#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v6b s SER 2 N 0.00 -0.18 -0.27 1.61 0.01 -1.26 -5.16 113.70 108.45 1v6b s SER 2 Ca 0.00 0.09 -0.11 0.00 1.31 0.00 0.00 55.95 57.24 1v6b s SER 2 Cb 0.00 0.32 0.11 0.00 0.21 0.00 0.00 66.02 66.66 1v6b s SER 2 CO 0.00 -0.42 0.62 -1.83 0.41 0.00 0.00 173.24 172.02 1v6b s GLU 3 N -1.24 0.57 0.00 12.44 -1.05 -1.26 -4.82 118.70 123.34 1v6b s GLU 3 Ca -0.13 1.30 0.00 0.00 -0.15 0.00 0.00 54.97 55.99 1v6b s GLU 3 Cb -0.05 0.55 0.00 0.00 -0.44 0.00 0.00 34.13 34.18 1v6b s GLU 3 CO 0.04 -0.19 0.00 0.41 0.95 0.00 0.00 175.26 176.47 1v6b n GLY 4 N 5.06 0.88 1.29 -3.83 0.00 -1.26 -5.11 105.19 102.22 1v6b n GLY 4 Ca -0.14 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1v6b n GLY 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v6b n ALA 5 N -3.00 -1.86 0.00 4.61 0.00 -1.26 -4.57 120.51 114.43 1v6b n ALA 5 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1v6b n ALA 5 Cb 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.21 1v6b n ALA 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v6b n ALA 6 N -0.96 0.00 -0.14 0.00 0.00 -1.26 -4.11 120.51 114.04 1v6b n ALA 6 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1v6b n ALA 6 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 1v6b n ALA 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v6b h THR 7 N 0.00 1.12 -1.03 0.00 1.03 -1.96 -2.18 112.91 109.89 1v6b h THR 7 Ca 0.00 -0.25 0.26 0.00 -0.01 0.00 0.00 66.41 66.42 1v6b h THR 7 Cb 0.00 0.53 -0.11 0.00 -1.07 0.00 0.00 68.15 67.50 1v6b h THR 7 CO 0.00 0.12 0.63 -0.03 -0.01 0.00 0.00 175.52 176.23 1v6b h MET 8 N 0.56 0.47 -6.64 0.00 4.05 -1.88 -3.41 114.93 108.08 1v6b h MET 8 Ca 0.15 -0.03 -0.44 0.00 -0.28 0.00 0.00 59.70 59.10 1v6b h MET 8 Cb -0.04 -0.11 0.03 0.00 -0.80 0.00 0.00 31.60 30.69 1v6b h MET 8 CO -0.03 0.31 -0.14 -0.06 0.23 0.00 0.00 176.91 177.22 1v6b s PHE 9 N -5.65 2.47 0.53 1.39 0.40 -0.82 -5.06 117.98 111.24 1v6b s PHE 9 Ca -0.10 -0.34 -0.15 0.00 -0.60 0.00 0.00 56.93 55.74 1v6b s PHE 9 Cb 0.27 -2.50 -0.07 0.00 0.51 0.00 0.00 43.02 41.22 1v6b s PHE 9 CO 0.80 -0.79 0.98 0.45 0.70 0.00 0.00 175.22 177.36 1v6b s SER 10 N -4.46 6.52 0.30 1.36 0.15 -1.26 -4.87 113.70 111.45 1v6b s SER 10 Ca 0.58 1.50 0.26 0.00 0.70 0.00 0.00 55.95 58.98 1v6b s SER 10 Cb -0.09 -2.48 0.89 0.00 -1.71 0.00 0.00 66.02 62.63 1v6b s SER 10 CO 0.37 -0.64 1.76 1.55 1.20 0.00 0.00 173.24 177.48 1v6b h PRO 11 N 0.65 0.00 -0.56 5.44 0.13 -1.93 -2.60 132.00 133.13 1v6b h PRO 11 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1v6b h PRO 11 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1v6b h PRO 11 CO 0.62 0.00 0.00 -1.91 -0.23 0.00 0.00 178.00 176.48 1v6b n GLU 12 N -2.47 3.74 0.01 0.86 4.07 -1.26 -3.73 120.64 121.86 1v6b n GLU 12 Ca 0.03 -2.86 -0.02 0.00 -0.06 0.00 0.00 57.16 54.25 1v6b n GLU 12 Cb 0.35 -1.89 -0.01 0.00 -0.06 0.00 0.00 31.44 29.84 1v6b n GLU 12 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1v6b n GLN 13 N 0.78 0.08 -0.11 5.31 1.13 -1.00 -4.77 117.38 118.79 1v6b n GLN 13 Ca 0.24 0.03 -0.11 0.00 -1.94 0.00 0.00 57.00 55.23 1v6b n GLN 13 Cb 0.90 -0.63 -0.03 0.00 0.11 0.00 0.00 30.24 30.59 1v6b n GLN 13 CO 0.00 0.00 0.00 -0.84 -1.44 0.00 0.00 177.06 174.78 1v6b h ILE 14 N -0.14 1.26 -2.05 5.09 3.07 -1.72 -3.41 117.51 119.61 1v6b h ILE 14 Ca -0.04 -0.99 -0.64 0.00 1.55 0.00 0.00 64.86 64.74 1v6b h ILE 14 Cb 0.55 1.24 0.09 0.00 -0.27 0.00 0.00 36.82 38.43 1v6b h ILE 14 CO -0.03 0.33 0.16 0.00 -1.05 0.00 0.00 178.15 177.56 1v6b n ALA 15 N -2.39 -0.75 0.00 0.16 0.00 -1.24 -0.63 120.51 115.66 1v6b n ALA 15 Ca -0.02 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1v6b n ALA 15 Cb 0.28 -1.99 0.00 0.00 0.00 0.00 0.00 19.45 17.74 1v6b n ALA 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1v6b n GLY 16 N 1.74 2.30 3.90 0.00 0.00 -1.26 -4.95 105.19 106.92 1v6b n GLY 16 Ca 0.13 -0.52 -0.29 0.00 0.00 0.00 0.00 46.02 45.34 1v6b n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1v6b s LYS 17 N 0.00 1.45 -0.34 1.61 1.02 0.19 -5.06 119.74 118.62 1v6b s LYS 17 Ca 0.00 -0.04 0.01 0.00 0.02 0.00 0.00 55.97 55.96 1v6b s LYS 17 Cb 0.00 -1.91 0.11 0.00 -0.52 0.00 0.00 37.83 35.51 1v6b s LYS 17 CO 0.00 -1.92 0.11 0.16 -0.92 0.00 0.00 175.35 172.78 1v6b s ASP 18 N -4.62 4.17 0.13 2.83 -4.77 -1.26 -5.02 116.67 108.13 1v6b s ASP 18 Ca 0.66 -1.93 0.04 0.00 -3.30 0.00 0.00 52.55 48.02 1v6b s ASP 18 Cb -0.09 -1.10 -0.04 0.00 -1.09 0.00 0.00 42.92 40.60 1v6b s ASP 18 CO 0.51 -0.38 -0.10 0.54 0.70 0.00 0.00 175.17 176.43 1v6b s VAL 19 N 1.23 1.09 0.29 2.11 0.11 -1.26 0.91 120.40 124.87 1v6b s VAL 19 Ca 0.11 -1.89 -0.01 0.00 -2.93 0.00 0.00 61.98 57.26 1v6b s VAL 19 Cb -0.19 -1.66 -0.02 0.00 -1.53 0.00 0.00 36.38 32.99 1v6b s VAL 19 CO -0.17 -0.67 0.34 -0.13 -3.33 0.00 0.00 175.10 171.15 1v6b s ARG 20 N -3.36 1.64 -0.23 1.54 0.52 -0.87 -4.86 118.95 113.33 1v6b s ARG 20 Ca 0.12 -1.71 -0.02 0.00 -0.52 0.00 0.00 55.73 53.60 1v6b s ARG 20 Cb 0.00 0.38 0.01 0.00 0.52 0.00 0.00 34.95 35.86 1v6b s ARG 20 CO 0.00 -0.64 -0.08 -1.17 0.02 0.00 0.00 175.30 173.44 1v6b s LEU 21 N -3.22 2.92 -0.13 2.53 2.96 -1.26 -2.10 118.68 120.39 1v6b s LEU 21 Ca 0.34 -0.68 -0.06 0.00 -0.22 0.00 0.00 54.13 53.51 1v6b s LEU 21 Cb 0.02 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 45.01 1v6b s LEU 21 CO 0.18 -0.07 0.07 -0.76 -1.32 0.00 0.00 176.35 174.45 1v6b s LEU 22 N 1.37 3.95 -0.18 -0.68 1.43 0.11 -4.91 118.68 119.77 1v6b s LEU 22 Ca 0.03 0.24 -0.03 0.00 -1.03 0.00 0.00 54.13 53.34 1v6b s LEU 22 Cb -0.15 -1.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.10 1v6b s LEU 22 CO -0.05 0.32 -0.07 -0.60 0.23 0.00 0.00 176.35 176.17 1v6b s ARG 23 N -0.51 3.43 0.14 1.70 3.52 -1.26 0.12 118.95 126.09 1v6b s ARG 23 Ca 0.11 -0.63 0.05 0.00 -0.13 0.00 0.00 55.73 55.13 1v6b s ARG 23 Cb -0.12 -2.86 -0.04 0.00 -1.56 0.00 0.00 34.95 30.37 1v6b s ARG 23 CO 0.02 0.02 0.12 0.42 -0.81 0.00 0.00 175.30 175.07 1v6b s ILE 24 N 0.89 4.47 0.00 4.11 1.01 0.27 -4.91 121.20 127.04 1v6b s ILE 24 Ca -0.02 -1.02 -0.06 0.00 0.00 0.00 0.00 60.65 59.56 1v6b s ILE 24 Cb -0.15 -3.25 -0.05 0.00 0.01 0.00 0.00 42.46 39.03 1v6b s ILE 24 CO 0.01 -0.05 0.25 -0.75 0.00 0.00 0.00 174.94 174.40 1v6b s LYS 25 N -2.92 3.56 -0.99 2.79 2.20 -1.26 0.54 119.74 123.65 1v6b s LYS 25 Ca 0.30 -0.11 -0.17 0.00 -0.36 0.00 0.00 55.97 55.63 1v6b s LYS 25 Cb -0.11 -3.08 0.14 0.00 -1.51 0.00 0.00 37.83 33.28 1v6b s LYS 25 CO 0.23 0.65 1.18 0.15 -0.36 0.00 0.00 175.35 177.20 1v6b s LYS 26 N -1.78 3.71 -0.15 4.03 1.02 -0.06 -4.81 119.74 121.70 1v6b s LYS 26 Ca 0.27 -1.98 0.00 0.00 0.02 0.00 0.00 55.97 54.28 1v6b s LYS 26 Cb -0.13 -4.93 0.03 0.00 -0.52 0.00 0.00 37.83 32.28 1v6b s LYS 26 CO 0.16 -1.75 -0.10 -2.00 -0.92 0.00 0.00 175.35 170.75 1v6b s GLU 27 N 2.31 1.85 0.00 1.68 2.12 -1.26 -4.92 118.70 120.47 1v6b s GLU 27 Ca 0.34 -0.50 0.00 0.00 0.36 0.00 0.00 54.97 55.17 1v6b s GLU 27 Cb -0.05 -1.98 0.00 0.00 0.26 0.00 0.00 34.13 32.37 1v6b s GLU 27 CO -0.07 -0.32 0.00 0.41 -0.54 0.00 0.00 175.26 174.74 1v6b n GLY 28 N 4.83 2.09 3.76 -1.50 0.00 -1.26 -3.97 105.19 109.15 1v6b n GLY 28 Ca -0.14 0.06 -0.02 0.00 0.00 0.00 0.00 46.02 45.91 1v6b n GLY 28 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v6b s SER 29 N -2.46 -0.11 0.00 1.61 0.01 -1.26 -5.03 113.70 106.46 1v6b s SER 29 Ca 0.00 -0.42 0.00 0.00 1.31 0.00 0.00 55.95 56.84 1v6b s SER 29 Cb 0.00 0.42 0.00 0.00 0.21 0.00 0.00 66.02 66.65 1v6b s SER 29 CO 0.00 -0.80 0.01 -0.11 0.41 0.00 0.00 173.24 172.75 1v6b n LEU 30 N -0.54 1.34 -2.16 2.44 7.94 -1.26 0.17 117.00 124.94 1v6b n LEU 30 Ca -0.06 0.01 -0.01 0.00 -1.11 0.00 0.00 56.01 54.84 1v6b n LEU 30 Cb 0.61 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.56 1v6b n LEU 30 CO 0.15 0.00 -0.18 0.47 -1.11 0.00 0.00 177.39 176.72 1v6b n ASP 31 N -0.23 -5.17 -3.73 1.96 8.00 -1.26 -2.01 116.55 114.11 1v6b n ASP 31 Ca 0.00 0.63 -0.12 0.00 0.71 0.00 0.00 54.79 56.00 1v6b n ASP 31 Cb 0.00 -3.30 -0.13 0.00 -0.02 0.00 0.00 41.12 37.68 1v6b n ASP 31 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1v6b s LEU 32 N -1.13 0.40 -0.12 0.64 2.96 -1.26 -3.55 118.68 116.61 1v6b s LEU 32 Ca 0.04 0.56 -0.17 0.00 -0.22 0.00 0.00 54.13 54.34 1v6b s LEU 32 Cb -0.01 0.81 -0.04 0.00 0.50 0.00 0.00 46.19 47.45 1v6b s LEU 32 CO 0.41 -0.16 0.42 0.00 -1.32 0.00 0.00 176.35 175.70 1v6b s ALA 33 N 1.20 3.52 0.24 5.97 0.00 0.21 -4.99 121.76 127.92 1v6b s ALA 33 Ca -0.09 -0.26 0.11 0.00 0.00 0.00 0.00 51.96 51.72 1v6b s ALA 33 Cb -0.10 -2.56 -0.05 0.00 0.00 0.00 0.00 23.12 20.42 1v6b s ALA 33 CO -0.08 0.06 -0.19 -0.51 0.00 0.00 0.00 175.76 175.04 1v6b s LEU 34 N 0.45 2.60 0.17 0.00 1.43 -1.26 0.30 118.68 122.37 1v6b s LEU 34 Ca 0.23 -0.90 -0.19 0.00 -1.03 0.00 0.00 54.13 52.25 1v6b s LEU 34 Cb -0.15 -1.22 0.04 0.00 0.03 0.00 0.00 46.19 44.90 1v6b s LEU 34 CO 0.09 0.07 0.52 -1.83 0.23 0.00 0.00 176.35 175.43 1v6b s GLU 35 N -3.13 1.29 1.63 1.70 -1.05 -0.93 -4.61 118.70 113.59 1v6b s GLU 35 Ca 0.26 -0.73 0.00 0.00 -0.15 0.00 0.00 54.97 54.35 1v6b s GLU 35 Cb -0.07 0.53 0.00 0.00 -0.44 0.00 0.00 34.13 34.15 1v6b s GLU 35 CO 0.13 -0.54 0.00 0.41 0.95 0.00 0.00 175.26 176.21 1v6b n GLY 36 N -0.32 0.80 1.20 -3.83 0.00 -1.26 -2.22 105.19 99.56 1v6b n GLY 36 Ca -0.13 -1.33 0.14 0.00 0.00 0.00 0.00 46.02 44.70 1v6b n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v6b n GLY 37 N 0.00 -1.87 7.00 -0.02 0.00 0.28 -4.35 105.19 106.23 1v6b n GLY 37 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1v6b n GLY 37 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1v6b n VAL 38 N -3.66 0.00 -0.62 1.61 3.14 -1.22 -2.64 118.33 114.94 1v6b n VAL 38 Ca -0.02 0.00 -0.17 0.00 -2.96 0.00 0.00 64.34 61.19 1v6b n VAL 38 Cb 0.64 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.39 1v6b n VAL 38 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 1v6b n ASP 39 N -3.22 4.02 -4.97 6.55 8.00 -1.26 -4.68 116.55 120.98 1v6b n ASP 39 Ca 0.00 -2.22 -0.20 0.00 0.71 0.00 0.00 54.79 53.07 1v6b n ASP 39 Cb 0.00 -0.96 -0.02 0.00 -0.02 0.00 0.00 41.12 40.12 1v6b n ASP 39 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1v6b s SER 40 N 3.34 6.19 0.00 -2.24 1.04 -1.08 -4.99 113.70 115.96 1v6b s SER 40 Ca 0.35 -0.02 0.22 0.00 0.48 0.00 0.00 55.95 56.98 1v6b s SER 40 Cb 0.11 -1.66 0.93 0.00 0.10 0.00 0.00 66.02 65.50 1v6b s SER 40 CO -0.02 -0.18 1.70 -0.81 0.98 0.00 0.00 173.24 174.91 1v6b n PRO 41 N -1.47 0.00 0.10 4.02 -0.04 -1.26 -2.76 135.00 133.59 1v6b n PRO 41 Ca -0.06 0.12 -0.21 0.00 -0.04 0.00 0.00 63.50 63.31 1v6b n PRO 41 Cb 0.57 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.38 1v6b n PRO 41 CO 0.00 0.00 0.00 -0.24 -0.04 0.00 0.00 175.50 175.22 1v6b h VAL 42 N 0.00 1.18 0.00 0.52 3.04 -1.92 -3.47 116.25 115.59 1v6b h VAL 42 Ca 0.00 -2.71 0.00 0.00 -1.01 0.00 0.00 66.70 62.98 1v6b h VAL 42 Cb 0.38 2.89 0.00 0.00 -2.01 0.00 0.00 31.29 32.55 1v6b h VAL 42 CO 0.00 0.84 0.00 0.61 -1.01 0.00 0.00 177.57 178.01 1v6b n GLY 43 N 1.73 0.63 0.54 3.17 0.00 -1.11 -4.94 105.19 105.20 1v6b n GLY 43 Ca -0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.82 1v6b n GLY 43 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1v6b n LYS 44 N -2.41 0.15 -4.28 1.61 -0.00 -1.26 -4.92 118.16 107.05 1v6b n LYS 44 Ca 0.00 -0.35 -0.35 0.00 -0.00 0.00 0.00 58.31 57.61 1v6b n LYS 44 Cb 0.03 0.40 -0.09 0.00 -0.00 0.00 0.00 35.03 35.37 1v6b n LYS 44 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1v6b s VAL 45 N -2.77 4.53 -0.10 0.58 1.01 -1.26 0.10 120.40 122.49 1v6b s VAL 45 Ca 0.03 -0.16 -0.06 0.00 0.00 0.00 0.00 61.98 61.78 1v6b s VAL 45 Cb -0.01 -2.92 0.04 0.00 0.00 0.00 0.00 36.38 33.49 1v6b s VAL 45 CO 0.02 0.60 0.24 0.68 0.00 0.00 0.00 175.10 176.64 1v6b s VAL 46 N -0.86 -0.03 0.10 2.92 -7.23 -0.94 -2.52 120.40 111.84 1v6b s VAL 46 Ca 0.13 0.09 -0.31 0.00 -1.81 0.00 0.00 61.98 60.09 1v6b s VAL 46 Cb -0.11 -0.36 -0.10 0.00 0.56 0.00 0.00 36.38 36.37 1v6b s VAL 46 CO 0.03 0.04 1.89 -0.69 -0.31 0.00 0.00 175.10 176.06 1v6b s VAL 47 N 0.82 2.65 -0.05 1.32 1.01 -1.12 -2.19 120.40 122.84 1v6b s VAL 47 Ca -0.06 0.00 -0.25 0.00 0.00 0.00 0.00 61.98 61.67 1v6b s VAL 47 Cb -0.07 -3.00 -0.22 0.00 0.00 0.00 0.00 36.38 33.09 1v6b s VAL 47 CO -0.05 -0.00 1.07 -1.28 0.00 0.00 0.00 175.10 174.84 1v6b h SER 48 N 9.31 0.15 -4.09 3.32 0.87 -0.41 -0.03 113.55 122.67 1v6b h SER 48 Ca -0.48 -0.71 0.04 0.00 -1.23 0.00 0.00 61.79 59.41 1v6b h SER 48 Cb 1.23 -0.05 -0.23 0.00 -0.44 0.00 0.00 62.40 62.91 1v6b h SER 48 CO 0.95 0.84 0.43 0.00 -0.53 0.00 0.00 176.83 178.52 1v6b s ALA 49 N -3.36 -1.90 -0.73 6.23 0.00 -0.98 -4.80 121.76 116.22 1v6b s ALA 49 Ca -0.16 1.62 -0.10 0.00 0.00 0.00 0.00 51.96 53.32 1v6b s ALA 49 Cb 0.01 -0.76 0.19 0.00 0.00 0.00 0.00 23.12 22.56 1v6b s ALA 49 CO 0.72 -0.31 0.62 0.08 0.00 0.00 0.00 175.76 176.87 1v6b s VAL 50 N -0.74 4.90 -0.38 0.00 1.01 -1.26 -0.62 120.40 123.32 1v6b s VAL 50 Ca -0.02 -2.53 -0.41 0.00 0.00 0.00 0.00 61.98 59.02 1v6b s VAL 50 Cb -0.02 -4.09 -0.16 0.00 0.00 0.00 0.00 36.38 32.12 1v6b s VAL 50 CO 0.02 -0.96 1.92 -1.22 0.00 0.00 0.00 175.10 174.86 1v6b n TYR 51 N 3.95 1.72 -0.23 5.22 4.02 -1.23 -4.70 117.16 125.90 1v6b n TYR 51 Ca 0.09 0.61 0.18 0.00 -0.01 0.00 0.00 57.90 58.77 1v6b n TYR 51 Cb 0.43 -2.41 0.51 0.00 -0.02 0.00 0.00 39.34 37.85 1v6b n TYR 51 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 176.86 177.34 1v6b h GLU 52 N 8.53 0.40 -3.33 -0.72 4.57 -1.95 -2.87 114.58 119.20 1v6b h GLU 52 Ca -0.34 -0.02 -0.74 0.00 -1.18 0.00 0.00 59.36 57.08 1v6b h GLU 52 Cb 1.35 -0.09 -0.11 0.00 -0.16 0.00 0.00 28.75 29.74 1v6b h GLU 52 CO 1.01 0.26 2.51 0.41 -1.18 0.00 0.00 179.01 182.02 1v6b n GLY 53 N -1.52 4.76 3.85 1.92 0.00 -1.26 -4.65 105.19 108.29 1v6b n GLY 53 Ca 0.18 -1.94 -0.04 0.00 0.00 0.00 0.00 46.02 44.23 1v6b n GLY 53 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1v6b s GLY 54 N 1.29 0.08 0.30 -0.02 0.00 -1.08 -4.80 107.32 103.09 1v6b s GLY 54 Ca 0.47 -0.30 0.24 0.00 0.00 0.00 0.00 44.72 45.13 1v6b s GLY 54 CO -0.04 1.57 1.63 0.00 0.00 0.00 0.00 173.10 176.26 1v6b h ALA 55 N 2.00 0.94 0.14 3.20 0.00 0.24 -3.04 119.26 122.73 1v6b h ALA 55 Ca -0.28 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 1v6b h ALA 55 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1v6b h ALA 55 CO 0.35 0.00 -0.07 0.00 0.00 0.00 0.00 179.25 179.53 1v6b h ALA 56 N 2.27 -0.18 -0.44 0.00 0.00 -1.75 -2.11 119.26 117.06 1v6b h ALA 56 Ca 0.00 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 1v6b h ALA 56 Cb 0.86 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1v6b h ALA 56 CO 0.00 -0.50 -0.02 1.49 0.00 0.00 0.00 179.25 180.23 1v6b h GLU 57 N -0.39 0.78 -0.49 0.00 4.57 -1.72 -3.09 114.58 114.24 1v6b h GLU 57 Ca -0.02 -0.26 0.10 0.00 -1.18 0.00 0.00 59.36 58.00 1v6b h GLU 57 Cb 0.32 -0.07 -0.10 0.00 -0.16 0.00 0.00 28.75 28.74 1v6b h GLU 57 CO 0.03 0.86 -0.27 -0.09 -1.18 0.00 0.00 179.01 178.36 1v6b h ARG 58 N 0.62 -0.15 -0.32 1.92 2.43 -1.45 -1.58 114.38 115.85 1v6b h ARG 58 Ca 0.12 0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.34 1v6b h ARG 58 Cb 0.52 0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 30.03 1v6b h ARG 58 CO 0.03 -0.10 -0.51 1.25 -1.51 0.00 0.00 179.97 179.13 1v6b h HIS 59 N -0.15 -1.55 -2.65 2.20 2.76 -1.30 -3.47 115.15 110.98 1v6b h HIS 59 Ca 0.22 0.07 0.00 0.00 -2.20 0.00 0.00 60.37 58.46 1v6b h HIS 59 Cb 0.51 0.72 0.00 0.00 1.55 0.00 0.00 27.41 30.18 1v6b h HIS 59 CO -0.53 -0.46 0.00 0.41 -1.30 0.00 0.00 177.93 176.04 1v6b n GLY 60 N -1.36 0.86 2.03 5.26 0.00 -0.60 -5.01 105.19 106.36 1v6b n GLY 60 Ca -0.04 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1v6b n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v6b n GLY 61 N -1.33 -0.51 3.69 -0.02 0.00 -1.26 -5.08 105.19 100.68 1v6b n GLY 61 Ca 0.00 0.05 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1v6b n GLY 61 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1v6b s VAL 62 N -1.87 5.07 0.00 1.61 1.01 -1.26 -5.05 120.40 119.91 1v6b s VAL 62 Ca 0.00 1.17 0.00 0.00 0.00 0.00 0.00 61.98 63.15 1v6b s VAL 62 Cb 0.00 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.45 1v6b s VAL 62 CO 0.00 0.20 0.00 1.33 0.00 0.00 0.00 175.10 176.63 1v6b n VAL 63 N 4.24 0.00 -2.84 2.92 0.24 -1.26 -4.87 118.33 116.75 1v6b n VAL 63 Ca -0.03 0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.86 1v6b n VAL 63 Cb 0.51 -0.18 -0.04 0.00 -1.47 0.00 0.00 33.84 32.66 1v6b n VAL 63 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1v6b s LYS 64 N 0.07 4.58 0.00 7.34 2.20 -1.26 -3.38 119.74 129.28 1v6b s LYS 64 Ca 0.00 1.25 0.00 0.00 -0.36 0.00 0.00 55.97 56.86 1v6b s LYS 64 Cb 0.00 -3.39 0.00 0.00 -1.51 0.00 0.00 37.83 32.93 1v6b s LYS 64 CO 0.00 0.17 0.00 0.41 -0.36 0.00 0.00 175.35 175.57 1v6b n GLY 65 N 2.50 2.18 3.64 5.54 0.00 -0.02 -4.91 105.19 114.11 1v6b n GLY 65 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1v6b n GLY 65 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1v6b n ASP 66 N 0.00 1.83 -4.44 1.61 9.92 -1.22 -4.63 116.55 119.63 1v6b n ASP 66 Ca 0.00 1.13 -0.43 0.00 -0.53 0.00 0.00 54.79 54.96 1v6b n ASP 66 Cb 0.00 -1.39 -0.04 0.00 -0.64 0.00 0.00 41.12 39.05 1v6b n ASP 66 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1v6b s GLU 67 N -1.87 3.11 0.21 -1.24 2.02 -1.26 -2.81 118.70 116.86 1v6b s GLU 67 Ca 0.59 -0.94 -0.30 0.00 0.02 0.00 0.00 54.97 54.35 1v6b s GLU 67 Cb -0.59 -4.25 -0.08 0.00 0.10 0.00 0.00 34.13 29.31 1v6b s GLU 67 CO 0.59 -1.77 1.04 0.42 0.02 0.00 0.00 175.26 175.57 1v6b s ILE 68 N 3.80 3.89 0.00 -1.63 -1.09 -1.05 -1.40 121.20 123.72 1v6b s ILE 68 Ca 0.20 1.76 0.00 0.00 -2.23 0.00 0.00 60.65 60.38 1v6b s ILE 68 Cb -0.18 -4.12 0.00 0.00 -1.58 0.00 0.00 42.46 36.58 1v6b s ILE 68 CO 0.09 0.36 0.00 0.23 -1.23 0.00 0.00 174.94 174.39 1v6b n MET 69 N 1.86 0.00 -4.14 2.79 2.81 -0.80 -4.36 117.12 115.28 1v6b n MET 69 Ca 0.00 0.00 -0.16 0.00 -1.81 0.00 0.00 57.70 55.73 1v6b n MET 69 Cb 0.46 -0.51 -0.15 0.00 -0.71 0.00 0.00 33.22 32.32 1v6b n MET 69 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1v6b s ALA 70 N -1.65 0.45 -0.29 3.04 0.00 -1.11 0.19 121.76 122.39 1v6b s ALA 70 Ca 0.00 -0.17 0.02 0.00 0.00 0.00 0.00 51.96 51.82 1v6b s ALA 70 Cb 0.00 -0.16 0.07 0.00 0.00 0.00 0.00 23.12 23.03 1v6b s ALA 70 CO 0.00 0.08 -0.04 0.42 0.00 0.00 0.00 175.76 176.22 1v6b s ILE 71 N 0.10 2.36 0.00 0.00 1.01 -0.76 -1.38 121.20 122.52 1v6b s ILE 71 Ca -0.01 -1.79 0.00 0.00 0.00 0.00 0.00 60.65 58.85 1v6b s ILE 71 Cb -0.05 -2.48 0.00 0.00 0.01 0.00 0.00 42.46 39.94 1v6b s ILE 71 CO -0.00 -0.20 0.00 -3.20 0.00 0.00 0.00 174.94 171.53 1v6b n ASN 72 N 4.42 0.00 0.00 3.58 2.85 0.34 -3.16 115.26 123.29 1v6b n ASN 72 Ca -0.09 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.38 1v6b n ASN 72 Cb 0.42 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.44 1v6b n ASN 72 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1v6b n GLY 73 N 0.00 0.05 3.76 8.20 0.00 -1.26 -4.62 105.19 111.32 1v6b n GLY 73 Ca 0.00 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 1v6b n GLY 73 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1v6b s LYS 74 N -0.82 4.28 0.08 1.61 2.47 -1.19 -4.94 119.74 121.22 1v6b s LYS 74 Ca 0.00 2.31 -0.31 0.00 -1.56 0.00 0.00 55.97 56.42 1v6b s LYS 74 Cb 0.00 -3.07 -0.06 0.00 -1.46 0.00 0.00 37.83 33.23 1v6b s LYS 74 CO 0.00 -0.35 1.26 0.42 0.16 0.00 0.00 175.35 176.85 1v6b s ILE 75 N -0.62 3.78 -0.14 5.43 1.01 -1.26 -1.84 121.20 127.57 1v6b s ILE 75 Ca 0.54 1.28 0.15 0.00 0.00 0.00 0.00 60.65 62.63 1v6b s ILE 75 Cb -0.42 -3.82 0.31 0.00 0.01 0.00 0.00 42.46 38.54 1v6b s ILE 75 CO 0.50 0.10 1.16 1.33 0.00 0.00 0.00 174.94 178.03 1v6b n VAL 76 N 3.94 1.76 0.19 2.92 0.24 0.50 -4.79 118.33 123.08 1v6b n VAL 76 Ca 0.10 -2.31 -0.08 0.00 -2.04 0.00 0.00 64.34 60.00 1v6b n VAL 76 Cb 0.45 -0.13 -0.04 0.00 -1.47 0.00 0.00 33.84 32.65 1v6b n VAL 76 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 1v6b h THR 77 N 1.10 0.00 -0.82 3.34 1.35 -1.57 -2.99 112.91 113.32 1v6b h THR 77 Ca -0.01 0.00 -0.53 0.00 -0.55 0.00 0.00 66.41 65.32 1v6b h THR 77 Cb 1.07 0.00 -0.24 0.00 -1.73 0.00 0.00 68.15 67.25 1v6b h THR 77 CO 0.00 0.00 0.69 -0.67 -0.25 0.00 0.00 175.52 175.29 1v6b n ASP 78 N -3.48 6.62 -4.95 5.36 -0.08 -1.26 -4.66 116.55 114.10 1v6b n ASP 78 Ca -0.06 -3.50 -0.23 0.00 -1.51 0.00 0.00 54.79 49.49 1v6b n ASP 78 Cb 0.21 -0.97 -0.01 0.00 2.34 0.00 0.00 41.12 42.69 1v6b n ASP 78 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 1v6b s TYR 79 N -3.05 3.45 0.20 -0.67 1.51 -1.13 -4.91 117.35 112.75 1v6b s TYR 79 Ca 0.52 0.29 0.04 0.00 -1.01 0.00 0.00 57.07 56.90 1v6b s TYR 79 Cb 0.41 -1.92 -0.03 0.00 -0.11 0.00 0.00 41.96 40.31 1v6b s TYR 79 CO 0.01 0.09 0.33 0.95 -1.11 0.00 0.00 175.55 175.82 1v6b s THR 80 N -2.31 5.29 0.10 -0.71 -4.23 -1.26 -3.39 115.64 109.13 1v6b s THR 80 Ca 0.41 -0.82 -0.20 0.00 -1.18 0.00 0.00 61.69 59.89 1v6b s THR 80 Cb -0.10 -3.80 -0.05 0.00 1.34 0.00 0.00 72.50 69.89 1v6b s THR 80 CO 0.35 -0.22 1.35 -0.07 -0.54 0.00 0.00 174.62 175.49 1v6b h LEU 81 N 1.63 -1.37 -0.38 4.79 3.38 -1.84 0.27 115.31 121.80 1v6b h LEU 81 Ca -0.50 0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.71 1v6b h LEU 81 Cb 1.21 0.60 -0.07 0.00 0.09 0.00 0.00 40.66 42.49 1v6b h LEU 81 CO 0.65 -0.17 -0.43 0.00 0.09 0.00 0.00 178.44 178.58 1v6b h ALA 82 N -0.10 -0.63 -0.04 1.53 0.00 -1.95 1.88 119.26 119.95 1v6b h ALA 82 Ca 0.09 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1v6b h ALA 82 Cb 0.28 1.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1v6b h ALA 82 CO -0.57 -0.85 -0.03 0.93 0.00 0.00 0.00 179.25 178.73 1v6b h GLU 83 N -0.26 -0.01 0.12 0.00 4.39 -1.44 0.95 114.58 118.34 1v6b h GLU 83 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.77 1v6b h GLU 83 Cb 0.43 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 1v6b h GLU 83 CO -0.49 -0.00 -0.24 0.00 -1.16 0.00 0.00 179.01 177.12 1v6b h ALA 84 N -1.03 -0.83 -0.24 3.43 0.00 -0.03 1.49 119.26 122.05 1v6b h ALA 84 Ca 0.01 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1v6b h ALA 84 Cb 0.02 0.58 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1v6b h ALA 84 CO -0.04 -0.87 -0.14 0.39 0.00 0.00 0.00 179.25 178.59 1v6b n GLU 85 N -3.79 -0.10 0.11 0.00 1.02 0.64 0.92 120.64 119.43 1v6b n GLU 85 Ca -0.04 0.91 -0.13 0.00 -0.02 0.00 0.00 57.16 57.88 1v6b n GLU 85 Cb 0.20 -1.35 -0.06 0.00 -0.02 0.00 0.00 31.44 30.21 1v6b n GLU 85 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1v6b h ALA 86 N -0.43 -0.41 -0.66 0.62 0.00 0.11 -0.37 119.26 118.12 1v6b h ALA 86 Ca 0.04 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.97 1v6b h ALA 86 Cb 0.10 0.39 -0.08 0.00 0.00 0.00 0.00 17.79 18.20 1v6b h ALA 86 CO -0.22 -0.78 -0.40 0.00 0.00 0.00 0.00 179.25 177.85 1v6b h ALA 87 N 0.32 -0.39 -0.48 0.00 0.00 0.52 1.18 119.26 120.42 1v6b h ALA 87 Ca 0.03 0.08 0.10 0.00 0.00 0.00 0.00 54.91 55.11 1v6b h ALA 87 Cb 0.47 1.25 -0.09 0.00 0.00 0.00 0.00 17.79 19.41 1v6b h ALA 87 CO -0.14 -0.67 -0.14 1.25 0.00 0.00 0.00 179.25 179.55 1v6b h LEU 88 N -0.01 -0.50 0.14 0.00 5.85 0.83 -1.11 115.31 120.51 1v6b h LEU 88 Ca 0.11 0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.99 1v6b h LEU 88 Cb 0.29 0.32 -0.05 0.00 0.37 0.00 0.00 40.66 41.59 1v6b h LEU 88 CO -0.63 -0.17 -0.45 1.56 -0.34 0.00 0.00 178.44 178.40 1v6b h GLN 89 N -0.02 -0.67 -0.29 1.25 4.20 0.16 -1.32 115.11 118.42 1v6b h GLN 89 Ca 0.23 0.05 0.03 0.00 0.06 0.00 0.00 58.65 59.01 1v6b h GLN 89 Cb 0.37 0.15 -0.04 0.00 0.30 0.00 0.00 27.48 28.26 1v6b h GLN 89 CO -0.50 -0.45 -0.26 0.87 -0.67 0.00 0.00 178.83 177.82 1v6b h LYS 90 N -0.70 -0.10 -0.94 1.46 1.57 0.21 1.86 116.57 119.93 1v6b h LYS 90 Ca 0.01 0.01 0.08 0.00 -1.87 0.00 0.00 60.65 58.88 1v6b h LYS 90 Cb 0.71 0.02 -0.11 0.00 0.08 0.00 0.00 32.23 32.93 1v6b h LYS 90 CO -0.25 -0.07 -0.55 0.00 -0.57 0.00 0.00 179.45 178.01 1v6b n ALA 91 N -2.97 -0.60 0.00 3.86 0.00 -0.51 0.24 120.51 120.53 1v6b n ALA 91 Ca -0.01 0.80 -0.09 0.00 0.00 0.00 0.00 53.44 54.14 1v6b n ALA 91 Cb 0.14 -0.13 -0.03 0.00 0.00 0.00 0.00 19.45 19.43 1v6b n ALA 91 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1v6b h TRP 92 N 0.00 -0.36 -0.35 0.00 2.91 0.07 -1.76 115.95 116.46 1v6b h TRP 92 Ca 0.15 0.02 0.08 0.00 1.13 0.00 0.00 58.89 60.27 1v6b h TRP 92 Cb 0.39 0.18 -0.08 0.00 -0.51 0.00 0.00 29.16 29.13 1v6b h TRP 92 CO -0.97 -0.21 -0.24 -0.91 -1.03 0.00 0.00 178.44 175.08 1v6b h ASN 93 N -0.18 -0.80 -0.77 2.65 2.35 0.93 -1.46 115.58 118.31 1v6b h ASN 93 Ca 0.09 0.16 0.10 0.00 -0.55 0.00 0.00 56.30 56.10 1v6b h ASN 93 Cb 0.31 0.40 -0.11 0.00 0.05 0.00 0.00 38.32 38.96 1v6b h ASN 93 CO -0.23 -0.27 -0.35 0.00 -1.65 0.00 0.00 177.43 174.93 1v6b n GLN 94 N -5.39 -0.23 0.00 0.81 6.02 0.67 -4.89 117.38 114.36 1v6b n GLN 94 Ca 0.01 1.18 0.00 0.00 -0.01 0.00 0.00 57.00 58.18 1v6b n GLN 94 Cb 0.30 -1.74 0.00 0.00 1.02 0.00 0.00 30.24 29.82 1v6b n GLN 94 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1v6b n GLY 95 N -1.31 0.71 0.92 1.08 0.00 -0.55 -5.10 105.19 100.94 1v6b n GLY 95 Ca 0.06 -0.21 0.11 0.00 0.00 0.00 0.00 46.02 45.98 1v6b n GLY 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v6b n GLY 96 N 0.00 -1.24 0.13 -0.02 0.00 -1.26 -4.73 105.19 98.07 1v6b n GLY 96 Ca 0.00 -0.62 -0.22 0.00 0.00 0.00 0.00 46.02 45.18 1v6b n GLY 96 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1v6b n ASP 97 N -4.30 1.99 -4.19 1.61 8.00 -1.26 -4.87 116.55 113.53 1v6b n ASP 97 Ca -0.01 0.10 -0.12 0.00 0.71 0.00 0.00 54.79 55.47 1v6b n ASP 97 Cb 0.60 -0.65 -0.10 0.00 -0.02 0.00 0.00 41.12 40.95 1v6b n ASP 97 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 1v6b s TRP 98 N -2.51 1.09 0.07 1.24 -0.00 -1.26 -0.88 118.94 116.68 1v6b s TRP 98 Ca -0.33 -1.30 0.07 0.00 -0.00 0.00 0.00 56.10 54.53 1v6b s TRP 98 Cb 0.10 -0.56 -0.03 0.00 -0.00 0.00 0.00 33.47 32.98 1v6b s TRP 98 CO 0.60 -0.56 -0.18 -1.50 -0.00 0.00 0.00 176.95 175.31 1v6b s ILE 99 N -4.07 1.43 -0.08 0.66 2.07 0.19 -4.90 121.20 116.49 1v6b s ILE 99 Ca 0.33 -1.30 -0.03 0.00 -1.41 0.00 0.00 60.65 58.25 1v6b s ILE 99 Cb 0.07 -1.30 -0.04 0.00 0.13 0.00 0.00 42.46 41.33 1v6b s ILE 99 CO 0.08 -0.03 0.04 -1.81 -1.91 0.00 0.00 174.94 171.31 1v6b s ASP 100 N -1.55 5.52 -0.11 4.50 1.01 -1.26 0.97 116.67 125.75 1v6b s ASP 100 Ca 0.04 0.21 -0.03 0.00 0.71 0.00 0.00 52.55 53.47 1v6b s ASP 100 Cb -0.09 -1.61 0.05 0.00 1.01 0.00 0.00 42.92 42.27 1v6b s ASP 100 CO 0.03 0.37 0.09 -0.76 0.21 0.00 0.00 175.17 175.11 1v6b s LEU 101 N -1.02 0.19 -0.46 1.23 1.43 0.31 0.13 118.68 120.49 1v6b s LEU 101 Ca 0.15 -0.21 -0.20 0.00 -1.03 0.00 0.00 54.13 52.85 1v6b s LEU 101 Cb -0.12 -0.12 0.03 0.00 0.03 0.00 0.00 46.19 46.02 1v6b s LEU 101 CO 0.04 -0.30 0.60 -0.69 0.23 0.00 0.00 176.35 176.24 1v6b s VAL 102 N 2.18 4.89 0.07 -1.59 1.01 -0.48 0.05 120.40 126.52 1v6b s VAL 102 Ca 0.04 -0.18 0.07 0.00 0.00 0.00 0.00 61.98 61.91 1v6b s VAL 102 Cb -0.14 -4.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.00 1v6b s VAL 102 CO -0.06 -0.64 -0.19 -0.69 0.00 0.00 0.00 175.10 173.51 1v6b s VAL 103 N 2.64 1.57 0.38 2.92 1.01 -0.89 -1.90 120.40 126.13 1v6b s VAL 103 Ca 0.18 -1.33 -0.25 0.00 0.00 0.00 0.00 61.98 60.59 1v6b s VAL 103 Cb -0.16 -1.41 -0.09 0.00 0.00 0.00 0.00 36.38 34.72 1v6b s VAL 103 CO 0.16 0.03 1.04 0.00 0.00 0.00 0.00 175.10 176.33 1v6b s ALA 104 N -1.00 3.14 0.41 5.51 0.00 -0.49 -2.06 121.76 127.28 1v6b s ALA 104 Ca 0.05 0.69 -0.25 0.00 0.00 0.00 0.00 51.96 52.46 1v6b s ALA 104 Cb -0.09 -3.26 -0.08 0.00 0.00 0.00 0.00 23.12 19.68 1v6b s ALA 104 CO 0.03 -0.15 1.18 0.08 0.00 0.00 0.00 175.76 176.90 1v6b s VAL 105 N -1.60 3.10 -0.28 0.00 1.01 0.26 -4.17 120.40 118.71 1v6b s VAL 105 Ca 0.55 0.90 -0.11 0.00 0.00 0.00 0.00 61.98 63.33 1v6b s VAL 105 Cb -0.22 -3.50 0.11 0.00 0.00 0.00 0.00 36.38 32.77 1v6b s VAL 105 CO 0.28 0.07 0.63 0.00 0.00 0.00 0.00 175.10 176.08 1v6b s PRO 107 N 2.59 3.15 -0.40 0.00 0.04 -1.26 -4.97 135.00 134.16 1v6b s PRO 107 Ca -0.07 1.06 -0.29 0.00 0.04 0.00 0.00 61.00 61.75 1v6b s PRO 107 Cb -0.11 -2.02 0.01 0.00 0.04 0.00 0.00 34.50 32.43 1v6b s PRO 107 CO -0.19 -0.93 1.40 -1.25 0.04 0.00 0.00 177.00 176.08 1v6b s PRO 108 N -4.59 3.62 0.00 0.56 0.04 -1.26 -4.35 135.00 129.02 1v6b s PRO 108 Ca 0.60 0.99 0.00 0.00 0.04 0.00 0.00 61.00 62.63 1v6b s PRO 108 Cb -0.15 -4.01 0.00 0.00 0.04 0.00 0.00 34.50 30.39 1v6b s PRO 108 CO 0.46 -1.51 0.00 0.36 0.04 0.00 0.00 177.00 176.35 1v6b n LYS 109 N 7.98 0.00 -2.05 4.56 2.85 -1.26 -5.14 118.16 125.10 1v6b n LYS 109 Ca 0.16 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.42 1v6b n LYS 109 Cb 0.48 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.86 1v6b n LYS 109 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 1v6b n GLU 110 N -1.85 -4.77 -3.33 -1.58 2.13 -1.26 -5.09 120.64 104.89 1v6b n GLU 110 Ca 0.00 3.48 0.03 0.00 0.66 0.00 0.00 57.16 61.33 1v6b n GLU 110 Cb 0.00 -4.02 -0.05 0.00 0.27 0.00 0.00 31.44 27.64 1v6b n GLU 110 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 1v6b s TYR 111 N -0.49 -0.06 -0.21 4.31 5.04 -1.26 -5.06 117.35 119.62 1v6b s TYR 111 Ca 0.00 0.10 -0.15 0.00 -2.44 0.00 0.00 57.07 54.58 1v6b s TYR 111 Cb 0.00 0.03 -0.19 0.00 0.35 0.00 0.00 41.96 42.16 1v6b s TYR 111 CO 0.00 -0.03 0.08 -0.25 -1.34 0.00 0.00 175.55 174.01 1v6b n ASP 112 N 4.05 1.94 -1.36 4.32 9.92 -1.26 -5.08 116.55 129.08 1v6b n ASP 112 Ca -0.10 0.32 0.18 0.00 -0.53 0.00 0.00 54.79 54.67 1v6b n ASP 112 Cb 0.56 -0.87 -0.05 0.00 -0.64 0.00 0.00 41.12 40.12 1v6b n ASP 112 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1v6b n ASP 113 N -4.13 -8.08 -3.63 -2.24 9.92 -1.26 -4.91 116.55 102.23 1v6b n ASP 113 Ca -0.38 0.59 -0.30 0.00 -0.53 0.00 0.00 54.79 54.17 1v6b n ASP 113 Cb 0.82 -4.14 0.02 0.00 -0.64 0.00 0.00 41.12 37.18 1v6b n ASP 113 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1v6b n GLU 114 N -4.07 -1.72 0.00 -1.24 1.02 -1.26 -4.98 120.64 108.39 1v6b n GLU 114 Ca 0.00 1.10 0.00 0.00 -0.02 0.00 0.00 57.16 58.24 1v6b n GLU 114 Cb 0.62 -2.38 0.00 0.00 -0.02 0.00 0.00 31.44 29.66 1v6b n GLU 114 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1v6b n LEU 115 N -1.52 0.00 0.00 -4.62 7.94 -1.26 -5.06 117.00 112.48 1v6b n LEU 115 Ca -0.20 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.70 1v6b n LEU 115 Cb 0.68 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.63 1v6b n LEU 115 CO 0.60 0.00 0.28 1.07 -1.11 0.00 0.00 177.39 178.23 1v6b n THR 116 N 0.00 0.32 -0.09 1.96 5.66 -1.26 -4.78 114.28 116.08 1v6b n THR 116 Ca 0.00 -0.42 -0.16 0.00 -3.05 0.00 0.00 64.05 60.43 1v6b n THR 116 Cb 0.00 1.03 -0.08 0.00 -1.55 0.00 0.00 70.33 69.73 1v6b n THR 116 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 1v6b n PHE 117 N -0.16 0.00 1.94 1.09 3.72 -1.26 -5.33 117.46 117.47 1v6b n PHE 117 Ca 0.00 0.00 0.16 0.00 -0.05 0.00 0.00 57.45 57.56 1v6b n PHE 117 Cb 0.28 -0.70 0.92 0.00 -0.94 0.00 0.00 39.48 39.04 1v6b n PHE 117 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90