#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hvx s GLN 3 N 0.00 1.20 -0.09 4.33 -0.21 0.14 -4.88 119.66 120.15 3hvx s GLN 3 Ca 0.00 -1.56 0.00 0.00 0.02 0.00 0.00 55.36 53.82 3hvx s GLN 3 Cb 0.00 -0.61 0.02 0.00 1.00 0.00 0.00 33.01 33.42 3hvx s GLN 3 CO 0.00 -0.01 -0.07 0.99 -2.12 0.00 0.00 175.29 174.08 3hvx s THR 4 N -3.38 0.87 0.00 -0.19 2.01 -1.26 0.32 115.64 114.01 3hvx s THR 4 Ca 0.23 -0.24 0.00 0.00 0.31 0.00 0.00 61.69 61.99 3hvx s THR 4 Cb 0.04 -0.89 0.00 0.00 0.01 0.00 0.00 72.50 71.66 3hvx s THR 4 CO 0.05 0.33 0.00 1.33 -0.69 0.00 0.00 174.62 175.63 3hvx n VAL 5 N 4.61 0.00 -3.89 3.82 0.24 -0.27 -4.91 118.33 117.92 3hvx n VAL 5 Ca -0.16 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.03 3hvx n VAL 5 Cb 0.50 -0.30 -0.13 0.00 -1.47 0.00 0.00 33.84 32.45 3hvx n VAL 5 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 3hvx s HIS 6 N 0.60 0.05 -0.14 6.34 3.76 -0.00 -1.02 115.29 124.87 3hvx s HIS 6 Ca 0.00 -0.11 -0.05 0.00 -0.15 0.00 0.00 55.06 54.76 3hvx s HIS 6 Cb 0.00 -0.04 0.07 0.00 1.11 0.00 0.00 32.58 33.72 3hvx s HIS 6 CO 0.00 -0.06 0.27 0.12 -0.85 0.00 0.00 174.74 174.23 3hvx s PHE 7 N -0.38 -0.45 -1.39 1.40 5.36 -0.02 -1.27 117.98 121.24 3hvx s PHE 7 Ca -0.04 0.95 -0.01 0.00 -0.96 0.00 0.00 56.93 56.86 3hvx s PHE 7 Cb -0.03 -0.04 0.01 0.00 -0.34 0.00 0.00 43.02 42.63 3hvx s PHE 7 CO -0.00 -0.39 0.56 0.00 -1.46 0.00 0.00 175.22 173.93 3hvx n GLN 8 N 5.35 -4.01 -0.99 10.12 10.64 -1.26 -1.63 117.38 135.60 3hvx n GLN 8 Ca -0.06 0.49 0.00 0.00 -1.83 0.00 0.00 57.00 55.60 3hvx n GLN 8 Cb 0.50 -4.84 0.00 0.00 -0.86 0.00 0.00 30.24 25.03 3hvx n GLN 8 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3hvx n GLY 9 N -1.79 0.70 3.23 2.61 0.00 -1.26 -5.03 105.19 103.65 3hvx n GLY 9 Ca -0.28 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.49 3hvx n GLY 9 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hvx s ASN 10 N -2.40 2.37 0.47 1.61 0.02 -0.64 -5.11 114.94 111.25 3hvx s ASN 10 Ca 0.00 -0.48 -0.24 0.00 -1.02 0.00 0.00 52.86 51.13 3hvx s ASN 10 Cb 0.00 -0.21 -0.07 0.00 0.02 0.00 0.00 41.25 40.99 3hvx s ASN 10 CO 0.00 0.17 1.29 -2.16 0.02 0.00 0.00 177.10 176.42 3hvx s PRO 11 N -1.00 3.62 -0.08 -0.60 0.04 -1.26 -0.84 135.00 134.89 3hvx s PRO 11 Ca 0.07 2.08 -0.01 0.00 0.04 0.00 0.00 61.00 63.18 3hvx s PRO 11 Cb -0.08 -2.49 0.03 0.00 0.04 0.00 0.00 34.50 32.00 3hvx s PRO 11 CO 0.01 -0.75 -0.02 0.08 0.04 0.00 0.00 177.00 176.36 3hvx s VAL 12 N -1.36 0.53 0.05 -0.36 1.01 -0.19 -4.86 120.40 115.22 3hvx s VAL 12 Ca 0.64 0.02 -0.27 0.00 0.00 0.00 0.00 61.98 62.36 3hvx s VAL 12 Cb -0.36 -0.65 -0.05 0.00 0.00 0.00 0.00 36.38 35.32 3hvx s VAL 12 CO 0.45 0.28 0.86 -0.89 0.00 0.00 0.00 175.10 175.79 3hvx s THR 13 N 1.85 4.71 -0.11 3.92 2.01 -1.26 -1.11 115.64 125.65 3hvx s THR 13 Ca 0.04 1.82 0.04 0.00 0.31 0.00 0.00 61.69 63.90 3hvx s THR 13 Cb -0.12 -4.21 0.00 0.00 0.01 0.00 0.00 72.50 68.18 3hvx s THR 13 CO -0.06 0.30 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.26 3hvx s VAL 14 N 0.23 2.13 0.44 3.82 1.01 0.15 -0.76 120.40 127.41 3hvx s VAL 14 Ca 0.43 -0.99 -0.23 0.00 0.00 0.00 0.00 61.98 61.19 3hvx s VAL 14 Cb -0.21 -1.82 -0.08 0.00 0.00 0.00 0.00 36.38 34.27 3hvx s VAL 14 CO 0.25 0.56 1.11 0.00 0.00 0.00 0.00 175.10 177.02 3hvx s ALA 15 N 0.39 3.01 0.00 5.51 0.00 0.07 0.29 121.76 131.03 3hvx s ALA 15 Ca -0.17 0.82 0.00 0.00 0.00 0.00 0.00 51.96 52.61 3hvx s ALA 15 Cb -0.18 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.61 3hvx s ALA 15 CO 0.08 -0.46 0.00 0.09 0.00 0.00 0.00 175.76 175.47 3hvx n ASN 16 N -0.36 0.00 -3.77 0.00 3.02 -1.26 -4.21 115.26 108.68 3hvx n ASN 16 Ca 0.07 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.48 3hvx n ASN 16 Cb 0.49 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.57 3hvx n ASN 16 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3hvx s SER 17 N -4.00 -0.20 0.18 6.41 1.04 -1.26 -4.02 113.70 111.85 3hvx s SER 17 Ca 0.00 0.15 -0.31 0.00 0.48 0.00 0.00 55.95 56.27 3hvx s SER 17 Cb 0.00 0.36 -0.09 0.00 0.10 0.00 0.00 66.02 66.38 3hvx s SER 17 CO 0.00 -0.40 1.46 -0.51 0.98 0.00 0.00 173.24 174.78 3hvx s ILE 18 N -1.12 2.84 0.09 -1.02 2.07 -1.25 -3.99 121.20 118.83 3hvx s ILE 18 Ca -0.12 0.64 -0.34 0.00 -1.41 0.00 0.00 60.65 59.42 3hvx s ILE 18 Cb -0.05 -3.41 -0.14 0.00 0.13 0.00 0.00 42.46 38.99 3hvx s ILE 18 CO 0.04 0.07 1.62 -0.81 -1.91 0.00 0.00 174.94 173.95 3hvx n PRO 19 N 3.29 2.04 -2.46 3.50 -0.04 -1.26 -4.98 135.00 135.09 3hvx n PRO 19 Ca 0.10 0.74 -0.27 0.00 -0.04 0.00 0.00 63.50 64.03 3hvx n PRO 19 Cb 0.40 -2.51 0.02 0.00 -0.04 0.00 0.00 33.50 31.37 3hvx n PRO 19 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 3hvx s GLN 20 N 1.57 3.23 0.19 0.54 -0.21 -1.26 -4.62 119.66 119.11 3hvx s GLN 20 Ca 0.83 0.13 -0.33 0.00 0.02 0.00 0.00 55.36 56.01 3hvx s GLN 20 Cb -0.72 -2.30 -0.14 0.00 1.00 0.00 0.00 33.01 30.85 3hvx s GLN 20 CO 0.42 -0.48 1.44 0.00 -2.12 0.00 0.00 175.29 174.55 3hvx n ALA 21 N -2.46 0.82 0.00 6.09 0.00 -1.26 -1.35 120.51 122.35 3hvx n ALA 21 Ca 0.03 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.91 3hvx n ALA 21 Cb 0.56 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.75 3hvx n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hvx n GLY 22 N 2.64 0.17 3.77 0.00 0.00 0.64 -4.99 105.19 107.41 3hvx n GLY 22 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3hvx n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hvx s SER 23 N -2.04 6.86 0.00 1.61 0.01 -0.46 -4.74 113.70 114.95 3hvx s SER 23 Ca 0.00 2.60 -0.30 0.00 1.31 0.00 0.00 55.95 59.56 3hvx s SER 23 Cb 0.00 -2.64 -0.06 0.00 0.21 0.00 0.00 66.02 63.53 3hvx s SER 23 CO 0.00 -0.47 1.42 -0.75 0.41 0.00 0.00 173.24 173.85 3hvx s LYS 24 N -1.60 4.27 0.13 12.44 2.47 -1.26 -0.89 119.74 135.30 3hvx s LYS 24 Ca 0.49 1.99 -0.31 0.00 -1.56 0.00 0.00 55.97 56.58 3hvx s LYS 24 Cb -0.38 -3.59 -0.08 0.00 -1.46 0.00 0.00 37.83 32.32 3hvx s LYS 24 CO 0.50 -0.60 1.33 0.00 0.16 0.00 0.00 175.35 176.74 3hvx s ALA 25 N 2.47 3.53 0.57 3.13 0.00 0.17 -4.86 121.76 126.77 3hvx s ALA 25 Ca 0.65 1.06 -0.15 0.00 0.00 0.00 0.00 51.96 53.51 3hvx s ALA 25 Cb -0.32 -3.50 -0.05 0.00 0.00 0.00 0.00 23.12 19.25 3hvx s ALA 25 CO 0.27 -0.55 1.03 -0.65 0.00 0.00 0.00 175.76 175.86 3hvx s GLN 26 N 0.70 3.55 0.60 0.00 -0.21 -1.26 -4.95 119.66 118.09 3hvx s GLN 26 Ca 0.61 1.06 -0.18 0.00 0.02 0.00 0.00 55.36 56.87 3hvx s GLN 26 Cb -0.35 -2.07 -0.03 0.00 1.00 0.00 0.00 33.01 31.56 3hvx s GLN 26 CO 0.33 -0.61 1.15 0.95 -2.12 0.00 0.00 175.29 174.99 3hvx s THR 27 N -2.61 2.97 0.19 -0.19 -4.23 -1.26 -5.00 115.64 105.51 3hvx s THR 27 Ca 0.61 0.55 -0.09 0.00 -1.18 0.00 0.00 61.69 61.58 3hvx s THR 27 Cb -0.13 -3.15 -0.01 0.00 1.34 0.00 0.00 72.50 70.54 3hvx s THR 27 CO 0.37 -0.18 0.32 0.72 -0.54 0.00 0.00 174.62 175.31 3hvx s PHE 28 N -1.89 0.49 -0.07 3.99 -0.12 -1.26 -5.00 117.98 114.11 3hvx s PHE 28 Ca 0.73 -0.83 0.01 0.00 -0.05 0.00 0.00 56.93 56.79 3hvx s PHE 28 Cb -0.25 -0.05 0.02 0.00 -0.63 0.00 0.00 43.02 42.10 3hvx s PHE 28 CO 0.34 -0.78 -0.09 0.99 -0.05 0.00 0.00 175.22 175.63 3hvx s THR 29 N -4.01 0.93 0.29 -4.49 2.01 -1.26 -2.97 115.64 106.15 3hvx s THR 29 Ca 0.21 -0.32 0.03 0.00 0.31 0.00 0.00 61.69 61.93 3hvx s THR 29 Cb 0.03 -0.90 -0.06 0.00 0.01 0.00 0.00 72.50 71.58 3hvx s THR 29 CO 0.04 0.32 0.05 -0.76 -0.69 0.00 0.00 174.62 173.58 3hvx s LEU 30 N 1.05 2.11 -0.17 4.42 1.43 0.43 -4.72 118.68 123.24 3hvx s LEU 30 Ca -0.08 -1.34 -0.04 0.00 -1.03 0.00 0.00 54.13 51.64 3hvx s LEU 30 Cb -0.14 -0.31 -0.03 0.00 0.03 0.00 0.00 46.19 45.74 3hvx s LEU 30 CO -0.01 -0.60 -0.03 -0.69 0.23 0.00 0.00 176.35 175.26 3hvx s VAL 31 N -3.38 3.89 0.55 -1.59 1.01 -0.71 0.20 120.40 120.37 3hvx s VAL 31 Ca 0.35 -0.35 -0.09 0.00 0.00 0.00 0.00 61.98 61.89 3hvx s VAL 31 Cb 0.08 -2.72 0.13 0.00 0.00 0.00 0.00 36.38 33.87 3hvx s VAL 31 CO 0.14 0.48 0.69 0.00 0.00 0.00 0.00 175.10 176.41 3hvx n ALA 32 N 3.71 -0.98 0.21 5.51 0.00 -0.29 -1.02 120.51 127.65 3hvx n ALA 32 Ca -0.17 -0.92 0.07 0.00 0.00 0.00 0.00 53.44 52.42 3hvx n ALA 32 Cb 0.52 -0.05 0.45 0.00 0.00 0.00 0.00 19.45 20.38 3hvx n ALA 32 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 3hvx h LYS 33 N 0.00 0.00 -0.62 0.00 2.10 -1.89 -0.84 116.57 115.32 3hvx h LYS 33 Ca -0.23 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.42 3hvx h LYS 33 Cb 0.64 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 3hvx h LYS 33 CO 0.16 0.30 0.00 -0.40 -2.00 0.00 0.00 179.45 177.51 3hvx n ASP 34 N -3.73 3.49 -0.01 7.07 5.75 -1.26 -4.82 116.55 123.04 3hvx n ASP 34 Ca -0.01 -2.09 -0.00 0.00 -0.01 0.00 0.00 54.79 52.68 3hvx n ASP 34 Cb 0.40 -0.44 -0.00 0.00 -1.03 0.00 0.00 41.12 40.05 3hvx n ASP 34 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3hvx n LEU 35 N 1.22 0.02 -4.91 -2.12 4.77 -0.32 -5.03 117.00 110.62 3hvx n LEU 35 Ca 0.21 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.93 3hvx n LEU 35 Cb 0.58 -0.57 -0.01 0.00 -2.33 0.00 0.00 43.42 41.09 3hvx n LEU 35 CO 0.16 -0.04 0.37 -0.94 -1.33 0.00 0.00 177.39 175.61 3hvx s SER 36 N -2.21 6.28 -0.08 -1.43 1.04 -1.26 -4.84 113.70 111.21 3hvx s SER 36 Ca 0.00 0.81 -0.21 0.00 0.48 0.00 0.00 55.95 57.02 3hvx s SER 36 Cb 0.00 -2.19 -0.04 0.00 0.10 0.00 0.00 66.02 63.89 3hvx s SER 36 CO 0.00 -0.49 0.62 -1.81 0.98 0.00 0.00 173.24 172.54 3hvx s ASP 37 N -4.04 6.89 -0.09 7.02 1.01 -1.26 -1.14 116.67 125.06 3hvx s ASP 37 Ca 0.45 1.06 0.04 0.00 0.71 0.00 0.00 52.55 54.82 3hvx s ASP 37 Cb -0.10 -2.37 0.00 0.00 1.01 0.00 0.00 42.92 41.46 3hvx s ASP 37 CO 0.42 -0.06 -0.21 -0.69 0.21 0.00 0.00 175.17 174.84 3hvx s VAL 38 N 0.67 1.83 0.35 -1.27 1.01 0.13 -4.93 120.40 118.19 3hvx s VAL 38 Ca 0.33 -0.89 0.08 0.00 0.00 0.00 0.00 61.98 61.50 3hvx s VAL 38 Cb -0.17 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 3hvx s VAL 38 CO 0.15 0.51 0.19 0.42 0.00 0.00 0.00 175.10 176.37 3hvx s THR 39 N 0.37 3.05 0.30 3.92 -4.23 -1.26 -0.42 115.64 117.37 3hvx s THR 39 Ca -0.17 -1.61 -0.02 0.00 -1.18 0.00 0.00 61.69 58.72 3hvx s THR 39 Cb -0.17 -3.02 0.26 0.00 1.34 0.00 0.00 72.50 70.91 3hvx s THR 39 CO 0.07 -0.16 1.96 0.25 -0.54 0.00 0.00 174.62 176.21 3hvx h LEU 40 N 1.44 0.94 -2.75 4.79 5.85 -1.92 -0.33 115.31 123.33 3hvx h LEU 40 Ca -0.44 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.27 3hvx h LEU 40 Cb 1.25 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 42.05 3hvx h LEU 40 CO 0.62 0.67 0.05 1.23 -0.34 0.00 0.00 178.44 180.67 3hvx h GLY 41 N 1.11 0.00 1.21 3.75 0.00 -1.96 -0.53 103.07 106.65 3hvx h GLY 41 Ca 0.31 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.76 3hvx h GLY 41 CO -0.08 0.00 0.28 -1.61 0.00 0.00 0.00 176.54 175.14 3hvx h GLN 42 N 0.00 0.00 -0.49 4.80 4.15 -1.45 -1.59 115.11 120.53 3hvx h GLN 42 Ca 0.01 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.38 3hvx h GLN 42 Cb 0.11 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.77 3hvx h GLN 42 CO -0.00 0.00 0.05 1.19 -1.93 0.00 0.00 178.83 178.14 3hvx n PHE 43 N -4.40 1.73 -1.59 3.99 3.72 -0.21 -4.99 117.46 115.72 3hvx n PHE 43 Ca 0.06 -0.91 -0.65 0.00 -0.05 0.00 0.00 57.45 55.91 3hvx n PHE 43 Cb 0.47 -0.48 -0.10 0.00 -0.94 0.00 0.00 39.48 38.43 3hvx n PHE 43 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3hvx n ALA 44 N 0.01 -0.94 0.00 4.37 0.00 -0.60 -1.37 120.51 121.99 3hvx n ALA 44 Ca 0.28 0.41 0.00 0.00 0.00 0.00 0.00 53.44 54.14 3hvx n ALA 44 Cb 1.13 -1.92 0.00 0.00 0.00 0.00 0.00 19.45 18.66 3hvx n ALA 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hvx n GLY 45 N 4.80 3.04 3.90 0.00 0.00 -1.26 -5.06 105.19 110.60 3hvx n GLY 45 Ca 0.36 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.10 3hvx n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hvx s LYS 46 N -0.84 3.39 0.32 1.61 -0.14 -0.47 -4.74 119.74 118.87 3hvx s LYS 46 Ca 0.00 0.32 -0.20 0.00 -1.36 0.00 0.00 55.97 54.73 3hvx s LYS 46 Cb 0.00 -2.25 -0.09 0.00 -1.68 0.00 0.00 37.83 33.80 3hvx s LYS 46 CO 0.00 -0.46 0.83 1.03 -0.76 0.00 0.00 175.35 175.99 3hvx s ARG 47 N -4.95 4.24 -0.08 1.68 3.00 -0.23 -3.79 118.95 118.83 3hvx s ARG 47 Ca 0.51 0.97 0.02 0.00 0.00 0.00 0.00 55.73 57.23 3hvx s ARG 47 Cb -0.11 -2.56 0.01 0.00 0.00 0.00 0.00 34.95 32.30 3hvx s ARG 47 CO 0.48 0.20 -0.15 0.15 0.00 0.00 0.00 175.30 175.98 3hvx s LYS 48 N -2.59 2.05 -0.36 3.54 3.01 0.07 -1.39 119.74 124.09 3hvx s LYS 48 Ca 0.52 -0.52 -0.07 0.00 -1.01 0.00 0.00 55.97 54.89 3hvx s LYS 48 Cb -0.13 -1.68 0.05 0.00 -1.01 0.00 0.00 37.83 35.06 3hvx s LYS 48 CO 0.18 0.02 0.14 0.08 0.51 0.00 0.00 175.35 176.29 3hvx s VAL 49 N 0.72 3.81 -0.34 3.17 1.01 0.57 -0.53 120.40 128.81 3hvx s VAL 49 Ca -0.13 -1.27 -0.23 0.00 0.00 0.00 0.00 61.98 60.35 3hvx s VAL 49 Cb -0.16 -3.24 0.01 0.00 0.00 0.00 0.00 36.38 32.99 3hvx s VAL 49 CO 0.03 -0.29 0.78 -0.76 0.00 0.00 0.00 175.10 174.86 3hvx s LEU 50 N 1.38 4.12 -0.45 3.92 1.43 0.17 -0.70 118.68 128.54 3hvx s LEU 50 Ca 0.00 0.45 -0.08 0.00 -1.03 0.00 0.00 54.13 53.47 3hvx s LEU 50 Cb -0.21 -3.03 0.11 0.00 0.03 0.00 0.00 46.19 43.09 3hvx s LEU 50 CO 0.02 -0.69 0.30 0.21 0.23 0.00 0.00 176.35 176.42 3hvx s ASN 51 N 1.76 5.61 -0.21 2.29 2.47 -0.03 -1.03 114.94 125.80 3hvx s ASN 51 Ca 0.31 -1.82 -0.09 0.00 0.42 0.00 0.00 52.86 51.68 3hvx s ASN 51 Cb -0.14 -1.98 -0.05 0.00 -1.45 0.00 0.00 41.25 37.64 3hvx s ASN 51 CO 0.15 -0.63 0.12 -0.63 -3.72 0.00 0.00 177.10 172.39 3hvx s ILE 52 N 1.34 5.13 0.09 -5.21 1.01 0.64 -0.84 121.20 123.36 3hvx s ILE 52 Ca 0.05 0.09 0.09 0.00 0.00 0.00 0.00 60.65 60.89 3hvx s ILE 52 Cb -0.25 -3.36 -0.03 0.00 0.01 0.00 0.00 42.46 38.83 3hvx s ILE 52 CO -0.01 0.40 -0.25 -0.36 0.00 0.00 0.00 174.94 174.73 3hvx s PHE 53 N 0.74 2.13 0.25 3.97 0.40 0.09 -2.22 117.98 123.34 3hvx s PHE 53 Ca 0.06 -0.40 0.02 0.00 -0.60 0.00 0.00 56.93 56.02 3hvx s PHE 53 Cb -0.13 -1.21 0.29 0.00 0.51 0.00 0.00 43.02 42.49 3hvx s PHE 53 CO 0.02 0.21 1.61 -1.35 0.70 0.00 0.00 175.22 176.41 3hvx h PRO 54 N 4.34 0.40 -1.77 0.24 0.11 -1.69 -3.38 132.00 130.25 3hvx h PRO 54 Ca -0.47 -0.21 0.02 0.00 0.11 0.00 0.00 66.00 65.44 3hvx h PRO 54 Cb 1.16 0.01 -0.24 0.00 0.11 0.00 0.00 31.00 32.04 3hvx h PRO 54 CO 0.41 0.78 0.33 0.45 -0.21 0.00 0.00 178.00 179.75 3hvx s SER 55 N -6.88 -0.57 0.00 -2.05 0.15 -1.26 -4.41 113.70 98.69 3hvx s SER 55 Ca -0.06 1.05 0.27 0.00 0.70 0.00 0.00 55.95 57.91 3hvx s SER 55 Cb 0.12 1.05 1.61 0.00 -1.71 0.00 0.00 66.02 67.10 3hvx s SER 55 CO 0.80 -0.22 2.04 2.30 1.20 0.00 0.00 173.24 179.36 3hvx n ILE 56 N 2.24 0.00 0.89 6.45 -6.64 -1.26 -3.43 119.36 117.61 3hvx n ILE 56 Ca -0.13 -0.00 0.10 0.00 -1.77 0.00 0.00 62.75 60.95 3hvx n ILE 56 Cb 0.56 -0.42 0.03 0.00 -1.44 0.00 0.00 39.64 38.37 3hvx n ILE 56 CO 0.00 0.00 0.00 0.47 -1.77 0.00 0.00 176.55 175.25 3hvx n ASP 57 N -0.92 2.21 -3.86 7.28 8.00 -1.26 -4.83 116.55 123.17 3hvx n ASP 57 Ca 0.20 -1.61 -0.12 0.00 0.71 0.00 0.00 54.79 53.98 3hvx n ASP 57 Cb 0.09 0.30 -0.14 0.00 -0.02 0.00 0.00 41.12 41.35 3hvx n ASP 57 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3hvx s THR 58 N -2.07 0.00 0.00 -3.53 -1.32 -1.22 -4.94 115.64 102.56 3hvx s THR 58 Ca 0.20 -0.03 0.00 0.00 -1.21 0.00 0.00 61.69 60.64 3hvx s THR 58 Cb 0.17 -0.07 0.00 0.00 -1.51 0.00 0.00 72.50 71.09 3hvx s THR 58 CO 0.41 -0.02 0.00 0.61 -2.21 0.00 0.00 174.62 173.42 3hvx n GLY 59 N 3.01 1.72 3.73 6.08 0.00 -1.26 -4.59 105.19 113.87 3hvx n GLY 59 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 3hvx n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hvx s VAL 60 N -2.03 4.31 -0.27 1.61 0.11 -1.26 -4.93 120.40 117.93 3hvx s VAL 60 Ca 0.00 -0.77 -0.11 0.00 -2.93 0.00 0.00 61.98 58.17 3hvx s VAL 60 Cb 0.00 -3.03 -0.05 0.00 -1.53 0.00 0.00 36.38 31.77 3hvx s VAL 60 CO 0.00 0.20 0.21 0.00 -3.33 0.00 0.00 175.10 172.18 3hvx n ALA 62 N 4.95 -0.18 -0.03 0.00 0.00 -1.26 -2.38 120.51 121.61 3hvx n ALA 62 Ca -0.13 0.94 -0.02 0.00 0.00 0.00 0.00 53.44 54.23 3hvx n ALA 62 Cb 0.52 -0.39 0.24 0.00 0.00 0.00 0.00 19.45 19.82 3hvx n ALA 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hvx h ALA 63 N 1.22 1.26 -0.03 0.00 0.00 -1.99 -1.37 119.26 118.34 3hvx h ALA 63 Ca 0.31 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3hvx h ALA 63 Cb 0.55 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3hvx h ALA 63 CO -0.95 0.49 -0.14 1.03 0.00 0.00 0.00 179.25 179.68 3hvx h SER 64 N 0.55 0.17 -0.63 0.00 0.87 -1.91 -1.47 113.55 111.13 3hvx h SER 64 Ca 0.11 -0.67 0.12 0.00 -1.23 0.00 0.00 61.79 60.12 3hvx h SER 64 Cb 0.42 -0.05 -0.09 0.00 -0.44 0.00 0.00 62.40 62.23 3hvx h SER 64 CO 0.02 0.82 0.11 0.58 -0.53 0.00 0.00 176.83 177.83 3hvx h VAL 65 N -0.46 0.59 -0.35 2.23 2.07 -1.30 -1.67 116.25 117.35 3hvx h VAL 65 Ca -0.01 -0.08 -0.05 0.00 0.82 0.00 0.00 66.70 67.37 3hvx h VAL 65 Cb 0.81 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 3hvx h VAL 65 CO 0.03 0.04 0.00 0.03 0.02 0.00 0.00 177.57 177.70 3hvx h ARG 66 N 0.23 0.61 -0.72 1.57 3.08 -1.23 -0.05 114.38 117.88 3hvx h ARG 66 Ca 0.33 -0.19 0.16 0.00 0.07 0.00 0.00 59.98 60.35 3hvx h ARG 66 Cb 0.52 -0.06 -0.11 0.00 0.08 0.00 0.00 29.97 30.40 3hvx h ARG 66 CO -0.45 0.73 0.14 -0.22 -1.07 0.00 0.00 179.97 179.10 3hvx h LYS 67 N 0.42 0.22 0.07 0.04 3.64 -0.90 -1.57 116.57 118.48 3hvx h LYS 67 Ca 0.10 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.46 3hvx h LYS 67 Cb 0.45 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 3hvx h LYS 67 CO 0.02 0.15 -0.03 0.35 -2.27 0.00 0.00 179.45 177.66 3hvx h PHE 68 N 0.23 -0.08 -0.93 1.91 3.57 -0.96 -2.57 116.94 118.10 3hvx h PHE 68 Ca 0.40 -0.00 0.18 0.00 3.53 0.00 0.00 57.97 62.08 3hvx h PHE 68 Cb 0.68 0.03 -0.08 0.00 2.79 0.00 0.00 35.95 39.37 3hvx h PHE 68 CO -0.29 0.29 0.60 -0.91 -2.23 0.00 0.00 178.31 175.77 3hvx h ASN 69 N -0.48 0.59 -0.12 0.41 2.35 -0.80 -0.17 115.58 117.37 3hvx h ASN 69 Ca -0.01 0.06 -0.23 0.00 -0.55 0.00 0.00 56.30 55.57 3hvx h ASN 69 Cb 0.41 -0.06 0.01 0.00 0.05 0.00 0.00 38.32 38.74 3hvx h ASN 69 CO 0.02 0.25 -0.82 1.56 -1.65 0.00 0.00 177.43 176.78 3hvx h GLN 70 N 0.60 0.78 -0.68 0.81 4.20 -1.31 -2.34 115.11 117.16 3hvx h GLN 70 Ca 0.49 -0.67 0.04 0.00 0.06 0.00 0.00 58.65 58.58 3hvx h GLN 70 Cb 0.96 0.15 -0.05 0.00 0.30 0.00 0.00 27.48 28.84 3hvx h GLN 70 CO -0.24 1.27 0.41 -0.07 -0.67 0.00 0.00 178.83 179.52 3hvx h LEU 71 N 0.52 0.65 -0.24 1.46 3.38 -0.89 -1.97 115.31 118.22 3hvx h LEU 71 Ca -0.07 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 3hvx h LEU 71 Cb 1.46 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 42.08 3hvx h LEU 71 CO 0.17 0.44 -0.20 0.00 0.09 0.00 0.00 178.44 178.94 3hvx h ALA 72 N 1.31 0.34 0.00 1.53 0.00 -1.02 -2.63 119.26 118.79 3hvx h ALA 72 Ca 0.28 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3hvx h ALA 72 Cb 0.08 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3hvx h ALA 72 CO -0.13 0.28 -0.07 1.79 0.00 0.00 0.00 179.25 181.11 3hvx h THR 73 N 0.25 0.21 0.00 0.00 1.35 -1.42 -1.90 112.91 111.40 3hvx h THR 73 Ca 0.04 -0.66 0.00 0.00 -0.55 0.00 0.00 66.41 65.24 3hvx h THR 73 Cb 0.74 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 68.71 3hvx h THR 73 CO 0.05 0.07 0.00 -0.33 -0.25 0.00 0.00 175.52 175.06 3hvx h GLU 74 N 0.00 0.00 -6.08 4.72 4.39 -0.96 -3.43 114.58 113.22 3hvx h GLU 74 Ca -0.00 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 59.11 3hvx h GLU 74 Cb 0.54 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.14 3hvx h GLU 74 CO 0.01 0.00 -0.11 0.42 -1.16 0.00 0.00 179.01 178.17 3hvx s ILE 75 N -3.56 4.91 0.36 3.13 1.01 -0.72 -5.02 121.20 121.31 3hvx s ILE 75 Ca -0.00 1.05 -0.27 0.00 0.00 0.00 0.00 60.65 61.43 3hvx s ILE 75 Cb 0.08 -3.82 -0.09 0.00 0.01 0.00 0.00 42.46 38.64 3hvx s ILE 75 CO 0.31 0.52 1.19 -0.62 0.00 0.00 0.00 174.94 176.35 3hvx s ASP 76 N -0.81 6.71 -1.12 3.58 -1.08 -1.26 -3.45 116.67 119.23 3hvx s ASP 76 Ca 0.27 2.42 -0.05 0.00 -0.52 0.00 0.00 52.55 54.67 3hvx s ASP 76 Cb -0.18 -2.63 0.01 0.00 -1.46 0.00 0.00 42.92 38.66 3hvx s ASP 76 CO 0.16 -0.55 0.97 -3.20 0.52 0.00 0.00 175.17 173.06 3hvx n ASN 77 N 0.45 -4.57 -3.90 -0.34 5.15 -1.26 -4.89 115.26 105.89 3hvx n ASN 77 Ca 0.02 -0.49 -0.24 0.00 -0.60 0.00 0.00 54.58 53.28 3hvx n ASN 77 Cb 0.45 -4.42 -0.17 0.00 -0.53 0.00 0.00 39.78 35.11 3hvx n ASN 77 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3hvx s THR 78 N -3.29 0.81 -0.07 -0.44 2.01 -1.22 -1.06 115.64 112.38 3hvx s THR 78 Ca 0.34 -0.21 -0.00 0.00 0.31 0.00 0.00 61.69 62.12 3hvx s THR 78 Cb -0.15 -0.83 -0.03 0.00 0.01 0.00 0.00 72.50 71.49 3hvx s THR 78 CO 0.63 0.31 -0.03 0.68 -0.69 0.00 0.00 174.62 175.52 3hvx s VAL 79 N 1.33 4.01 -0.20 3.82 -7.23 -0.48 -4.75 120.40 116.90 3hvx s VAL 79 Ca -0.03 -0.39 -0.10 0.00 -1.81 0.00 0.00 61.98 59.64 3hvx s VAL 79 Cb -0.14 -2.68 -0.05 0.00 0.56 0.00 0.00 36.38 34.08 3hvx s VAL 79 CO -0.03 0.58 0.15 -0.69 -0.31 0.00 0.00 175.10 174.80 3hvx s VAL 80 N -0.87 5.39 -0.28 1.32 1.01 -0.55 -0.32 120.40 126.10 3hvx s VAL 80 Ca 0.13 0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.32 3hvx s VAL 80 Cb -0.11 -3.49 0.03 0.00 0.00 0.00 0.00 36.38 32.81 3hvx s VAL 80 CO 0.03 0.42 -0.01 -0.76 0.00 0.00 0.00 175.10 174.78 3hvx s LEU 81 N 0.47 3.64 -0.52 3.92 1.43 0.12 -0.31 118.68 127.43 3hvx s LEU 81 Ca 0.09 -1.04 -0.17 0.00 -1.03 0.00 0.00 54.13 51.98 3hvx s LEU 81 Cb -0.12 -1.72 0.09 0.00 0.03 0.00 0.00 46.19 44.47 3hvx s LEU 81 CO -0.01 -0.20 0.54 -0.55 0.23 0.00 0.00 176.35 176.36 3hvx s SER 82 N 1.32 6.18 -0.10 2.29 0.15 -0.03 -0.85 113.70 122.66 3hvx s SER 82 Ca -0.02 -1.32 0.02 0.00 0.70 0.00 0.00 55.95 55.33 3hvx s SER 82 Cb -0.18 -2.24 -0.02 0.00 -1.71 0.00 0.00 66.02 61.87 3hvx s SER 82 CO -0.02 -0.85 -0.15 -0.63 1.20 0.00 0.00 173.24 172.79 3hvx s ILE 83 N 2.13 2.88 0.37 6.45 1.01 -0.02 -1.38 121.20 132.63 3hvx s ILE 83 Ca 0.08 -0.75 -0.14 0.00 0.00 0.00 0.00 60.65 59.84 3hvx s ILE 83 Cb -0.24 -2.16 0.04 0.00 0.01 0.00 0.00 42.46 40.11 3hvx s ILE 83 CO 0.07 0.55 0.74 -0.94 0.00 0.00 0.00 174.94 175.37 3hvx s SER 84 N -0.01 0.09 0.00 3.58 1.04 -1.02 -0.73 113.70 116.66 3hvx s SER 84 Ca -0.04 -1.14 0.28 0.00 0.48 0.00 0.00 55.95 55.52 3hvx s SER 84 Cb -0.14 0.82 0.96 0.00 0.10 0.00 0.00 66.02 67.76 3hvx s SER 84 CO 0.04 -1.61 1.69 0.00 0.98 0.00 0.00 173.24 174.35 3hvx n ALA 85 N -0.53 2.63 -1.70 5.32 0.00 -1.26 -0.91 120.51 124.07 3hvx n ALA 85 Ca -0.07 -0.45 -0.38 0.00 0.00 0.00 0.00 53.44 52.53 3hvx n ALA 85 Cb 0.60 -1.14 0.05 0.00 0.00 0.00 0.00 19.45 18.96 3hvx n ALA 85 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3hvx n ASP 86 N 0.14 1.98 -4.76 0.00 8.00 -1.26 -4.48 116.55 116.17 3hvx n ASP 86 Ca 0.18 0.92 -0.31 0.00 0.71 0.00 0.00 54.79 56.29 3hvx n ASP 86 Cb 0.37 -1.50 0.10 0.00 -0.02 0.00 0.00 41.12 40.06 3hvx n ASP 86 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3hvx s LEU 87 N -2.89 3.02 0.49 0.64 1.43 -1.26 -4.58 118.68 115.53 3hvx s LEU 87 Ca 0.73 1.88 0.14 0.00 -1.03 0.00 0.00 54.13 55.85 3hvx s LEU 87 Cb -0.43 -4.53 1.17 0.00 0.03 0.00 0.00 46.19 42.44 3hvx s LEU 87 CO 0.48 -2.16 2.11 -0.65 0.23 0.00 0.00 176.35 176.37 3hvx h PRO 88 N -1.18 0.14 -0.59 1.29 0.11 -1.90 -1.48 132.00 128.39 3hvx h PRO 88 Ca -0.44 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.57 3hvx h PRO 88 Cb 1.24 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 3hvx h PRO 88 CO 0.50 0.09 -0.00 0.74 -0.21 0.00 0.00 178.00 179.12 3hvx h PHE 89 N 0.14 1.15 -0.21 0.65 0.05 -1.90 -1.46 116.94 115.36 3hvx h PHE 89 Ca 0.06 -0.20 -0.01 0.00 3.82 0.00 0.00 57.97 61.64 3hvx h PHE 89 Cb 0.07 -0.30 -0.01 0.00 2.00 0.00 0.00 35.95 37.71 3hvx h PHE 89 CO -0.00 1.02 0.10 0.00 -0.18 0.00 0.00 178.31 179.25 3hvx h ALA 90 N 0.98 0.27 -0.93 2.45 0.00 -1.65 -2.71 119.26 117.66 3hvx h ALA 90 Ca 0.17 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.05 3hvx h ALA 90 Cb 0.56 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 3hvx h ALA 90 CO 0.03 -0.19 0.61 1.96 0.00 0.00 0.00 179.25 181.66 3hvx h GLN 91 N 0.21 1.08 0.00 0.00 4.20 -1.19 -1.33 115.11 118.08 3hvx h GLN 91 Ca 0.07 -0.07 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 3hvx h GLN 91 Cb 0.10 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 27.62 3hvx h GLN 91 CO -0.01 0.72 -0.35 0.77 -0.67 0.00 0.00 178.83 179.28 3hvx h SER 92 N 1.12 0.00 -0.11 1.46 0.02 -1.14 -1.85 113.55 113.04 3hvx h SER 92 Ca 0.39 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.29 3hvx h SER 92 Cb 0.11 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.65 3hvx h SER 92 CO -0.14 0.35 -0.13 0.03 -1.14 0.00 0.00 176.83 175.80 3hvx h ARG 93 N 0.00 0.28 -0.68 3.45 2.47 -1.04 -1.19 114.38 117.67 3hvx h ARG 93 Ca -0.00 -0.16 0.00 0.00 -1.26 0.00 0.00 59.98 58.56 3hvx h ARG 93 Cb 0.99 0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 29.29 3hvx h ARG 93 CO 0.05 0.71 0.43 0.35 0.56 0.00 0.00 179.97 182.07 3hvx h PHE 94 N -0.14 0.88 0.00 3.04 3.57 -1.18 -2.82 116.94 120.29 3hvx h PHE 94 Ca 0.01 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 3hvx h PHE 94 Cb 0.67 -0.29 -0.00 0.00 2.79 0.00 0.00 35.95 39.12 3hvx h PHE 94 CO 0.09 0.58 -0.55 0.66 -2.23 0.00 0.00 178.31 176.86 3hvx h SER 95 N 0.92 0.00 -3.93 0.41 4.64 -1.44 -3.50 113.55 110.65 3hvx h SER 95 Ca 0.25 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.59 3hvx h SER 95 Cb -0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 3hvx h SER 95 CO -0.05 0.08 -0.04 0.61 -0.87 0.00 0.00 176.83 176.56 3hvx n GLY 96 N 1.16 -2.22 0.20 -0.77 0.00 -0.45 -3.70 105.19 99.42 3hvx n GLY 96 Ca 0.01 -1.50 -0.08 0.00 0.00 0.00 0.00 46.02 44.45 3hvx n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hvx h ALA 97 N -0.10 -0.02 -0.07 4.61 0.00 -1.89 -3.31 119.26 118.48 3hvx h ALA 97 Ca 0.00 0.07 -0.58 0.00 0.00 0.00 0.00 54.91 54.40 3hvx h ALA 97 Cb 0.09 0.34 0.05 0.00 0.00 0.00 0.00 17.79 18.27 3hvx h ALA 97 CO 0.00 -0.58 1.90 -0.85 0.00 0.00 0.00 179.25 179.72 3hvx n GLU 98 N -5.31 1.21 -2.56 0.00 -0.00 -1.26 -4.90 120.64 107.82 3hvx n GLU 98 Ca -0.02 -1.78 -0.33 0.00 -0.00 0.00 0.00 57.16 55.04 3hvx n GLU 98 Cb 0.22 -2.98 -0.05 0.00 -0.00 0.00 0.00 31.44 28.63 3hvx n GLU 98 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 3hvx s GLY 99 N 5.66 2.22 0.05 -1.84 0.00 -1.24 -4.94 107.32 107.22 3hvx s GLY 99 Ca 0.62 0.30 0.01 0.00 0.00 0.00 0.00 44.72 45.64 3hvx s GLY 99 CO 0.16 0.58 0.12 1.08 0.00 0.00 0.00 173.10 175.04 3hvx s LEU 100 N -3.70 3.99 0.19 0.66 1.43 -1.26 -5.05 118.68 114.94 3hvx s LEU 100 Ca 0.61 0.12 -0.31 0.00 -1.03 0.00 0.00 54.13 53.52 3hvx s LEU 100 Cb -0.10 -2.54 -0.10 0.00 0.03 0.00 0.00 46.19 43.48 3hvx s LEU 100 CO 0.24 0.21 1.49 0.21 0.23 0.00 0.00 176.35 178.73 3hvx s ASN 101 N -2.20 6.64 -2.01 2.29 2.47 -1.26 -0.53 114.94 120.34 3hvx s ASN 101 Ca 0.29 2.60 0.00 0.00 0.42 0.00 0.00 52.86 56.16 3hvx s ASN 101 Cb -0.12 -2.60 0.00 0.00 -1.45 0.00 0.00 41.25 37.07 3hvx s ASN 101 CO 0.21 -0.75 0.00 0.59 -3.72 0.00 0.00 177.10 173.42 3hvx n ASN 102 N 3.35 -5.35 -4.39 -4.21 3.02 -1.26 -4.97 115.26 101.45 3hvx n ASN 102 Ca 0.11 0.43 -0.37 0.00 -0.03 0.00 0.00 54.58 54.72 3hvx n ASN 102 Cb 0.40 -4.54 -0.13 0.00 -0.61 0.00 0.00 39.78 34.90 3hvx n ASN 102 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3hvx s VAL 103 N -2.74 4.15 -0.12 2.41 1.01 0.31 -1.48 120.40 123.93 3hvx s VAL 103 Ca 0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.50 3hvx s VAL 103 Cb 0.00 -3.05 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 3hvx s VAL 103 CO 0.00 0.19 -0.02 -0.63 0.00 0.00 0.00 175.10 174.65 3hvx s ILE 104 N 1.56 4.12 -0.23 2.22 -1.09 0.57 -4.64 121.20 123.71 3hvx s ILE 104 Ca 0.04 -0.30 -0.16 0.00 -2.23 0.00 0.00 60.65 58.01 3hvx s ILE 104 Cb -0.16 -2.77 -0.04 0.00 -1.58 0.00 0.00 42.46 37.91 3hvx s ILE 104 CO 0.03 0.54 0.40 0.28 -1.23 0.00 0.00 174.94 174.96 3hvx s THR 105 N -0.19 5.18 -0.05 2.92 -1.32 -1.26 -0.85 115.64 120.05 3hvx s THR 105 Ca 0.04 0.68 0.02 0.00 -1.21 0.00 0.00 61.69 61.22 3hvx s THR 105 Cb -0.13 -3.73 0.02 0.00 -1.51 0.00 0.00 72.50 67.15 3hvx s THR 105 CO 0.02 0.20 -0.09 -0.76 -2.21 0.00 0.00 174.62 171.78 3hvx s LEU 106 N 1.67 1.54 -0.13 9.08 1.43 -0.48 -4.22 118.68 127.58 3hvx s LEU 106 Ca 0.18 -0.22 -0.06 0.00 -1.03 0.00 0.00 54.13 52.99 3hvx s LEU 106 Cb -0.15 -0.66 -0.04 0.00 0.03 0.00 0.00 46.19 45.37 3hvx s LEU 106 CO 0.09 0.00 0.09 -0.55 0.23 0.00 0.00 176.35 176.21 3hvx s SER 107 N 0.71 5.92 0.00 2.29 0.15 -0.19 -2.43 113.70 120.16 3hvx s SER 107 Ca -0.13 0.28 0.15 0.00 0.70 0.00 0.00 55.95 56.95 3hvx s SER 107 Cb -0.15 -1.90 0.54 0.00 -1.71 0.00 0.00 66.02 62.80 3hvx s SER 107 CO 0.02 0.33 1.40 0.35 1.20 0.00 0.00 173.24 176.54 3hvx n THR 108 N 2.49 0.29 0.10 6.45 -2.24 -0.09 -1.74 114.28 119.54 3hvx n THR 108 Ca -0.19 -0.34 0.11 0.00 -2.27 0.00 0.00 64.05 61.36 3hvx n THR 108 Cb 0.54 0.23 0.59 0.00 -2.10 0.00 0.00 70.33 69.58 3hvx n THR 108 CO 0.00 0.00 0.00 2.19 -0.57 0.00 0.00 175.07 176.69 3hvx h PHE 109 N 1.78 0.17 0.00 4.78 -5.15 -1.79 0.17 116.94 116.90 3hvx h PHE 109 Ca 0.00 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 57.74 3hvx h PHE 109 Cb 0.40 -0.06 -0.06 0.00 0.22 0.00 0.00 35.95 36.45 3hvx h PHE 109 CO 0.14 0.09 -0.51 2.89 -2.00 0.00 0.00 178.31 178.92 3hvx n ARG 110 N -4.48 1.23 -3.07 6.09 1.85 -1.26 -4.75 116.66 112.27 3hvx n ARG 110 Ca 0.03 -2.90 -0.16 0.00 -1.00 0.00 0.00 57.85 53.82 3hvx n ARG 110 Cb 0.25 -1.30 -0.02 0.00 -1.05 0.00 0.00 32.46 30.34 3hvx n ARG 110 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3hvx n ASN 111 N -0.86 1.02 -0.28 2.89 3.02 0.57 -4.96 115.26 116.67 3hvx n ASN 111 Ca 0.16 -2.95 0.22 0.00 -0.03 0.00 0.00 54.58 51.97 3hvx n ASN 111 Cb 0.76 -0.60 0.53 0.00 -0.61 0.00 0.00 39.78 39.86 3hvx n ASN 111 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hvx h ALA 112 N 3.00 2.28 -0.38 5.41 0.00 -1.83 -1.88 119.26 125.86 3hvx h ALA 112 Ca 0.06 0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.11 3hvx h ALA 112 Cb 1.01 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 3hvx h ALA 112 CO 0.51 -0.62 0.30 1.05 0.00 0.00 0.00 179.25 180.48 3hvx h GLU 113 N 0.37 0.00 -0.30 0.00 9.09 -1.92 -0.13 114.58 121.69 3hvx h GLU 113 Ca 0.52 0.00 0.06 0.00 0.05 0.00 0.00 59.36 59.99 3hvx h GLU 113 Cb 1.38 0.00 -0.06 0.00 -1.65 0.00 0.00 28.75 28.43 3hvx h GLU 113 CO -0.21 0.00 -0.07 0.35 0.05 0.00 0.00 179.01 179.13 3hvx h PHE 114 N 0.00 -0.14 -0.86 2.06 3.57 -1.68 -1.31 116.94 118.57 3hvx h PHE 114 Ca 0.18 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.77 3hvx h PHE 114 Cb 0.78 0.11 -0.05 0.00 2.79 0.00 0.00 35.95 39.57 3hvx h PHE 114 CO 0.00 -0.12 0.56 -0.07 -2.23 0.00 0.00 178.31 176.45 3hvx h LEU 115 N 0.01 0.86 0.69 0.59 3.38 -1.20 -0.45 115.31 119.19 3hvx h LEU 115 Ca 0.15 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 3hvx h LEU 115 Cb 0.22 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 40.80 3hvx h LEU 115 CO -0.30 0.56 -0.33 1.56 0.09 0.00 0.00 178.44 180.01 3hvx h GLN 116 N 0.98 -0.89 -0.59 1.13 1.08 -1.42 -1.51 115.11 113.88 3hvx h GLN 116 Ca 0.37 0.06 0.04 0.00 -1.45 0.00 0.00 58.65 57.67 3hvx h GLN 116 Cb 0.19 0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 27.79 3hvx h GLN 116 CO -0.13 -0.57 0.39 0.00 -0.95 0.00 0.00 178.83 177.57 3hvx h ALA 117 N -1.07 1.74 -0.32 3.87 0.00 -1.04 -0.60 119.26 121.83 3hvx h ALA 117 Ca -0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3hvx h ALA 117 Cb 0.73 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3hvx h ALA 117 CO 0.16 0.19 0.00 0.66 0.00 0.00 0.00 179.25 180.25 3hvx n TYR 118 N -4.47 0.42 -2.60 0.00 4.01 -0.20 -4.83 117.16 109.50 3hvx n TYR 118 Ca 0.08 -0.21 -0.17 0.00 -0.16 0.00 0.00 57.90 57.43 3hvx n TYR 118 Cb 0.17 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.21 3hvx n TYR 118 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hvx n GLY 119 N 1.13 -0.30 0.12 2.72 0.00 -0.23 -4.14 105.19 104.49 3hvx n GLY 119 Ca 0.14 -0.12 0.06 0.00 0.00 0.00 0.00 46.02 46.10 3hvx n GLY 119 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hvx n VAL 120 N -4.14 1.34 -2.67 1.61 0.24 -0.61 -3.84 118.33 110.26 3hvx n VAL 120 Ca -0.14 -1.57 -0.43 0.00 -2.04 0.00 0.00 64.34 60.16 3hvx n VAL 120 Cb 0.62 0.07 -0.03 0.00 -1.47 0.00 0.00 33.84 33.04 3hvx n VAL 120 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3hvx s ALA 121 N -1.95 3.24 0.16 2.33 0.00 -0.97 -0.51 121.76 124.07 3hvx s ALA 121 Ca 0.20 -0.48 -0.31 0.00 0.00 0.00 0.00 51.96 51.37 3hvx s ALA 121 Cb 0.17 -3.78 -0.08 0.00 0.00 0.00 0.00 23.12 19.43 3hvx s ALA 121 CO 0.02 -2.05 1.37 0.42 0.00 0.00 0.00 175.76 175.51 3hvx s ILE 122 N 4.11 3.20 -0.12 0.00 1.01 -0.94 -0.75 121.20 127.71 3hvx s ILE 122 Ca 0.44 0.92 0.13 0.00 0.00 0.00 0.00 60.65 62.15 3hvx s ILE 122 Cb -0.09 -3.59 -0.20 0.00 0.01 0.00 0.00 42.46 38.60 3hvx s ILE 122 CO 0.27 0.10 0.34 0.00 0.00 0.00 0.00 174.94 175.65 3hvx n ALA 123 N 3.30 2.70 -3.45 9.38 0.00 0.06 -2.05 120.51 130.45 3hvx n ALA 123 Ca 0.09 -0.33 -0.11 0.00 0.00 0.00 0.00 53.44 53.09 3hvx n ALA 123 Cb 0.42 -0.46 -0.00 0.00 0.00 0.00 0.00 19.45 19.41 3hvx n ALA 123 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 3hvx s ASP 124 N -3.34 0.37 0.42 0.00 3.84 -1.26 -4.88 116.67 111.82 3hvx s ASP 124 Ca -0.03 -1.28 0.00 0.00 -0.00 0.00 0.00 52.55 51.24 3hvx s ASP 124 Cb 0.09 0.78 0.00 0.00 -1.38 0.00 0.00 42.92 42.41 3hvx s ASP 124 CO 0.56 -1.54 0.00 0.61 -0.00 0.00 0.00 175.17 174.80 3hvx n GLY 125 N -0.55 -0.77 0.20 2.12 0.00 -1.26 -3.58 105.19 101.35 3hvx n GLY 125 Ca -0.05 -1.15 0.11 0.00 0.00 0.00 0.00 46.02 44.93 3hvx n GLY 125 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hvx h PRO 126 N 0.00 0.00 -0.28 1.61 0.13 -2.00 -2.75 132.00 128.71 3hvx h PRO 126 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3hvx h PRO 126 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3hvx h PRO 126 CO 0.00 0.07 0.00 1.28 -0.23 0.00 0.00 178.00 179.12 3hvx n LEU 127 N -3.08 1.82 -4.57 1.56 4.77 -1.26 -4.94 117.00 111.30 3hvx n LEU 127 Ca 0.03 -0.85 -0.53 0.00 -0.03 0.00 0.00 56.01 54.63 3hvx n LEU 127 Cb 0.56 -0.18 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 3hvx n LEU 127 CO 0.35 0.43 0.83 1.17 -1.33 0.00 0.00 177.39 178.84 3hvx n LYS 128 N 0.46 0.92 -0.07 3.23 4.81 -1.04 -0.86 118.16 125.61 3hvx n LYS 128 Ca 0.14 0.33 0.00 0.00 -0.87 0.00 0.00 58.31 57.91 3hvx n LYS 128 Cb 0.32 -1.94 0.00 0.00 0.02 0.00 0.00 35.03 33.42 3hvx n LYS 128 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hvx n GLY 129 N 2.31 0.69 4.00 3.14 0.00 -0.87 -4.99 105.19 109.46 3hvx n GLY 129 Ca 0.19 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.01 3hvx n GLY 129 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hvx s LEU 130 N 0.00 3.41 0.25 0.99 1.43 -0.04 -4.93 118.68 119.79 3hvx s LEU 130 Ca 0.00 -0.29 -0.24 0.00 -1.03 0.00 0.00 54.13 52.57 3hvx s LEU 130 Cb 0.00 -2.61 -0.09 0.00 0.03 0.00 0.00 46.19 43.52 3hvx s LEU 130 CO 0.00 -1.04 0.83 0.00 0.23 0.00 0.00 176.35 176.37 3hvx s ALA 131 N -2.60 3.34 0.75 4.21 0.00 -1.26 -2.22 121.76 123.98 3hvx s ALA 131 Ca 0.57 0.37 -0.11 0.00 0.00 0.00 0.00 51.96 52.79 3hvx s ALA 131 Cb -0.09 -3.01 0.04 0.00 0.00 0.00 0.00 23.12 20.06 3hvx s ALA 131 CO 0.36 0.26 1.08 0.00 0.00 0.00 0.00 175.76 177.46 3hvx s ALA 132 N -1.46 2.43 -0.08 0.00 0.00 0.34 -2.61 121.76 120.37 3hvx s ALA 132 Ca 0.44 0.01 -0.30 0.00 0.00 0.00 0.00 51.96 52.12 3hvx s ALA 132 Cb -0.19 -3.17 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 3hvx s ALA 132 CO 0.24 -1.51 1.15 0.50 0.00 0.00 0.00 175.76 176.13 3hvx s ARG 133 N -5.05 4.36 0.07 0.00 6.06 -1.26 -4.25 118.95 118.87 3hvx s ARG 133 Ca 0.60 1.58 -0.24 0.00 -2.50 0.00 0.00 55.73 55.17 3hvx s ARG 133 Cb -0.15 -3.57 0.06 0.00 0.06 0.00 0.00 34.95 31.35 3hvx s ARG 133 CO 0.55 -0.44 0.57 0.00 -2.50 0.00 0.00 175.30 173.48 3hvx s ALA 134 N 2.30 -1.49 -0.08 6.12 0.00 -0.94 -0.89 121.76 126.78 3hvx s ALA 134 Ca 0.53 0.67 0.01 0.00 0.00 0.00 0.00 51.96 53.17 3hvx s ALA 134 Cb -0.22 0.50 0.02 0.00 0.00 0.00 0.00 23.12 23.42 3hvx s ALA 134 CO 0.20 -0.58 -0.10 0.08 0.00 0.00 0.00 175.76 175.36 3hvx s VAL 135 N -2.73 1.01 -0.13 0.00 1.01 -0.58 -0.26 120.40 118.73 3hvx s VAL 135 Ca -0.04 -0.37 0.01 0.00 0.00 0.00 0.00 61.98 61.59 3hvx s VAL 135 Cb -0.00 -0.97 0.02 0.00 0.00 0.00 0.00 36.38 35.42 3hvx s VAL 135 CO -0.04 0.34 -0.16 -0.69 0.00 0.00 0.00 175.10 174.55 3hvx s VAL 136 N 1.01 1.63 -0.21 2.92 1.01 -0.20 -1.05 120.40 125.51 3hvx s VAL 136 Ca -0.08 -0.71 -0.07 0.00 0.00 0.00 0.00 61.98 61.12 3hvx s VAL 136 Cb -0.15 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 3hvx s VAL 136 CO -0.00 0.47 0.05 -0.69 0.00 0.00 0.00 175.10 174.92 3hvx s VAL 137 N 1.10 4.35 -0.13 2.92 1.01 0.10 0.41 120.40 130.17 3hvx s VAL 137 Ca -0.03 -0.17 0.02 0.00 0.00 0.00 0.00 61.98 61.79 3hvx s VAL 137 Cb -0.14 -2.99 -0.00 0.00 0.00 0.00 0.00 36.38 33.24 3hvx s VAL 137 CO -0.04 0.40 -0.19 -0.63 0.00 0.00 0.00 175.10 174.64 3hvx s ILE 138 N 1.01 2.46 0.00 2.22 1.01 0.31 -0.59 121.20 127.63 3hvx s ILE 138 Ca 0.03 -0.86 0.00 0.00 0.00 0.00 0.00 60.65 59.82 3hvx s ILE 138 Cb -0.14 -1.99 0.00 0.00 0.01 0.00 0.00 42.46 40.33 3hvx s ILE 138 CO 0.03 0.54 0.00 -0.90 0.00 0.00 0.00 174.94 174.60 3hvx n ASP 139 N 3.71 0.00 0.21 3.58 3.85 0.88 -0.75 116.55 128.03 3hvx n ASP 139 Ca -0.19 -0.72 0.07 0.00 -0.71 0.00 0.00 54.79 53.24 3hvx n ASP 139 Cb 0.52 0.00 0.47 0.00 -1.35 0.00 0.00 41.12 40.77 3hvx n ASP 139 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 3hvx h GLU 140 N 0.00 0.00 -0.60 0.11 3.07 -1.85 -1.88 114.58 113.42 3hvx h GLU 140 Ca 0.00 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 3hvx h GLU 140 Cb 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 3hvx h GLU 140 CO 0.00 0.28 0.02 0.09 -1.40 0.00 0.00 179.01 178.00 3hvx n ASN 141 N -3.70 5.65 -3.72 1.42 4.13 -1.26 -4.16 115.26 113.62 3hvx n ASN 141 Ca -0.01 -2.95 -0.25 0.00 1.68 0.00 0.00 54.58 53.05 3hvx n ASN 141 Cb 0.39 -0.69 0.05 0.00 -1.54 0.00 0.00 39.78 37.99 3hvx n ASN 141 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 3hvx n ASP 142 N 0.56 -4.29 -4.46 6.41 8.00 -0.71 -4.94 116.55 117.13 3hvx n ASP 142 Ca 0.29 -0.69 -0.33 0.00 0.71 0.00 0.00 54.79 54.76 3hvx n ASP 142 Cb 1.21 -4.43 -0.13 0.00 -0.02 0.00 0.00 41.12 37.75 3hvx n ASP 142 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 3hvx s ASN 143 N -3.64 4.35 0.05 -2.24 0.01 -1.26 -0.66 114.94 111.56 3hvx s ASN 143 Ca 0.44 -0.20 -0.30 0.00 -0.71 0.00 0.00 52.86 52.08 3hvx s ASN 143 Cb -0.21 -1.49 -0.09 0.00 0.41 0.00 0.00 41.25 39.87 3hvx s ASN 143 CO 0.78 0.22 1.84 -0.69 -1.51 0.00 0.00 177.10 177.74 3hvx s VAL 144 N 0.02 3.00 -0.49 1.60 1.01 -0.07 -0.09 120.40 125.39 3hvx s VAL 144 Ca -0.02 0.21 0.11 0.00 0.00 0.00 0.00 61.98 62.28 3hvx s VAL 144 Cb -0.14 -3.13 -0.13 0.00 0.00 0.00 0.00 36.38 32.98 3hvx s VAL 144 CO 0.04 -0.01 0.46 2.30 0.00 0.00 0.00 175.10 177.88 3hvx n ILE 145 N 5.23 0.00 -3.66 2.22 -5.35 0.25 -0.26 119.36 117.78 3hvx n ILE 145 Ca 0.18 -0.24 -0.14 0.00 -0.27 0.00 0.00 62.75 62.28 3hvx n ILE 145 Cb 0.41 0.94 -0.08 0.00 -1.74 0.00 0.00 39.64 39.17 3hvx n ILE 145 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 3hvx s PHE 146 N -2.11 -0.56 -0.13 4.28 2.19 -1.05 -4.85 117.98 115.75 3hvx s PHE 146 Ca 0.04 1.23 -0.13 0.00 0.33 0.00 0.00 56.93 58.39 3hvx s PHE 146 Cb 0.08 0.24 0.04 0.00 -1.31 0.00 0.00 43.02 42.07 3hvx s PHE 146 CO 0.46 -0.38 0.38 -1.54 1.83 0.00 0.00 175.22 175.97 3hvx s SER 147 N -0.28 -0.38 -0.03 6.13 1.04 -1.26 0.02 113.70 118.94 3hvx s SER 147 Ca -0.05 0.71 0.00 0.00 0.48 0.00 0.00 55.95 57.10 3hvx s SER 147 Cb -0.03 0.74 0.03 0.00 0.10 0.00 0.00 66.02 66.85 3hvx s SER 147 CO 0.03 -0.16 -0.00 -1.58 0.98 0.00 0.00 173.24 172.51 3hvx s GLN 148 N 0.07 0.31 -0.41 4.02 0.74 -0.22 -4.98 119.66 119.20 3hvx s GLN 148 Ca -0.01 0.06 -0.12 0.00 0.05 0.00 0.00 55.36 55.34 3hvx s GLN 148 Cb -0.03 -0.48 0.04 0.00 1.10 0.00 0.00 33.01 33.65 3hvx s GLN 148 CO 0.01 -0.13 0.27 -1.17 -0.55 0.00 0.00 175.29 173.72 3hvx s LEU 149 N 0.97 5.03 -0.11 3.68 2.96 -1.26 -1.53 118.68 128.43 3hvx s LEU 149 Ca -0.10 -1.14 -0.29 0.00 -0.22 0.00 0.00 54.13 52.38 3hvx s LEU 149 Cb -0.13 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.45 3hvx s LEU 149 CO -0.02 -0.47 1.51 -0.69 -1.32 0.00 0.00 176.35 175.36 3hvx s VAL 150 N 1.57 3.85 0.43 1.68 1.01 -0.07 -4.88 120.40 123.99 3hvx s VAL 150 Ca 0.03 1.02 0.12 0.00 0.00 0.00 0.00 61.98 63.15 3hvx s VAL 150 Cb -0.21 -3.68 0.19 0.00 0.00 0.00 0.00 36.38 32.69 3hvx s VAL 150 CO 0.06 -0.11 1.99 -0.78 0.00 0.00 0.00 175.10 176.26 3hvx h ASP 151 N 9.16 0.11 -3.69 3.32 3.58 -1.93 -3.36 116.42 123.61 3hvx h ASP 151 Ca -0.34 -0.02 -0.68 0.00 0.42 0.00 0.00 57.03 56.41 3hvx h ASP 151 Cb 1.15 -0.03 -0.31 0.00 1.72 0.00 0.00 39.33 41.86 3hvx h ASP 151 CO 0.96 0.24 -0.68 -0.70 -2.88 0.00 0.00 179.24 176.18 3hvx s GLU 152 N -4.78 2.61 0.29 0.28 2.56 -1.26 -0.82 118.70 117.57 3hvx s GLU 152 Ca -0.05 -1.16 0.03 0.00 0.00 0.00 0.00 54.97 53.80 3hvx s GLU 152 Cb 0.16 -3.22 0.73 0.00 2.00 0.00 0.00 34.13 33.79 3hvx s GLU 152 CO 0.71 -0.57 1.69 0.82 -0.56 0.00 0.00 175.26 177.34 3hvx h ILE 153 N 6.29 0.44 -0.45 -3.70 1.08 -1.34 0.40 117.51 120.23 3hvx h ILE 153 Ca -0.25 -0.12 0.00 0.00 -0.39 0.00 0.00 64.86 64.10 3hvx h ILE 153 Cb 1.08 0.05 0.00 0.00 -3.07 0.00 0.00 36.82 34.88 3hvx h ILE 153 CO 0.56 0.07 0.00 0.35 -0.69 0.00 0.00 178.15 178.44 3hvx n THR 154 N -5.08 1.46 -3.86 -0.27 -2.24 -1.26 -4.67 114.28 98.35 3hvx n THR 154 Ca 0.22 -0.87 -0.21 0.00 -2.27 0.00 0.00 64.05 60.92 3hvx n THR 154 Cb 0.66 -0.07 -0.03 0.00 -2.10 0.00 0.00 70.33 68.79 3hvx n THR 154 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3hvx s THR 155 N -1.87 4.06 0.46 4.28 -4.23 0.13 -4.97 115.64 113.50 3hvx s THR 155 Ca 0.37 -1.28 -0.22 0.00 -1.18 0.00 0.00 61.69 59.38 3hvx s THR 155 Cb 0.25 -3.35 -0.08 0.00 1.34 0.00 0.00 72.50 70.66 3hvx s THR 155 CO 0.16 -0.24 1.09 -1.61 -0.54 0.00 0.00 174.62 173.48 3hvx s GLU 156 N -3.98 3.84 0.85 3.99 2.02 -1.26 -4.98 118.70 119.18 3hvx s GLU 156 Ca 0.38 1.54 -0.10 0.00 0.02 0.00 0.00 54.97 56.81 3hvx s GLU 156 Cb -0.07 -2.29 0.11 0.00 0.10 0.00 0.00 34.13 31.97 3hvx s GLU 156 CO 0.27 -0.43 1.11 -2.14 0.02 0.00 0.00 175.26 174.09 3hvx s PRO 157 N -2.89 1.57 -1.22 0.39 0.02 -1.26 -4.88 135.00 126.74 3hvx s PRO 157 Ca 0.64 1.28 -0.20 0.00 0.02 0.00 0.00 61.00 62.74 3hvx s PRO 157 Cb -0.22 -1.81 -0.02 0.00 0.02 0.00 0.00 34.50 32.47 3hvx s PRO 157 CO 0.27 -2.16 1.87 -3.47 -0.33 0.00 0.00 177.00 173.18 3hvx n ASP 158 N -3.88 3.85 -0.38 2.53 4.64 -1.26 -4.77 116.55 117.28 3hvx n ASP 158 Ca 0.10 -2.80 -0.01 0.00 -1.38 0.00 0.00 54.79 50.71 3hvx n ASP 158 Cb 0.53 -1.71 0.13 0.00 -1.04 0.00 0.00 41.12 39.03 3hvx n ASP 158 CO 0.00 0.00 0.00 1.88 -0.82 0.00 0.00 177.20 178.26 3hvx h TYR 159 N 8.56 1.25 -0.59 -0.67 0.99 -1.99 -1.71 116.97 122.81 3hvx h TYR 159 Ca 0.34 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 61.08 3hvx h TYR 159 Cb 0.88 -0.42 -0.03 0.00 1.00 0.00 0.00 36.73 38.16 3hvx h TYR 159 CO 1.31 0.75 0.31 1.49 -0.00 0.00 0.00 178.16 182.01 3hvx h GLU 160 N 1.31 0.84 -0.53 4.88 4.81 -1.99 -0.48 114.58 123.42 3hvx h GLU 160 Ca 0.39 -0.11 -0.06 0.00 -0.13 0.00 0.00 59.36 59.45 3hvx h GLU 160 Cb -0.06 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.14 3hvx h GLU 160 CO -0.11 0.66 0.12 0.00 -0.73 0.00 0.00 179.01 178.95 3hvx h ALA 161 N 1.13 0.70 -0.75 2.92 0.00 -1.80 -0.80 119.26 120.66 3hvx h ALA 161 Ca 0.21 -0.22 0.01 0.00 0.00 0.00 0.00 54.91 54.91 3hvx h ALA 161 Cb 0.08 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 3hvx h ALA 161 CO -0.03 0.41 0.49 0.00 0.00 0.00 0.00 179.25 180.12 3hvx h ALA 162 N 1.00 0.96 0.00 0.00 0.00 -0.69 -2.49 119.26 118.04 3hvx h ALA 162 Ca 0.17 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3hvx h ALA 162 Cb 0.36 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3hvx h ALA 162 CO 0.00 0.34 -0.67 -0.07 0.00 0.00 0.00 179.25 178.85 3hvx h LEU 163 N 0.99 0.00 -1.99 0.00 3.38 -0.84 -3.32 115.31 113.53 3hvx h LEU 163 Ca 0.28 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 3hvx h LEU 163 Cb -0.08 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 3hvx h LEU 163 CO -0.07 0.00 -0.03 0.00 0.09 0.00 0.00 178.44 178.43 3hvx h ALA 164 N 2.02 1.05 0.00 1.53 0.00 -0.67 -2.07 119.26 121.12 3hvx h ALA 164 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3hvx h ALA 164 Cb 0.99 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3hvx h ALA 164 CO 0.00 0.04 0.00 1.33 0.00 0.00 0.00 179.25 180.62 3hvx n VAL 165 N -3.20 0.10 0.73 0.00 0.24 -1.23 -2.71 118.33 112.26 3hvx n VAL 165 Ca -0.01 0.02 0.11 0.00 -2.04 0.00 0.00 64.34 62.42 3hvx n VAL 165 Cb 0.23 -0.56 -0.03 0.00 -1.47 0.00 0.00 33.84 32.01 3hvx n VAL 165 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3hvx n LEU 166 N -1.39 0.68 -5.01 1.34 4.77 -0.78 -4.89 117.00 111.73 3hvx n LEU 166 Ca 0.10 -0.21 -0.18 0.00 -0.03 0.00 0.00 56.01 55.69 3hvx n LEU 166 Cb 0.27 -0.06 0.03 0.00 -2.33 0.00 0.00 43.42 41.32 3hvx n LEU 166 CO 0.23 0.13 0.23 -0.75 -1.33 0.00 0.00 177.39 175.91 3hvx s LYS 167 N -3.13 2.65 0.00 3.23 2.47 -1.10 -4.96 119.74 118.90 3hvx s LYS 167 Ca 0.05 -1.23 0.00 0.00 -1.56 0.00 0.00 55.97 53.23 3hvx s LYS 167 Cb 0.15 -2.68 0.00 0.00 -1.46 0.00 0.00 37.83 33.84 3hvx s LYS 167 CO 0.83 -0.48 0.00 0.00 0.16 0.00 0.00 175.35 175.86