#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hcx s VAL 2 N 0.00 4.87 -0.03 12.58 1.01 -1.26 -0.53 120.40 137.04 3hcx s VAL 2 Ca 0.00 0.57 -0.04 0.00 0.00 0.00 0.00 61.98 62.50 3hcx s VAL 2 Cb 0.00 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 3hcx s VAL 2 CO 0.00 -0.36 0.20 0.00 0.00 0.00 0.00 175.10 174.94 3hcx s ALA 3 N 2.76 3.92 -0.17 5.51 0.00 0.49 -1.19 121.76 133.08 3hcx s ALA 3 Ca 0.25 -0.69 -0.02 0.00 0.00 0.00 0.00 51.96 51.50 3hcx s ALA 3 Cb -0.14 -1.95 -0.01 0.00 0.00 0.00 0.00 23.12 21.02 3hcx s ALA 3 CO 0.16 0.70 -0.10 0.71 0.00 0.00 0.00 175.76 177.22 3hcx s TYR 4 N -1.26 2.87 -0.11 0.00 2.02 -0.52 0.15 117.35 120.50 3hcx s TYR 4 Ca 0.25 -0.89 0.03 0.00 -0.37 0.00 0.00 57.07 56.09 3hcx s TYR 4 Cb -0.13 -1.96 0.00 0.00 -0.40 0.00 0.00 41.96 39.47 3hcx s TYR 4 CO 0.15 -0.43 -0.22 0.42 -1.57 0.00 0.00 175.55 173.90 3hcx s ILE 5 N 0.94 2.17 -0.06 2.71 1.01 0.06 -0.15 121.20 127.89 3hcx s ILE 5 Ca -0.02 -0.97 -0.23 0.00 0.00 0.00 0.00 60.65 59.43 3hcx s ILE 5 Cb -0.15 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 3hcx s ILE 5 CO -0.01 0.55 0.68 0.00 0.00 0.00 0.00 174.94 176.17 3hcx s ALA 6 N 0.47 3.36 -0.11 9.38 0.00 0.29 -0.85 121.76 134.30 3hcx s ALA 6 Ca -0.15 0.12 0.02 0.00 0.00 0.00 0.00 51.96 51.94 3hcx s ALA 6 Cb -0.17 -2.92 -0.01 0.00 0.00 0.00 0.00 23.12 20.02 3hcx s ALA 6 CO 0.06 -0.06 -0.17 0.42 0.00 0.00 0.00 175.76 176.01 3hcx s ILE 7 N 0.63 2.74 -0.05 0.00 1.01 -0.37 -1.40 121.20 123.76 3hcx s ILE 7 Ca 0.36 -0.78 -0.02 0.00 0.00 0.00 0.00 60.65 60.20 3hcx s ILE 7 Cb -0.18 -2.11 0.03 0.00 0.01 0.00 0.00 42.46 40.21 3hcx s ILE 7 CO 0.18 0.54 0.11 -0.83 0.00 0.00 0.00 174.94 174.94 3hcx s GLY 8 N 0.19 -0.02 -0.01 6.18 0.00 -0.35 -1.29 107.32 112.02 3hcx s GLY 8 Ca -0.10 0.45 -0.05 0.00 0.00 0.00 0.00 44.72 45.03 3hcx s GLY 8 CO 0.06 0.64 0.10 -0.45 0.00 0.00 0.00 173.10 173.45 3hcx s SER 9 N 0.72 0.01 -0.06 1.64 0.15 -0.65 -0.12 113.70 115.39 3hcx s SER 9 Ca -0.06 -0.09 0.09 0.00 0.70 0.00 0.00 55.95 56.59 3hcx s SER 9 Cb -0.08 0.20 0.13 0.00 -1.71 0.00 0.00 66.02 64.57 3hcx s SER 9 CO -0.03 -0.23 1.02 0.00 1.20 0.00 0.00 173.24 175.20 3hcx n ALA 10 N 2.08 2.02 -2.53 5.45 0.00 -1.24 -0.33 120.51 125.97 3hcx n ALA 10 Ca -0.19 -1.70 -0.42 0.00 0.00 0.00 0.00 53.44 51.13 3hcx n ALA 10 Cb 0.57 -0.25 -0.03 0.00 0.00 0.00 0.00 19.45 19.73 3hcx n ALA 10 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3hcx s LEU 11 N -1.62 4.40 -0.20 0.00 2.96 -1.26 -4.81 118.68 118.15 3hcx s LEU 11 Ca 0.15 1.78 -0.19 0.00 -0.22 0.00 0.00 54.13 55.65 3hcx s LEU 11 Cb 0.13 -3.58 -0.08 0.00 0.50 0.00 0.00 46.19 43.16 3hcx s LEU 11 CO 0.01 -0.26 0.65 0.00 -1.32 0.00 0.00 176.35 175.44 3hcx n ALA 12 N 3.60 -0.49 -3.18 5.97 0.00 -1.26 -0.49 120.51 124.67 3hcx n ALA 12 Ca 0.06 0.19 -0.08 0.00 0.00 0.00 0.00 53.44 53.61 3hcx n ALA 12 Cb 0.49 -0.77 0.03 0.00 0.00 0.00 0.00 19.45 19.20 3hcx n ALA 12 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3hcx n SER 13 N 1.71 -7.19 0.25 0.00 7.64 -1.26 -4.89 113.62 109.87 3hcx n SER 13 Ca 0.13 -0.37 0.17 0.00 1.01 0.00 0.00 58.87 59.81 3hcx n SER 13 Cb -0.02 -5.06 0.73 0.00 -1.01 0.00 0.00 64.21 58.85 3hcx n SER 13 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3hcx h PRO 14 N -0.20 0.00 -0.42 1.43 0.13 -1.13 -3.19 132.00 128.60 3hcx h PRO 14 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 3hcx h PRO 14 Cb 1.14 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.25 3hcx h PRO 14 CO 0.36 0.00 0.27 1.25 -0.23 0.00 0.00 178.00 179.64 3hcx h LEU 15 N 0.00 0.50 -0.34 1.56 7.12 -1.90 0.39 115.31 122.64 3hcx h LEU 15 Ca 0.00 -0.04 -0.10 0.00 0.13 0.00 0.00 57.88 57.87 3hcx h LEU 15 Cb 0.35 -0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 40.34 3hcx h LEU 15 CO 0.00 0.39 -0.49 1.05 -0.13 0.00 0.00 178.44 179.26 3hcx h GLU 16 N 0.57 0.00 -0.11 1.25 4.11 -1.93 -1.07 114.58 117.40 3hcx h GLU 16 Ca 0.15 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.57 3hcx h GLU 16 Cb -0.03 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.22 3hcx h GLU 16 CO -0.03 0.49 0.02 1.96 0.07 0.00 0.00 179.01 181.52 3hcx h GLN 17 N 0.00 0.17 -0.66 1.06 1.08 -1.48 -1.65 115.11 113.63 3hcx h GLN 17 Ca -0.00 -0.04 -0.05 0.00 -1.45 0.00 0.00 58.65 57.10 3hcx h GLN 17 Cb 1.24 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 28.62 3hcx h GLN 17 CO 0.06 0.37 0.23 0.28 -0.95 0.00 0.00 178.83 178.82 3hcx h VAL 18 N -0.05 1.25 -0.54 -0.54 2.07 -0.22 -1.43 116.25 116.79 3hcx h VAL 18 Ca 0.03 -0.81 -0.04 0.00 0.82 0.00 0.00 66.70 66.70 3hcx h VAL 18 Cb 0.28 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 3hcx h VAL 18 CO 0.00 0.32 0.19 0.78 0.02 0.00 0.00 177.57 178.87 3hcx h ASN 19 N 0.95 0.73 -0.53 0.57 2.35 -1.14 -0.19 115.58 118.31 3hcx h ASN 19 Ca 0.22 -0.10 -0.10 0.00 -0.55 0.00 0.00 56.30 55.76 3hcx h ASN 19 Cb 0.26 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.42 3hcx h ASN 19 CO -0.01 0.68 -0.06 0.00 -1.65 0.00 0.00 177.43 176.39 3hcx h ALA 20 N 1.42 0.84 -0.61 -0.83 0.00 -1.07 -2.26 119.26 116.75 3hcx h ALA 20 Ca 0.18 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 3hcx h ALA 20 Cb 0.20 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3hcx h ALA 20 CO -0.01 0.66 0.30 0.00 0.00 0.00 0.00 179.25 180.20 3hcx h ALA 21 N 1.01 0.79 -0.71 0.00 0.00 -0.52 -1.40 119.26 118.43 3hcx h ALA 21 Ca 0.15 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3hcx h ALA 21 Cb 0.61 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 3hcx h ALA 21 CO 0.04 0.34 0.39 -0.07 0.00 0.00 0.00 179.25 179.95 3hcx h LEU 22 N 0.84 0.89 -0.82 0.00 3.38 -0.92 0.31 115.31 118.98 3hcx h LEU 22 Ca 0.21 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.10 3hcx h LEU 22 Cb 0.10 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 3hcx h LEU 22 CO -0.03 0.73 0.54 0.50 0.09 0.00 0.00 178.44 180.27 3hcx h LYS 23 N 0.98 1.05 -0.47 1.13 3.64 -1.12 -1.35 116.57 120.44 3hcx h LYS 23 Ca 0.25 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.54 3hcx h LYS 23 Cb 0.04 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.60 3hcx h LYS 23 CO -0.04 0.70 0.17 0.00 -2.27 0.00 0.00 179.45 178.01 3hcx h ALA 24 N 1.32 0.61 -0.82 5.00 0.00 -0.46 -2.37 119.26 122.54 3hcx h ALA 24 Ca 0.31 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3hcx h ALA 24 Cb -0.08 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.49 3hcx h ALA 24 CO -0.08 0.23 0.53 -0.07 0.00 0.00 0.00 179.25 179.85 3hcx h LEU 25 N 0.61 0.88 -1.79 0.00 3.38 -0.64 -1.91 115.31 115.85 3hcx h LEU 25 Ca 0.15 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 3hcx h LEU 25 Cb 0.22 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 3hcx h LEU 25 CO -0.01 0.62 -0.15 1.23 0.09 0.00 0.00 178.44 180.22 3hcx h GLY 26 N 1.04 0.00 0.31 0.83 0.00 -0.95 -2.50 103.07 101.81 3hcx h GLY 26 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.65 3hcx h GLY 26 CO -0.10 0.00 -0.10 1.22 0.00 0.00 0.00 176.54 177.56 3hcx n ASP 27 N -3.76 0.88 -4.73 0.19 8.00 -0.73 -4.71 116.55 111.69 3hcx n ASP 27 Ca -0.02 -1.00 -0.42 0.00 0.71 0.00 0.00 54.79 54.06 3hcx n ASP 27 Cb 0.26 0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.35 3hcx n ASP 27 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3hcx n ILE 28 N -0.53 0.53 -1.51 0.53 5.41 -0.94 -4.92 119.36 117.93 3hcx n ILE 28 Ca 0.16 -0.13 -0.36 0.00 1.00 0.00 0.00 62.75 63.42 3hcx n ILE 28 Cb 0.30 -1.93 0.08 0.00 -0.71 0.00 0.00 39.64 37.38 3hcx n ILE 28 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 3hcx n PRO 29 N 2.99 0.76 -2.27 0.38 -0.02 -1.26 -3.06 135.00 132.52 3hcx n PRO 29 Ca 0.12 0.32 -0.18 0.00 -2.02 0.00 0.00 63.50 61.74 3hcx n PRO 29 Cb 0.35 -2.38 -0.02 0.00 -0.02 0.00 0.00 33.50 31.43 3hcx n PRO 29 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3hcx n GLU 30 N -2.00 -1.79 -3.79 -0.52 1.02 -1.26 -4.81 120.64 107.48 3hcx n GLU 30 Ca 0.14 0.91 -0.12 0.00 -0.02 0.00 0.00 57.16 58.07 3hcx n GLU 30 Cb 0.49 -5.50 -0.08 0.00 -0.02 0.00 0.00 31.44 26.33 3hcx n GLU 30 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3hcx s SER 31 N -2.12 -0.10 -0.03 1.62 0.01 -1.17 -1.77 113.70 110.14 3hcx s SER 31 Ca 0.00 -0.15 -0.17 0.00 1.31 0.00 0.00 55.95 56.94 3hcx s SER 31 Cb 0.00 0.32 0.03 0.00 0.21 0.00 0.00 66.02 66.58 3hcx s SER 31 CO 0.00 -0.53 0.37 -1.38 0.41 0.00 0.00 173.24 172.11 3hcx s HIS 32 N -2.10 -0.27 0.03 2.43 -3.43 -0.15 -4.77 115.29 107.03 3hcx s HIS 32 Ca -0.08 0.46 -0.30 0.00 -0.80 0.00 0.00 55.06 54.33 3hcx s HIS 32 Cb -0.03 0.15 -0.05 0.00 -1.43 0.00 0.00 32.58 31.22 3hcx s HIS 32 CO -0.01 -0.41 1.16 0.42 -2.00 0.00 0.00 174.74 173.90 3hcx s ILE 33 N -1.19 4.23 -0.18 -5.38 1.01 -1.26 -0.93 121.20 117.50 3hcx s ILE 33 Ca -0.12 1.60 -0.24 0.00 0.00 0.00 0.00 60.65 61.88 3hcx s ILE 33 Cb -0.04 -4.02 -0.22 0.00 0.01 0.00 0.00 42.46 38.18 3hcx s ILE 33 CO 0.05 0.10 0.43 -0.07 0.00 0.00 0.00 174.94 175.46 3hcx h LEU 34 N 7.04 0.01 -7.00 2.97 3.38 -0.93 -3.47 115.31 117.31 3hcx h LEU 34 Ca -0.40 -0.70 0.02 0.00 0.09 0.00 0.00 57.88 56.89 3hcx h LEU 34 Cb 1.21 -0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.82 3hcx h LEU 34 CO 0.81 1.31 0.31 0.28 0.09 0.00 0.00 178.44 181.24 3hcx s THR 35 N -2.31 0.00 -0.01 0.22 -1.32 -1.18 -5.01 115.64 106.03 3hcx s THR 35 Ca -0.25 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.28 3hcx s THR 35 Cb 0.02 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 70.00 3hcx s THR 35 CO 0.63 0.00 -0.14 -0.69 -2.21 0.00 0.00 174.62 172.21 3hcx s VAL 36 N -3.48 1.13 1.14 5.08 1.01 -1.26 -1.08 120.40 122.94 3hcx s VAL 36 Ca 0.02 -0.61 -0.18 0.00 0.00 0.00 0.00 61.98 61.21 3hcx s VAL 36 Cb -0.01 -0.94 0.26 0.00 0.00 0.00 0.00 36.38 35.69 3hcx s VAL 36 CO -0.11 0.32 1.17 -0.94 0.00 0.00 0.00 175.10 175.53 3hcx s SER 37 N -0.32 1.48 0.91 3.32 1.04 0.03 -5.00 113.70 115.15 3hcx s SER 37 Ca 0.05 0.53 -0.10 0.00 0.48 0.00 0.00 55.95 56.91 3hcx s SER 37 Cb -0.06 -0.72 0.14 0.00 0.10 0.00 0.00 66.02 65.49 3hcx s SER 37 CO -0.01 -3.77 1.13 -0.44 0.98 0.00 0.00 173.24 171.13 3hcx s SER 38 N -4.16 2.97 -0.07 7.02 0.01 -1.26 -4.80 113.70 113.41 3hcx s SER 38 Ca 0.72 2.08 -0.19 0.00 1.31 0.00 0.00 55.95 59.86 3hcx s SER 38 Cb -0.08 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.57 3hcx s SER 38 CO 0.55 -3.05 0.54 -0.36 0.41 0.00 0.00 173.24 171.33 3hcx s PHE 39 N -2.67 3.58 0.35 2.43 0.08 -1.26 -4.60 117.98 115.89 3hcx s PHE 39 Ca 0.66 1.04 0.08 0.00 0.12 0.00 0.00 56.93 58.84 3hcx s PHE 39 Cb -0.22 -2.59 -0.05 0.00 -0.57 0.00 0.00 43.02 39.59 3hcx s PHE 39 CO 0.58 0.24 0.07 0.71 -0.10 0.00 0.00 175.22 176.72 3hcx s TYR 40 N 0.31 2.60 -0.12 0.36 1.51 0.42 0.00 117.35 122.43 3hcx s TYR 40 Ca 0.29 -0.46 0.01 0.00 -1.01 0.00 0.00 57.07 55.90 3hcx s TYR 40 Cb -0.16 -1.61 0.02 0.00 -0.11 0.00 0.00 41.96 40.09 3hcx s TYR 40 CO 0.14 0.40 -0.13 0.50 -1.11 0.00 0.00 175.55 175.34 3hcx s ARG 41 N -3.78 2.07 0.02 -0.62 3.52 0.29 -1.14 118.95 119.32 3hcx s ARG 41 Ca 0.36 -0.49 0.07 0.00 -0.13 0.00 0.00 55.73 55.55 3hcx s ARG 41 Cb 0.00 -1.89 -0.02 0.00 -1.56 0.00 0.00 34.95 31.48 3hcx s ARG 41 CO 0.21 -0.18 -0.20 0.95 -0.81 0.00 0.00 175.30 175.27 3hcx s THR 42 N 1.34 1.61 0.51 4.11 -4.23 -0.40 -4.11 115.64 114.46 3hcx s THR 42 Ca 0.00 -1.07 -0.20 0.00 -1.18 0.00 0.00 61.69 59.24 3hcx s THR 42 Cb -0.14 -1.38 -0.07 0.00 1.34 0.00 0.00 72.50 72.25 3hcx s THR 42 CO -0.07 0.28 1.10 -2.84 -0.54 0.00 0.00 174.62 172.55 3hcx s PRO 43 N -0.92 3.59 0.68 3.99 0.02 -1.26 -0.71 135.00 140.39 3hcx s PRO 43 Ca 0.07 1.53 -0.17 0.00 0.02 0.00 0.00 61.00 62.46 3hcx s PRO 43 Cb -0.08 -2.10 0.01 0.00 0.02 0.00 0.00 34.50 32.34 3hcx s PRO 43 CO 0.01 -0.64 1.23 -1.25 -0.33 0.00 0.00 177.00 176.02 3hcx s PRO 44 N -3.17 2.44 0.11 5.54 0.04 -1.25 -4.81 135.00 133.90 3hcx s PRO 44 Ca 0.69 1.86 -0.30 0.00 0.04 0.00 0.00 61.00 63.29 3hcx s PRO 44 Cb -0.22 -1.86 -0.06 0.00 0.04 0.00 0.00 34.50 32.41 3hcx s PRO 44 CO 0.25 -1.63 1.00 -1.17 0.04 0.00 0.00 177.00 175.49 3hcx s LEU 45 N -4.70 4.48 0.00 -3.56 1.98 -1.26 -4.80 118.68 110.82 3hcx s LEU 45 Ca 0.77 1.85 0.00 0.00 -2.89 0.00 0.00 54.13 53.87 3hcx s LEU 45 Cb -0.32 -3.59 0.00 0.00 0.66 0.00 0.00 46.19 42.94 3hcx s LEU 45 CO 0.41 -0.13 0.00 0.61 -1.89 0.00 0.00 176.35 175.35 3hcx n GLY 46 N 2.30 2.46 0.14 7.98 0.00 -1.26 -4.83 105.19 111.98 3hcx n GLY 46 Ca 0.03 -1.83 0.01 0.00 0.00 0.00 0.00 46.02 44.22 3hcx n GLY 46 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hcx h PRO 47 N 0.00 0.00 0.00 1.61 0.11 -2.04 -3.25 132.00 128.42 3hcx h PRO 47 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3hcx h PRO 47 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3hcx h PRO 47 CO 0.00 0.58 0.12 1.04 -0.21 0.00 0.00 178.00 179.53 3hcx n GLN 48 N -3.59 0.11 -2.73 1.05 3.00 -1.26 -4.86 117.38 109.11 3hcx n GLN 48 Ca -0.00 0.59 -0.05 0.00 -0.01 0.00 0.00 57.00 57.53 3hcx n GLN 48 Cb 0.64 -1.98 0.01 0.00 0.00 0.00 0.00 30.24 28.91 3hcx n GLN 48 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 3hcx n ASP 49 N -2.11 -7.17 -3.25 1.08 -0.08 -1.23 -5.03 116.55 98.76 3hcx n ASP 49 Ca -0.01 0.33 -0.20 0.00 -1.51 0.00 0.00 54.79 53.41 3hcx n ASP 49 Cb 0.14 -4.83 0.15 0.00 2.34 0.00 0.00 41.12 38.92 3hcx n ASP 49 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3hcx n GLN 50 N -0.67 -1.38 -0.71 -0.67 1.13 -1.26 -5.01 117.38 108.81 3hcx n GLN 50 Ca 0.08 -1.30 -0.32 0.00 -1.94 0.00 0.00 57.00 53.52 3hcx n GLN 50 Cb 0.43 -0.97 0.15 0.00 0.11 0.00 0.00 30.24 29.96 3hcx n GLN 50 CO 0.00 0.00 0.00 -2.30 -1.44 0.00 0.00 177.06 173.32 3hcx n PRO 51 N -3.16 -0.44 -2.50 -1.09 -0.02 -1.26 -4.55 135.00 121.99 3hcx n PRO 51 Ca 0.11 -0.07 -0.40 0.00 -2.02 0.00 0.00 63.50 61.12 3hcx n PRO 51 Cb 0.39 -2.19 -0.04 0.00 -0.02 0.00 0.00 33.50 31.63 3hcx n PRO 51 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3hcx s ASP 52 N -2.42 7.18 0.04 2.55 1.11 -1.26 -3.96 116.67 119.92 3hcx s ASP 52 Ca 0.63 2.22 -0.18 0.00 0.18 0.00 0.00 52.55 55.40 3hcx s ASP 52 Cb -0.22 -2.62 -0.06 0.00 1.07 0.00 0.00 42.92 41.09 3hcx s ASP 52 CO 0.61 -0.20 0.53 -0.47 1.18 0.00 0.00 175.17 176.83 3hcx s TYR 53 N -1.26 3.77 -0.23 4.23 5.04 0.11 -4.66 117.35 124.35 3hcx s TYR 53 Ca 0.47 1.20 -0.09 0.00 -2.44 0.00 0.00 57.07 56.20 3hcx s TYR 53 Cb -0.30 -2.47 -0.04 0.00 0.35 0.00 0.00 41.96 39.50 3hcx s TYR 53 CO 0.38 0.57 0.13 -1.17 -1.34 0.00 0.00 175.55 174.11 3hcx s LEU 54 N -0.96 3.91 -0.04 6.97 0.20 0.56 -1.27 118.68 128.04 3hcx s LEU 54 Ca 0.28 0.03 0.05 0.00 0.69 0.00 0.00 54.13 55.18 3hcx s LEU 54 Cb -0.19 -2.04 -0.02 0.00 -0.43 0.00 0.00 46.19 43.51 3hcx s LEU 54 CO 0.17 0.05 -0.19 0.20 -0.29 0.00 0.00 176.35 176.30 3hcx s ASN 55 N 1.11 3.64 0.24 3.68 -0.87 -0.29 -1.63 114.94 120.82 3hcx s ASN 55 Ca 0.06 -0.31 -0.15 0.00 -1.57 0.00 0.00 52.86 50.89 3hcx s ASN 55 Cb -0.14 -0.72 0.00 0.00 -0.02 0.00 0.00 41.25 40.38 3hcx s ASN 55 CO 0.04 0.32 0.53 0.00 -2.57 0.00 0.00 177.10 175.42 3hcx s ALA 56 N -0.60 -0.53 0.04 0.60 0.00 -0.41 -0.43 121.76 120.42 3hcx s ALA 56 Ca 0.09 -0.67 0.06 0.00 0.00 0.00 0.00 51.96 51.44 3hcx s ALA 56 Cb -0.11 0.99 -0.02 0.00 0.00 0.00 0.00 23.12 23.98 3hcx s ALA 56 CO 0.00 -0.88 -0.17 0.00 0.00 0.00 0.00 175.76 174.71 3hcx s ALA 57 N -3.98 1.44 -0.05 0.00 0.00 -1.26 -1.24 121.76 116.68 3hcx s ALA 57 Ca 0.18 -0.91 0.03 0.00 0.00 0.00 0.00 51.96 51.25 3hcx s ALA 57 Cb -0.02 -0.27 0.01 0.00 0.00 0.00 0.00 23.12 22.84 3hcx s ALA 57 CO 0.07 0.31 -0.12 0.08 0.00 0.00 0.00 175.76 176.10 3hcx s VAL 58 N -0.78 1.07 -0.24 0.00 1.01 -0.03 -0.79 120.40 120.63 3hcx s VAL 58 Ca 0.05 -0.47 -0.16 0.00 0.00 0.00 0.00 61.98 61.40 3hcx s VAL 58 Cb -0.08 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.30 3hcx s VAL 58 CO 0.01 0.33 0.41 0.00 0.00 0.00 0.00 175.10 175.85 3hcx s ALA 59 N 0.47 3.57 -0.19 5.51 0.00 -0.25 -0.76 121.76 130.11 3hcx s ALA 59 Ca -0.10 -0.67 0.01 0.00 0.00 0.00 0.00 51.96 51.20 3hcx s ALA 59 Cb -0.13 -2.71 0.03 0.00 0.00 0.00 0.00 23.12 20.31 3hcx s ALA 59 CO 0.02 -0.53 -0.16 -1.17 0.00 0.00 0.00 175.76 173.92 3hcx s LEU 60 N 1.82 2.23 0.01 0.00 2.96 0.12 -0.18 118.68 125.64 3hcx s LEU 60 Ca 0.18 -0.75 -0.30 0.00 -0.22 0.00 0.00 54.13 53.03 3hcx s LEU 60 Cb -0.15 -1.38 -0.03 0.00 0.50 0.00 0.00 46.19 45.13 3hcx s LEU 60 CO 0.09 -0.06 0.97 -0.70 -1.32 0.00 0.00 176.35 175.32 3hcx s GLU 61 N 1.33 4.58 -0.07 1.98 2.56 -0.11 -0.38 118.70 128.58 3hcx s GLU 61 Ca 0.02 1.41 -0.13 0.00 0.00 0.00 0.00 54.97 56.26 3hcx s GLU 61 Cb -0.14 -3.45 0.03 0.00 2.00 0.00 0.00 34.13 32.57 3hcx s GLU 61 CO -0.11 -0.01 0.32 -0.08 -0.56 0.00 0.00 175.26 174.83 3hcx s THR 62 N 0.85 0.03 -1.98 -1.70 -1.32 0.31 -0.98 115.64 110.85 3hcx s THR 62 Ca 0.51 -0.24 0.19 0.00 -1.21 0.00 0.00 61.69 60.94 3hcx s THR 62 Cb -0.21 -0.55 0.36 0.00 -1.51 0.00 0.00 72.50 70.59 3hcx s THR 62 CO 0.28 -0.13 1.29 -1.54 -2.21 0.00 0.00 174.62 172.31 3hcx n SER 63 N 2.08 3.16 -4.76 8.08 3.41 -0.73 -1.28 113.62 123.58 3hcx n SER 63 Ca -0.17 -1.91 -0.34 0.00 -0.26 0.00 0.00 58.87 56.19 3hcx n SER 63 Cb 0.57 -0.22 0.04 0.00 -0.26 0.00 0.00 64.21 64.34 3hcx n SER 63 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3hcx s LEU 64 N -1.28 3.46 0.66 1.04 1.43 -1.26 -5.03 118.68 117.70 3hcx s LEU 64 Ca 0.32 2.10 -0.14 0.00 -1.03 0.00 0.00 54.13 55.39 3hcx s LEU 64 Cb 0.19 -4.56 -0.00 0.00 0.03 0.00 0.00 46.19 41.84 3hcx s LEU 64 CO 0.26 -1.65 1.07 0.00 0.23 0.00 0.00 176.35 176.27 3hcx s ALA 65 N -2.14 2.60 0.20 4.21 0.00 -1.26 -4.84 121.76 120.53 3hcx s ALA 65 Ca 0.70 0.33 -0.10 0.00 0.00 0.00 0.00 51.96 52.89 3hcx s ALA 65 Cb -0.23 -3.24 0.23 0.00 0.00 0.00 0.00 23.12 19.88 3hcx s ALA 65 CO 0.39 -1.15 1.78 -1.35 0.00 0.00 0.00 175.76 175.44 3hcx h PRO 66 N -0.16 0.55 0.00 0.00 0.11 -2.00 -1.08 132.00 129.43 3hcx h PRO 66 Ca -0.46 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.56 3hcx h PRO 66 Cb 1.22 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 3hcx h PRO 66 CO 0.56 0.36 -0.31 0.93 -0.21 0.00 0.00 178.00 179.33 3hcx h GLU 67 N 0.56 0.00 -0.46 1.05 5.08 -1.99 -1.12 114.58 117.71 3hcx h GLU 67 Ca 0.29 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.52 3hcx h GLU 67 Cb 0.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 3hcx h GLU 67 CO -0.21 0.31 -0.18 0.93 -1.00 0.00 0.00 179.01 178.85 3hcx h GLU 68 N 0.00 0.94 -0.66 2.33 5.08 -1.67 -1.38 114.58 119.21 3hcx h GLU 68 Ca -0.00 -0.39 -0.02 0.00 -1.00 0.00 0.00 59.36 57.95 3hcx h GLU 68 Cb 0.65 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 3hcx h GLU 68 CO 0.04 1.05 0.35 1.25 -1.00 0.00 0.00 179.01 180.70 3hcx h LEU 69 N 0.78 0.84 -0.40 1.33 5.85 -0.68 -2.36 115.31 120.67 3hcx h LEU 69 Ca 0.11 -0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.79 3hcx h LEU 69 Cb 0.75 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.51 3hcx h LEU 69 CO 0.06 0.71 0.04 0.25 -0.34 0.00 0.00 178.44 179.17 3hcx h LEU 70 N 0.91 -0.08 -0.74 2.25 5.85 -1.06 -0.78 115.31 121.67 3hcx h LEU 70 Ca 0.23 0.08 0.15 0.00 0.84 0.00 0.00 57.88 59.18 3hcx h LEU 70 Cb 0.07 0.13 -0.10 0.00 0.37 0.00 0.00 40.66 41.13 3hcx h LEU 70 CO -0.03 -0.00 0.25 0.78 -0.34 0.00 0.00 178.44 179.09 3hcx h ASN 71 N 0.16 0.17 -0.31 1.25 2.35 -0.74 0.57 115.58 119.04 3hcx h ASN 71 Ca 0.20 0.12 -0.13 0.00 -0.55 0.00 0.00 56.30 55.94 3hcx h ASN 71 Cb 0.26 0.13 -0.00 0.00 0.05 0.00 0.00 38.32 38.76 3hcx h ASN 71 CO -0.29 0.05 -0.32 0.45 -1.65 0.00 0.00 177.43 175.66 3hcx h HIS 72 N 0.37 0.92 -0.79 1.19 3.86 -0.94 -0.79 115.15 118.97 3hcx h HIS 72 Ca 0.41 -0.28 -0.02 0.00 -1.16 0.00 0.00 60.37 59.32 3hcx h HIS 72 Cb 0.65 -0.19 -0.04 0.00 1.06 0.00 0.00 27.41 28.89 3hcx h HIS 72 CO -0.20 1.05 0.41 1.79 0.86 0.00 0.00 177.93 181.84 3hcx h THR 73 N 0.53 1.24 -0.48 2.45 1.35 -0.40 0.61 112.91 118.21 3hcx h THR 73 Ca 0.05 -0.62 -0.07 0.00 -0.55 0.00 0.00 66.41 65.22 3hcx h THR 73 Cb 0.90 0.19 -0.02 0.00 -1.73 0.00 0.00 68.15 67.49 3hcx h THR 73 CO 0.08 0.27 0.03 1.56 -0.25 0.00 0.00 175.52 177.21 3hcx h GLN 74 N 1.11 0.82 -0.47 4.72 4.20 -0.78 -1.02 115.11 123.69 3hcx h GLN 74 Ca 0.28 -0.25 0.01 0.00 0.06 0.00 0.00 58.65 58.75 3hcx h GLN 74 Cb 0.06 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 3hcx h GLN 74 CO -0.04 0.85 0.30 -0.09 -0.67 0.00 0.00 178.83 179.18 3hcx h ARG 75 N 0.68 0.59 -0.66 1.46 2.43 -0.79 -1.47 114.38 116.63 3hcx h ARG 75 Ca 0.14 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.21 3hcx h ARG 75 Cb 0.46 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.85 3hcx h ARG 75 CO 0.02 0.39 0.18 0.82 -1.51 0.00 0.00 179.97 179.88 3hcx h ILE 76 N 0.61 1.26 -1.00 1.20 2.04 -0.67 0.18 117.51 121.13 3hcx h ILE 76 Ca 0.18 -0.91 0.06 0.00 1.00 0.00 0.00 64.86 65.19 3hcx h ILE 76 Cb -0.04 0.58 -0.06 0.00 -0.74 0.00 0.00 36.82 36.56 3hcx h ILE 76 CO -0.06 0.35 0.65 -0.33 0.00 0.00 0.00 178.15 178.76 3hcx h GLU 77 N 0.98 1.16 -0.27 2.37 5.08 -0.93 0.14 114.58 123.11 3hcx h GLU 77 Ca 0.21 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.41 3hcx h GLU 77 Cb 0.33 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 3hcx h GLU 77 CO -0.00 0.77 -0.19 -0.07 -1.00 0.00 0.00 179.01 178.51 3hcx h LEU 78 N 1.20 0.64 -0.14 1.33 3.38 -0.58 -1.64 115.31 119.50 3hcx h LEU 78 Ca 0.42 -0.44 -0.23 0.00 0.09 0.00 0.00 57.88 57.72 3hcx h LEU 78 Cb 0.11 -0.18 0.01 0.00 0.09 0.00 0.00 40.66 40.70 3hcx h LEU 78 CO -0.16 0.95 -0.90 1.56 0.09 0.00 0.00 178.44 179.97 3hcx h GLN 79 N 0.35 0.62 0.00 1.13 4.20 -0.71 -3.35 115.11 117.35 3hcx h GLN 79 Ca 0.05 -0.59 0.00 0.00 0.06 0.00 0.00 58.65 58.17 3hcx h GLN 79 Cb 0.73 0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.66 3hcx h GLN 79 CO 0.05 1.21 -1.09 1.04 -0.67 0.00 0.00 178.83 179.37 3hcx n GLN 80 N -3.85 0.14 -3.57 1.46 1.13 0.47 -5.01 117.38 108.16 3hcx n GLN 80 Ca -0.08 -0.03 -0.14 0.00 -1.94 0.00 0.00 57.00 54.81 3hcx n GLN 80 Cb 0.81 -1.52 -0.05 0.00 0.11 0.00 0.00 30.24 29.59 3hcx n GLN 80 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hcx n GLY 81 N 1.44 3.25 3.54 1.08 0.00 -0.62 -4.83 105.19 109.04 3hcx n GLY 81 Ca 0.03 -1.83 -0.11 0.00 0.00 0.00 0.00 46.02 44.11 3hcx n GLY 81 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3hcx s ARG 82 N -2.95 1.71 0.37 1.61 1.70 -1.26 -4.62 118.95 115.51 3hcx s ARG 82 Ca 0.28 -1.49 -0.13 0.00 -0.47 0.00 0.00 55.73 53.93 3hcx s ARG 82 Cb 0.01 0.46 -0.08 0.00 -0.57 0.00 0.00 34.95 34.77 3hcx s ARG 82 CO 0.20 -0.71 0.76 0.14 -1.08 0.00 0.00 175.30 174.61 3hcx s VAL 83 N -3.54 4.73 0.04 4.99 -7.23 -1.26 -0.74 120.40 117.39 3hcx s VAL 83 Ca 0.26 0.79 -0.30 0.00 -1.81 0.00 0.00 61.98 60.91 3hcx s VAL 83 Cb -0.00 -3.68 -0.05 0.00 0.56 0.00 0.00 36.38 33.21 3hcx s VAL 83 CO 0.14 -0.38 1.21 -0.13 -0.31 0.00 0.00 175.10 175.62 3hcx s ARG 84 N -3.49 4.41 0.33 4.82 1.81 -1.26 -4.89 118.95 120.68 3hcx s ARG 84 Ca 0.53 1.76 0.13 0.00 -1.72 0.00 0.00 55.73 56.43 3hcx s ARG 84 Cb -0.10 -3.40 0.56 0.00 -0.45 0.00 0.00 34.95 31.56 3hcx s ARG 84 CO 0.25 -0.31 1.71 -0.22 -0.68 0.00 0.00 175.30 176.06 3hcx h LYS 85 N 6.98 0.00 -0.01 3.54 3.64 -1.97 -1.52 116.57 127.23 3hcx h LYS 85 Ca -0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 3hcx h LYS 85 Cb 1.20 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 3hcx h LYS 85 CO 0.83 0.48 -0.11 0.00 -2.27 0.00 0.00 179.45 178.38 3hcx n ALA 86 N -2.41 2.78 -2.95 5.00 0.00 -1.26 -4.37 120.51 117.30 3hcx n ALA 86 Ca -0.01 -0.42 -0.14 0.00 0.00 0.00 0.00 53.44 52.86 3hcx n ALA 86 Cb 0.52 -1.16 0.02 0.00 0.00 0.00 0.00 19.45 18.83 3hcx n ALA 86 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3hcx n GLU 87 N -0.19 0.89 -0.08 0.00 1.02 -0.72 -4.98 120.64 116.58 3hcx n GLU 87 Ca 0.16 -2.55 0.25 0.00 -0.02 0.00 0.00 57.16 55.00 3hcx n GLU 87 Cb 0.35 -1.35 0.71 0.00 -0.02 0.00 0.00 31.44 31.13 3hcx n GLU 87 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hcx h ARG 88 N 3.42 0.00 0.00 3.49 3.08 -1.51 0.86 114.38 123.72 3hcx h ARG 88 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3hcx h ARG 88 Cb 1.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.05 3hcx h ARG 88 CO 0.34 0.00 -0.21 0.11 -1.07 0.00 0.00 179.97 179.14 3hcx h TRP 89 N 0.00 0.00 -3.64 3.04 0.09 -1.94 -3.45 115.95 110.05 3hcx h TRP 89 Ca 0.34 0.00 -0.44 0.00 0.09 0.00 0.00 58.89 58.88 3hcx h TRP 89 Cb 1.39 0.00 0.18 0.00 0.08 0.00 0.00 29.16 30.81 3hcx h TRP 89 CO 0.00 0.00 0.13 0.20 0.09 0.00 0.00 178.44 178.86 3hcx s GLY 90 N -4.06 1.55 0.53 11.11 0.00 0.30 -4.96 107.32 111.80 3hcx s GLY 90 Ca 0.06 -0.49 -0.22 0.00 0.00 0.00 0.00 44.72 44.07 3hcx s GLY 90 CO 0.68 0.22 1.35 -1.05 0.00 0.00 0.00 173.10 174.30 3hcx n PRO 91 N -4.51 1.73 -1.23 2.90 -0.02 -1.26 -4.74 135.00 127.86 3hcx n PRO 91 Ca 0.07 0.63 -0.29 0.00 -2.02 0.00 0.00 63.50 61.89 3hcx n PRO 91 Cb 0.58 -2.56 0.19 0.00 -0.02 0.00 0.00 33.50 31.68 3hcx n PRO 91 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3hcx s ARG 92 N -2.82 0.10 0.41 -0.52 0.52 -1.26 -4.31 118.95 111.07 3hcx s ARG 92 Ca 0.70 0.29 0.25 0.00 -0.52 0.00 0.00 55.73 56.45 3hcx s ARG 92 Cb -0.42 -1.72 0.61 0.00 0.52 0.00 0.00 34.95 33.93 3hcx s ARG 92 CO 0.50 -2.90 1.70 1.79 0.02 0.00 0.00 175.30 176.41 3hcx h THR 93 N -2.01 0.00 -3.28 0.02 1.35 -1.28 -3.41 112.91 104.31 3hcx h THR 93 Ca -0.52 -0.80 -0.56 0.00 -0.55 0.00 0.00 66.41 63.98 3hcx h THR 93 Cb 1.32 1.79 -0.35 0.00 -1.73 0.00 0.00 68.15 69.19 3hcx h THR 93 CO 0.52 0.00 -0.83 -0.22 -0.25 0.00 0.00 175.52 174.75 3hcx s LEU 94 N -5.85 1.62 -0.15 3.87 2.96 -1.26 -3.66 118.68 116.21 3hcx s LEU 94 Ca 0.07 -0.38 -0.01 0.00 -0.22 0.00 0.00 54.13 53.58 3hcx s LEU 94 Cb 0.07 -1.00 -0.01 0.00 0.50 0.00 0.00 46.19 45.75 3hcx s LEU 94 CO 0.63 -0.00 -0.11 -1.81 -1.32 0.00 0.00 176.35 173.73 3hcx s ASP 95 N 1.05 4.10 -0.06 3.68 1.01 0.83 -4.83 116.67 122.46 3hcx s ASP 95 Ca -0.06 -0.33 0.05 0.00 0.71 0.00 0.00 52.55 52.92 3hcx s ASP 95 Cb -0.15 -1.64 -0.00 0.00 1.01 0.00 0.00 42.92 42.14 3hcx s ASP 95 CO -0.02 0.13 -0.21 -0.76 0.21 0.00 0.00 175.17 174.52 3hcx s LEU 96 N 0.58 1.97 -0.03 1.23 1.43 -1.26 -1.21 118.68 121.38 3hcx s LEU 96 Ca -0.07 -0.44 0.02 0.00 -1.03 0.00 0.00 54.13 52.61 3hcx s LEU 96 Cb -0.15 -1.18 0.01 0.00 0.03 0.00 0.00 46.19 44.90 3hcx s LEU 96 CO 0.03 0.17 -0.07 -1.81 0.23 0.00 0.00 176.35 174.90 3hcx s ASP 97 N 0.12 1.01 -0.52 2.29 1.01 -0.49 -4.97 116.67 115.12 3hcx s ASP 97 Ca -0.08 -0.15 -0.29 0.00 0.71 0.00 0.00 52.55 52.74 3hcx s ASP 97 Cb -0.14 -0.35 0.02 0.00 1.01 0.00 0.00 42.92 43.47 3hcx s ASP 97 CO 0.04 0.02 1.23 -0.63 0.21 0.00 0.00 175.17 176.04 3hcx s ILE 98 N 0.44 4.04 -0.01 0.77 1.01 -1.26 -0.55 121.20 125.64 3hcx s ILE 98 Ca -0.06 0.99 -0.20 0.00 0.00 0.00 0.00 60.65 61.38 3hcx s ILE 98 Cb -0.10 -4.57 -0.26 0.00 0.01 0.00 0.00 42.46 37.53 3hcx s ILE 98 CO 0.00 -1.12 1.04 0.24 0.00 0.00 0.00 174.94 175.10 3hcx h MET 99 N 9.80 0.39 -3.40 2.79 2.86 -0.91 -3.36 114.93 123.11 3hcx h MET 99 Ca -0.25 -0.49 -0.15 0.00 -2.06 0.00 0.00 59.70 56.75 3hcx h MET 99 Cb 1.07 0.16 -0.22 0.00 0.06 0.00 0.00 31.60 32.67 3hcx h MET 99 CO 1.15 1.17 -0.46 -0.51 1.06 0.00 0.00 176.91 179.32 3hcx s LEU 100 N -8.16 1.40 -0.35 1.22 1.43 -1.10 -1.38 118.68 111.74 3hcx s LEU 100 Ca -0.13 -0.05 -0.00 0.00 -1.03 0.00 0.00 54.13 52.92 3hcx s LEU 100 Cb 0.03 0.75 0.12 0.00 0.03 0.00 0.00 46.19 47.12 3hcx s LEU 100 CO 0.83 -0.32 0.17 0.12 0.23 0.00 0.00 176.35 177.38 3hcx s PHE 101 N -1.08 1.22 0.00 0.29 5.36 -1.26 -1.44 117.98 121.07 3hcx s PHE 101 Ca -0.12 -1.71 0.00 0.00 -0.96 0.00 0.00 56.93 54.14 3hcx s PHE 101 Cb -0.06 -1.37 0.00 0.00 -0.34 0.00 0.00 43.02 41.25 3hcx s PHE 101 CO 0.02 -0.83 0.00 0.41 -1.46 0.00 0.00 175.22 173.36 3hcx n GLY 102 N 4.37 2.46 1.82 13.12 0.00 -0.33 -1.08 105.19 125.54 3hcx n GLY 102 Ca 0.04 -0.22 0.08 0.00 0.00 0.00 0.00 46.02 45.91 3hcx n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hcx n ASN 103 N 0.75 5.50 -4.80 1.61 3.02 -1.26 -4.91 115.26 115.17 3hcx n ASN 103 Ca 0.00 -2.80 -0.34 0.00 -0.03 0.00 0.00 54.58 51.40 3hcx n ASN 103 Cb 0.00 -0.66 -0.04 0.00 -0.61 0.00 0.00 39.78 38.47 3hcx n ASN 103 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3hcx s GLU 104 N -2.52 3.93 -0.14 3.52 0.41 -0.24 -4.71 118.70 118.95 3hcx s GLU 104 Ca 0.54 1.35 0.01 0.00 -0.41 0.00 0.00 54.97 56.46 3hcx s GLU 104 Cb 0.40 -2.19 -0.00 0.00 -1.78 0.00 0.00 34.13 30.56 3hcx s GLU 104 CO 0.18 -0.32 -0.18 0.08 -0.49 0.00 0.00 175.26 174.54 3hcx s VAL 105 N -1.95 2.51 -0.08 2.63 1.01 -1.26 -4.42 120.40 118.84 3hcx s VAL 105 Ca 0.65 -0.84 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 3hcx s VAL 105 Cb -0.16 -2.03 0.03 0.00 0.00 0.00 0.00 36.38 34.21 3hcx s VAL 105 CO 0.20 0.53 -0.02 -0.63 0.00 0.00 0.00 175.10 175.18 3hcx s ILE 106 N 0.65 0.55 -0.53 2.22 1.01 0.18 -4.98 121.20 120.30 3hcx s ILE 106 Ca -0.09 -0.00 0.07 0.00 0.00 0.00 0.00 60.65 60.63 3hcx s ILE 106 Cb -0.16 -0.65 0.29 0.00 0.01 0.00 0.00 42.46 41.94 3hcx s ILE 106 CO 0.02 0.28 0.74 0.59 0.00 0.00 0.00 174.94 176.57 3hcx n ASN 107 N 4.95 2.70 -4.87 3.58 4.13 -1.25 -0.89 115.26 123.61 3hcx n ASN 107 Ca -0.11 -3.27 -0.21 0.00 1.68 0.00 0.00 54.58 52.67 3hcx n ASN 107 Cb 0.50 -0.63 0.08 0.00 -1.54 0.00 0.00 39.78 38.19 3hcx n ASN 107 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 3hcx s THR 108 N -2.65 2.17 0.31 3.41 -4.23 -0.00 -4.99 115.64 109.66 3hcx s THR 108 Ca 0.41 -0.82 0.03 0.00 -1.18 0.00 0.00 61.69 60.13 3hcx s THR 108 Cb 0.21 -2.35 0.13 0.00 1.34 0.00 0.00 72.50 71.83 3hcx s THR 108 CO -0.07 0.00 1.82 -0.08 -0.54 0.00 0.00 174.62 175.75 3hcx h GLU 109 N -0.12 0.53 0.00 3.99 4.81 -2.05 -3.18 114.58 118.56 3hcx h GLU 109 Ca -0.33 -0.14 -0.24 0.00 -0.13 0.00 0.00 59.36 58.52 3hcx h GLU 109 Cb 1.28 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.55 3hcx h GLU 109 CO 0.41 0.62 -1.61 0.54 -0.73 0.00 0.00 179.01 178.24 3hcx n ARG 110 N -4.23 0.63 -3.98 1.92 1.74 -1.26 -4.96 116.66 106.53 3hcx n ARG 110 Ca 0.01 0.25 -0.21 0.00 -0.77 0.00 0.00 57.85 57.14 3hcx n ARG 110 Cb 0.30 -1.79 -0.17 0.00 -1.02 0.00 0.00 32.46 29.78 3hcx n ARG 110 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3hcx s LEU 111 N -5.92 1.03 -0.15 0.55 2.96 -1.20 -5.11 118.68 110.83 3hcx s LEU 111 Ca -0.04 -0.09 0.00 0.00 -0.22 0.00 0.00 54.13 53.78 3hcx s LEU 111 Cb 0.08 -0.41 0.02 0.00 0.50 0.00 0.00 46.19 46.39 3hcx s LEU 111 CO 0.82 -0.11 -0.15 -0.89 -1.32 0.00 0.00 176.35 174.70 3hcx s THR 112 N 1.32 1.64 -0.02 3.68 2.01 -1.25 -0.82 115.64 122.19 3hcx s THR 112 Ca -0.05 -0.69 0.00 0.00 0.31 0.00 0.00 61.69 61.27 3hcx s THR 112 Cb -0.13 -1.53 0.02 0.00 0.01 0.00 0.00 72.50 70.86 3hcx s THR 112 CO -0.02 0.46 -0.00 -0.69 -0.69 0.00 0.00 174.62 173.67 3hcx s VAL 113 N 1.46 0.15 0.77 3.82 1.01 -0.07 -3.72 120.40 123.82 3hcx s VAL 113 Ca 0.05 0.04 -0.15 0.00 0.00 0.00 0.00 61.98 61.92 3hcx s VAL 113 Cb -0.13 -0.22 0.03 0.00 0.00 0.00 0.00 36.38 36.06 3hcx s VAL 113 CO -0.11 0.11 0.97 -2.65 0.00 0.00 0.00 175.10 173.42 3hcx n PRO 114 N 3.79 0.33 -1.57 2.72 -0.02 -1.26 -0.65 135.00 138.34 3hcx n PRO 114 Ca -0.23 0.17 -0.48 0.00 -2.02 0.00 0.00 63.50 60.94 3hcx n PRO 114 Cb 0.53 -2.23 -0.04 0.00 -0.02 0.00 0.00 33.50 31.74 3hcx n PRO 114 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 3hcx n HIS 115 N -2.84 1.17 0.29 6.00 -0.00 -0.48 -4.79 115.22 114.58 3hcx n HIS 115 Ca 0.12 0.71 0.17 0.00 -0.00 0.00 0.00 57.72 58.73 3hcx n HIS 115 Cb 0.50 -2.25 0.85 0.00 -0.00 0.00 0.00 29.99 29.09 3hcx n HIS 115 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 176.34 176.44 3hcx h TYR 116 N 3.02 0.00 0.00 1.57 -0.00 -1.94 -2.99 116.97 116.64 3hcx h TYR 116 Ca -0.42 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.31 3hcx h TYR 116 Cb 1.35 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.08 3hcx h TYR 116 CO 0.52 0.05 0.00 -3.47 -0.00 0.00 0.00 178.16 175.26 3hcx n ASP 117 N -3.27 1.41 0.20 0.10 2.03 -1.26 -4.82 116.55 110.95 3hcx n ASP 117 Ca -0.01 -1.53 0.05 0.00 0.52 0.00 0.00 54.79 53.82 3hcx n ASP 117 Cb 0.22 0.00 0.49 0.00 -0.72 0.00 0.00 41.12 41.11 3hcx n ASP 117 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3hcx h MET 118 N 0.00 0.06 0.00 -0.67 -0.00 -1.90 -0.98 114.93 111.44 3hcx h MET 118 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 59.69 3hcx h MET 118 Cb 0.36 -0.01 0.00 0.00 -0.00 0.00 0.00 31.60 31.95 3hcx h MET 118 CO 0.00 0.20 0.00 1.63 -0.00 0.00 0.00 176.91 178.74 3hcx n LYS 119 N -4.34 0.13 -0.07 -0.10 5.02 -1.26 -1.43 118.16 116.10 3hcx n LYS 119 Ca -0.02 0.40 0.10 0.00 -2.02 0.00 0.00 58.31 56.78 3hcx n LYS 119 Cb 0.23 -1.77 0.13 0.00 -0.02 0.00 0.00 35.03 33.59 3hcx n LYS 119 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3hcx n ASN 120 N -2.03 2.95 -4.08 4.39 3.02 -0.38 -4.90 115.26 114.24 3hcx n ASN 120 Ca 0.02 -1.89 -0.34 0.00 -0.03 0.00 0.00 54.58 52.34 3hcx n ASN 120 Cb 0.19 -0.10 -0.13 0.00 -0.61 0.00 0.00 39.78 39.13 3hcx n ASN 120 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3hcx s ARG 121 N -1.56 1.84 0.40 3.52 0.52 -0.52 -4.96 118.95 118.19 3hcx s ARG 121 Ca 0.28 -1.77 0.12 0.00 -0.52 0.00 0.00 55.73 53.85 3hcx s ARG 121 Cb 0.18 -3.35 0.94 0.00 0.52 0.00 0.00 34.95 33.24 3hcx s ARG 121 CO 0.27 -0.95 1.94 0.78 0.02 0.00 0.00 175.30 177.35 3hcx h GLY 122 N 7.85 0.81 2.00 -3.53 0.00 -1.90 -1.21 103.07 107.08 3hcx h GLY 122 Ca -0.10 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.00 3hcx h GLY 122 CO 0.59 0.11 0.00 0.27 0.00 0.00 0.00 176.54 177.52 3hcx h PHE 123 N 0.53 0.00 0.10 5.60 -5.15 -1.93 -1.23 116.94 114.87 3hcx h PHE 123 Ca 0.35 0.00 -0.37 0.00 -0.20 0.00 0.00 57.97 57.75 3hcx h PHE 123 Cb 0.62 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 36.76 3hcx h PHE 123 CO -0.00 0.00 -2.07 -1.33 -2.00 0.00 0.00 178.31 172.91 3hcx n MET 124 N -2.65 0.74 -0.02 6.09 2.81 -0.56 -4.52 117.12 119.01 3hcx n MET 124 Ca 0.01 0.24 -0.14 0.00 -1.81 0.00 0.00 57.70 56.00 3hcx n MET 124 Cb 0.26 -1.68 -0.03 0.00 -0.71 0.00 0.00 33.22 31.07 3hcx n MET 124 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 3hcx h LEU 125 N 0.06 0.84 -0.13 4.03 3.38 -0.96 -3.03 115.31 119.50 3hcx h LEU 125 Ca -0.45 -0.51 -0.03 0.00 0.09 0.00 0.00 57.88 56.99 3hcx h LEU 125 Cb 2.01 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 42.52 3hcx h LEU 125 CO 0.06 1.29 -0.04 -0.50 0.09 0.00 0.00 178.44 179.33 3hcx h TRP 126 N 0.52 0.29 -0.70 1.13 4.06 -1.49 0.11 115.95 119.88 3hcx h TRP 126 Ca -0.02 -0.07 -0.02 0.00 2.06 0.00 0.00 58.89 60.84 3hcx h TRP 126 Cb 1.28 -0.07 -0.03 0.00 -1.00 0.00 0.00 29.16 29.34 3hcx h TRP 126 CO 0.07 0.57 0.37 -1.35 -3.56 0.00 0.00 178.44 174.54 3hcx h PRO 127 N -0.07 0.97 -0.55 0.49 0.11 -1.79 -1.67 132.00 129.48 3hcx h PRO 127 Ca 0.03 -0.11 -0.02 0.00 0.11 0.00 0.00 66.00 66.01 3hcx h PRO 127 Cb 0.48 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 31.37 3hcx h PRO 127 CO 0.02 0.72 0.29 1.25 -0.21 0.00 0.00 178.00 180.07 3hcx h LEU 128 N 0.98 0.71 -1.49 2.35 5.85 -1.37 -2.59 115.31 119.75 3hcx h LEU 128 Ca 0.25 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 3hcx h LEU 128 Cb 0.05 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 3hcx h LEU 128 CO -0.04 0.62 -0.13 0.15 -0.34 0.00 0.00 178.44 178.70 3hcx h PHE 129 N 0.75 0.17 -0.76 1.25 3.57 -0.26 0.14 116.94 121.80 3hcx h PHE 129 Ca 0.19 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.63 3hcx h PHE 129 Cb 0.08 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.74 3hcx h PHE 129 CO -0.01 0.30 0.29 1.49 -2.23 0.00 0.00 178.31 178.16 3hcx h GLU 130 N 0.16 1.15 0.00 1.11 4.81 -0.93 -2.58 114.58 118.31 3hcx h GLU 130 Ca 0.03 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 59.05 3hcx h GLU 130 Cb 0.34 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.54 3hcx h GLU 130 CO 0.02 0.94 -0.88 0.44 -0.73 0.00 0.00 179.01 178.80 3hcx n ILE 131 N -4.30 0.06 -2.95 2.32 -5.35 -0.94 -4.63 119.36 103.57 3hcx n ILE 131 Ca 0.06 -0.10 -0.14 0.00 -0.27 0.00 0.00 62.75 62.30 3hcx n ILE 131 Cb 0.19 0.47 0.02 0.00 -1.74 0.00 0.00 39.64 38.57 3hcx n ILE 131 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3hcx n ALA 132 N -1.64 0.47 0.27 -1.28 0.00 0.46 -4.99 120.51 113.81 3hcx n ALA 132 Ca 0.04 -2.36 0.13 0.00 0.00 0.00 0.00 53.44 51.24 3hcx n ALA 132 Cb 0.38 -1.07 0.76 0.00 0.00 0.00 0.00 19.45 19.52 3hcx n ALA 132 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3hcx h PRO 133 N 3.42 0.00 -0.66 0.00 0.13 -1.66 -2.09 132.00 131.14 3hcx h PRO 133 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 3hcx h PRO 133 Cb 1.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.14 3hcx h PRO 133 CO 0.34 0.10 0.00 0.39 -0.23 0.00 0.00 178.00 178.60 3hcx n GLU 134 N -3.66 3.52 -1.84 0.86 -0.58 -1.26 -4.40 120.64 113.28 3hcx n GLU 134 Ca -0.02 -2.70 -0.41 0.00 -0.42 0.00 0.00 57.16 53.62 3hcx n GLU 134 Cb 0.21 -1.84 0.00 0.00 -0.57 0.00 0.00 31.44 29.24 3hcx n GLU 134 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 3hcx s LEU 135 N -1.70 4.28 -0.06 -4.62 0.20 -0.79 -4.90 118.68 111.10 3hcx s LEU 135 Ca 0.48 2.98 0.04 0.00 0.69 0.00 0.00 54.13 58.33 3hcx s LEU 135 Cb 0.31 -3.73 -0.00 0.00 -0.43 0.00 0.00 46.19 42.34 3hcx s LEU 135 CO 0.24 -0.90 -0.18 -0.69 -0.29 0.00 0.00 176.35 174.53 3hcx s VAL 136 N -1.14 1.49 0.74 1.68 1.01 -1.26 -1.36 120.40 121.55 3hcx s VAL 136 Ca 0.54 -0.73 -0.11 0.00 0.00 0.00 0.00 61.98 61.68 3hcx s VAL 136 Cb -0.45 -1.29 0.04 0.00 0.00 0.00 0.00 36.38 34.67 3hcx s VAL 136 CO 0.61 0.43 1.09 -0.36 0.00 0.00 0.00 175.10 176.86 3hcx s PHE 137 N 0.19 3.10 0.45 5.22 0.40 0.49 -4.90 117.98 122.92 3hcx s PHE 137 Ca -0.08 1.15 0.17 0.00 -0.60 0.00 0.00 56.93 57.57 3hcx s PHE 137 Cb -0.13 -3.05 1.13 0.00 0.51 0.00 0.00 43.02 41.47 3hcx s PHE 137 CO 0.03 -1.42 1.95 -1.35 0.70 0.00 0.00 175.22 175.13 3hcx h PRO 138 N -0.84 0.31 0.00 0.24 0.11 -1.88 -0.45 132.00 129.49 3hcx h PRO 138 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3hcx h PRO 138 Cb 1.25 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3hcx h PRO 138 CO 0.61 0.21 0.00 -0.40 -0.21 0.00 0.00 178.00 178.21 3hcx n ASP 139 N -4.45 0.00 0.00 -2.05 5.75 -1.26 -4.88 116.55 109.66 3hcx n ASP 139 Ca 0.12 -1.10 0.00 0.00 -0.01 0.00 0.00 54.79 53.80 3hcx n ASP 139 Cb 0.51 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 3hcx n ASP 139 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hcx n GLY 140 N 0.81 1.49 3.76 6.12 0.00 -0.18 -5.05 105.19 112.15 3hcx n GLY 140 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 3hcx n GLY 140 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hcx s GLU 141 N -0.80 4.24 -0.06 1.61 2.02 -1.26 -4.69 118.70 119.76 3hcx s GLU 141 Ca 0.00 2.37 -0.18 0.00 0.02 0.00 0.00 54.97 57.18 3hcx s GLU 141 Cb 0.00 -3.05 -0.05 0.00 0.10 0.00 0.00 34.13 31.13 3hcx s GLU 141 CO 0.00 -0.39 0.48 -1.64 0.02 0.00 0.00 175.26 173.73 3hcx s MET 142 N -1.30 4.23 0.24 1.61 -1.94 -1.26 -0.38 119.30 120.49 3hcx s MET 142 Ca 0.55 0.49 -0.05 0.00 -1.71 0.00 0.00 55.69 54.97 3hcx s MET 142 Cb -0.43 -3.36 0.45 0.00 2.01 0.00 0.00 34.83 33.50 3hcx s MET 142 CO 0.52 0.35 1.73 1.25 -0.01 0.00 0.00 175.02 178.86 3hcx h LEU 143 N 5.94 0.25 -1.31 -0.03 5.85 -1.55 -1.16 115.31 123.31 3hcx h LEU 143 Ca -0.45 0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.41 3hcx h LEU 143 Cb 1.19 0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.28 3hcx h LEU 143 CO 0.71 0.09 0.48 0.08 -0.34 0.00 0.00 178.44 179.46 3hcx h ARG 144 N 0.42 0.89 -0.25 1.25 0.11 -1.79 -1.99 114.38 113.02 3hcx h ARG 144 Ca 0.41 -0.05 -0.17 0.00 0.10 0.00 0.00 59.98 60.26 3hcx h ARG 144 Cb 0.62 -0.20 -0.00 0.00 1.11 0.00 0.00 29.97 31.49 3hcx h ARG 144 CO -0.41 0.59 -0.53 0.37 0.10 0.00 0.00 179.97 180.09 3hcx h GLN 145 N 0.92 0.73 -0.12 0.08 5.75 -1.62 -1.13 115.11 119.71 3hcx h GLN 145 Ca 0.28 -0.45 0.00 0.00 -0.15 0.00 0.00 58.65 58.33 3hcx h GLN 145 Cb 0.00 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.59 3hcx h GLN 145 CO -0.08 1.08 0.07 0.82 -2.65 0.00 0.00 178.83 178.08 3hcx h ILE 146 N 0.57 1.02 -0.63 2.39 2.04 -0.81 0.18 117.51 122.27 3hcx h ILE 146 Ca 0.02 -0.05 -0.06 0.00 1.00 0.00 0.00 64.86 65.76 3hcx h ILE 146 Cb 1.11 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 38.01 3hcx h ILE 146 CO 0.11 0.03 0.15 -0.07 0.00 0.00 0.00 178.15 178.37 3hcx h LEU 147 N 0.16 0.94 0.11 1.44 3.38 -1.29 -1.26 115.31 118.78 3hcx h LEU 147 Ca 0.05 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 3hcx h LEU 147 Cb -0.01 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.50 3hcx h LEU 147 CO -0.02 0.91 -0.05 -0.74 0.09 0.00 0.00 178.44 178.63 3hcx h HIS 148 N 0.95 -0.14 -0.43 1.13 2.76 -1.02 -2.39 115.15 116.01 3hcx h HIS 148 Ca 0.20 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.35 3hcx h HIS 148 Cb 0.34 0.05 -0.02 0.00 1.55 0.00 0.00 27.41 29.33 3hcx h HIS 148 CO 0.02 0.33 0.22 1.15 -1.30 0.00 0.00 177.93 178.35 3hcx h THR 149 N -0.72 1.17 0.00 6.26 2.02 -0.65 -3.09 112.91 117.91 3hcx h THR 149 Ca -0.02 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 66.69 3hcx h THR 149 Cb 0.54 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 3hcx h THR 149 CO 0.03 0.19 -0.25 0.54 0.37 0.00 0.00 175.52 176.39 3hcx n ARG 150 N -4.68 0.16 -3.63 6.66 1.74 -0.48 -4.95 116.66 111.48 3hcx n ARG 150 Ca 0.01 0.09 -0.24 0.00 -0.77 0.00 0.00 57.85 56.93 3hcx n ARG 150 Cb 0.10 -1.64 0.07 0.00 -1.02 0.00 0.00 32.46 29.97 3hcx n ARG 150 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hcx n ALA 151 N -1.67 -1.35 -1.79 7.54 0.00 -0.90 -4.93 120.51 117.40 3hcx n ALA 151 Ca 0.05 0.35 -0.41 0.00 0.00 0.00 0.00 53.44 53.43 3hcx n ALA 151 Cb 0.39 -5.21 -0.01 0.00 0.00 0.00 0.00 19.45 14.62 3hcx n ALA 151 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3hcx s PHE 152 N -3.32 2.83 0.39 0.00 0.08 -1.24 -4.96 117.98 111.76 3hcx s PHE 152 Ca 0.56 1.16 -0.27 0.00 0.12 0.00 0.00 56.93 58.50 3hcx s PHE 152 Cb -0.25 -3.89 -0.09 0.00 -0.57 0.00 0.00 43.02 38.22 3hcx s PHE 152 CO 0.74 -2.68 1.31 -0.51 -0.10 0.00 0.00 175.22 173.99 3hcx s ASP 153 N -0.05 6.40 0.78 1.36 1.01 -1.26 -5.00 116.67 119.91 3hcx s ASP 153 Ca 0.54 2.68 -0.13 0.00 0.71 0.00 0.00 52.55 56.35 3hcx s ASP 153 Cb -0.44 -2.64 0.07 0.00 1.01 0.00 0.00 42.92 40.92 3hcx s ASP 153 CO 0.54 -0.79 1.15 -0.54 0.21 0.00 0.00 175.17 175.74 3hcx s LYS 154 N -2.15 1.93 0.17 8.23 1.02 -1.26 -4.97 119.74 122.70 3hcx s LYS 154 Ca 0.55 1.53 -0.08 0.00 0.02 0.00 0.00 55.97 57.99 3hcx s LYS 154 Cb -0.39 -1.83 -0.06 0.00 -0.52 0.00 0.00 37.83 35.03 3hcx s LYS 154 CO 0.50 -1.95 0.46 -0.51 -0.92 0.00 0.00 175.35 172.93 3hcx s LEU 155 N -5.69 4.25 0.40 3.17 1.43 -1.26 -5.08 118.68 115.89 3hcx s LEU 155 Ca 0.68 0.78 -0.23 0.00 -1.03 0.00 0.00 54.13 54.33 3hcx s LEU 155 Cb -0.24 -3.40 -0.10 0.00 0.03 0.00 0.00 46.19 42.49 3hcx s LEU 155 CO 0.51 0.03 1.00 0.20 0.23 0.00 0.00 176.35 178.31 3hcx s ASN 156 N -2.25 6.90 0.53 2.29 0.01 -1.26 -4.93 114.94 116.23 3hcx s ASN 156 Ca 0.42 1.89 -0.19 0.00 -0.71 0.00 0.00 52.86 54.26 3hcx s ASN 156 Cb -0.12 -2.57 -0.06 0.00 0.41 0.00 0.00 41.25 38.90 3hcx s ASN 156 CO 0.22 -0.39 1.09 -0.54 -1.51 0.00 0.00 177.10 175.97 3hcx s LYS 157 N -2.64 3.49 0.00 -0.60 -0.14 -1.26 -0.55 119.74 118.04 3hcx s LYS 157 Ca 0.58 1.49 0.04 0.00 -1.36 0.00 0.00 55.97 56.72 3hcx s LYS 157 Cb -0.17 -2.04 0.23 0.00 -1.68 0.00 0.00 37.83 34.17 3hcx s LYS 157 CO 0.22 -0.72 0.71 1.87 -0.76 0.00 0.00 175.35 176.67