 120.20 1vm6 s LYS 201 Ca 0.00 0.98 -0.14 0.00 -1.36 0.00 0.00 55.97 55.45 1vm6 s LYS 201 Cb 0.00 -2.12 0.04 0.00 -1.68 0.00 0.00 37.83 34.08 1vm6 s LYS 201 CO 0.00 -0.38 1.17 -0.51 -0.76 0.00 0.00 175.35 174.87 1vm6 s ASP 202 N -3.10 4.29 0.70 2.83 1.01 -1.26 -4.68 116.67 116.46 1vm6 s ASP 202 Ca 0.59 2.22 -0.16 0.00 0.71 0.00 0.00 52.55 55.91 1vm6 s ASP 202 Cb -0.11 -2.57 0.02 0.00 1.01 0.00 0.00 42.92 41.27 1vm6 s ASP 202 CO 0.34 -2.19 1.25 -2.84 0.21 0.00 0.00 175.17 171.94 1vm6 s PRO 203 N -4.09 2.26 0.00 8.23 0.02 -1.26 -4.41 135.00 135.74 1vm6 s PRO 203 Ca 0.71 1.92 0.00 0.00 0.02 0.00 0.00 61.00 63.65 1vm6 s PRO 203 Cb -0.26 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.44 1vm6 s PRO 203 CO 0.46 -1.79 0.00 0.41 -0.33 0.00 0.00 177.00 175.76 1vm6 n GLY 204 N 0.69 1.07 3.71 0.52 0.00 -0.78 -4.86 105.19 105.54 1vm6 n GLY 204 Ca 0.15 -1.79 -0.37 0.00 0.00 0.00 0.00 46.02 44.01 1vm6 n GLY 204 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1vm6 s MET 205 N -1.35 4.23 -0.08 1.61 -1.94 -1.26 -1.36 119.30 119.16 1vm6 s MET 205 Ca 0.00 0.10 0.03 0.00 -1.71 0.00 0.00 55.69 54.11 1vm6 s MET 205 Cb 0.00 -3.46 -0.02 0.00 2.01 0.00 0.00 34.83 33.36 1vm6 s MET 205 CO 0.00 0.16 -0.16 0.71 -0.01 0.00 0.00 175.02 175.72 1vm6 s TYR 206 N 0.71 2.68 0.45 -0.03 1.51 -0.41 -4.99 117.35 117.27 1vm6 s TYR 206 Ca 0.17 -0.43 -0.21 0.00 -1.01 0.00 0.00 57.07 55.59 1vm6 s TYR 206 Cb -0.13 -1.69 -0.10 0.00 -0.11 0.00 0.00 41.96 39.93 1vm6 s TYR 206 CO 0.05 -0.02 1.00 -1.54 -1.11 0.00 0.00 175.55 173.93 1vm6 s SER 207 N -0.27 6.66 0.56 2.29 1.04 -1.26 -4.20 113.70 118.52 1vm6 s SER 207 Ca 0.01 1.84 0.25 0.00 0.48 0.00 0.00 55.95 58.53 1vm6 s SER 207 Cb -0.13 -2.56 1.60 0.00 0.10 0.00 0.00 66.02 65.04 1vm6 s SER 207 CO 0.03 -0.55 2.20 0.15 0.98 0.00 0.00 173.24 176.05 1vm6 h PHE 208 N 1.87 0.00 -0.66 5.02 3.57 -1.96 -0.84 116.94 123.94 1vm6 h PHE 208 Ca -0.49 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 60.98 1vm6 h PHE 208 Cb 1.20 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.91 1vm6 h PHE 208 CO 0.59 0.01 0.28 1.49 -2.23 0.00 0.00 178.31 178.46 1vm6 h GLU 209 N 0.00 0.95 -0.29 1.11 4.81 -1.93 -0.85 114.58 118.38 1vm6 h GLU 209 Ca -0.00 -0.14 -0.10 0.00 -0.13 0.00 0.00 59.36 58.98 1vm6 h GLU 209 Cb 0.03 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 1vm6 h GLU 209 CO 0.00 0.76 -0.25 0.93 -0.73 0.00 0.00 179.01 179.72 1vm6 h GLU 210 N 0.94 0.56 -0.60 1.92 5.08 -1.55 0.20 114.58 121.13 1vm6 h GLU 210 Ca 0.22 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1vm6 h GLU 210 Cb 0.15 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 1vm6 h GLU 210 CO -0.02 0.76 0.39 0.28 -1.00 0.00 0.00 179.01 179.42 1vm6 h VAL 211 N 0.49 1.16 0.00 3.13 2.07 -0.80 -2.68 116.25 119.63 1vm6 h VAL 211 Ca 0.07 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1vm6 h VAL 211 Cb 0.69 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1vm6 h VAL 211 CO 0.05 0.16 0.00 0.40 0.02 0.00 0.00 177.57 178.20 1vm6 h ILE 212 N 0.82 0.00 -5.48 4.57 2.04 -0.81 -3.49 117.51 115.15 1vm6 h ILE 212 Ca 0.22 -0.78 0.00 0.00 1.00 0.00 0.00 64.86 65.31 1vm6 h ILE 212 Cb -0.08 1.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.74 1vm6 h ILE 212 CO -0.05 0.00 -1.04 0.49 0.00 0.00 0.00 178.15 177.56 1vm6 n PHE 213 N -2.86 -2.87 -0.69 1.37 3.72 0.51 -5.09 117.46 111.55 1vm6 n PHE 213 Ca 0.04 1.40 0.00 0.00 -0.05 0.00 0.00 57.45 58.84 1vm6 n PHE 213 Cb 0.46 -3.07 0.00 0.00 -0.94 0.00 0.00 39.48 35.93 1vm6 n PHE 213 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12