#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hvc s GLN 2 N 0.00 1.53 -0.16 -0.52 0.74 -1.26 -1.85 119.66 118.13 1hvc s GLN 2 Ca 0.00 -0.53 -0.01 0.00 0.05 0.00 0.00 55.36 54.87 1hvc s GLN 2 Cb 0.00 -1.36 -0.01 0.00 1.10 0.00 0.00 33.01 32.74 1hvc s GLN 2 CO 0.00 0.22 -0.11 0.42 -0.55 0.00 0.00 175.29 175.27 1hvc s ILE 3 N 0.04 3.07 0.55 -2.34 1.09 0.13 -4.97 121.20 118.76 1hvc s ILE 3 Ca -0.03 -0.63 -0.08 0.00 -1.10 0.00 0.00 60.65 58.82 1hvc s ILE 3 Cb -0.10 -2.33 -0.03 0.00 -1.06 0.00 0.00 42.46 38.94 1hvc s ILE 3 CO 0.01 0.49 0.90 0.42 -0.10 0.00 0.00 174.94 176.67 1hvc s THR 4 N 0.78 4.72 -0.23 2.92 -4.23 -1.26 -0.51 115.64 117.83 1hvc s THR 4 Ca -0.04 0.46 0.16 0.00 -1.18 0.00 0.00 61.69 61.09 1hvc s THR 4 Cb -0.15 -3.83 0.45 0.00 1.34 0.00 0.00 72.50 70.31 1hvc s THR 4 CO 0.01 -0.94 1.35 0.18 -0.54 0.00 0.00 174.62 174.68 1hvc n LEU 5 N -2.49 3.47 -0.14 4.79 7.99 -1.26 -4.55 117.00 124.81 1hvc n LEU 5 Ca 0.03 -2.92 0.05 0.00 -0.01 0.00 0.00 56.01 53.16 1hvc n LEU 5 Cb 0.55 -0.48 0.36 0.00 -0.11 0.00 0.00 43.42 43.74 1hvc n LEU 5 CO 0.55 0.68 1.21 -0.50 -1.51 0.00 0.00 177.39 177.82 1hvc h TRP 6 N 1.44 0.71 -1.69 -1.77 4.06 -1.94 -3.44 115.95 113.32 1hvc h TRP 6 Ca 0.00 0.02 -0.53 0.00 2.06 0.00 0.00 58.89 60.43 1hvc h TRP 6 Cb 1.28 -0.24 -0.06 0.00 -1.00 0.00 0.00 29.16 29.13 1hvc h TRP 6 CO 0.37 0.41 -0.48 -0.65 -3.56 0.00 0.00 178.44 174.53 1hvc s GLN 7 N -5.64 2.40 0.17 0.49 -0.21 -1.26 -5.10 119.66 110.51 1hvc s GLN 7 Ca -0.09 -1.61 -0.32 0.00 0.02 0.00 0.00 55.36 53.36 1hvc s GLN 7 Cb 0.19 -2.19 -0.11 0.00 1.00 0.00 0.00 33.01 31.89 1hvc s GLN 7 CO 0.76 -0.04 1.63 1.03 -2.12 0.00 0.00 175.29 176.56 1hvc s ARG 8 N -3.95 4.18 -1.22 2.91 0.52 -1.26 -4.88 118.95 115.25 1hvc s ARG 8 Ca 0.42 2.45 -0.17 0.00 -0.52 0.00 0.00 55.73 57.91 1hvc s ARG 8 Cb -0.01 -3.16 -0.03 0.00 0.52 0.00 0.00 34.95 32.27 1hvc s ARG 8 CO 0.24 -0.67 2.12 -0.35 0.02 0.00 0.00 175.30 176.66 1hvc n PRO 9 N 4.11 2.38 -3.18 3.54 -0.04 -1.26 -4.93 135.00 135.61 1hvc n PRO 9 Ca 0.15 -2.35 -0.39 0.00 -0.04 0.00 0.00 63.50 60.87 1hvc n PRO 9 Cb 0.37 -3.17 -0.06 0.00 -0.04 0.00 0.00 33.50 30.61 1hvc n PRO 9 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1hvc s LEU 10 N 1.92 4.41 0.17 1.53 1.43 -1.26 -0.09 118.68 126.80 1hvc s LEU 10 Ca 0.51 1.17 0.01 0.00 -1.03 0.00 0.00 54.13 54.79 1hvc s LEU 10 Cb 0.14 -2.95 -0.04 0.00 0.03 0.00 0.00 46.19 43.37 1hvc s LEU 10 CO -0.01 0.08 0.04 0.68 0.23 0.00 0.00 176.35 177.36 1hvc s VAL 11 N -0.11 0.45 -0.17 -1.59 -7.23 0.17 -4.89 120.40 107.03 1hvc s VAL 11 Ca 0.32 -1.96 -0.23 0.00 -1.81 0.00 0.00 61.98 58.30 1hvc s VAL 11 Cb -0.18 -2.17 -0.02 0.00 0.56 0.00 0.00 36.38 34.56 1hvc s VAL 11 CO 0.17 -0.40 0.73 -0.89 -0.31 0.00 0.00 175.10 174.41 1hvc s THR 12 N -3.82 4.96 0.34 5.32 2.01 -1.26 0.08 115.64 123.28 1hvc s THR 12 Ca 0.26 1.41 0.08 0.00 0.31 0.00 0.00 61.69 63.75 1hvc s THR 12 Cb 0.07 -4.04 -0.03 0.00 0.01 0.00 0.00 72.50 68.51 1hvc s THR 12 CO 0.05 0.09 0.28 0.27 -0.69 0.00 0.00 174.62 174.61 1hvc s ILE 13 N 1.90 3.39 0.01 1.82 -4.36 0.19 -3.60 121.20 120.54 1hvc s ILE 13 Ca 0.34 -1.41 0.05 0.00 -0.26 0.00 0.00 60.65 59.36 1hvc s ILE 13 Cb -0.16 -3.14 -0.01 0.00 1.25 0.00 0.00 42.46 40.39 1hvc s ILE 13 CO 0.12 -0.16 -0.14 0.00 0.24 0.00 0.00 174.94 175.00 1hvc s ARG 14 N -3.98 1.07 -0.39 0.37 3.03 -0.76 -0.79 118.95 117.50 1hvc s ARG 14 Ca 0.41 -0.58 0.05 0.00 2.03 0.00 0.00 55.73 57.64 1hvc s ARG 14 Cb -0.05 -1.05 0.17 0.00 -1.03 0.00 0.00 34.95 32.98 1hvc s ARG 14 CO 0.26 0.28 0.50 -1.50 -1.13 0.00 0.00 175.30 173.71 1hvc s ILE 15 N -0.49 -0.64 0.00 4.99 -1.16 -1.11 -1.27 121.20 121.52 1hvc s ILE 15 Ca 0.04 -0.56 0.00 0.00 -0.51 0.00 0.00 60.65 59.63 1hvc s ILE 15 Cb -0.06 -0.36 0.00 0.00 0.61 0.00 0.00 42.46 42.65 1hvc s ILE 15 CO 0.00 -0.32 0.00 0.61 -2.81 0.00 0.00 174.94 172.42 1hvc n GLY 16 N 4.28 -1.68 1.04 1.50 0.00 -1.26 -4.37 105.19 104.70 1hvc n GLY 16 Ca 0.11 -1.42 -0.00 0.00 0.00 0.00 0.00 46.02 44.71 1hvc n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hvc n GLY 17 N 0.00 2.16 3.62 -0.02 0.00 -1.26 -4.88 105.19 104.80 1hvc n GLY 17 Ca 0.00 -0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1hvc n GLY 17 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hvc s GLN 18 N -1.40 3.97 0.20 1.61 -0.21 -1.26 -5.10 119.66 117.46 1hvc s GLN 18 Ca 0.17 -0.34 -0.30 0.00 0.02 0.00 0.00 55.36 54.91 1hvc s GLN 18 Cb 0.13 -3.34 -0.08 0.00 1.00 0.00 0.00 33.01 30.72 1hvc s GLN 18 CO 0.04 0.14 0.97 -0.51 -2.12 0.00 0.00 175.29 173.81 1hvc s LEU 19 N 0.77 4.58 0.11 2.90 1.43 -1.26 -2.75 118.68 124.47 1hvc s LEU 19 Ca 0.05 1.93 0.04 0.00 -1.03 0.00 0.00 54.13 55.12 1hvc s LEU 19 Cb -0.13 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.45 1hvc s LEU 19 CO 0.02 0.04 -0.10 -0.54 0.23 0.00 0.00 176.35 176.00 1hvc s LYS 20 N -0.77 0.93 0.02 1.70 1.02 0.03 -4.95 119.74 117.73 1hvc s LYS 20 Ca 0.44 -1.26 -0.17 0.00 0.02 0.00 0.00 55.97 54.99 1hvc s LYS 20 Cb -0.26 -0.58 -0.06 0.00 -0.52 0.00 0.00 37.83 36.41 1hvc s LYS 20 CO 0.32 0.08 0.49 -2.00 -0.92 0.00 0.00 175.35 173.32 1hvc s GLU 21 N -3.11 4.08 0.05 1.68 2.56 -1.26 0.53 118.70 123.23 1hvc s GLU 21 Ca 0.09 0.56 -0.11 0.00 0.00 0.00 0.00 54.97 55.52 1hvc s GLU 21 Cb -0.01 -3.25 0.01 0.00 2.00 0.00 0.00 34.13 32.88 1hvc s GLU 21 CO 0.00 0.62 0.23 0.00 -0.56 0.00 0.00 175.26 175.55 1hvc s ALA 22 N -0.95 -0.43 -0.16 6.30 0.00 0.11 -4.47 121.76 122.16 1hvc s ALA 22 Ca 0.26 -0.26 -0.17 0.00 0.00 0.00 0.00 51.96 51.80 1hvc s ALA 22 Cb -0.18 0.34 -0.04 0.00 0.00 0.00 0.00 23.12 23.24 1hvc s ALA 22 CO 0.16 -0.41 0.42 -1.17 0.00 0.00 0.00 175.76 174.76 1hvc s LEU 23 N -2.23 4.23 -0.49 0.00 2.96 0.10 0.44 118.68 123.69 1hvc s LEU 23 Ca -0.03 0.66 -0.29 0.00 -0.22 0.00 0.00 54.13 54.25 1hvc s LEU 23 Cb 0.00 -2.58 0.02 0.00 0.50 0.00 0.00 46.19 44.13 1hvc s LEU 23 CO -0.05 -0.01 1.29 -0.76 -1.32 0.00 0.00 176.35 175.50 1hvc s LEU 24 N 0.84 3.54 -0.30 -0.68 1.43 0.87 -0.26 118.68 124.12 1hvc s LEU 24 Ca 0.22 0.49 0.02 0.00 -1.03 0.00 0.00 54.13 53.83 1hvc s LEU 24 Cb -0.15 -3.39 0.09 0.00 0.03 0.00 0.00 46.19 42.78 1hvc s LEU 24 CO 0.08 -1.45 0.03 -0.62 0.23 0.00 0.00 176.35 174.63 1hvc s ASP 25 N 3.43 4.35 0.26 2.29 -1.08 -0.64 -3.91 116.67 121.37 1hvc s ASP 25 Ca 0.52 -1.76 0.25 0.00 -0.52 0.00 0.00 52.55 51.05 1hvc s ASP 25 Cb -0.10 -1.32 0.90 0.00 -1.46 0.00 0.00 42.92 40.95 1hvc s ASP 25 CO 0.30 -0.35 1.75 0.71 0.52 0.00 0.00 175.17 178.10 1hvc h THR 26 N 6.60 0.00 -0.00 1.71 1.35 -1.84 -3.15 112.91 117.58 1hvc h THR 26 Ca -0.11 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.38 1hvc h THR 26 Cb 1.03 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.70 1hvc h THR 26 CO 0.48 0.00 -0.44 0.61 -0.25 0.00 0.00 175.52 175.92 1hvc n GLY 27 N 0.61 -0.88 3.64 5.82 0.00 -1.26 -4.58 105.19 108.54 1hvc n GLY 27 Ca 0.04 -0.41 -0.40 0.00 0.00 0.00 0.00 46.02 45.25 1hvc n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hvc s ALA 28 N -2.76 3.57 0.32 4.61 0.00 -1.19 -4.95 121.76 121.36 1hvc s ALA 28 Ca 0.17 -0.52 0.01 0.00 0.00 0.00 0.00 51.96 51.62 1hvc s ALA 28 Cb 0.18 -2.86 0.53 0.00 0.00 0.00 0.00 23.12 20.97 1hvc s ALA 28 CO 0.63 -0.62 1.93 -0.44 0.00 0.00 0.00 175.76 177.26 1hvc h ASP 29 N 7.79 0.75 -2.12 0.00 5.19 -1.88 0.12 116.42 126.26 1hvc h ASP 29 Ca -0.31 -0.07 -0.57 0.00 -0.62 0.00 0.00 57.03 55.46 1hvc h ASP 29 Cb 1.14 -0.19 -0.11 0.00 0.18 0.00 0.00 39.33 40.36 1hvc h ASP 29 CO 0.73 0.63 -0.66 -1.81 -3.12 0.00 0.00 179.24 175.01 1hvc s ASP 30 N -6.51 4.28 -0.26 6.45 1.01 -1.26 -3.04 116.67 117.34 1hvc s ASP 30 Ca -0.10 -0.81 -0.10 0.00 0.71 0.00 0.00 52.55 52.26 1hvc s ASP 30 Cb 0.17 -0.66 -0.05 0.00 1.01 0.00 0.00 42.92 43.39 1hvc s ASP 30 CO 0.78 -0.06 0.15 -0.89 0.21 0.00 0.00 175.17 175.36 1hvc s THR 31 N -2.41 5.09 -0.17 -1.27 2.01 -1.26 -3.15 115.64 114.48 1hvc s THR 31 Ca 0.32 0.09 0.01 0.00 0.31 0.00 0.00 61.69 62.43 1hvc s THR 31 Cb -0.05 -3.40 0.01 0.00 0.01 0.00 0.00 72.50 69.08 1hvc s THR 31 CO 0.19 0.30 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.54 1hvc s VAL 32 N 1.50 2.22 0.13 3.82 1.01 -0.55 -0.83 120.40 127.70 1hvc s VAL 32 Ca 0.07 -0.90 0.08 0.00 0.00 0.00 0.00 61.98 61.22 1hvc s VAL 32 Cb -0.15 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 1hvc s VAL 32 CO 0.08 0.53 -0.11 -0.76 0.00 0.00 0.00 175.10 174.84 1hvc s LEU 33 N 1.10 2.98 0.75 3.92 1.43 0.62 -0.51 118.68 128.97 1hvc s LEU 33 Ca -0.00 -0.47 -0.15 0.00 -1.03 0.00 0.00 54.13 52.48 1hvc s LEU 33 Cb -0.14 -1.75 0.01 0.00 0.03 0.00 0.00 46.19 44.34 1hvc s LEU 33 CO -0.07 0.15 0.87 -1.84 0.23 0.00 0.00 176.35 175.69 1hvc n GLU 34 N 0.48 0.34 -1.67 1.70 0.28 -1.26 -0.78 120.64 119.73 1hvc n GLU 34 Ca -0.13 0.17 -0.60 0.00 -0.16 0.00 0.00 57.16 56.45 1hvc n GLU 34 Cb 0.53 -2.15 -0.08 0.00 1.43 0.00 0.00 31.44 31.18 1hvc n GLU 34 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1hvc n GLU 35 N -1.85 0.65 -3.64 3.44 4.07 -0.83 -4.44 120.64 118.05 1hvc n GLU 35 Ca 0.12 0.24 -0.14 0.00 -0.06 0.00 0.00 57.16 57.32 1hvc n GLU 35 Cb 0.50 -1.83 -0.06 0.00 -0.06 0.00 0.00 31.44 29.98 1hvc n GLU 35 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1hvc s MET 36 N 2.29 0.93 -0.56 5.31 0.23 -1.26 -5.03 119.30 121.20 1hvc s MET 36 Ca 0.97 -0.22 -0.15 0.00 -1.03 0.00 0.00 55.69 55.27 1hvc s MET 36 Cb -1.20 0.42 0.14 0.00 -1.53 0.00 0.00 34.83 32.66 1hvc s MET 36 CO 0.66 -0.31 0.50 -0.80 -2.03 0.00 0.00 175.02 173.04 1hvc s ASN 37 N -1.77 6.16 0.26 -1.18 -0.87 -1.26 -5.04 114.94 111.24 1hvc s ASN 37 Ca -0.07 -1.92 -0.21 0.00 -1.57 0.00 0.00 52.86 49.09 1hvc s ASN 37 Cb -0.01 -2.17 -0.09 0.00 -0.02 0.00 0.00 41.25 38.95 1hvc s ASN 37 CO 0.01 -0.80 0.79 -0.76 -2.57 0.00 0.00 177.10 173.76 1hvc s LEU 38 N 1.39 4.30 0.43 0.60 2.01 -1.26 -5.07 118.68 121.08 1hvc s LEU 38 Ca 0.05 1.51 -0.19 0.00 0.01 0.00 0.00 54.13 55.51 1hvc s LEU 38 Cb -0.27 -3.77 -0.10 0.00 0.01 0.00 0.00 46.19 42.06 1hvc s LEU 38 CO 0.01 -0.03 0.92 -2.16 1.01 0.00 0.00 176.35 176.10 1hvc s PRO 39 N -2.13 4.15 0.00 1.29 0.04 -1.26 -4.90 135.00 132.19 1hvc s PRO 39 Ca 0.46 1.02 0.00 0.00 0.04 0.00 0.00 61.00 62.53 1hvc s PRO 39 Cb -0.16 -2.21 0.00 0.00 0.04 0.00 0.00 34.50 32.17 1hvc s PRO 39 CO 0.21 -0.04 0.00 0.41 0.04 0.00 0.00 177.00 177.62 1hvc n GLY 40 N -0.74 2.60 3.65 0.56 0.00 -1.26 -5.09 105.19 104.91 1hvc n GLY 40 Ca 0.06 -2.10 -0.24 0.00 0.00 0.00 0.00 46.02 43.75 1hvc n GLY 40 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1hvc s LYS 41 N -1.97 2.34 0.16 1.61 2.20 -1.26 -5.12 119.74 117.69 1hvc s LYS 41 Ca 0.00 -1.33 0.02 0.00 -0.36 0.00 0.00 55.97 54.30 1hvc s LYS 41 Cb 0.00 -2.22 -0.05 0.00 -1.51 0.00 0.00 37.83 34.05 1hvc s LYS 41 CO 0.00 0.39 -0.00 1.67 -0.36 0.00 0.00 175.35 177.05 1hvc s TRP 42 N -2.15 1.14 0.10 4.03 1.48 -1.26 -4.54 118.94 117.73 1hvc s TRP 42 Ca 0.30 -1.03 0.09 0.00 -1.06 0.00 0.00 56.10 54.41 1hvc s TRP 42 Cb -0.07 -0.65 -0.04 0.00 -1.16 0.00 0.00 33.47 31.55 1hvc s TRP 42 CO 0.20 -0.23 -0.22 0.15 -4.06 0.00 0.00 176.95 172.78 1hvc s LYS 43 N -3.92 1.72 0.32 3.25 1.02 -0.45 -4.88 119.74 116.80 1hvc s LYS 43 Ca 0.23 -1.18 -0.27 0.00 0.02 0.00 0.00 55.97 54.77 1hvc s LYS 43 Cb 0.06 -2.04 -0.10 0.00 -0.52 0.00 0.00 37.83 35.23 1hvc s LYS 43 CO 0.03 0.49 0.97 -1.25 -0.92 0.00 0.00 175.35 174.66 1hvc s PRO 44 N -1.84 4.58 0.01 -1.68 0.04 -1.26 0.11 135.00 134.95 1hvc s PRO 44 Ca 0.15 1.40 -0.13 0.00 0.04 0.00 0.00 61.00 62.47 1hvc s PRO 44 Cb -0.10 -2.86 0.02 0.00 0.04 0.00 0.00 34.50 31.59 1hvc s PRO 44 CO 0.07 0.26 0.26 0.21 0.04 0.00 0.00 177.00 177.84 1hvc s LYS 45 N -1.95 0.67 -0.23 4.56 2.20 -0.15 -4.86 119.74 119.99 1hvc s LYS 45 Ca 0.49 -0.36 -0.05 0.00 -0.36 0.00 0.00 55.97 55.70 1hvc s LYS 45 Cb -0.21 0.29 -0.02 0.00 -1.51 0.00 0.00 37.83 36.39 1hvc s LYS 45 CO 0.26 -0.19 0.00 -1.64 -0.36 0.00 0.00 175.35 173.43 1hvc s MET 46 N -1.78 3.49 0.05 4.03 -1.94 -1.26 0.09 119.30 121.98 1hvc s MET 46 Ca -0.11 -0.56 0.04 0.00 -1.71 0.00 0.00 55.69 53.35 1hvc s MET 46 Cb -0.04 -3.14 -0.04 0.00 2.01 0.00 0.00 34.83 33.62 1hvc s MET 46 CO 0.01 -0.19 -0.01 0.96 -0.01 0.00 0.00 175.02 175.77 1hvc s ILE 47 N 1.54 3.97 0.36 2.53 -4.36 -0.57 -4.92 121.20 119.75 1hvc s ILE 47 Ca 0.06 -0.86 0.08 0.00 -0.26 0.00 0.00 60.65 59.67 1hvc s ILE 47 Cb -0.15 -2.83 -0.05 0.00 1.25 0.00 0.00 42.46 40.68 1hvc s ILE 47 CO -0.00 0.23 0.13 -0.83 0.24 0.00 0.00 174.94 174.71 1hvc s GLY 48 N -1.97 2.08 0.00 6.27 0.00 -1.26 -1.47 107.32 110.97 1hvc s GLY 48 Ca 0.23 -1.93 0.00 0.00 0.00 0.00 0.00 44.72 43.01 1hvc s GLY 48 CO 0.14 -1.83 0.00 0.61 0.00 0.00 0.00 173.10 172.03 1hvc n GLY 49 N -1.14 3.10 0.30 0.20 0.00 -0.39 -4.99 105.19 102.27 1hvc n GLY 49 Ca -0.03 -0.31 -0.08 0.00 0.00 0.00 0.00 46.02 45.60 1hvc n GLY 49 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1hvc h ILE 50 N 0.00 0.33 -0.40 -0.61 1.08 -1.84 -3.17 117.51 112.89 1hvc h ILE 50 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1hvc h ILE 50 Cb 0.00 0.33 0.00 0.00 -3.07 0.00 0.00 36.82 34.08 1hvc h ILE 50 CO 0.00 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 178.07 1hvc n GLY 51 N -1.40 3.12 0.00 5.37 0.00 0.04 -4.73 105.19 107.59 1hvc n GLY 51 Ca -0.01 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1hvc n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hvc n GLY 52 N 0.40 0.86 3.62 -0.02 0.00 -1.19 -3.96 105.19 104.89 1hvc n GLY 52 Ca 0.18 -1.99 -0.29 0.00 0.00 0.00 0.00 46.02 43.92 1hvc n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hvc s PHE 53 N -2.08 2.82 0.15 1.61 0.40 -1.26 -1.26 117.98 118.35 1hvc s PHE 53 Ca 0.00 -0.12 0.05 0.00 -0.60 0.00 0.00 56.93 56.26 1hvc s PHE 53 Cb 0.00 -1.44 -0.04 0.00 0.51 0.00 0.00 43.02 42.05 1hvc s PHE 53 CO 0.00 0.46 -0.11 0.96 0.70 0.00 0.00 175.22 177.23 1hvc s ILE 54 N -1.36 1.24 0.05 0.64 -4.36 -0.54 -4.74 121.20 112.12 1hvc s ILE 54 Ca 0.24 -1.99 -0.18 0.00 -0.26 0.00 0.00 60.65 58.46 1hvc s ILE 54 Cb -0.11 -1.78 -0.06 0.00 1.25 0.00 0.00 42.46 41.76 1hvc s ILE 54 CO 0.16 -0.66 0.51 -0.54 0.24 0.00 0.00 174.94 174.65 1hvc s LYS 55 N -3.49 4.10 0.17 0.37 1.02 -1.26 -1.51 119.74 119.13 1hvc s LYS 55 Ca 0.15 0.62 0.01 0.00 0.02 0.00 0.00 55.97 56.77 1hvc s LYS 55 Cb 0.01 -3.23 -0.04 0.00 -0.52 0.00 0.00 37.83 34.04 1hvc s LYS 55 CO 0.02 0.66 0.02 0.14 -0.92 0.00 0.00 175.35 175.26 1hvc s VAL 56 N -1.10 0.52 -0.18 3.17 -7.23 0.11 -4.61 120.40 111.08 1hvc s VAL 56 Ca 0.27 -1.96 -0.04 0.00 -1.81 0.00 0.00 61.98 58.44 1hvc s VAL 56 Cb -0.18 -2.12 -0.02 0.00 0.56 0.00 0.00 36.38 34.61 1hvc s VAL 56 CO 0.17 -0.45 -0.03 -0.13 -0.31 0.00 0.00 175.10 174.35 1hvc s ARG 57 N -3.96 3.59 -0.34 4.82 0.52 -0.55 -0.97 118.95 122.07 1hvc s ARG 57 Ca 0.25 -0.54 -0.20 0.00 -0.52 0.00 0.00 55.73 54.71 1hvc s ARG 57 Cb 0.07 -2.98 -0.00 0.00 0.52 0.00 0.00 34.95 32.55 1hvc s ARG 57 CO 0.04 0.08 0.63 -1.14 0.02 0.00 0.00 175.30 174.92 1hvc s GLN 58 N 0.80 3.76 -0.11 3.54 0.74 0.12 -0.07 119.66 128.44 1hvc s GLN 58 Ca -0.01 0.14 -0.03 0.00 0.05 0.00 0.00 55.36 55.51 1hvc s GLN 58 Cb -0.14 -3.78 -0.03 0.00 1.10 0.00 0.00 33.01 30.16 1hvc s GLN 58 CO 0.02 -0.67 0.01 0.71 -0.55 0.00 0.00 175.29 174.82 1hvc s TYR 59 N 2.65 3.18 0.12 1.67 1.51 -0.31 -1.35 117.35 124.83 1hvc s TYR 59 Ca 0.24 0.15 0.04 0.00 -1.01 0.00 0.00 57.07 56.50 1hvc s TYR 59 Cb -0.15 -1.85 -0.04 0.00 -0.11 0.00 0.00 41.96 39.82 1hvc s TYR 59 CO 0.14 0.40 0.11 -0.51 -1.11 0.00 0.00 175.55 174.58 1hvc s ASP 60 N -0.63 5.53 -1.40 2.29 1.01 -1.26 -2.12 116.67 120.09 1hvc s ASP 60 Ca 0.10 -0.07 -0.07 0.00 0.71 0.00 0.00 52.55 53.22 1hvc s ASP 60 Cb -0.12 -1.46 0.04 0.00 1.01 0.00 0.00 42.92 42.39 1hvc s ASP 60 CO 0.02 0.12 0.93 0.00 0.21 0.00 0.00 175.17 176.45 1hvc n GLN 61 N 0.03 -5.88 -2.88 8.23 6.02 -0.98 -4.92 117.38 117.00 1hvc n GLN 61 Ca -0.08 0.67 -0.40 0.00 -0.01 0.00 0.00 57.00 57.17 1hvc n GLN 61 Cb 0.53 -5.50 -0.05 0.00 1.02 0.00 0.00 30.24 26.25 1hvc n GLN 61 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1hvc s ILE 62 N -3.43 4.60 -0.10 5.09 -1.09 0.45 -4.73 121.20 121.98 1hvc s ILE 62 Ca 0.38 1.82 -0.16 0.00 -2.23 0.00 0.00 60.65 60.46 1hvc s ILE 62 Cb -0.18 -4.20 -0.05 0.00 -1.58 0.00 0.00 42.46 36.45 1hvc s ILE 62 CO 0.80 0.36 0.39 -0.22 -1.23 0.00 0.00 174.94 175.04 1hvc s LEU 63 N -0.15 4.31 0.03 2.97 1.98 -1.26 -1.18 118.68 125.38 1hvc s LEU 63 Ca 0.42 0.74 0.06 0.00 -2.89 0.00 0.00 54.13 52.46 1hvc s LEU 63 Cb -0.22 -2.55 -0.02 0.00 0.66 0.00 0.00 46.19 44.06 1hvc s LEU 63 CO 0.26 0.12 -0.19 -0.63 -1.89 0.00 0.00 176.35 174.02 1hvc s ILE 64 N 0.14 1.52 -0.32 6.68 1.01 -0.68 -4.57 121.20 124.97 1hvc s ILE 64 Ca 0.22 -1.05 -0.10 0.00 0.00 0.00 0.00 60.65 59.72 1hvc s ILE 64 Cb -0.15 -1.31 -0.01 0.00 0.01 0.00 0.00 42.46 41.00 1hvc s ILE 64 CO 0.09 0.23 0.17 -1.61 0.00 0.00 0.00 174.94 173.82 1hvc s GLU 65 N -0.96 3.35 -0.38 2.79 2.02 -0.39 -1.85 118.70 123.26 1hvc s GLU 65 Ca 0.06 -0.72 -0.09 0.00 0.02 0.00 0.00 54.97 54.24 1hvc s GLU 65 Cb -0.08 -3.63 0.05 0.00 0.10 0.00 0.00 34.13 30.58 1hvc s GLU 65 CO 0.01 -0.44 0.20 0.42 0.02 0.00 0.00 175.26 175.48 1hvc s ILE 66 N 1.63 4.23 -1.35 -1.63 1.01 0.16 -1.83 121.20 123.43 1hvc s ILE 66 Ca 0.05 -1.16 -0.07 0.00 0.00 0.00 0.00 60.65 59.46 1hvc s ILE 66 Cb -0.17 -3.47 0.02 0.00 0.01 0.00 0.00 42.46 38.85 1hvc s ILE 66 CO 0.07 -0.34 1.08 0.00 0.00 0.00 0.00 174.94 175.75 1hvc n GLY 68 N -1.74 0.74 3.57 0.00 0.00 -1.26 -5.03 105.19 101.47 1hvc n GLY 68 Ca -0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.60 1hvc n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1hvc s HIS 69 N -3.21 3.17 0.23 1.61 4.02 -0.71 -5.10 115.29 115.30 1hvc s HIS 69 Ca 0.00 -0.10 -0.14 0.00 1.02 0.00 0.00 55.06 55.84 1hvc s HIS 69 Cb 0.00 -2.10 -0.08 0.00 -1.02 0.00 0.00 32.58 29.39 1hvc s HIS 69 CO 0.00 0.01 0.64 0.15 1.02 0.00 0.00 174.74 176.55 1hvc s LYS 70 N 0.66 4.00 0.02 1.40 1.02 -1.26 -0.66 119.74 124.91 1hvc s LYS 70 Ca 0.02 0.57 -0.07 0.00 0.02 0.00 0.00 55.97 56.52 1hvc s LYS 70 Cb -0.13 -2.71 -0.00 0.00 -0.52 0.00 0.00 37.83 34.46 1hvc s LYS 70 CO 0.02 0.33 0.12 0.00 -0.92 0.00 0.00 175.35 174.90 1hvc s ALA 71 N -1.71 -0.22 -0.04 5.17 0.00 -0.77 -4.68 121.76 119.50 1hvc s ALA 71 Ca 0.46 -0.31 -0.02 0.00 0.00 0.00 0.00 51.96 52.09 1hvc s ALA 71 Cb -0.13 0.18 0.03 0.00 0.00 0.00 0.00 23.12 23.20 1hvc s ALA 71 CO 0.19 -0.26 0.07 0.42 0.00 0.00 0.00 175.76 176.19 1hvc s ILE 72 N -1.91 -0.10 0.01 0.00 1.01 -1.26 -1.69 121.20 117.25 1hvc s ILE 72 Ca -0.11 0.31 -0.02 0.00 0.00 0.00 0.00 60.65 60.84 1hvc s ILE 72 Cb -0.05 -0.15 0.01 0.00 0.01 0.00 0.00 42.46 42.27 1hvc s ILE 72 CO -0.01 0.13 0.07 0.61 0.00 0.00 0.00 174.94 175.74 1hvc n GLY 73 N 4.73 1.03 3.72 6.18 0.00 -0.32 -4.90 105.19 115.63 1hvc n GLY 73 Ca -0.16 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.54 1hvc n GLY 73 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hvc s THR 74 N -2.40 4.74 -0.03 2.61 2.01 -1.26 -0.41 115.64 120.90 1hvc s THR 74 Ca 0.02 2.06 0.07 0.00 0.31 0.00 0.00 61.69 64.14 1hvc s THR 74 Cb -0.00 -4.32 -0.01 0.00 0.01 0.00 0.00 72.50 68.17 1hvc s THR 74 CO 0.00 0.21 -0.23 0.68 -0.69 0.00 0.00 174.62 174.60 1hvc s VAL 75 N 0.67 1.83 -0.17 3.82 -7.23 -0.90 -4.42 120.40 114.00 1hvc s VAL 75 Ca 0.50 -0.97 -0.08 0.00 -1.81 0.00 0.00 61.98 59.62 1hvc s VAL 75 Cb -0.22 -1.53 -0.04 0.00 0.56 0.00 0.00 36.38 35.15 1hvc s VAL 75 CO 0.29 0.52 0.09 -0.76 -0.31 0.00 0.00 175.10 174.92 1hvc s LEU 76 N -0.41 4.02 -0.15 1.32 1.43 -0.01 -1.16 118.68 123.71 1hvc s LEU 76 Ca 0.05 0.20 -0.01 0.00 -1.03 0.00 0.00 54.13 53.34 1hvc s LEU 76 Cb -0.10 -2.01 -0.01 0.00 0.03 0.00 0.00 46.19 44.10 1hvc s LEU 76 CO 0.00 0.24 -0.10 -0.69 0.23 0.00 0.00 176.35 176.03 1hvc s VAL 77 N 0.00 3.21 0.06 -1.59 1.01 0.89 -0.28 120.40 123.71 1hvc s VAL 77 Ca 0.08 -0.59 -0.12 0.00 0.00 0.00 0.00 61.98 61.34 1hvc s VAL 77 Cb -0.12 -2.38 0.04 0.00 0.00 0.00 0.00 36.38 33.93 1hvc s VAL 77 CO 0.00 0.50 0.57 0.61 0.00 0.00 0.00 175.10 176.78 1hvc n GLY 78 N 3.78 0.79 2.69 4.51 0.00 0.04 -1.48 105.19 115.52 1hvc n GLY 78 Ca -0.18 -1.01 -0.40 0.00 0.00 0.00 0.00 46.02 44.43 1hvc n GLY 78 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1hvc n PRO 79 N -0.40 2.76 -3.63 1.61 -0.04 -1.26 -1.96 135.00 132.08 1hvc n PRO 79 Ca -0.00 -2.30 -0.37 0.00 -0.04 0.00 0.00 63.50 60.78 1hvc n PRO 79 Cb 0.30 -3.06 -0.06 0.00 -0.04 0.00 0.00 33.50 30.64 1hvc n PRO 79 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1hvc s THR 80 N 3.28 5.27 0.39 0.52 -1.32 -1.26 -5.00 115.64 117.52 1hvc s THR 80 Ca 0.53 0.54 0.08 0.00 -1.21 0.00 0.00 61.69 61.64 1hvc s THR 80 Cb 0.15 -3.59 0.19 0.00 -1.51 0.00 0.00 72.50 67.74 1hvc s THR 80 CO -0.05 0.52 1.96 1.55 -2.21 0.00 0.00 174.62 176.40 1hvc h PRO 81 N 5.49 0.36 -5.56 7.08 0.13 -1.97 -3.42 132.00 134.10 1hvc h PRO 81 Ca -0.49 -0.06 -0.53 0.00 -0.87 0.00 0.00 66.00 64.05 1hvc h PRO 81 Cb 1.20 -0.06 -0.29 0.00 0.13 0.00 0.00 31.00 31.98 1hvc h PRO 81 CO 0.66 0.38 -0.83 0.54 -0.23 0.00 0.00 178.00 178.52 1hvc s VAL 82 N -4.99 1.30 -0.01 1.56 0.11 -1.26 -5.05 120.40 112.07 1hvc s VAL 82 Ca -0.07 -0.71 -0.30 0.00 -2.93 0.00 0.00 61.98 57.97 1hvc s VAL 82 Cb 0.16 -1.09 -0.06 0.00 -1.53 0.00 0.00 36.38 33.87 1hvc s VAL 82 CO 0.73 0.36 1.46 0.20 -3.33 0.00 0.00 175.10 174.53 1hvc s ASN 83 N -0.40 6.80 -0.22 3.54 0.01 -1.26 -4.68 114.94 118.73 1hvc s ASN 83 Ca 0.06 2.16 -0.03 0.00 -0.71 0.00 0.00 52.86 54.34 1hvc s ASN 83 Cb -0.06 -2.56 -0.00 0.00 0.41 0.00 0.00 41.25 39.04 1hvc s ASN 83 CO -0.01 -0.77 -0.06 -0.63 -1.51 0.00 0.00 177.10 174.13 1hvc s ILE 84 N 2.67 3.23 -0.47 0.60 1.01 0.34 0.02 121.20 128.60 1hvc s ILE 84 Ca 0.66 -0.57 -0.23 0.00 0.00 0.00 0.00 60.65 60.51 1hvc s ILE 84 Cb -0.32 -2.48 0.03 0.00 0.01 0.00 0.00 42.46 39.70 1hvc s ILE 84 CO 0.27 0.41 0.78 -0.63 0.00 0.00 0.00 174.94 175.77 1hvc s ILE 85 N 1.45 4.65 0.70 2.92 -1.09 0.64 -1.48 121.20 128.99 1hvc s ILE 85 Ca 0.05 0.26 -0.00 0.00 -2.23 0.00 0.00 60.65 58.74 1hvc s ILE 85 Cb -0.14 -4.34 0.12 0.00 -1.58 0.00 0.00 42.46 36.51 1hvc s ILE 85 CO -0.04 -0.78 0.96 -0.83 -1.23 0.00 0.00 174.94 173.02 1hvc s GLY 86 N 2.29 1.76 0.61 6.18 0.00 -1.19 -1.61 107.32 115.37 1hvc s GLY 86 Ca 0.27 -1.71 0.32 0.00 0.00 0.00 0.00 44.72 43.61 1hvc s GLY 86 CO 0.20 -1.17 2.16 3.21 0.00 0.00 0.00 173.10 177.50 1hvc h ARG 87 N -0.44 0.00 -0.11 2.90 3.08 -0.84 -2.16 114.38 116.81 1hvc h ARG 87 Ca -0.37 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.68 1hvc h ARG 87 Cb 1.27 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.32 1hvc h ARG 87 CO 0.41 0.00 0.05 -2.95 -1.07 0.00 0.00 179.97 176.41 1hvc h ASN 88 N 0.00 0.13 0.06 7.04 -1.07 -1.80 -2.55 115.58 117.39 1hvc h ASN 88 Ca 0.05 -0.01 -0.37 0.00 0.07 0.00 0.00 56.30 56.04 1hvc h ASN 88 Cb 0.33 -0.03 -0.06 0.00 -2.07 0.00 0.00 38.32 36.49 1hvc h ASN 88 CO -0.00 0.12 -2.32 0.18 0.07 0.00 0.00 177.43 175.48 1hvc n LEU 89 N -4.49 1.51 -0.32 6.14 4.77 -0.88 -4.36 117.00 119.37 1hvc n LEU 89 Ca -0.01 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.93 1hvc n LEU 89 Cb 0.10 -0.24 0.08 0.00 -2.33 0.00 0.00 43.42 41.04 1hvc n LEU 89 CO 0.35 0.70 1.22 -0.07 -1.33 0.00 0.00 177.39 178.25 1hvc h LEU 90 N 0.01 1.00 -1.79 2.23 3.38 -1.35 -1.28 115.31 117.51 1hvc h LEU 90 Ca -0.52 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 57.44 1hvc h LEU 90 Cb 2.07 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 42.55 1hvc h LEU 90 CO -0.01 0.74 0.20 0.71 0.09 0.00 0.00 178.44 180.18 1hvc h THR 91 N 1.17 1.00 0.00 0.22 1.35 -1.70 -2.20 112.91 112.74 1hvc h THR 91 Ca 0.31 -0.09 -0.10 0.00 -0.55 0.00 0.00 66.41 65.98 1hvc h THR 91 Cb -0.10 0.70 -0.01 0.00 -1.73 0.00 0.00 68.15 67.01 1hvc h THR 91 CO -0.06 0.05 -0.47 1.56 -0.25 0.00 0.00 175.52 176.34 1hvc h GLN 92 N 0.27 0.00 -0.36 4.72 4.20 -1.44 -2.91 115.11 119.59 1hvc h GLN 92 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 1hvc h GLN 92 Cb 0.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.94 1hvc h GLN 92 CO -0.03 0.47 0.00 0.44 -0.67 0.00 0.00 178.83 179.05 1hvc n ILE 93 N -3.70 0.47 -2.06 2.54 -5.35 -0.87 -4.93 119.36 105.46 1hvc n ILE 93 Ca -0.01 -0.51 -0.08 0.00 -0.27 0.00 0.00 62.75 61.88 1hvc n ILE 93 Cb 0.54 0.33 -0.01 0.00 -1.74 0.00 0.00 39.64 38.76 1hvc n ILE 93 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1hvc n GLY 94 N 1.17 0.14 3.73 3.28 0.00 -1.10 -4.88 105.19 107.52 1hvc n GLY 94 Ca 0.15 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 1hvc n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hvc s THR 96 N 0.00 1.03 -0.12 0.00 -4.23 0.42 -4.43 115.64 108.31 1hvc s THR 96 Ca 0.45 -2.03 -0.11 0.00 -1.18 0.00 0.00 61.69 58.81 1hvc s THR 96 Cb -0.22 -1.99 -0.05 0.00 1.34 0.00 0.00 72.50 71.57 1hvc s THR 96 CO 0.28 -0.62 0.23 -0.76 -0.54 0.00 0.00 174.62 173.21 1hvc s LEU 97 N -3.19 4.33 -0.05 4.79 1.43 0.12 -1.27 118.68 124.84 1hvc s LEU 97 Ca 0.20 0.53 0.02 0.00 -1.03 0.00 0.00 54.13 53.85 1hvc s LEU 97 Cb 0.04 -2.25 0.01 0.00 0.03 0.00 0.00 46.19 44.02 1hvc s LEU 97 CO 0.03 0.27 -0.10 0.20 0.23 0.00 0.00 176.35 176.98 1hvc s ASN 98 N -0.39 1.44 0.10 2.29 0.01 -0.71 -0.33 114.94 117.36 1hvc s ASN 98 Ca 0.16 -0.23 0.03 0.00 -0.71 0.00 0.00 52.86 52.10 1hvc s ASN 98 Cb -0.13 -0.60 -0.04 0.00 0.41 0.00 0.00 41.25 40.89 1hvc s ASN 98 CO 0.05 0.02 0.15 -0.36 -1.51 0.00 0.00 177.10 175.45 1hvc s PHE 99 N 0.59 3.29 0.00 2.20 0.40 -0.09 -2.26 117.98 122.10 1hvc s PHE 99 Ca -0.11 0.10 0.00 0.00 -0.60 0.00 0.00 56.93 56.33 1hvc s PHE 99 Cb -0.14 -1.64 0.00 0.00 0.51 0.00 0.00 43.02 41.76 1hvc s PHE 99 CO 0.02 0.54 0.00 0.41 0.70 0.00 0.00 175.22 176.89 1hvc n GLY 200 N 0.14 0.67 3.43 4.36 0.00 -1.23 -3.15 105.19 109.41 1hvc n GLY 200 Ca -0.07 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1hvc n GLY 200 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hvc n GLY 201 N -0.72 2.37 0.00 -0.02 0.00 -1.26 -4.44 105.19 101.12 1hvc n GLY 201 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1hvc n GLY 201 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1hvc n SER 202 N 1.01 0.00 -0.22 1.61 2.88 -1.26 -5.04 113.62 112.61 1hvc n SER 202 Ca 0.00 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.52 1hvc n SER 202 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 1hvc n SER 202 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1hvc n SER 203 N 0.00 -0.02 -0.78 -3.46 2.88 -1.26 -4.87 113.62 106.11 1hvc n SER 203 Ca 0.00 -0.01 0.00 0.00 -1.33 0.00 0.00 58.87 57.53 1hvc n SER 203 Cb 0.00 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.42 1hvc n SER 203 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1hvc n GLY 204 N 0.29 -3.64 3.61 0.46 0.00 -1.26 -5.05 105.19 99.60 1hvc n GLY 204 Ca 0.03 -1.00 -0.56 0.00 0.00 0.00 0.00 46.02 44.49 1hvc n GLY 204 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1hvc n PRO 1 N -1.40 0.79 -4.59 1.61 -0.02 -1.19 -4.77 135.00 125.42 1hvc n PRO 1 Ca 0.00 0.28 -0.33 0.00 -2.02 0.00 0.00 63.50 61.44 1hvc n PRO 1 Cb 0.10 -1.89 -0.16 0.00 -0.02 0.00 0.00 33.50 31.53 1hvc n PRO 1 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1hvc s GLN 2 N 1.16 3.16 -0.21 -0.52 0.74 -1.26 -0.92 119.66 121.81 1hvc s GLN 2 Ca 0.90 -0.78 -0.03 0.00 0.05 0.00 0.00 55.36 55.50 1hvc s GLN 2 Cb -1.10 -2.56 -0.00 0.00 1.10 0.00 0.00 33.01 30.45 1hvc s GLN 2 CO 0.56 0.02 -0.07 0.42 -0.55 0.00 0.00 175.29 175.66 1hvc s ILE 3 N 0.79 3.11 0.62 -2.34 1.01 0.56 -4.97 121.20 119.98 1hvc s ILE 3 Ca -0.06 -0.58 -0.07 0.00 0.00 0.00 0.00 60.65 59.94 1hvc s ILE 3 Cb -0.15 -2.40 0.01 0.00 0.01 0.00 0.00 42.46 39.93 1hvc s ILE 3 CO -0.00 0.45 0.95 0.42 0.00 0.00 0.00 174.94 176.75 1hvc s THR 4 N 1.44 3.58 -0.17 2.92 -4.23 -1.26 -0.70 115.64 117.21 1hvc s THR 4 Ca 0.06 0.10 0.17 0.00 -1.18 0.00 0.00 61.69 60.84 1hvc s THR 4 Cb -0.14 -3.45 0.43 0.00 1.34 0.00 0.00 72.50 70.69 1hvc s THR 4 CO -0.05 -0.49 1.31 0.18 -0.54 0.00 0.00 174.62 175.03 1hvc n LEU 5 N -2.69 3.29 0.18 4.79 4.77 -1.26 -4.52 117.00 121.57 1hvc n LEU 5 Ca 0.05 -3.02 0.03 0.00 -0.03 0.00 0.00 56.01 53.05 1hvc n LEU 5 Cb 0.58 -0.49 0.36 0.00 -2.33 0.00 0.00 43.42 41.53 1hvc n LEU 5 CO 0.54 0.69 0.70 -0.50 -1.33 0.00 0.00 177.39 177.49 1hvc h TRP 6 N 1.13 0.00 -1.83 -1.77 4.06 -1.95 -3.42 115.95 112.17 1hvc h TRP 6 Ca 0.00 0.00 -0.59 0.00 2.06 0.00 0.00 58.89 60.36 1hvc h TRP 6 Cb 1.26 0.00 -0.13 0.00 -1.00 0.00 0.00 29.16 29.29 1hvc h TRP 6 CO 0.30 0.39 -0.58 1.14 -3.56 0.00 0.00 178.44 176.13 1hvc s GLN 7 N -4.01 1.92 0.16 0.49 -2.07 -1.26 -5.09 119.66 109.79 1hvc s GLN 7 Ca -0.02 -2.11 -0.33 0.00 -1.82 0.00 0.00 55.36 51.08 1hvc s GLN 7 Cb 0.14 -1.34 -0.13 0.00 -1.09 0.00 0.00 33.01 30.59 1hvc s GLN 7 CO 0.71 -0.17 1.70 0.54 -1.32 0.00 0.00 175.29 176.75 1hvc n ARG 8 N -0.94 2.51 -1.34 9.60 1.74 -1.26 -4.84 116.66 122.13 1hvc n ARG 8 Ca -0.07 0.91 -0.40 0.00 -0.77 0.00 0.00 57.85 57.52 1hvc n ARG 8 Cb 0.67 -2.73 -0.03 0.00 -1.02 0.00 0.00 32.46 29.35 1hvc n ARG 8 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1hvc n PRO 9 N 4.19 2.26 -3.04 5.56 -0.04 -1.26 -4.90 135.00 137.76 1hvc n PRO 9 Ca 0.17 -2.12 -0.40 0.00 -0.04 0.00 0.00 63.50 61.11 1hvc n PRO 9 Cb 0.33 -3.00 -0.05 0.00 -0.04 0.00 0.00 33.50 30.74 1hvc n PRO 9 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1hvc s LEU 10 N 1.36 4.25 0.15 1.53 1.43 -1.26 -1.26 118.68 124.89 1hvc s LEU 10 Ca 0.53 1.09 0.05 0.00 -1.03 0.00 0.00 54.13 54.77 1hvc s LEU 10 Cb 0.14 -3.05 -0.04 0.00 0.03 0.00 0.00 46.19 43.27 1hvc s LEU 10 CO 0.01 -0.20 -0.11 0.68 0.23 0.00 0.00 176.35 176.96 1hvc s VAL 11 N 1.30 1.28 0.00 -1.59 -7.23 -0.80 -4.96 120.40 108.40 1hvc s VAL 11 Ca 0.35 -2.06 -0.29 0.00 -1.81 0.00 0.00 61.98 58.17 1hvc s VAL 11 Cb -0.17 -1.85 -0.03 0.00 0.56 0.00 0.00 36.38 34.88 1hvc s VAL 11 CO 0.15 -0.70 0.92 -0.89 -0.31 0.00 0.00 175.10 174.28 1hvc s THR 12 N -3.17 4.85 0.09 5.32 2.01 -1.26 -1.53 115.64 121.96 1hvc s THR 12 Ca 0.17 1.95 0.10 0.00 0.31 0.00 0.00 61.69 64.21 1hvc s THR 12 Cb 0.01 -4.27 -0.04 0.00 0.01 0.00 0.00 72.50 68.22 1hvc s THR 12 CO 0.02 0.20 -0.24 0.27 -0.69 0.00 0.00 174.62 174.18 1hvc s ILE 13 N 0.83 2.44 -0.21 1.82 -4.36 0.57 -3.06 121.20 119.23 1hvc s ILE 13 Ca 0.49 -1.54 -0.03 0.00 -0.26 0.00 0.00 60.65 59.31 1hvc s ILE 13 Cb -0.21 -2.06 -0.01 0.00 1.25 0.00 0.00 42.46 41.44 1hvc s ILE 13 CO 0.26 0.19 -0.06 -0.75 0.24 0.00 0.00 174.94 174.82 1hvc s LYS 14 N -1.80 3.35 -0.03 0.37 2.20 -0.45 -1.34 119.74 122.04 1hvc s LYS 14 Ca 0.14 -0.64 0.01 0.00 -0.36 0.00 0.00 55.97 55.12 1hvc s LYS 14 Cb -0.10 -2.95 0.02 0.00 -1.51 0.00 0.00 37.83 33.29 1hvc s LYS 14 CO 0.06 -0.16 -0.04 -1.50 -0.36 0.00 0.00 175.35 173.35 1hvc s ILE 15 N 1.36 0.43 -0.76 5.43 2.07 0.44 -1.32 121.20 128.86 1hvc s ILE 15 Ca 0.04 -0.11 -0.35 0.00 -1.41 0.00 0.00 60.65 58.83 1hvc s ILE 15 Cb -0.14 -0.45 -0.19 0.00 0.13 0.00 0.00 42.46 41.81 1hvc s ILE 15 CO -0.03 0.18 2.48 0.61 -1.91 0.00 0.00 174.94 176.26 1hvc n GLY 16 N 3.76 -0.26 2.58 1.50 0.00 -1.26 0.97 105.19 112.49 1hvc n GLY 16 Ca -0.23 1.09 -0.22 0.00 0.00 0.00 0.00 46.02 46.66 1hvc n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hvc n GLY 17 N 6.76 4.69 3.92 -0.02 0.00 -1.26 -4.96 105.19 114.31 1hvc n GLY 17 Ca 0.59 -2.34 -0.29 0.00 0.00 0.00 0.00 46.02 43.97 1hvc n GLY 17 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hvc s GLN 18 N -3.34 3.49 -0.06 1.61 -0.21 0.27 -5.10 119.66 116.32 1hvc s GLN 18 Ca 0.43 -0.39 -0.19 0.00 0.02 0.00 0.00 55.36 55.22 1hvc s GLN 18 Cb 0.39 -2.96 -0.05 0.00 1.00 0.00 0.00 33.01 31.40 1hvc s GLN 18 CO -0.12 0.53 0.54 -0.51 -2.12 0.00 0.00 175.29 173.62 1hvc s LEU 19 N -2.82 4.35 0.25 2.90 1.02 -1.26 -0.42 118.68 122.69 1hvc s LEU 19 Ca 0.37 1.00 0.05 0.00 0.02 0.00 0.00 54.13 55.57 1hvc s LEU 19 Cb -0.12 -2.82 -0.05 0.00 0.02 0.00 0.00 46.19 43.22 1hvc s LEU 19 CO 0.28 0.04 -0.04 -0.54 0.02 0.00 0.00 176.35 176.10 1hvc s LYS 20 N 0.24 1.41 0.16 1.70 -0.14 -0.45 -4.97 119.74 117.69 1hvc s LYS 20 Ca 0.29 -1.70 0.09 0.00 -1.36 0.00 0.00 55.97 53.29 1hvc s LYS 20 Cb -0.17 -0.90 -0.04 0.00 -1.68 0.00 0.00 37.83 35.05 1hvc s LYS 20 CO 0.14 -0.00 -0.14 -1.83 -0.76 0.00 0.00 175.35 172.76 1hvc s GLU 21 N -3.78 1.92 0.04 1.68 -1.05 -1.26 -0.32 118.70 115.94 1hvc s GLU 21 Ca 0.28 -1.26 -0.03 0.00 -0.15 0.00 0.00 54.97 53.81 1hvc s GLU 21 Cb 0.04 -2.12 -0.02 0.00 -0.44 0.00 0.00 34.13 31.59 1hvc s GLU 21 CO 0.09 0.45 0.04 0.00 0.95 0.00 0.00 175.26 176.79 1hvc s ALA 22 N -1.52 0.15 -0.10 -0.84 0.00 -0.58 -4.42 121.76 114.45 1hvc s ALA 22 Ca 0.22 -0.78 -0.20 0.00 0.00 0.00 0.00 51.96 51.21 1hvc s ALA 22 Cb -0.09 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.24 1hvc s ALA 22 CO 0.13 -0.31 0.56 -1.17 0.00 0.00 0.00 175.76 174.96 1hvc s LEU 23 N -2.29 4.29 -0.36 0.00 2.96 0.90 -1.91 118.68 122.26 1hvc s LEU 23 Ca -0.03 0.95 -0.29 0.00 -0.22 0.00 0.00 54.13 54.54 1hvc s LEU 23 Cb 0.00 -2.83 0.01 0.00 0.50 0.00 0.00 46.19 43.87 1hvc s LEU 23 CO -0.06 -0.04 1.20 -0.76 -1.32 0.00 0.00 176.35 175.37 1hvc s LEU 24 N 0.69 3.80 -0.33 -0.68 1.43 -0.39 -0.42 118.68 122.78 1hvc s LEU 24 Ca 0.30 0.92 0.01 0.00 -1.03 0.00 0.00 54.13 54.34 1hvc s LEU 24 Cb -0.16 -3.54 0.10 0.00 0.03 0.00 0.00 46.19 42.62 1hvc s LEU 24 CO 0.13 -1.11 0.08 -0.62 0.23 0.00 0.00 176.35 175.07 1hvc s ASP 25 N 2.50 4.32 0.19 2.29 -1.08 -0.18 -4.10 116.67 120.61 1hvc s ASP 25 Ca 0.51 -1.88 0.23 0.00 -0.52 0.00 0.00 52.55 50.90 1hvc s ASP 25 Cb -0.12 -1.18 0.91 0.00 -1.46 0.00 0.00 42.92 41.06 1hvc s ASP 25 CO 0.24 -0.40 1.71 0.35 0.52 0.00 0.00 175.17 177.60 1hvc n THR 26 N 4.57 0.72 1.12 1.71 -2.24 -1.26 -2.78 114.28 116.12 1hvc n THR 26 Ca 0.01 0.08 0.14 0.00 -2.27 0.00 0.00 64.05 62.00 1hvc n THR 26 Cb 0.42 -0.93 0.52 0.00 -2.10 0.00 0.00 70.33 68.24 1hvc n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hvc n GLY 27 N 0.47 -1.28 3.67 3.38 0.00 -1.25 -4.58 105.19 105.59 1hvc n GLY 27 Ca 0.04 -0.21 -0.38 0.00 0.00 0.00 0.00 46.02 45.47 1hvc n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hvc s ALA 28 N -2.85 3.57 0.27 4.61 0.00 -1.12 -4.97 121.76 121.27 1hvc s ALA 28 Ca 0.17 -0.61 -0.03 0.00 0.00 0.00 0.00 51.96 51.49 1hvc s ALA 28 Cb 0.19 -2.57 0.37 0.00 0.00 0.00 0.00 23.12 21.11 1hvc s ALA 28 CO 0.56 -0.29 1.94 -0.44 0.00 0.00 0.00 175.76 177.53 1hvc h ASP 29 N 7.43 1.05 -2.33 0.00 5.19 -1.89 0.12 116.42 125.99 1hvc h ASP 29 Ca -0.36 -0.02 -0.57 0.00 -0.62 0.00 0.00 57.03 55.46 1hvc h ASP 29 Cb 1.16 -0.25 -0.14 0.00 0.18 0.00 0.00 39.33 40.29 1hvc h ASP 29 CO 0.70 0.74 -0.67 -1.81 -3.12 0.00 0.00 179.24 175.08 1hvc s ASP 30 N -6.14 3.33 -0.27 6.45 1.01 -1.26 -2.96 116.67 116.83 1hvc s ASP 30 Ca -0.12 -1.22 -0.10 0.00 0.71 0.00 0.00 52.55 51.81 1hvc s ASP 30 Cb 0.18 -0.28 -0.05 0.00 1.01 0.00 0.00 42.92 43.79 1hvc s ASP 30 CO 0.81 -0.30 0.17 -0.89 0.21 0.00 0.00 175.17 175.17 1hvc s THR 31 N -2.80 5.21 -0.22 -1.27 2.01 -1.26 -3.32 115.64 113.98 1hvc s THR 31 Ca 0.32 0.13 0.02 0.00 0.31 0.00 0.00 61.69 62.47 1hvc s THR 31 Cb 0.04 -3.47 0.04 0.00 0.01 0.00 0.00 72.50 69.13 1hvc s THR 31 CO 0.15 0.28 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.53 1hvc s VAL 32 N 1.61 2.02 0.10 3.82 1.01 -0.91 -0.90 120.40 127.15 1hvc s VAL 32 Ca 0.07 -1.28 0.03 0.00 0.00 0.00 0.00 61.98 60.80 1hvc s VAL 32 Cb -0.15 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 1hvc s VAL 32 CO 0.09 0.20 0.11 -0.76 0.00 0.00 0.00 175.10 174.74 1hvc s LEU 33 N 1.23 3.86 0.61 3.92 2.01 0.43 -0.91 118.68 129.83 1hvc s LEU 33 Ca -0.03 -0.01 -0.18 0.00 0.01 0.00 0.00 54.13 53.93 1hvc s LEU 33 Cb -0.17 -2.52 -0.12 0.00 0.01 0.00 0.00 46.19 43.40 1hvc s LEU 33 CO -0.08 0.14 0.04 -0.62 1.01 0.00 0.00 176.35 176.85 1hvc n GLU 34 N 0.23 0.16 -1.44 1.70 1.02 -1.26 -1.93 120.64 119.11 1hvc n GLU 34 Ca -0.08 0.07 -0.61 0.00 -0.02 0.00 0.00 57.16 56.51 1hvc n GLU 34 Cb 0.52 -1.29 -0.11 0.00 -0.02 0.00 0.00 31.44 30.55 1hvc n GLU 34 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1hvc n GLU 35 N 0.91 0.18 -4.06 3.49 -0.58 -1.01 -4.48 120.64 115.10 1hvc n GLU 35 Ca 0.08 0.06 -0.10 0.00 -0.42 0.00 0.00 57.16 56.77 1hvc n GLU 35 Cb 0.49 -1.63 -0.07 0.00 -0.57 0.00 0.00 31.44 29.65 1hvc n GLU 35 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1hvc s MET 36 N 5.02 1.32 -0.44 3.49 0.23 -1.26 -5.04 119.30 122.63 1hvc s MET 36 Ca 1.13 -1.37 -0.20 0.00 -1.03 0.00 0.00 55.69 54.23 1hvc s MET 36 Cb -1.41 0.38 0.02 0.00 -1.53 0.00 0.00 34.83 32.29 1hvc s MET 36 CO 0.69 -0.50 0.62 -1.12 -2.03 0.00 0.00 175.02 172.68 1hvc s SER 37 N -3.05 6.31 -0.07 -1.18 0.01 -1.26 -5.05 113.70 109.40 1hvc s SER 37 Ca 0.27 -0.39 -0.02 0.00 1.31 0.00 0.00 55.95 57.11 1hvc s SER 37 Cb 0.03 -2.31 -0.04 0.00 0.21 0.00 0.00 66.02 63.92 1hvc s SER 37 CO 0.08 -0.76 0.04 -0.76 0.41 0.00 0.00 173.24 172.25 1hvc s LEU 38 N 2.73 3.78 0.43 2.44 1.43 -1.26 -5.04 118.68 123.20 1hvc s LEU 38 Ca 0.21 0.19 -0.23 0.00 -1.03 0.00 0.00 54.13 53.27 1hvc s LEU 38 Cb -0.15 -1.96 -0.08 0.00 0.03 0.00 0.00 46.19 44.03 1hvc s LEU 38 CO 0.18 0.36 1.08 -2.16 0.23 0.00 0.00 176.35 176.04 1hvc s PRO 39 N -1.12 3.98 0.00 1.29 0.04 -1.26 -4.93 135.00 133.00 1hvc s PRO 39 Ca 0.16 1.55 0.00 0.00 0.04 0.00 0.00 61.00 62.75 1hvc s PRO 39 Cb -0.12 -2.42 0.00 0.00 0.04 0.00 0.00 34.50 32.01 1hvc s PRO 39 CO 0.05 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.19 1hvc n GLY 40 N 0.26 2.77 3.82 0.56 0.00 -1.26 -5.06 105.19 106.28 1hvc n GLY 40 Ca 0.06 -2.05 -0.34 0.00 0.00 0.00 0.00 46.02 43.69 1hvc n GLY 40 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1hvc s ARG 41 N -2.48 4.22 0.37 1.61 6.06 -1.26 -5.07 118.95 122.39 1hvc s ARG 41 Ca 0.00 0.94 0.04 0.00 -2.50 0.00 0.00 55.73 54.21 1hvc s ARG 41 Cb 0.00 -2.53 -0.05 0.00 0.06 0.00 0.00 34.95 32.43 1hvc s ARG 41 CO 0.00 0.18 0.07 1.67 -2.50 0.00 0.00 175.30 174.72 1hvc s TRP 42 N -1.87 1.94 0.04 5.12 1.48 -1.26 -4.65 118.94 119.74 1hvc s TRP 42 Ca 0.53 -1.03 0.04 0.00 -1.06 0.00 0.00 56.10 54.58 1hvc s TRP 42 Cb -0.13 -1.30 -0.02 0.00 -1.16 0.00 0.00 33.47 30.86 1hvc s TRP 42 CO 0.18 -0.03 -0.12 -1.59 -4.06 0.00 0.00 176.95 171.33 1hvc s LYS 43 N -3.83 0.79 0.34 3.25 0.00 -0.84 -4.93 119.74 114.51 1hvc s LYS 43 Ca 0.30 -0.75 -0.29 0.00 0.00 0.00 0.00 55.97 55.24 1hvc s LYS 43 Cb 0.07 -0.74 -0.12 0.00 0.00 0.00 0.00 37.83 37.03 1hvc s LYS 43 CO 0.14 0.18 1.38 -2.30 0.00 0.00 0.00 175.35 174.75 1hvc n PRO 44 N 1.78 2.32 -4.00 1.78 -0.02 -1.26 -0.71 135.00 134.89 1hvc n PRO 44 Ca -0.19 0.82 -0.09 0.00 -2.02 0.00 0.00 63.50 62.01 1hvc n PRO 44 Cb 0.55 -2.47 -0.08 0.00 -0.02 0.00 0.00 33.50 31.48 1hvc n PRO 44 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1hvc s LYS 45 N -1.66 0.99 -0.09 -0.52 2.47 0.15 -4.85 119.74 116.24 1hvc s LYS 45 Ca 0.57 -1.20 0.02 0.00 -1.56 0.00 0.00 55.97 53.80 1hvc s LYS 45 Cb -0.54 0.32 -0.02 0.00 -1.46 0.00 0.00 37.83 36.13 1hvc s LYS 45 CO 0.60 -0.32 -0.15 -1.64 0.16 0.00 0.00 175.35 174.00 1hvc s MET 46 N -3.96 2.94 0.10 4.03 -1.94 -1.26 0.28 119.30 119.49 1hvc s MET 46 Ca 0.16 -0.72 0.04 0.00 -1.71 0.00 0.00 55.69 53.46 1hvc s MET 46 Cb 0.05 -2.47 -0.04 0.00 2.01 0.00 0.00 34.83 34.38 1hvc s MET 46 CO -0.03 0.39 -0.11 0.96 -0.01 0.00 0.00 175.02 176.22 1hvc s ILE 47 N -0.13 1.06 0.28 2.53 -4.36 0.19 -4.96 121.20 115.82 1hvc s ILE 47 Ca -0.02 -1.66 0.03 0.00 -0.26 0.00 0.00 60.65 58.74 1hvc s ILE 47 Cb -0.14 -1.41 -0.04 0.00 1.25 0.00 0.00 42.46 42.13 1hvc s ILE 47 CO 0.04 -0.51 0.17 -0.83 0.24 0.00 0.00 174.94 174.05 1hvc s GLY 48 N -2.44 1.96 0.00 6.27 0.00 -1.26 0.49 107.32 112.34 1hvc s GLY 48 Ca 0.06 -1.80 0.00 0.00 0.00 0.00 0.00 44.72 42.99 1hvc s GLY 48 CO 0.01 -1.53 0.00 0.61 0.00 0.00 0.00 173.10 172.19 1hvc n GLY 49 N -0.52 2.94 3.76 0.20 0.00 0.09 -4.97 105.19 106.69 1hvc n GLY 49 Ca 0.02 -0.47 -0.41 0.00 0.00 0.00 0.00 46.02 45.16 1hvc n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hvc s ILE 50 N -1.27 2.44 0.00 -0.61 -1.09 -1.26 -2.72 121.20 116.68 1hvc s ILE 50 Ca 0.00 0.40 0.00 0.00 -2.23 0.00 0.00 60.65 58.82 1hvc s ILE 50 Cb 0.00 -3.25 0.00 0.00 -1.58 0.00 0.00 42.46 37.63 1hvc s ILE 50 CO 0.00 0.08 0.00 0.61 -1.23 0.00 0.00 174.94 174.40 1hvc n GLY 51 N 1.46 2.96 0.00 6.18 0.00 -1.26 -0.78 105.19 113.75 1hvc n GLY 51 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1hvc n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hvc n GLY 52 N -2.00 0.54 3.60 -0.02 0.00 -1.10 -4.21 105.19 102.00 1hvc n GLY 52 Ca 0.00 -1.72 -0.34 0.00 0.00 0.00 0.00 46.02 43.96 1hvc n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hvc s PHE 53 N -2.62 2.97 0.16 1.61 0.08 -1.26 -0.73 117.98 118.19 1hvc s PHE 53 Ca 0.00 0.04 0.11 0.00 0.12 0.00 0.00 56.93 57.19 1hvc s PHE 53 Cb 0.00 -1.70 -0.04 0.00 -0.57 0.00 0.00 43.02 40.71 1hvc s PHE 53 CO 0.00 0.36 -0.22 0.96 -0.10 0.00 0.00 175.22 176.23 1hvc s ILE 54 N -0.86 2.52 -0.08 0.64 -4.36 0.18 -4.88 121.20 114.36 1hvc s ILE 54 Ca 0.14 -1.83 -0.22 0.00 -0.26 0.00 0.00 60.65 58.47 1hvc s ILE 54 Cb -0.11 -2.19 -0.04 0.00 1.25 0.00 0.00 42.46 41.38 1hvc s ILE 54 CO 0.03 -0.03 0.66 -0.75 0.24 0.00 0.00 174.94 175.08 1hvc s LYS 55 N -2.46 4.41 0.23 0.37 2.36 -1.26 -0.64 119.74 122.75 1hvc s LYS 55 Ca 0.19 0.79 0.08 0.00 -2.55 0.00 0.00 55.97 54.48 1hvc s LYS 55 Cb -0.09 -3.45 -0.05 0.00 -1.05 0.00 0.00 37.83 33.19 1hvc s LYS 55 CO 0.10 0.07 -0.12 0.14 1.55 0.00 0.00 175.35 177.09 1hvc s VAL 56 N 0.81 1.75 -0.24 4.02 -7.23 0.14 -4.49 120.40 115.16 1hvc s VAL 56 Ca 0.35 -2.20 -0.10 0.00 -1.81 0.00 0.00 61.98 58.22 1hvc s VAL 56 Cb -0.17 -2.18 -0.05 0.00 0.56 0.00 0.00 36.38 34.54 1hvc s VAL 56 CO 0.16 -0.50 0.16 -0.13 -0.31 0.00 0.00 175.10 174.49 1hvc s ARG 57 N -3.66 4.04 -0.22 4.82 0.52 0.02 0.34 118.95 124.81 1hvc s ARG 57 Ca 0.25 -0.28 -0.14 0.00 -0.52 0.00 0.00 55.73 55.04 1hvc s ARG 57 Cb 0.00 -3.55 -0.04 0.00 0.52 0.00 0.00 34.95 31.88 1hvc s ARG 57 CO 0.09 0.03 0.31 -1.14 0.02 0.00 0.00 175.30 174.60 1hvc s GLN 58 N 1.15 4.13 -0.11 3.54 0.74 0.11 -0.81 119.66 128.41 1hvc s GLN 58 Ca 0.07 0.02 0.01 0.00 0.05 0.00 0.00 55.36 55.51 1hvc s GLN 58 Cb -0.14 -3.54 -0.02 0.00 1.10 0.00 0.00 33.01 30.41 1hvc s GLN 58 CO 0.05 -0.01 -0.14 0.71 -0.55 0.00 0.00 175.29 175.35 1hvc s TYR 59 N 1.25 2.77 0.15 1.67 1.51 -0.66 -1.99 117.35 122.05 1hvc s TYR 59 Ca 0.15 -0.56 0.04 0.00 -1.01 0.00 0.00 57.07 55.68 1hvc s TYR 59 Cb -0.14 -1.79 -0.04 0.00 -0.11 0.00 0.00 41.96 39.88 1hvc s TYR 59 CO 0.07 -0.14 0.19 -0.51 -1.11 0.00 0.00 175.55 174.05 1hvc s ASP 60 N 0.11 5.86 -1.46 2.29 1.01 -1.26 -0.65 116.67 122.56 1hvc s ASP 60 Ca -0.06 0.00 -0.08 0.00 0.71 0.00 0.00 52.55 53.11 1hvc s ASP 60 Cb -0.15 -1.64 0.03 0.00 1.01 0.00 0.00 42.92 42.18 1hvc s ASP 60 CO 0.05 0.07 0.80 0.00 0.21 0.00 0.00 175.17 176.30 1hvc n GLN 61 N -0.38 -5.49 -3.27 8.23 3.00 -1.14 -4.91 117.38 113.43 1hvc n GLN 61 Ca -0.08 0.75 -0.39 0.00 -0.01 0.00 0.00 57.00 57.28 1hvc n GLN 61 Cb 0.54 -5.64 -0.06 0.00 0.00 0.00 0.00 30.24 25.08 1hvc n GLN 61 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1hvc s ILE 62 N -3.19 4.88 0.05 5.09 -1.09 -0.40 -4.69 121.20 121.85 1hvc s ILE 62 Ca 0.46 1.17 -0.24 0.00 -2.23 0.00 0.00 60.65 59.82 1hvc s ILE 62 Cb -0.22 -3.89 -0.06 0.00 -1.58 0.00 0.00 42.46 36.72 1hvc s ILE 62 CO 0.57 0.48 0.73 -0.22 -1.23 0.00 0.00 174.94 175.26 1hvc s LEU 63 N -0.56 4.46 -0.01 2.97 2.96 -1.26 -1.38 118.68 125.85 1hvc s LEU 63 Ca 0.29 1.41 -0.01 0.00 -0.22 0.00 0.00 54.13 55.60 1hvc s LEU 63 Cb -0.18 -3.17 0.00 0.00 0.50 0.00 0.00 46.19 43.34 1hvc s LEU 63 CO 0.17 0.07 0.03 -0.51 -1.32 0.00 0.00 176.35 174.79 1hvc s ILE 64 N -0.25 -0.00 -0.24 6.68 2.07 -0.42 -4.38 121.20 124.66 1hvc s ILE 64 Ca 0.36 0.00 -0.05 0.00 -1.41 0.00 0.00 60.65 59.56 1hvc s ILE 64 Cb -0.20 -0.06 -0.01 0.00 0.13 0.00 0.00 42.46 42.32 1hvc s ILE 64 CO 0.22 0.00 -0.01 -1.61 -1.91 0.00 0.00 174.94 171.63 1hvc s GLU 65 N 0.03 3.36 -0.31 3.50 2.02 -0.43 -1.53 118.70 125.35 1hvc s GLU 65 Ca -0.00 -0.65 -0.04 0.00 0.02 0.00 0.00 54.97 54.30 1hvc s GLU 65 Cb -0.00 -3.11 0.04 0.00 0.10 0.00 0.00 34.13 31.15 1hvc s GLU 65 CO -0.00 -0.24 0.04 0.42 0.02 0.00 0.00 175.26 175.51 1hvc s ILE 66 N 1.50 3.45 -1.51 -1.63 1.01 0.12 -1.35 121.20 122.79 1hvc s ILE 66 Ca 0.05 -1.11 -0.12 0.00 0.00 0.00 0.00 60.65 59.47 1hvc s ILE 66 Cb -0.15 -2.90 0.08 0.00 0.01 0.00 0.00 42.46 39.50 1hvc s ILE 66 CO -0.01 -0.06 0.93 0.00 0.00 0.00 0.00 174.94 175.80 1hvc n GLY 68 N -1.68 1.28 3.73 0.00 0.00 -1.26 -5.01 105.19 102.25 1hvc n GLY 68 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.63 1hvc n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1hvc s HIS 69 N -2.90 3.54 0.25 1.61 4.02 0.42 -5.07 115.29 117.17 1hvc s HIS 69 Ca 0.00 0.95 -0.30 0.00 1.02 0.00 0.00 55.06 56.73 1hvc s HIS 69 Cb 0.00 -2.56 -0.09 0.00 -1.02 0.00 0.00 32.58 28.91 1hvc s HIS 69 CO 0.00 0.21 0.97 0.15 1.02 0.00 0.00 174.74 177.09 1hvc s LYS 70 N 0.47 4.80 0.01 1.40 1.02 -1.26 0.11 119.74 126.29 1hvc s LYS 70 Ca 0.27 1.54 0.01 0.00 0.02 0.00 0.00 55.97 57.82 1hvc s LYS 70 Cb -0.16 -3.23 -0.01 0.00 -0.52 0.00 0.00 37.83 33.91 1hvc s LYS 70 CO 0.12 0.44 -0.05 0.00 -0.92 0.00 0.00 175.35 174.94 1hvc s ALA 71 N -1.20 0.37 -0.21 5.17 0.00 -0.58 -4.70 121.76 120.62 1hvc s ALA 71 Ca 0.42 -0.35 -0.01 0.00 0.00 0.00 0.00 51.96 52.02 1hvc s ALA 71 Cb -0.27 -0.03 0.06 0.00 0.00 0.00 0.00 23.12 22.87 1hvc s ALA 71 CO 0.33 0.04 -0.02 0.42 0.00 0.00 0.00 175.76 176.53 1hvc s ILE 72 N -0.52 1.10 0.07 0.00 1.01 -1.26 -1.29 121.20 120.31 1hvc s ILE 72 Ca -0.03 -0.87 -0.06 0.00 0.00 0.00 0.00 60.65 59.69 1hvc s ILE 72 Cb -0.04 -1.43 0.02 0.00 0.01 0.00 0.00 42.46 41.02 1hvc s ILE 72 CO -0.00 -0.09 0.28 0.61 0.00 0.00 0.00 174.94 175.74 1hvc n GLY 73 N 4.84 1.28 3.72 6.18 0.00 -0.48 -4.84 105.19 115.88 1hvc n GLY 73 Ca -0.11 -1.02 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 1hvc n GLY 73 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hvc s THR 74 N -2.52 4.74 -0.09 2.61 2.01 -1.26 -1.27 115.64 119.86 1hvc s THR 74 Ca 0.06 2.05 0.03 0.00 0.31 0.00 0.00 61.69 64.14 1hvc s THR 74 Cb -0.01 -4.31 0.01 0.00 0.01 0.00 0.00 72.50 68.20 1hvc s THR 74 CO 0.02 0.21 -0.19 0.68 -0.69 0.00 0.00 174.62 174.65 1hvc s VAL 75 N 0.71 1.67 -0.01 3.82 -7.23 0.18 -4.57 120.40 114.97 1hvc s VAL 75 Ca 0.51 -0.78 -0.19 0.00 -1.81 0.00 0.00 61.98 59.71 1hvc s VAL 75 Cb -0.22 -1.48 -0.06 0.00 0.56 0.00 0.00 36.38 35.19 1hvc s VAL 75 CO 0.29 0.47 0.53 -0.76 -0.31 0.00 0.00 175.10 175.32 1hvc s LEU 76 N 0.59 4.43 -0.14 1.32 1.43 -0.08 -1.65 118.68 124.58 1hvc s LEU 76 Ca -0.15 1.08 0.01 0.00 -1.03 0.00 0.00 54.13 54.05 1hvc s LEU 76 Cb -0.17 -2.81 -0.00 0.00 0.03 0.00 0.00 46.19 43.25 1hvc s LEU 76 CO 0.05 0.17 -0.17 -0.69 0.23 0.00 0.00 176.35 175.94 1hvc s VAL 77 N -0.44 2.56 0.00 -1.59 1.01 0.00 -0.43 120.40 121.52 1hvc s VAL 77 Ca 0.28 -0.82 0.00 0.00 0.00 0.00 0.00 61.98 61.44 1hvc s VAL 77 Cb -0.18 -2.06 0.00 0.00 0.00 0.00 0.00 36.38 34.15 1hvc s VAL 77 CO 0.16 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.39 1hvc n GLY 78 N 3.85 0.76 2.63 4.51 0.00 -0.82 -0.80 105.19 115.32 1hvc n GLY 78 Ca -0.19 -0.76 -0.41 0.00 0.00 0.00 0.00 46.02 44.66 1hvc n GLY 78 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1hvc n PRO 79 N 0.00 3.51 -3.08 1.61 -0.04 -1.26 -2.39 135.00 133.34 1hvc n PRO 79 Ca 0.00 -2.89 -0.39 0.00 -0.04 0.00 0.00 63.50 60.18 1hvc n PRO 79 Cb 0.00 -2.98 -0.06 0.00 -0.04 0.00 0.00 33.50 30.42 1hvc n PRO 79 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1hvc s THR 80 N 1.57 4.60 0.41 0.52 -1.32 -1.26 -4.97 115.64 115.18 1hvc s THR 80 Ca 0.51 1.51 0.11 0.00 -1.21 0.00 0.00 61.69 62.61 1hvc s THR 80 Cb 0.14 -4.05 0.31 0.00 -1.51 0.00 0.00 72.50 67.40 1hvc s THR 80 CO -0.06 0.49 1.98 -0.65 -2.21 0.00 0.00 174.62 174.17 1hvc h PRO 81 N 4.79 0.51 -4.47 7.08 0.11 -1.88 -3.44 132.00 134.70 1hvc h PRO 81 Ca -0.47 -0.03 -0.30 0.00 0.11 0.00 0.00 66.00 65.31 1hvc h PRO 81 Cb 1.21 -0.12 -0.24 0.00 0.11 0.00 0.00 31.00 31.96 1hvc h PRO 81 CO 0.67 0.34 -0.74 0.08 -0.21 0.00 0.00 178.00 178.13 1hvc s VAL 82 N -5.49 0.49 0.00 3.15 1.01 -1.26 -5.07 120.40 113.24 1hvc s VAL 82 Ca -0.08 -0.72 -0.30 0.00 0.00 0.00 0.00 61.98 60.88 1hvc s VAL 82 Cb 0.19 -0.50 -0.06 0.00 0.00 0.00 0.00 36.38 36.01 1hvc s VAL 82 CO 0.75 -0.17 1.50 0.20 0.00 0.00 0.00 175.10 177.39 1hvc s ASN 83 N -0.96 6.76 -0.17 3.32 0.01 -1.26 -4.70 114.94 117.94 1hvc s ASN 83 Ca -0.05 2.21 -0.01 0.00 -0.71 0.00 0.00 52.86 54.30 1hvc s ASN 83 Cb -0.07 -2.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.03 1hvc s ASN 83 CO 0.00 -0.80 -0.12 -0.63 -1.51 0.00 0.00 177.10 174.04 1hvc s ILE 84 N 2.79 2.91 -0.29 0.60 1.01 -0.09 -0.07 121.20 128.08 1hvc s ILE 84 Ca 0.68 -0.68 -0.15 0.00 0.00 0.00 0.00 60.65 60.49 1hvc s ILE 84 Cb -0.33 -2.25 -0.03 0.00 0.01 0.00 0.00 42.46 39.85 1hvc s ILE 84 CO 0.28 0.50 0.39 -0.63 0.00 0.00 0.00 174.94 175.47 1hvc s ILE 85 N 0.88 5.16 0.36 2.92 -1.09 0.44 -2.14 121.20 127.73 1hvc s ILE 85 Ca -0.03 0.48 0.06 0.00 -2.23 0.00 0.00 60.65 58.93 1hvc s ILE 85 Cb -0.15 -3.74 0.06 0.00 -1.58 0.00 0.00 42.46 37.05 1hvc s ILE 85 CO -0.00 0.09 0.48 0.61 -1.23 0.00 0.00 174.94 174.88 1hvc n GLY 86 N 4.73 2.02 0.36 6.18 0.00 -1.21 -1.01 105.19 116.25 1hvc n GLY 86 Ca -0.08 -2.19 0.15 0.00 0.00 0.00 0.00 46.02 43.90 1hvc n GLY 86 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1hvc h ARG 87 N 0.00 0.20 -0.77 1.61 3.08 -0.83 -0.84 114.38 116.82 1hvc h ARG 87 Ca -0.17 -0.01 0.14 0.00 0.07 0.00 0.00 59.98 60.01 1hvc h ARG 87 Cb 0.78 -0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.73 1hvc h ARG 87 CO 0.25 0.13 0.51 -2.95 -1.07 0.00 0.00 179.97 176.84 1hvc h ASN 88 N 0.21 0.47 0.00 7.04 -1.07 -1.78 -2.37 115.58 118.07 1hvc h ASN 88 Ca 0.25 0.02 -0.33 0.00 0.07 0.00 0.00 56.30 56.32 1hvc h ASN 88 Cb 0.70 -0.07 -0.06 0.00 -2.07 0.00 0.00 38.32 36.82 1hvc h ASN 88 CO -0.04 0.25 -2.23 0.18 0.07 0.00 0.00 177.43 175.65 1hvc n LEU 89 N -4.50 1.60 -0.28 6.14 4.77 -0.84 -4.23 117.00 119.67 1hvc n LEU 89 Ca 0.15 -0.06 0.10 0.00 -0.03 0.00 0.00 56.01 56.16 1hvc n LEU 89 Cb 0.49 -0.22 0.26 0.00 -2.33 0.00 0.00 43.42 41.61 1hvc n LEU 89 CO 0.32 0.67 0.98 -0.07 -1.33 0.00 0.00 177.39 177.96 1hvc h LEU 90 N 0.00 0.12 -0.97 2.23 4.07 -1.13 -1.30 115.31 118.33 1hvc h LEU 90 Ca -0.49 0.16 -0.09 0.00 0.08 0.00 0.00 57.88 57.55 1hvc h LEU 90 Cb 1.91 0.19 -0.01 0.00 1.08 0.00 0.00 40.66 43.83 1hvc h LEU 90 CO -0.03 -0.06 -0.19 0.71 -1.08 0.00 0.00 178.44 177.79 1hvc h THR 91 N 0.30 1.25 -0.68 0.22 1.35 -1.64 -2.43 112.91 111.28 1hvc h THR 91 Ca 0.51 -1.17 -0.03 0.00 -0.55 0.00 0.00 66.41 65.17 1hvc h THR 91 Cb 0.95 1.25 -0.03 0.00 -1.73 0.00 0.00 68.15 68.58 1hvc h THR 91 CO -0.56 0.38 0.32 1.56 -0.25 0.00 0.00 175.52 176.97 1hvc h GLN 92 N 0.47 0.98 -0.60 4.72 4.20 -1.43 -2.93 115.11 120.52 1hvc h GLN 92 Ca 0.08 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1hvc h GLN 92 Cb 0.60 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1hvc h GLN 92 CO 0.04 0.79 0.00 0.44 -0.67 0.00 0.00 178.83 179.43 1hvc n ILE 93 N -4.44 0.81 -2.42 2.54 -5.35 -0.90 -4.94 119.36 104.66 1hvc n ILE 93 Ca 0.05 -0.49 -0.14 0.00 -0.27 0.00 0.00 62.75 61.90 1hvc n ILE 93 Cb 0.14 -0.15 0.00 0.00 -1.74 0.00 0.00 39.64 37.89 1hvc n ILE 93 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1hvc n GLY 94 N 0.56 -0.18 3.72 3.28 0.00 -1.11 -4.38 105.19 107.09 1hvc n GLY 94 Ca 0.11 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 1hvc n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hvc s THR 96 N 0.51 1.14 -0.14 0.00 -4.23 -0.96 -4.46 115.64 107.50 1hvc s THR 96 Ca 0.47 -1.99 -0.09 0.00 -1.18 0.00 0.00 61.69 58.90 1hvc s THR 96 Cb -0.21 -1.77 -0.05 0.00 1.34 0.00 0.00 72.50 71.82 1hvc s THR 96 CO 0.27 -0.71 0.18 -0.76 -0.54 0.00 0.00 174.62 173.06 1hvc s LEU 97 N -3.03 4.32 0.05 4.79 1.02 0.33 -1.74 118.68 124.43 1hvc s LEU 97 Ca 0.15 0.44 0.05 0.00 0.02 0.00 0.00 54.13 54.78 1hvc s LEU 97 Cb 0.01 -2.15 -0.02 0.00 0.02 0.00 0.00 46.19 44.05 1hvc s LEU 97 CO 0.01 0.30 -0.14 0.20 0.02 0.00 0.00 176.35 176.74 1hvc s ASN 98 N -0.44 1.61 0.00 2.29 -0.87 -0.40 0.17 114.94 117.31 1hvc s ASN 98 Ca 0.14 -0.49 0.00 0.00 -1.57 0.00 0.00 52.86 50.93 1hvc s ASN 98 Cb -0.12 -0.09 0.00 0.00 -0.02 0.00 0.00 41.25 41.02 1hvc s ASN 98 CO 0.03 -0.00 0.00 2.22 -2.57 0.00 0.00 177.10 176.78