#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hpy s MET 3 N 0.00 4.40 0.29 0.00 1.00 -1.26 -5.02 119.30 118.72 3hpy s MET 3 Ca 0.00 1.16 -0.02 0.00 0.00 0.00 0.00 55.69 56.83 3hpy s MET 3 Cb 0.00 -3.52 -0.01 0.00 0.00 0.00 0.00 34.83 31.30 3hpy s MET 3 CO 0.00 -0.20 0.36 -0.08 0.00 0.00 0.00 175.02 175.11 3hpy s THR 4 N 1.64 0.00 0.00 2.05 -1.32 -1.26 -5.01 115.64 111.74 3hpy s THR 4 Ca 0.43 -1.73 0.00 0.00 -1.21 0.00 0.00 61.69 59.19 3hpy s THR 4 Cb -0.18 -2.50 0.00 0.00 -1.51 0.00 0.00 72.50 68.31 3hpy s THR 4 CO 0.18 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.20 3hpy n GLY 5 N -0.47 3.92 3.69 6.08 0.00 -1.26 -4.40 105.19 112.75 3hpy n GLY 5 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 3hpy n GLY 5 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hpy s VAL 6 N 0.00 4.65 -0.18 1.61 1.01 -1.26 -1.00 120.40 125.23 3hpy s VAL 6 Ca 0.00 1.92 -0.16 0.00 0.00 0.00 0.00 61.98 63.74 3hpy s VAL 6 Cb 0.00 -4.24 -0.12 0.00 0.00 0.00 0.00 36.38 32.02 3hpy s VAL 6 CO 0.00 0.04 0.07 -0.07 0.00 0.00 0.00 175.10 175.15 3hpy h LEU 7 N 7.71 0.00 -7.55 3.92 3.38 -1.07 -3.46 115.31 118.24 3hpy h LEU 7 Ca -0.34 -0.31 0.16 0.00 0.09 0.00 0.00 57.88 57.48 3hpy h LEU 7 Cb 1.17 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.83 3hpy h LEU 7 CO 0.83 1.15 0.47 0.00 0.09 0.00 0.00 178.44 180.98 3hpy s ARG 8 N -2.28 1.16 0.20 1.13 1.70 -1.22 -4.76 118.95 114.89 3hpy s ARG 8 Ca -0.22 -0.61 -0.32 0.00 -0.47 0.00 0.00 55.73 54.11 3hpy s ARG 8 Cb 0.04 0.42 -0.12 0.00 -0.57 0.00 0.00 34.95 34.72 3hpy s ARG 8 CO 0.43 -0.53 1.73 -2.14 -1.08 0.00 0.00 175.30 173.71 3hpy s PRO 9 N -3.30 4.13 -0.23 3.89 0.02 -1.26 -2.03 135.00 136.22 3hpy s PRO 9 Ca 0.11 2.60 -0.09 0.00 0.02 0.00 0.00 61.00 63.64 3hpy s PRO 9 Cb -0.02 -3.15 -0.18 0.00 0.02 0.00 0.00 34.50 31.18 3hpy s PRO 9 CO 0.00 -0.76 -0.08 0.41 -0.33 0.00 0.00 177.00 176.24 3hpy n GLY 10 N 4.01 -0.51 3.51 0.52 0.00 0.48 -4.75 105.19 108.45 3hpy n GLY 10 Ca 0.16 -0.13 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 3hpy n GLY 10 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3hpy s HIS 11 N -2.50 -0.43 -0.07 1.61 -3.43 -0.52 -4.10 115.29 105.85 3hpy s HIS 11 Ca -0.33 0.47 0.01 0.00 -0.80 0.00 0.00 55.06 54.40 3hpy s HIS 11 Cb 0.10 0.50 0.02 0.00 -1.43 0.00 0.00 32.58 31.77 3hpy s HIS 11 CO 0.60 -0.56 -0.06 0.00 -2.00 0.00 0.00 174.74 172.72 3hpy s ALA 12 N -2.47 0.94 -0.32 -1.38 0.00 -0.72 -0.02 121.76 117.79 3hpy s ALA 12 Ca 0.00 -0.25 -0.09 0.00 0.00 0.00 0.00 51.96 51.63 3hpy s ALA 12 Cb -0.01 -0.62 0.01 0.00 0.00 0.00 0.00 23.12 22.50 3hpy s ALA 12 CO -0.04 -0.16 0.14 -1.14 0.00 0.00 0.00 175.76 174.56 3hpy s GLN 13 N 1.23 3.08 0.10 0.00 0.74 -0.17 -1.23 119.66 123.43 3hpy s GLN 13 Ca -0.05 -0.88 0.06 0.00 0.05 0.00 0.00 55.36 54.53 3hpy s GLN 13 Cb -0.14 -3.53 -0.04 0.00 1.10 0.00 0.00 33.01 30.40 3hpy s GLN 13 CO -0.02 -0.51 -0.03 0.08 -0.55 0.00 0.00 175.29 174.27 3hpy s VAL 14 N 1.55 3.82 -0.17 1.34 1.01 0.30 0.35 120.40 128.60 3hpy s VAL 14 Ca 0.03 -1.10 -0.17 0.00 0.00 0.00 0.00 61.98 60.73 3hpy s VAL 14 Cb -0.18 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 3hpy s VAL 14 CO 0.05 0.10 0.46 -0.13 0.00 0.00 0.00 175.10 175.57 3hpy s ARG 15 N -2.34 4.25 -0.00 2.72 0.52 0.87 -2.05 118.95 122.92 3hpy s ARG 15 Ca 0.25 0.35 0.07 0.00 -0.52 0.00 0.00 55.73 55.88 3hpy s ARG 15 Cb -0.11 -3.50 -0.03 0.00 0.52 0.00 0.00 34.95 31.83 3hpy s ARG 15 CO 0.17 0.02 -0.21 0.14 0.02 0.00 0.00 175.30 175.45 3hpy s VAL 16 N 1.08 2.54 0.19 3.52 -7.23 -0.89 -3.60 120.40 116.01 3hpy s VAL 16 Ca 0.23 -1.06 0.04 0.00 -1.81 0.00 0.00 61.98 59.38 3hpy s VAL 16 Cb -0.15 -1.98 -0.11 0.00 0.56 0.00 0.00 36.38 34.70 3hpy s VAL 16 CO 0.09 0.49 1.44 -0.07 -0.31 0.00 0.00 175.10 176.74 3hpy h LEU 17 N 5.10 0.22 -7.41 1.32 3.38 -1.88 -1.05 115.31 114.99 3hpy h LEU 17 Ca -0.46 -0.16 -0.60 0.00 0.09 0.00 0.00 57.88 56.75 3hpy h LEU 17 Cb 1.14 -0.07 -0.40 0.00 0.09 0.00 0.00 40.66 41.43 3hpy h LEU 17 CO 0.48 0.92 -0.76 0.21 0.09 0.00 0.00 178.44 179.38 3hpy s ASN 18 N -6.90 4.07 0.12 -0.43 3.84 -1.26 -4.69 114.94 109.68 3hpy s ASN 18 Ca -0.03 -1.58 -0.31 0.00 0.21 0.00 0.00 52.86 51.15 3hpy s ASN 18 Cb 0.11 -1.10 -0.09 0.00 -0.55 0.00 0.00 41.25 39.61 3hpy s ASN 18 CO 0.81 -0.35 1.58 0.25 -2.79 0.00 0.00 177.10 176.60 3hpy h LEU 19 N 7.96 -1.40 -0.31 3.21 7.12 -1.96 0.95 115.31 130.88 3hpy h LEU 19 Ca -0.13 0.17 0.04 0.00 0.13 0.00 0.00 57.88 58.10 3hpy h LEU 19 Cb 1.04 0.54 -0.04 0.00 -0.53 0.00 0.00 40.66 41.67 3hpy h LEU 19 CO 0.46 -0.48 0.05 -0.08 -0.13 0.00 0.00 178.44 178.26 3hpy h GLU 20 N -0.60 0.16 0.00 1.25 4.57 -1.99 0.32 114.58 118.29 3hpy h GLU 20 Ca 0.04 -0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.19 3hpy h GLU 20 Cb 0.68 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 29.23 3hpy h GLU 20 CO -0.34 0.10 -0.10 1.05 -1.18 0.00 0.00 179.01 178.54 3hpy h GLU 21 N 0.16 0.00 -0.24 1.92 4.11 -1.95 -1.02 114.58 117.56 3hpy h GLU 21 Ca 0.14 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.38 3hpy h GLU 21 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 3hpy h GLU 21 CO -0.20 0.10 -0.59 0.78 0.07 0.00 0.00 179.01 179.17 3hpy h GLY 22 N 1.36 0.91 0.96 1.06 0.00 0.11 -1.78 103.07 105.70 3hpy h GLY 22 Ca -0.00 -1.13 -0.06 0.00 0.00 0.00 0.00 47.33 46.15 3hpy h GLY 22 CO 0.01 1.01 0.05 -2.22 0.00 0.00 0.00 176.54 175.39 3hpy h ILE 23 N 0.59 1.25 -0.62 2.60 2.04 -0.41 -1.34 117.51 121.63 3hpy h ILE 23 Ca -0.01 -0.93 -0.03 0.00 1.00 0.00 0.00 64.86 64.89 3hpy h ILE 23 Cb 1.21 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 38.27 3hpy h ILE 23 CO 0.13 0.32 0.26 -0.74 0.00 0.00 0.00 178.15 178.12 3hpy h HIS 24 N 0.59 0.92 -0.03 1.37 2.76 -1.14 -0.51 115.15 119.11 3hpy h HIS 24 Ca 0.13 -0.06 -0.01 0.00 -2.20 0.00 0.00 60.37 58.23 3hpy h HIS 24 Cb 0.41 -0.28 -0.00 0.00 1.55 0.00 0.00 27.41 29.09 3hpy h HIS 24 CO 0.03 0.72 -0.00 0.35 -1.30 0.00 0.00 177.93 177.73 3hpy h PHE 25 N 0.86 0.07 0.00 5.26 3.04 -1.19 -1.07 116.94 123.90 3hpy h PHE 25 Ca 0.21 -0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.11 3hpy h PHE 25 Cb 0.18 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 38.67 3hpy h PHE 25 CO 0.01 0.39 -0.18 1.88 -2.02 0.00 0.00 178.31 178.39 3hpy h TYR 26 N -0.28 0.00 0.00 0.41 0.05 -1.18 -0.55 116.97 115.43 3hpy h TYR 26 Ca 0.01 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.70 3hpy h TYR 26 Cb 0.37 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.09 3hpy h TYR 26 CO 0.05 0.18 -2.07 2.89 -1.05 0.00 0.00 178.16 178.16 3hpy n ARG 27 N -3.70 0.67 -0.13 4.88 1.85 -0.21 -1.04 116.66 118.98 3hpy n ARG 27 Ca -0.01 -0.15 -0.24 0.00 -1.00 0.00 0.00 57.85 56.45 3hpy n ARG 27 Cb 0.30 -1.53 -0.11 0.00 -1.05 0.00 0.00 32.46 30.07 3hpy n ARG 27 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3hpy n ASN 28 N -2.39 1.97 -0.02 2.89 5.03 -0.41 -3.93 115.26 118.41 3hpy n ASN 28 Ca -0.11 0.13 -0.01 0.00 0.87 0.00 0.00 54.58 55.46 3hpy n ASN 28 Cb 0.71 -0.65 -0.00 0.00 -1.02 0.00 0.00 39.78 38.82 3hpy n ASN 28 CO 0.00 0.00 0.00 0.58 -1.83 0.00 0.00 177.26 176.01 3hpy h VAL 29 N -0.50 0.00 0.00 2.41 2.07 -1.23 -3.35 116.25 115.64 3hpy h VAL 29 Ca -0.62 -0.36 -0.02 0.00 0.82 0.00 0.00 66.70 66.52 3hpy h VAL 29 Cb 1.75 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.52 3hpy h VAL 29 CO -0.24 0.00 -0.10 0.25 0.02 0.00 0.00 177.57 177.50 3hpy h LEU 30 N -0.36 0.00 -0.39 2.57 5.85 -1.56 0.40 115.31 121.82 3hpy h LEU 30 Ca 0.00 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 3hpy h LEU 30 Cb 0.10 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.14 3hpy h LEU 30 CO 0.00 0.10 -0.13 0.61 -0.34 0.00 0.00 178.44 178.68 3hpy n GLY 31 N -1.15 0.48 3.88 3.75 0.00 -1.11 -0.76 105.19 110.28 3hpy n GLY 31 Ca -0.03 -0.56 -0.30 0.00 0.00 0.00 0.00 46.02 45.13 3hpy n GLY 31 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hpy s LEU 32 N -1.95 3.68 -0.28 0.99 1.02 -0.21 -4.05 118.68 117.88 3hpy s LEU 32 Ca 0.08 1.17 -0.13 0.00 0.02 0.00 0.00 54.13 55.26 3hpy s LEU 32 Cb -0.03 -4.10 -0.04 0.00 0.02 0.00 0.00 46.19 42.04 3hpy s LEU 32 CO 0.10 -0.52 0.30 -0.69 0.02 0.00 0.00 176.35 175.55 3hpy s VAL 33 N -2.59 5.23 0.22 -1.59 1.01 0.29 -4.45 120.40 118.52 3hpy s VAL 33 Ca 0.52 0.32 -0.30 0.00 0.00 0.00 0.00 61.98 62.52 3hpy s VAL 33 Cb -0.10 -3.65 -0.09 0.00 0.00 0.00 0.00 36.38 32.54 3hpy s VAL 33 CO 0.37 0.16 1.35 -0.70 0.00 0.00 0.00 175.10 176.28 3hpy s GLU 34 N 1.93 4.35 0.00 2.72 2.12 -1.26 -1.45 118.70 127.11 3hpy s GLU 34 Ca 0.11 2.13 0.00 0.00 0.36 0.00 0.00 54.97 57.57 3hpy s GLU 34 Cb -0.16 -3.17 0.00 0.00 0.26 0.00 0.00 34.13 31.06 3hpy s GLU 34 CO 0.11 -0.30 0.17 0.25 -0.54 0.00 0.00 175.26 174.94 3hpy n THR 35 N 2.49 0.00 0.00 -1.70 -2.24 0.96 -4.94 114.28 108.85 3hpy n THR 35 Ca 0.06 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 3hpy n THR 35 Cb 0.42 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.67 3hpy n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hpy n GLY 36 N 0.62 1.59 2.87 3.38 0.00 -1.24 -4.97 105.19 107.44 3hpy n GLY 36 Ca 0.00 -0.98 -0.13 0.00 0.00 0.00 0.00 46.02 44.91 3hpy n GLY 36 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hpy s ARG 37 N -2.00 0.02 0.49 1.61 0.52 -1.26 -0.95 118.95 117.38 3hpy s ARG 37 Ca 0.00 0.11 0.07 0.00 -0.52 0.00 0.00 55.73 55.38 3hpy s ARG 37 Cb 0.00 -0.06 0.01 0.00 0.52 0.00 0.00 34.95 35.42 3hpy s ARG 37 CO 0.00 -0.06 0.41 0.16 0.02 0.00 0.00 175.30 175.83 3hpy s ASP 38 N 0.37 4.79 0.62 0.23 3.84 -0.82 -5.00 116.67 120.71 3hpy s ASP 38 Ca -0.03 -1.02 0.42 0.00 -0.00 0.00 0.00 52.55 51.91 3hpy s ASP 38 Cb -0.04 -0.02 2.26 0.00 -1.38 0.00 0.00 42.92 43.74 3hpy s ASP 38 CO -0.01 -0.91 2.28 0.44 -0.00 0.00 0.00 175.17 176.96 3hpy h ASP 39 N 0.86 0.00 0.52 2.11 3.32 -1.99 -1.11 116.42 120.13 3hpy h ASP 39 Ca -0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.67 3hpy h ASP 39 Cb 1.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.83 3hpy h ASP 39 CO 0.57 0.00 -0.37 0.00 -1.72 0.00 0.00 179.24 177.72 3hpy n GLN 40 N -2.98 0.16 -0.10 3.56 6.02 -1.26 -4.93 117.38 117.85 3hpy n GLN 40 Ca -0.03 -0.08 0.00 0.00 -0.01 0.00 0.00 57.00 56.88 3hpy n GLN 40 Cb 0.07 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.83 3hpy n GLN 40 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hpy n GLY 41 N 1.46 0.77 3.80 1.08 0.00 -0.42 -4.98 105.19 106.90 3hpy n GLY 41 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 3hpy n GLY 41 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hpy s ARG 42 N -0.90 4.43 -0.10 1.61 0.52 -1.26 -4.68 118.95 118.58 3hpy s ARG 42 Ca 0.00 1.17 0.02 0.00 -0.52 0.00 0.00 55.73 56.39 3hpy s ARG 42 Cb 0.00 -2.72 -0.02 0.00 0.52 0.00 0.00 34.95 32.74 3hpy s ARG 42 CO 0.00 0.26 -0.15 0.08 0.02 0.00 0.00 175.30 175.50 3hpy s VAL 43 N -1.69 2.87 -0.13 3.52 1.01 -0.57 -1.95 120.40 123.47 3hpy s VAL 43 Ca 0.50 -0.75 -0.06 0.00 0.00 0.00 0.00 61.98 61.67 3hpy s VAL 43 Cb -0.16 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 3hpy s VAL 43 CO 0.21 0.55 0.10 -0.31 0.00 0.00 0.00 175.10 175.65 3hpy s TYR 44 N 0.01 3.44 0.13 5.22 1.51 -0.13 -1.74 117.35 125.79 3hpy s TYR 44 Ca -0.05 0.38 0.03 0.00 -1.01 0.00 0.00 57.07 56.41 3hpy s TYR 44 Cb -0.14 -1.95 -0.04 0.00 -0.11 0.00 0.00 41.96 39.71 3hpy s TYR 44 CO 0.04 0.56 -0.07 -0.06 -1.11 0.00 0.00 175.55 174.91 3hpy s PHE 45 N -0.67 1.11 0.10 2.71 0.40 -0.43 -0.03 117.98 121.17 3hpy s PHE 45 Ca 0.12 -0.87 -0.06 0.00 -0.60 0.00 0.00 56.93 55.52 3hpy s PHE 45 Cb -0.12 -0.61 -0.01 0.00 0.51 0.00 0.00 43.02 42.79 3hpy s PHE 45 CO 0.02 -0.06 0.15 -1.59 0.70 0.00 0.00 175.22 174.44 3hpy s LYS 46 N -3.81 0.85 0.37 0.44 -2.85 -0.53 -0.73 119.74 113.48 3hpy s LYS 46 Ca 0.16 -1.09 -0.24 0.00 -1.00 0.00 0.00 55.97 53.80 3hpy s LYS 46 Cb 0.04 0.31 -0.10 0.00 -2.06 0.00 0.00 37.83 36.02 3hpy s LYS 46 CO -0.01 -0.26 0.96 0.00 0.10 0.00 0.00 175.35 176.14 3hpy h TRP 48 N 2.62 0.92 0.00 0.00 5.08 -1.84 -2.48 115.95 120.24 3hpy h TRP 48 Ca -0.48 0.03 0.00 0.00 1.08 0.00 0.00 58.89 59.52 3hpy h TRP 48 Cb 1.19 -0.29 0.00 0.00 -3.00 0.00 0.00 29.16 27.06 3hpy h TRP 48 CO 0.61 0.40 0.00 -3.47 -1.28 0.00 0.00 178.44 174.70 3hpy n ASP 49 N -4.70 0.16 -4.68 0.11 2.03 -1.26 -4.32 116.55 103.89 3hpy n ASP 49 Ca 0.14 0.52 -0.29 0.00 0.52 0.00 0.00 54.79 55.68 3hpy n ASP 49 Cb 0.26 -0.56 0.14 0.00 -0.72 0.00 0.00 41.12 40.23 3hpy n ASP 49 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 3hpy s GLU 50 N -3.04 1.05 -0.04 -0.67 2.02 -0.94 -4.77 118.70 112.32 3hpy s GLU 50 Ca 0.11 0.18 0.08 0.00 0.02 0.00 0.00 54.97 55.36 3hpy s GLU 50 Cb 0.15 -1.84 -0.12 0.00 0.10 0.00 0.00 34.13 32.42 3hpy s GLU 50 CO 0.46 -2.23 0.13 0.54 0.02 0.00 0.00 175.26 174.17 3hpy n ARG 51 N -3.77 1.21 -2.29 1.61 1.74 -1.26 -3.49 116.66 110.40 3hpy n ARG 51 Ca 0.08 -0.05 -0.31 0.00 -0.77 0.00 0.00 57.85 56.80 3hpy n ARG 51 Cb 0.60 -1.21 -0.01 0.00 -1.02 0.00 0.00 32.46 30.81 3hpy n ARG 51 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3hpy s ASP 52 N -3.40 6.42 0.38 0.55 1.01 -1.26 -0.21 116.67 120.15 3hpy s ASP 52 Ca -0.04 1.37 0.11 0.00 0.71 0.00 0.00 52.55 54.71 3hpy s ASP 52 Cb 0.04 -2.44 0.89 0.00 1.01 0.00 0.00 42.92 42.43 3hpy s ASP 52 CO 0.35 -0.66 1.88 -0.74 0.21 0.00 0.00 175.17 176.21 3hpy h HIS 53 N 0.42 0.72 -2.72 4.23 2.76 -1.13 -3.43 115.15 116.00 3hpy h HIS 53 Ca -0.46 0.02 -0.08 0.00 -2.20 0.00 0.00 60.37 57.66 3hpy h HIS 53 Cb 1.19 -0.23 -0.18 0.00 1.55 0.00 0.00 27.41 29.75 3hpy h HIS 53 CO 0.64 0.26 -0.03 -1.54 -1.30 0.00 0.00 177.93 175.96 3hpy s SER 54 N -5.80 -0.40 0.00 3.26 1.04 -1.26 -4.45 113.70 106.09 3hpy s SER 54 Ca -0.09 0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.57 3hpy s SER 54 Cb 0.22 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.79 3hpy s SER 54 CO 0.78 -0.63 0.00 0.00 0.98 0.00 0.00 173.24 174.38 3hpy s TYR 56 N -0.01 -0.53 -0.05 0.00 5.04 -0.98 -1.76 117.35 119.07 3hpy s TYR 56 Ca 0.00 0.87 0.05 0.00 -2.44 0.00 0.00 57.07 55.55 3hpy s TYR 56 Cb 0.00 -0.04 -0.02 0.00 0.35 0.00 0.00 41.96 42.24 3hpy s TYR 56 CO 0.00 -0.50 -0.20 0.42 -1.34 0.00 0.00 175.55 173.94 3hpy s ILE 57 N 2.45 2.59 0.00 3.14 1.09 -0.36 -1.31 121.20 128.80 3hpy s ILE 57 Ca 0.04 -0.89 0.07 0.00 -1.10 0.00 0.00 60.65 58.77 3hpy s ILE 57 Cb -0.13 -1.98 -0.03 0.00 -1.06 0.00 0.00 42.46 39.26 3hpy s ILE 57 CO -0.11 0.58 -0.20 0.27 -0.10 0.00 0.00 174.94 175.37 3hpy s ILE 58 N -0.53 2.58 -0.04 2.92 -4.36 -0.71 -0.54 121.20 120.52 3hpy s ILE 58 Ca 0.07 -1.08 -0.01 0.00 -0.26 0.00 0.00 60.65 59.37 3hpy s ILE 58 Cb -0.11 -2.01 0.03 0.00 1.25 0.00 0.00 42.46 41.61 3hpy s ILE 58 CO 0.01 0.46 0.03 -0.60 0.24 0.00 0.00 174.94 175.09 3hpy s ARG 59 N -1.03 0.08 0.27 0.37 3.52 -0.87 -1.51 118.95 119.78 3hpy s ARG 59 Ca 0.12 0.23 -0.30 0.00 -0.13 0.00 0.00 55.73 55.66 3hpy s ARG 59 Cb -0.10 -0.48 -0.11 0.00 -1.56 0.00 0.00 34.95 32.70 3hpy s ARG 59 CO 0.02 -0.24 1.55 -2.00 -0.81 0.00 0.00 175.30 173.82 3hpy s GLU 60 N 1.60 4.17 0.34 5.12 2.12 -1.26 -2.10 118.70 128.70 3hpy s GLU 60 Ca -0.02 2.48 -0.04 0.00 0.36 0.00 0.00 54.97 57.75 3hpy s GLU 60 Cb -0.13 -3.06 0.01 0.00 0.26 0.00 0.00 34.13 31.21 3hpy s GLU 60 CO -0.03 -0.57 0.51 0.00 -0.54 0.00 0.00 175.26 174.63 3hpy s ALA 61 N 0.11 0.56 -0.25 6.30 0.00 -0.40 -4.86 121.76 123.22 3hpy s ALA 61 Ca 0.63 -1.40 0.19 0.00 0.00 0.00 0.00 51.96 51.38 3hpy s ALA 61 Cb -0.46 1.10 0.09 0.00 0.00 0.00 0.00 23.12 23.84 3hpy s ALA 61 CO 0.45 -0.82 1.28 -0.44 0.00 0.00 0.00 175.76 176.23 3hpy h ASP 62 N 2.10 0.00 -4.22 0.00 3.45 -1.93 -3.38 116.42 112.44 3hpy h ASP 62 Ca -0.29 0.00 -0.37 0.00 0.43 0.00 0.00 57.03 56.80 3hpy h ASP 62 Cb 1.24 0.00 -0.26 0.00 -0.56 0.00 0.00 39.33 39.75 3hpy h ASP 62 CO 0.39 0.27 -0.77 0.42 -1.57 0.00 0.00 179.24 177.97 3hpy s THR 63 N -3.11 0.72 1.00 0.35 -4.23 -1.26 -5.00 115.64 104.10 3hpy s THR 63 Ca 0.02 -0.63 -0.15 0.00 -1.18 0.00 0.00 61.69 59.76 3hpy s THR 63 Cb 0.07 -0.65 0.19 0.00 1.34 0.00 0.00 72.50 73.45 3hpy s THR 63 CO 0.75 0.03 1.16 0.00 -0.54 0.00 0.00 174.62 176.01 3hpy s ALA 64 N -0.57 1.49 0.00 3.99 0.00 -1.26 -4.69 121.76 120.71 3hpy s ALA 64 Ca 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.24 3hpy s ALA 64 Cb -0.05 -2.96 0.00 0.00 0.00 0.00 0.00 23.12 20.10 3hpy s ALA 64 CO 0.00 -2.68 0.00 0.41 0.00 0.00 0.00 175.76 173.50 3hpy n GLY 65 N -2.06 0.77 3.55 0.00 0.00 -1.24 -4.88 105.19 101.33 3hpy n GLY 65 Ca 0.09 -2.13 -0.34 0.00 0.00 0.00 0.00 46.02 43.64 3hpy n GLY 65 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3hpy s ILE 66 N -0.98 4.04 -0.09 -0.61 2.07 -1.26 -0.09 121.20 124.27 3hpy s ILE 66 Ca 0.00 -0.32 -0.24 0.00 -1.41 0.00 0.00 60.65 58.68 3hpy s ILE 66 Cb 0.00 -2.76 -0.29 0.00 0.13 0.00 0.00 42.46 39.55 3hpy s ILE 66 CO 0.00 0.52 0.81 0.44 -1.91 0.00 0.00 174.94 174.80 3hpy h ASP 67 N 6.35 0.27 -4.58 4.50 3.32 -0.45 -3.48 116.42 122.35 3hpy h ASP 67 Ca -0.36 -0.96 0.08 0.00 0.02 0.00 0.00 57.03 55.82 3hpy h ASP 67 Cb 1.19 -0.09 -0.17 0.00 0.22 0.00 0.00 39.33 40.48 3hpy h ASP 67 CO 0.62 1.25 0.47 0.72 -1.72 0.00 0.00 179.24 180.57 3hpy s PHE 68 N -2.35 -0.38 -0.13 4.55 -0.12 -1.18 -4.44 117.98 113.92 3hpy s PHE 68 Ca -0.16 0.37 0.02 0.00 -0.05 0.00 0.00 56.93 57.10 3hpy s PHE 68 Cb -0.00 0.51 0.02 0.00 -0.63 0.00 0.00 43.02 42.91 3hpy s PHE 68 CO 0.77 -0.52 -0.17 0.12 -0.05 0.00 0.00 175.22 175.36 3hpy s PHE 69 N -2.60 2.27 0.09 3.49 2.19 -0.77 -0.99 117.98 121.66 3hpy s PHE 69 Ca 0.02 -1.17 0.10 0.00 0.33 0.00 0.00 56.93 56.21 3hpy s PHE 69 Cb -0.01 -1.61 -0.04 0.00 -1.31 0.00 0.00 43.02 40.06 3hpy s PHE 69 CO -0.06 -0.59 -0.25 0.20 1.83 0.00 0.00 175.22 176.36 3hpy s GLY 70 N 1.09 1.54 -0.04 13.12 0.00 0.96 -1.26 107.32 122.72 3hpy s GLY 70 Ca -0.03 -1.36 0.05 0.00 0.00 0.00 0.00 44.72 43.37 3hpy s GLY 70 CO -0.05 -1.31 -0.18 -1.36 0.00 0.00 0.00 173.10 170.21 3hpy s PHE 71 N -0.97 2.60 0.03 1.90 0.08 0.53 0.18 117.98 122.33 3hpy s PHE 71 Ca 0.14 -0.25 -0.21 0.00 0.12 0.00 0.00 56.93 56.73 3hpy s PHE 71 Cb -0.10 -1.60 -0.06 0.00 -0.57 0.00 0.00 43.02 40.69 3hpy s PHE 71 CO 0.05 0.12 0.61 0.21 -0.10 0.00 0.00 175.22 176.10 3hpy s LYS 72 N -0.68 4.31 0.35 0.44 2.20 -0.86 -1.59 119.74 123.91 3hpy s LYS 72 Ca 0.11 0.78 0.08 0.00 -0.36 0.00 0.00 55.97 56.57 3hpy s LYS 72 Cb -0.11 -3.31 -0.03 0.00 -1.51 0.00 0.00 37.83 32.87 3hpy s LYS 72 CO 0.00 0.46 0.22 0.14 -0.36 0.00 0.00 175.35 175.81 3hpy s VAL 73 N -0.52 3.16 0.19 4.02 -7.23 0.20 -0.62 120.40 119.59 3hpy s VAL 73 Ca 0.31 -1.54 -0.20 0.00 -1.81 0.00 0.00 61.98 58.74 3hpy s VAL 73 Cb -0.19 -3.06 0.14 0.00 0.56 0.00 0.00 36.38 33.83 3hpy s VAL 73 CO 0.19 -0.16 1.60 0.25 -0.31 0.00 0.00 175.10 176.67 3hpy h LEU 74 N 1.38 -1.03 -7.99 1.32 5.85 -1.38 -3.41 115.31 110.05 3hpy h LEU 74 Ca -0.44 0.21 0.02 0.00 0.84 0.00 0.00 57.88 58.52 3hpy h LEU 74 Cb 1.25 0.53 -0.02 0.00 0.37 0.00 0.00 40.66 42.79 3hpy h LEU 74 CO 0.61 -0.29 0.28 1.51 -0.34 0.00 0.00 178.44 180.21 3hpy s ASP 75 N -5.16 -0.08 0.25 1.25 1.47 -1.26 -5.03 116.67 108.11 3hpy s ASP 75 Ca -0.14 -0.95 -0.05 0.00 1.18 0.00 0.00 52.55 52.59 3hpy s ASP 75 Cb 0.16 0.79 0.34 0.00 -0.34 0.00 0.00 42.92 43.87 3hpy s ASP 75 CO 0.70 -1.54 1.88 0.11 0.68 0.00 0.00 175.17 176.99 3hpy h LYS 76 N 2.00 1.09 -0.23 2.11 1.57 -1.90 -0.73 116.57 120.49 3hpy h LYS 76 Ca -0.28 -0.07 0.02 0.00 -1.87 0.00 0.00 60.65 58.45 3hpy h LYS 76 Cb 1.25 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 33.29 3hpy h LYS 76 CO 0.35 0.72 0.10 0.00 -0.57 0.00 0.00 179.45 180.05 3hpy h ALA 77 N 1.41 0.27 -0.98 3.86 0.00 -2.00 -0.72 119.26 121.10 3hpy h ALA 77 Ca 0.39 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.32 3hpy h ALA 77 Cb 0.10 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 3hpy h ALA 77 CO -0.15 -0.30 0.65 1.15 0.00 0.00 0.00 179.25 180.60 3hpy h THR 78 N 0.23 1.24 -0.12 0.00 2.02 -1.75 -1.31 112.91 113.22 3hpy h THR 78 Ca 0.10 -0.45 0.01 0.00 0.77 0.00 0.00 66.41 66.83 3hpy h THR 78 Cb 0.04 -0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 66.24 3hpy h THR 78 CO -0.07 0.24 0.06 0.25 0.37 0.00 0.00 175.52 176.36 3hpy h LEU 79 N 1.32 0.08 -0.53 2.58 5.85 -0.45 0.35 115.31 124.52 3hpy h LEU 79 Ca 0.36 0.01 0.05 0.00 0.84 0.00 0.00 57.88 59.14 3hpy h LEU 79 Cb -0.14 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 40.83 3hpy h LEU 79 CO -0.08 0.07 0.25 -0.33 -0.34 0.00 0.00 178.44 178.01 3hpy h GLU 80 N 0.13 0.47 -0.53 1.25 4.39 -0.52 -1.65 114.58 118.12 3hpy h GLU 80 Ca 0.05 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.72 3hpy h GLU 80 Cb 0.01 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.53 3hpy h GLU 80 CO -0.03 0.31 0.35 -0.22 -1.16 0.00 0.00 179.01 178.26 3hpy h LYS 81 N 0.49 0.70 -0.42 2.33 3.64 -0.77 -2.13 116.57 120.41 3hpy h LYS 81 Ca 0.24 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.57 3hpy h LYS 81 Cb 0.17 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 3hpy h LYS 81 CO -0.18 0.47 0.25 -0.07 -2.27 0.00 0.00 179.45 177.65 3hpy h LEU 82 N 0.72 0.50 -0.18 5.20 -0.00 -0.47 -0.80 115.31 120.27 3hpy h LEU 82 Ca 0.19 -0.06 0.04 0.00 -0.00 0.00 0.00 57.88 58.05 3hpy h LEU 82 Cb -0.08 -0.13 -0.03 0.00 -0.00 0.00 0.00 40.66 40.42 3hpy h LEU 82 CO -0.04 0.41 -0.04 -0.78 -0.00 0.00 0.00 178.44 177.99 3hpy h ASP 83 N 0.55 -0.16 -0.32 -0.43 -0.00 -1.09 0.19 116.42 115.15 3hpy h ASP 83 Ca 0.15 0.05 0.03 0.00 -0.00 0.00 0.00 57.03 57.26 3hpy h ASP 83 Cb 0.01 0.11 -0.03 0.00 -0.00 0.00 0.00 39.33 39.41 3hpy h ASP 83 CO -0.03 -0.06 0.14 0.00 -0.00 0.00 0.00 179.24 179.29 3hpy h ALA 84 N 1.18 0.38 -0.42 -0.78 0.00 -1.18 -0.87 119.26 117.58 3hpy h ALA 84 Ca 0.09 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 3hpy h ALA 84 Cb 0.13 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3hpy h ALA 84 CO -0.18 -0.25 0.07 -0.44 0.00 0.00 0.00 179.25 178.44 3hpy h ASP 85 N 0.29 0.59 -0.62 0.00 3.32 -0.70 0.17 116.42 119.48 3hpy h ASP 85 Ca 0.14 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 57.02 3hpy h ASP 85 Cb 0.08 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 3hpy h ASP 85 CO -0.12 0.61 0.11 -0.07 -1.72 0.00 0.00 179.24 178.05 3hpy h LEU 86 N 0.61 0.98 -0.10 1.55 3.38 -0.02 -1.25 115.31 120.46 3hpy h LEU 86 Ca 0.14 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 3hpy h LEU 86 Cb 0.28 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 3hpy h LEU 86 CO 0.00 0.99 -0.04 1.56 0.09 0.00 0.00 178.44 181.05 3hpy h GLN 87 N 0.93 0.20 -0.65 1.13 4.20 -0.58 -2.09 115.11 118.25 3hpy h GLN 87 Ca 0.19 -0.08 0.10 0.00 0.06 0.00 0.00 58.65 58.92 3hpy h GLN 87 Cb 0.42 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.15 3hpy h GLN 87 CO 0.01 0.54 0.44 0.00 -0.67 0.00 0.00 178.83 179.14 3hpy h ALA 88 N 0.66 1.97 0.00 3.87 0.00 -0.90 0.34 119.26 125.20 3hpy h ALA 88 Ca 0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3hpy h ALA 88 Cb 0.47 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3hpy h ALA 88 CO 0.01 -0.12 -0.19 -0.92 0.00 0.00 0.00 179.25 178.04 3hpy h TYR 89 N 0.48 0.00 0.00 0.00 3.20 -1.02 -3.46 116.97 116.17 3hpy h TYR 89 Ca 0.30 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.17 3hpy h TYR 89 Cb 0.55 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.82 3hpy h TYR 89 CO -0.00 0.19 0.00 0.41 -1.64 0.00 0.00 178.16 177.12 3hpy n GLY 90 N -0.93 1.09 3.91 1.82 0.00 0.12 -5.11 105.19 106.10 3hpy n GLY 90 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 3hpy n GLY 90 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hpy s LEU 91 N 0.00 4.10 -0.15 0.99 1.43 -0.80 -5.02 118.68 119.23 3hpy s LEU 91 Ca 0.00 0.61 -0.08 0.00 -1.03 0.00 0.00 54.13 53.63 3hpy s LEU 91 Cb 0.00 -3.42 -0.04 0.00 0.03 0.00 0.00 46.19 42.76 3hpy s LEU 91 CO 0.00 -0.17 0.13 0.42 0.23 0.00 0.00 176.35 176.96 3hpy s THR 92 N -2.05 5.38 0.07 5.49 -4.23 -1.26 -4.04 115.64 115.00 3hpy s THR 92 Ca 0.42 0.17 0.10 0.00 -1.18 0.00 0.00 61.69 61.20 3hpy s THR 92 Cb -0.11 -3.38 -0.03 0.00 1.34 0.00 0.00 72.50 70.32 3hpy s THR 92 CO 0.30 0.55 -0.27 0.42 -0.54 0.00 0.00 174.62 175.09 3hpy s THR 93 N -0.49 2.19 -0.11 3.99 -4.23 -1.26 -4.50 115.64 111.22 3hpy s THR 93 Ca 0.12 -1.52 0.03 0.00 -1.18 0.00 0.00 61.69 59.14 3hpy s THR 93 Cb -0.12 -1.89 0.01 0.00 1.34 0.00 0.00 72.50 71.84 3hpy s THR 93 CO 0.02 0.27 -0.19 -0.89 -0.54 0.00 0.00 174.62 173.29 3hpy s THR 94 N -0.89 1.78 -0.30 3.99 2.01 0.28 -4.95 115.64 117.55 3hpy s THR 94 Ca 0.13 -0.82 -0.19 0.00 0.31 0.00 0.00 61.69 61.11 3hpy s THR 94 Cb -0.10 -1.58 -0.02 0.00 0.01 0.00 0.00 72.50 70.81 3hpy s THR 94 CO 0.03 0.50 0.55 -0.60 -0.69 0.00 0.00 174.62 174.41 3hpy s ARG 95 N 0.76 3.91 -0.12 4.92 6.06 -1.26 -1.03 118.95 132.20 3hpy s ARG 95 Ca -0.10 0.21 -0.18 0.00 -2.50 0.00 0.00 55.73 53.16 3hpy s ARG 95 Cb -0.16 -3.71 -0.04 0.00 0.06 0.00 0.00 34.95 31.10 3hpy s ARG 95 CO 0.01 -0.49 0.46 0.42 -2.50 0.00 0.00 175.30 173.20 3hpy s ILE 96 N 2.43 5.20 0.66 4.11 1.09 0.76 -4.92 121.20 130.52 3hpy s ILE 96 Ca 0.22 0.92 -0.16 0.00 -1.10 0.00 0.00 60.65 60.53 3hpy s ILE 96 Cb -0.15 -3.80 -0.00 0.00 -1.06 0.00 0.00 42.46 37.45 3hpy s ILE 96 CO 0.11 0.34 1.15 -2.16 -0.10 0.00 0.00 174.94 174.28 3hpy s PRO 97 N 0.58 2.70 0.55 2.79 0.04 -1.26 -0.07 135.00 140.33 3hpy s PRO 97 Ca 0.25 1.58 -0.21 0.00 0.04 0.00 0.00 61.00 62.67 3hpy s PRO 97 Cb -0.15 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 3hpy s PRO 97 CO 0.10 -1.37 1.27 0.00 0.04 0.00 0.00 177.00 177.05 3hpy s ALA 98 N -2.07 2.73 0.00 8.56 0.00 -1.26 -2.32 121.76 127.41 3hpy s ALA 98 Ca 0.71 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.83 3hpy s ALA 98 Cb -0.25 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.37 3hpy s ALA 98 CO 0.40 -1.20 0.00 0.41 0.00 0.00 0.00 175.76 175.37 3hpy n GLY 99 N 0.63 3.15 0.35 0.00 0.00 0.48 -4.81 105.19 105.00 3hpy n GLY 99 Ca 0.11 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.30 3hpy n GLY 99 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3hpy h GLU 100 N 1.81 0.00 -5.15 1.61 4.22 -1.69 -3.34 114.58 112.04 3hpy h GLU 100 Ca 0.00 0.00 -0.64 0.00 0.08 0.00 0.00 59.36 58.80 3hpy h GLU 100 Cb 0.00 0.00 -0.33 0.00 0.50 0.00 0.00 28.75 28.92 3hpy h GLU 100 CO 0.00 0.00 -0.86 -1.64 -2.18 0.00 0.00 179.01 174.33 3hpy s MET 101 N -4.98 2.74 0.09 1.92 -1.94 -1.26 -5.09 119.30 110.77 3hpy s MET 101 Ca -0.05 -0.77 -0.36 0.00 -1.71 0.00 0.00 55.69 52.80 3hpy s MET 101 Cb 0.19 -2.10 -0.18 0.00 2.01 0.00 0.00 34.83 34.74 3hpy s MET 101 CO 0.70 0.13 1.01 1.28 -0.01 0.00 0.00 175.02 178.12 3hpy n LEU 102 N 3.63 0.24 -1.48 -0.03 4.77 -1.26 -0.98 117.00 121.89 3hpy n LEU 102 Ca -0.20 1.15 -0.13 0.00 -0.03 0.00 0.00 56.01 56.80 3hpy n LEU 102 Cb 0.53 -1.02 -0.05 0.00 -2.33 0.00 0.00 43.42 40.55 3hpy n LEU 102 CO 0.27 -1.91 -0.13 -0.62 -1.33 0.00 0.00 177.39 173.68 3hpy n GLU 103 N 1.56 -1.37 -5.04 3.23 -0.58 -1.26 -4.95 120.64 112.23 3hpy n GLU 103 Ca 0.18 0.76 -0.32 0.00 -0.42 0.00 0.00 57.16 57.36 3hpy n GLU 103 Cb 0.16 -5.04 -0.15 0.00 -0.57 0.00 0.00 31.44 25.84 3hpy n GLU 103 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 3hpy s THR 104 N -2.16 2.57 1.16 2.62 2.01 -0.15 -1.78 115.64 119.91 3hpy s THR 104 Ca 0.00 -0.87 -0.20 0.00 0.31 0.00 0.00 61.69 60.93 3hpy s THR 104 Cb 0.00 -2.00 0.29 0.00 0.01 0.00 0.00 72.50 70.80 3hpy s THR 104 CO 0.00 0.56 1.02 0.61 -0.69 0.00 0.00 174.62 176.12 3hpy n GLY 105 N 2.97 -2.80 3.73 4.40 0.00 0.39 -0.38 105.19 113.49 3hpy n GLY 105 Ca -0.18 -1.48 -0.33 0.00 0.00 0.00 0.00 46.02 44.03 3hpy n GLY 105 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3hpy s GLU 106 N -5.31 2.15 0.05 1.61 -1.05 -1.26 -4.32 118.70 110.56 3hpy s GLU 106 Ca 0.67 1.60 0.04 0.00 -0.15 0.00 0.00 54.97 57.13 3hpy s GLU 106 Cb -0.07 -1.85 -0.02 0.00 -0.44 0.00 0.00 34.13 31.75 3hpy s GLU 106 CO 0.51 -1.79 -0.11 1.03 0.95 0.00 0.00 175.26 175.84 3hpy s ARG 107 N -4.12 0.72 -0.37 -4.83 0.52 0.90 -4.51 118.95 107.26 3hpy s ARG 107 Ca 0.71 -0.81 -0.15 0.00 -0.52 0.00 0.00 55.73 54.96 3hpy s ARG 107 Cb -0.25 -0.64 -0.00 0.00 0.52 0.00 0.00 34.95 34.57 3hpy s ARG 107 CO 0.47 0.14 0.36 0.08 0.02 0.00 0.00 175.30 176.37 3hpy s VAL 108 N -1.16 5.17 0.02 3.52 1.01 0.60 -0.17 120.40 129.38 3hpy s VAL 108 Ca -0.04 -0.12 0.04 0.00 0.00 0.00 0.00 61.98 61.86 3hpy s VAL 108 Cb -0.09 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 3hpy s VAL 108 CO 0.01 -0.18 -0.09 -0.60 0.00 0.00 0.00 175.10 174.24 3hpy s ARG 109 N 1.99 2.41 0.14 2.72 3.52 -0.19 -0.35 118.95 129.19 3hpy s ARG 109 Ca 0.11 -0.81 -0.17 0.00 -0.13 0.00 0.00 55.73 54.73 3hpy s ARG 109 Cb -0.17 -2.42 0.04 0.00 -1.56 0.00 0.00 34.95 30.84 3hpy s ARG 109 CO 0.12 0.58 0.45 -0.59 -0.81 0.00 0.00 175.30 175.05 3hpy s PHE 110 N -1.01 -0.24 -0.18 5.12 -0.12 0.02 -0.56 117.98 121.02 3hpy s PHE 110 Ca 0.17 -0.07 -0.06 0.00 -0.05 0.00 0.00 56.93 56.92 3hpy s PHE 110 Cb -0.11 0.33 -0.04 0.00 -0.63 0.00 0.00 43.02 42.57 3hpy s PHE 110 CO 0.08 -0.76 0.04 -2.00 -0.05 0.00 0.00 175.22 172.52 3hpy s GLU 111 N -3.81 3.88 0.59 1.99 2.12 -1.26 -0.22 118.70 121.98 3hpy s GLU 111 Ca 0.04 -0.40 -0.08 0.00 0.36 0.00 0.00 54.97 54.89 3hpy s GLU 111 Cb 0.01 -3.15 -0.02 0.00 0.26 0.00 0.00 34.13 31.23 3hpy s GLU 111 CO -0.10 0.23 0.95 -0.51 -0.54 0.00 0.00 175.26 175.28 3hpy s LEU 112 N 0.46 3.28 0.45 2.70 1.43 0.17 -4.93 118.68 122.24 3hpy s LEU 112 Ca 0.01 1.09 0.30 0.00 -1.03 0.00 0.00 54.13 54.50 3hpy s LEU 112 Cb -0.13 -4.02 1.61 0.00 0.03 0.00 0.00 46.19 43.68 3hpy s LEU 112 CO 0.01 -0.91 1.92 -0.65 0.23 0.00 0.00 176.35 176.95 3hpy h PRO 113 N -0.20 0.00 -0.00 1.29 0.11 -1.89 0.24 132.00 131.55 3hpy h PRO 113 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3hpy h PRO 113 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3hpy h PRO 113 CO 0.62 0.00 -0.15 -1.13 -0.21 0.00 0.00 178.00 177.13 3hpy n SER 114 N -2.56 0.60 0.00 -2.05 3.41 -1.24 -4.67 113.62 107.10 3hpy n SER 114 Ca -0.02 -0.63 0.00 0.00 -0.26 0.00 0.00 58.87 57.96 3hpy n SER 114 Cb 0.06 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 3hpy n SER 114 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hpy n GLY 115 N 1.30 1.85 3.81 5.00 0.00 0.85 -1.06 105.19 116.94 3hpy n GLY 115 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 3hpy n GLY 115 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3hpy s HIS 116 N -2.39 3.17 -0.23 1.61 3.76 -1.26 -4.31 115.29 115.63 3hpy s HIS 116 Ca 0.00 1.60 -0.13 0.00 -0.15 0.00 0.00 55.06 56.38 3hpy s HIS 116 Cb 0.00 -2.97 -0.04 0.00 1.11 0.00 0.00 32.58 30.67 3hpy s HIS 116 CO 0.00 -0.48 0.27 -0.51 -0.85 0.00 0.00 174.74 173.18 3hpy s LEU 117 N -3.26 4.12 0.03 0.89 1.43 -1.26 -0.65 118.68 119.98 3hpy s LEU 117 Ca 0.64 0.27 0.05 0.00 -1.03 0.00 0.00 54.13 54.07 3hpy s LEU 117 Cb -0.14 -2.29 -0.03 0.00 0.03 0.00 0.00 46.19 43.76 3hpy s LEU 117 CO 0.17 -0.02 -0.12 -0.63 0.23 0.00 0.00 176.35 175.98 3hpy s ILE 118 N 1.31 3.24 0.08 -0.59 -1.09 0.69 -1.84 121.20 123.00 3hpy s ILE 118 Ca 0.13 -1.02 0.06 0.00 -2.23 0.00 0.00 60.65 57.58 3hpy s ILE 118 Cb -0.14 -2.41 -0.03 0.00 -1.58 0.00 0.00 42.46 38.30 3hpy s ILE 118 CO 0.07 0.33 -0.16 -1.61 -1.23 0.00 0.00 174.94 172.33 3hpy s GLU 119 N -1.55 0.91 -0.02 2.79 2.02 -0.39 -0.80 118.70 121.66 3hpy s GLU 119 Ca 0.17 -0.99 0.04 0.00 0.02 0.00 0.00 54.97 54.21 3hpy s GLU 119 Cb -0.11 -0.99 -0.01 0.00 0.10 0.00 0.00 34.13 33.13 3hpy s GLU 119 CO 0.08 0.23 -0.15 -0.51 0.02 0.00 0.00 175.26 174.92 3hpy s LEU 120 N -1.73 1.96 0.12 1.80 1.02 0.53 -0.35 118.68 122.04 3hpy s LEU 120 Ca 0.01 -0.29 -0.12 0.00 0.02 0.00 0.00 54.13 53.74 3hpy s LEU 120 Cb -0.10 -0.83 0.01 0.00 0.02 0.00 0.00 46.19 45.30 3hpy s LEU 120 CO 0.03 0.16 0.31 -0.72 0.02 0.00 0.00 176.35 176.15 3hpy s TYR 121 N -0.17 0.02 0.00 0.29 1.13 -0.62 -0.29 117.35 117.71 3hpy s TYR 121 Ca 0.02 -0.39 0.00 0.00 -1.41 0.00 0.00 57.07 55.28 3hpy s TYR 121 Cb -0.08 0.10 0.00 0.00 -1.10 0.00 0.00 41.96 40.88 3hpy s TYR 121 CO 0.00 -0.66 0.00 0.00 -2.51 0.00 0.00 175.55 172.39 3hpy n ALA 122 N -0.17 1.75 -3.64 9.51 0.00 -1.26 0.59 120.51 127.29 3hpy n ALA 122 Ca -0.14 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.97 3hpy n ALA 122 Cb 0.63 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.92 3hpy n ALA 122 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3hpy s GLU 123 N -0.97 3.06 -0.23 0.00 8.01 -1.26 -4.80 118.70 122.52 3hpy s GLU 123 Ca 0.00 -0.83 -0.11 0.00 0.01 0.00 0.00 54.97 54.04 3hpy s GLU 123 Cb 0.00 -2.48 0.08 0.00 -4.31 0.00 0.00 34.13 27.41 3hpy s GLU 123 CO 0.00 -0.02 0.54 0.21 0.01 0.00 0.00 175.26 176.00 3hpy s LYS 124 N 0.84 0.52 0.29 1.61 2.47 -1.26 -0.46 119.74 123.74 3hpy s LYS 124 Ca -0.06 1.05 -0.30 0.00 -1.56 0.00 0.00 55.97 55.10 3hpy s LYS 124 Cb -0.15 0.18 -0.12 0.00 -1.46 0.00 0.00 37.83 36.28 3hpy s LYS 124 CO -0.02 -0.17 1.58 2.41 0.16 0.00 0.00 175.35 179.31 3hpy n THR 125 N 4.56 1.01 -3.23 3.43 -1.04 -0.74 -4.79 114.28 113.48 3hpy n THR 125 Ca -0.19 -0.25 -0.40 0.00 -2.04 0.00 0.00 64.05 61.17 3hpy n THR 125 Cb 0.55 -1.92 -0.07 0.00 -1.82 0.00 0.00 70.33 67.07 3hpy n THR 125 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3hpy n VAL 127 N 4.93 0.00 0.00 0.00 0.24 0.71 -4.91 118.33 119.30 3hpy n VAL 127 Ca -0.04 -0.24 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 3hpy n VAL 127 Cb 0.50 1.00 0.00 0.00 -1.47 0.00 0.00 33.84 33.87 3hpy n VAL 127 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hpy n GLY 128 N 1.26 0.05 1.19 7.63 0.00 -0.59 -4.69 105.19 110.04 3hpy n GLY 128 Ca 0.02 -1.84 0.08 0.00 0.00 0.00 0.00 46.02 44.28 3hpy n GLY 128 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3hpy n ASN 129 N -0.76 4.41 0.00 1.61 2.04 -1.23 -4.47 115.26 116.86 3hpy n ASN 129 Ca 0.00 -3.01 0.00 0.00 -0.44 0.00 0.00 54.58 51.13 3hpy n ASN 129 Cb 0.00 -0.59 0.00 0.00 -2.53 0.00 0.00 39.78 36.66 3hpy n ASN 129 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3hpy n GLY 130 N -0.20 0.72 3.37 4.83 0.00 -1.26 -4.62 105.19 108.03 3hpy n GLY 130 Ca 0.24 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.95 3hpy n GLY 130 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hpy s ILE 131 N -2.90 2.37 0.78 -0.61 1.01 -1.26 -5.04 121.20 115.54 3hpy s ILE 131 Ca 0.00 -1.14 -0.15 0.00 0.00 0.00 0.00 60.65 59.36 3hpy s ILE 131 Cb 0.00 -1.90 0.01 0.00 0.01 0.00 0.00 42.46 40.58 3hpy s ILE 131 CO 0.00 0.48 0.75 -0.24 0.00 0.00 0.00 174.94 175.93 3hpy n SER 132 N 2.08 -0.49 -0.14 3.58 2.88 -1.26 -4.89 113.62 115.37 3hpy n SER 132 Ca -0.16 0.56 0.13 0.00 -1.33 0.00 0.00 58.87 58.06 3hpy n SER 132 Cb 0.52 -1.32 0.33 0.00 -0.75 0.00 0.00 64.21 62.98 3hpy n SER 132 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 3hpy n GLU 133 N -1.69 0.47 -4.67 -1.46 2.13 -1.26 -4.22 120.64 109.94 3hpy n GLU 133 Ca 0.11 -0.27 -0.33 0.00 0.66 0.00 0.00 57.16 57.33 3hpy n GLU 133 Cb 0.50 -1.49 -0.15 0.00 0.27 0.00 0.00 31.44 30.57 3hpy n GLU 133 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3hpy s VAL 134 N -2.72 2.60 -1.27 6.31 0.11 -1.26 -4.66 120.40 119.51 3hpy s VAL 134 Ca 0.19 -0.80 -0.06 0.00 -2.93 0.00 0.00 61.98 58.37 3hpy s VAL 134 Cb 0.18 -2.08 -0.01 0.00 -1.53 0.00 0.00 36.38 32.95 3hpy s VAL 134 CO 0.60 0.52 0.66 0.59 -3.33 0.00 0.00 175.10 174.14 3hpy n ASN 135 N 3.91 -2.40 -4.76 3.54 3.02 -1.26 -4.89 115.26 112.42 3hpy n ASN 135 Ca -0.19 -0.92 -0.41 0.00 -0.03 0.00 0.00 54.58 53.03 3hpy n ASN 135 Cb 0.52 -3.65 -0.02 0.00 -0.61 0.00 0.00 39.78 36.01 3hpy n ASN 135 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3hpy s PRO 136 N -6.05 4.37 0.71 3.52 0.04 -1.26 -4.94 135.00 131.39 3hpy s PRO 136 Ca 0.16 2.17 -0.10 0.00 0.04 0.00 0.00 61.00 63.27 3hpy s PRO 136 Cb -0.05 -3.12 0.03 0.00 0.04 0.00 0.00 34.50 31.41 3hpy s PRO 136 CO 0.84 -0.22 1.08 0.00 0.04 0.00 0.00 177.00 178.74 3hpy s ALA 137 N -0.62 2.93 0.23 8.56 0.00 -1.26 -4.98 121.76 126.62 3hpy s ALA 137 Ca 0.52 -0.54 0.17 0.00 0.00 0.00 0.00 51.96 52.12 3hpy s ALA 137 Cb -0.39 -2.90 0.68 0.00 0.00 0.00 0.00 23.12 20.52 3hpy s ALA 137 CO 0.47 -1.23 1.75 -1.00 0.00 0.00 0.00 175.76 175.74 3hpy h PRO 138 N -0.67 0.00 -2.52 0.00 0.13 -2.02 -3.48 132.00 123.44 3hpy h PRO 138 Ca -0.45 0.00 0.18 0.00 -0.87 0.00 0.00 66.00 64.85 3hpy h PRO 138 Cb 1.28 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.38 3hpy h PRO 138 CO 0.63 0.40 0.62 1.67 -0.23 0.00 0.00 178.00 181.09 3hpy s TRP 139 N -3.72 0.08 0.05 1.56 1.48 -1.26 -5.14 118.94 111.99 3hpy s TRP 139 Ca -0.01 -0.46 -0.01 0.00 -1.06 0.00 0.00 56.10 54.56 3hpy s TRP 139 Cb 0.12 0.69 0.00 0.00 -1.16 0.00 0.00 33.47 33.12 3hpy s TRP 139 CO 0.70 -0.88 0.08 0.27 -4.06 0.00 0.00 176.95 173.06 3hpy n ASN 140 N -1.25 -0.23 -0.41 -2.66 0.23 -1.26 -5.03 115.26 104.64 3hpy n ASN 140 Ca -0.02 -1.24 0.33 0.00 -0.53 0.00 0.00 54.58 53.12 3hpy n ASN 140 Cb 0.59 0.40 0.62 0.00 -2.08 0.00 0.00 39.78 39.32 3hpy n ASN 140 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3hpy h ALA 141 N 1.68 2.66 -0.67 -2.53 0.00 -2.00 -0.79 119.26 117.62 3hpy h ALA 141 Ca -0.04 0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.05 3hpy h ALA 141 Cb 0.16 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 3hpy h ALA 141 CO 0.05 -1.21 0.45 1.96 0.00 0.00 0.00 179.25 180.50 3hpy h GLN 142 N 0.16 0.53 0.00 0.00 4.20 -1.96 -0.74 115.11 117.30 3hpy h GLN 142 Ca 0.74 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.42 3hpy h GLN 142 Cb 2.30 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 29.96 3hpy h GLN 142 CO -0.34 0.35 0.00 2.89 -0.67 0.00 0.00 178.83 181.06 3hpy n ARG 143 N -4.48 0.67 -0.08 1.46 1.85 -0.30 -2.13 116.66 113.64 3hpy n ARG 143 Ca 0.11 0.00 0.04 0.00 -1.00 0.00 0.00 57.85 57.00 3hpy n ARG 143 Cb 0.34 -1.26 0.06 0.00 -1.05 0.00 0.00 32.46 30.54 3hpy n ARG 143 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 3hpy n GLU 144 N -0.76 1.66 -3.10 2.89 1.02 -0.29 -4.73 120.64 117.32 3hpy n GLU 144 Ca 0.08 -1.81 -0.44 0.00 -0.02 0.00 0.00 57.16 54.97 3hpy n GLU 144 Cb 0.04 -1.11 -0.05 0.00 -0.02 0.00 0.00 31.44 30.30 3hpy n GLU 144 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3hpy s HIS 145 N -1.60 2.98 0.00 -0.32 2.46 -0.91 -4.93 115.29 112.98 3hpy s HIS 145 Ca 0.14 -0.71 0.00 0.00 0.47 0.00 0.00 55.06 54.96 3hpy s HIS 145 Cb 0.12 -3.84 0.00 0.00 -0.13 0.00 0.00 32.58 28.73 3hpy s HIS 145 CO 0.01 -1.22 0.00 0.41 -2.47 0.00 0.00 174.74 171.47 3hpy n GLY 146 N 5.23 0.67 0.25 1.59 0.00 -1.26 -3.27 105.19 108.42 3hpy n GLY 146 Ca -0.07 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.09 3hpy n GLY 146 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3hpy h ILE 147 N 0.00 0.85 -5.30 -0.61 2.04 -0.10 -3.45 117.51 110.94 3hpy h ILE 147 Ca 0.00 -0.19 -0.19 0.00 1.00 0.00 0.00 64.86 65.48 3hpy h ILE 147 Cb 0.00 0.25 0.15 0.00 -0.74 0.00 0.00 36.82 36.48 3hpy h ILE 147 CO 0.00 0.10 -0.65 0.00 0.00 0.00 0.00 178.15 177.60 3hpy n ALA 148 N -2.41 -2.39 -1.18 1.87 0.00 0.06 -4.90 120.51 111.56 3hpy n ALA 148 Ca 0.10 0.11 -0.31 0.00 0.00 0.00 0.00 53.44 53.33 3hpy n ALA 148 Cb 0.25 -4.71 0.11 0.00 0.00 0.00 0.00 19.45 15.10 3hpy n ALA 148 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3hpy s PRO 149 N -4.05 1.95 -0.01 0.00 0.04 -1.25 -4.91 135.00 126.76 3hpy s PRO 149 Ca 0.35 1.16 -0.03 0.00 0.04 0.00 0.00 61.00 62.52 3hpy s PRO 149 Cb -0.05 -1.86 -0.27 0.00 0.04 0.00 0.00 34.50 32.36 3hpy s PRO 149 CO 0.70 -1.86 0.80 0.82 0.04 0.00 0.00 177.00 177.50 3hpy h ILE 150 N -1.29 1.08 -2.60 0.56 2.04 -0.81 -3.33 117.51 113.16 3hpy h ILE 150 Ca -0.44 -2.74 0.01 0.00 1.00 0.00 0.00 64.86 62.69 3hpy h ILE 150 Cb 1.24 2.72 -0.14 0.00 -0.74 0.00 0.00 36.82 39.90 3hpy h ILE 150 CO 0.51 0.81 0.29 0.00 0.00 0.00 0.00 178.15 179.76 3hpy s GLN 151 N -2.61 1.10 -0.39 2.37 -2.07 -1.25 -3.77 119.66 113.03 3hpy s GLN 151 Ca -0.10 -0.29 -0.29 0.00 -1.82 0.00 0.00 55.36 52.86 3hpy s GLN 151 Cb 0.07 0.51 0.01 0.00 -1.09 0.00 0.00 33.01 32.51 3hpy s GLN 151 CO 0.84 -0.46 1.35 -1.17 -1.32 0.00 0.00 175.29 174.54 3hpy s LEU 152 N -2.36 3.66 -0.06 2.60 2.96 -1.26 -1.50 118.68 122.72 3hpy s LEU 152 Ca 0.00 0.87 -0.07 0.00 -0.22 0.00 0.00 54.13 54.71 3hpy s LEU 152 Cb -0.01 -3.54 -0.29 0.00 0.50 0.00 0.00 46.19 42.85 3hpy s LEU 152 CO -0.08 -1.33 0.62 -0.78 -1.32 0.00 0.00 176.35 173.47 3hpy h ASP 153 N 10.19 0.50 0.00 3.68 3.58 -0.92 -3.43 116.42 130.02 3hpy h ASP 153 Ca -0.27 -0.83 0.00 0.00 0.42 0.00 0.00 57.03 56.36 3hpy h ASP 153 Cb 1.10 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 41.98 3hpy h ASP 153 CO 1.08 1.71 0.00 0.00 -2.88 0.00 0.00 179.24 179.15 3hpy n HIS 154 N -3.51 0.00 -3.86 0.28 1.44 -1.21 -4.58 115.22 103.79 3hpy n HIS 154 Ca -0.25 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.37 3hpy n HIS 154 Cb 1.06 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 31.11 3hpy n HIS 154 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3hpy s LEU 156 N -2.91 2.03 -0.13 0.00 0.20 -0.07 -1.86 118.68 115.94 3hpy s LEU 156 Ca 0.12 -0.90 -0.05 0.00 0.69 0.00 0.00 54.13 53.99 3hpy s LEU 156 Cb 0.03 -1.04 -0.04 0.00 -0.43 0.00 0.00 46.19 44.71 3hpy s LEU 156 CO -0.04 -0.21 0.06 -0.76 -0.29 0.00 0.00 176.35 175.11 3hpy s LEU 157 N 1.53 3.85 -0.32 -0.68 1.02 -0.53 -0.91 118.68 122.64 3hpy s LEU 157 Ca -0.02 0.20 -0.12 0.00 0.02 0.00 0.00 54.13 54.21 3hpy s LEU 157 Cb -0.17 -1.93 -0.02 0.00 0.02 0.00 0.00 46.19 44.09 3hpy s LEU 157 CO -0.07 0.31 0.20 -0.31 0.02 0.00 0.00 176.35 176.50 3hpy s TYR 158 N -0.47 3.21 0.22 0.29 1.51 -0.31 -1.00 117.35 120.80 3hpy s TYR 158 Ca 0.10 -0.27 -0.17 0.00 -1.01 0.00 0.00 57.07 55.72 3hpy s TYR 158 Cb -0.12 -2.42 0.02 0.00 -0.11 0.00 0.00 41.96 39.33 3hpy s TYR 158 CO 0.02 -0.36 0.55 0.20 -1.11 0.00 0.00 175.55 174.85 3hpy s GLY 159 N 1.69 0.04 0.52 0.71 0.00 -0.36 -2.55 107.32 107.37 3hpy s GLY 159 Ca 0.06 -0.37 -0.03 0.00 0.00 0.00 0.00 44.72 44.38 3hpy s GLY 159 CO 0.09 -0.31 0.79 2.56 0.00 0.00 0.00 173.10 176.24 3hpy s PRO 160 N -3.91 3.00 -1.00 2.90 0.04 -0.13 0.25 135.00 136.15 3hpy s PRO 160 Ca 0.12 -0.22 -0.07 0.00 0.04 0.00 0.00 61.00 60.87 3hpy s PRO 160 Cb -0.02 -2.40 0.01 0.00 0.04 0.00 0.00 34.50 32.12 3hpy s PRO 160 CO 0.01 -0.49 0.87 0.09 0.04 0.00 0.00 177.00 177.52 3hpy n ASN 161 N -2.35 -5.20 0.20 6.66 3.02 -1.26 -3.63 115.26 112.70 3hpy n ASN 161 Ca 0.03 -0.40 0.04 0.00 -0.03 0.00 0.00 54.58 54.22 3hpy n ASN 161 Cb 0.58 -3.84 0.43 0.00 -0.61 0.00 0.00 39.78 36.34 3hpy n ASN 161 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 3hpy h ILE 162 N -1.99 1.16 -0.78 2.41 1.08 -1.93 -2.49 117.51 114.97 3hpy h ILE 162 Ca -0.42 -1.01 -0.04 0.00 -0.39 0.00 0.00 64.86 63.00 3hpy h ILE 162 Cb 1.27 1.55 -0.03 0.00 -3.07 0.00 0.00 36.82 36.54 3hpy h ILE 162 CO 0.41 0.28 0.32 0.00 -0.69 0.00 0.00 178.15 178.48 3hpy h ALA 163 N 1.71 1.10 0.00 1.87 0.00 -1.90 0.10 119.26 122.15 3hpy h ALA 163 Ca -0.00 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 3hpy h ALA 163 Cb 0.53 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3hpy h ALA 163 CO 0.04 0.65 -0.66 0.93 0.00 0.00 0.00 179.25 180.20 3hpy h GLU 164 N 1.13 0.00 -0.37 0.00 5.08 -1.85 -2.68 114.58 115.89 3hpy h GLU 164 Ca 0.26 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.54 3hpy h GLU 164 Cb 0.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 3hpy h GLU 164 CO -0.02 0.66 -0.08 0.28 -1.00 0.00 0.00 179.01 178.85 3hpy h VAL 165 N 0.00 1.28 -0.63 3.13 2.07 -0.94 -2.69 116.25 118.46 3hpy h VAL 165 Ca -0.01 -1.14 0.05 0.00 0.82 0.00 0.00 66.70 66.42 3hpy h VAL 165 Cb 1.18 1.27 -0.05 0.00 -1.52 0.00 0.00 31.29 32.17 3hpy h VAL 165 CO 0.09 0.38 0.36 -0.61 0.02 0.00 0.00 177.57 177.81 3hpy h GLN 166 N 0.50 0.67 0.02 1.57 4.15 -0.66 -2.27 115.11 119.09 3hpy h GLN 166 Ca 0.09 -0.04 0.02 0.00 0.77 0.00 0.00 58.65 59.49 3hpy h GLN 166 Cb 0.59 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 28.09 3hpy h GLN 166 CO 0.03 0.44 -0.15 0.87 -1.93 0.00 0.00 178.83 178.09 3hpy h LYS 167 N 0.69 -0.26 -0.43 1.69 1.57 -1.33 -0.36 116.57 118.14 3hpy h LYS 167 Ca 0.27 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 59.13 3hpy h LYS 167 Cb 0.12 0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.43 3hpy h LYS 167 CO -0.15 -0.17 0.12 0.82 -0.57 0.00 0.00 179.45 179.51 3hpy h ILE 168 N -0.27 0.82 -0.39 1.86 2.04 -1.22 0.34 117.51 120.71 3hpy h ILE 168 Ca 0.05 -0.09 -0.12 0.00 1.00 0.00 0.00 64.86 65.69 3hpy h ILE 168 Cb 0.32 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 3hpy h ILE 168 CO -0.14 0.05 -0.25 -0.26 0.00 0.00 0.00 178.15 177.55 3hpy h PHE 169 N 0.28 0.91 0.00 1.37 -1.00 -1.17 -0.53 116.94 116.80 3hpy h PHE 169 Ca 0.21 -0.22 -0.20 0.00 2.81 0.00 0.00 57.97 60.57 3hpy h PHE 169 Cb 0.22 -0.21 -0.03 0.00 3.61 0.00 0.00 35.95 39.54 3hpy h PHE 169 CO -0.18 0.96 -1.30 1.79 -1.61 0.00 0.00 178.31 177.97 3hpy h THR 170 N 0.69 0.85 0.00 -1.55 1.35 -0.74 -0.25 112.91 113.25 3hpy h THR 170 Ca 0.09 -2.46 -0.15 0.00 -0.55 0.00 0.00 66.41 63.34 3hpy h THR 170 Cb 0.77 2.33 -0.03 0.00 -1.73 0.00 0.00 68.15 69.50 3hpy h THR 170 CO 0.06 0.48 -1.92 -0.62 -0.25 0.00 0.00 175.52 173.28 3hpy n GLU 171 N -3.06 0.66 -0.04 4.72 1.02 0.12 -4.36 120.64 119.70 3hpy n GLU 171 Ca -0.09 -0.03 -0.07 0.00 -0.02 0.00 0.00 57.16 56.95 3hpy n GLU 171 Cb 0.90 -1.60 -0.03 0.00 -0.02 0.00 0.00 31.44 30.69 3hpy n GLU 171 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3hpy n VAL 172 N -2.57 0.44 1.52 2.62 0.31 -0.26 -4.78 118.33 115.61 3hpy n VAL 172 Ca -0.14 -0.14 0.12 0.00 -0.01 0.00 0.00 64.34 64.18 3hpy n VAL 172 Cb 0.80 -1.20 0.52 0.00 -0.91 0.00 0.00 33.84 33.04 3hpy n VAL 172 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3hpy n LEU 173 N -3.05 1.17 -1.16 7.52 4.32 -0.88 -4.94 117.00 119.97 3hpy n LEU 173 Ca -0.15 -0.45 -0.09 0.00 -0.02 0.00 0.00 56.01 55.30 3hpy n LEU 173 Cb 0.63 -0.04 0.00 0.00 -1.62 0.00 0.00 43.42 42.39 3hpy n LEU 173 CO 0.04 0.22 -0.09 0.61 -1.22 0.00 0.00 177.39 176.96 3hpy n GLY 174 N 1.08 0.03 3.99 -0.72 0.00 -1.07 -4.38 105.19 104.12 3hpy n GLY 174 Ca 0.18 -0.47 -0.18 0.00 0.00 0.00 0.00 46.02 45.55 3hpy n GLY 174 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hpy s PHE 175 N -2.55 2.87 -0.01 1.61 0.40 -0.13 -4.72 117.98 115.46 3hpy s PHE 175 Ca 0.04 -0.36 -0.09 0.00 -0.60 0.00 0.00 56.93 55.91 3hpy s PHE 175 Cb -0.02 -2.27 0.01 0.00 0.51 0.00 0.00 43.02 41.25 3hpy s PHE 175 CO 0.04 -0.30 0.19 1.52 0.70 0.00 0.00 175.22 177.37 3hpy s TYR 176 N -2.32 -0.03 -0.10 0.36 -0.85 -0.11 -4.16 117.35 110.14 3hpy s TYR 176 Ca 0.52 0.00 -0.30 0.00 -0.52 0.00 0.00 57.07 56.78 3hpy s TYR 176 Cb -0.09 -0.00 -0.03 0.00 0.38 0.00 0.00 41.96 42.21 3hpy s TYR 176 CO 0.32 -0.31 1.40 -1.17 -1.52 0.00 0.00 175.55 174.28 3hpy s LEU 177 N -1.31 4.25 -0.24 -3.49 0.20 -1.26 -1.32 118.68 115.51 3hpy s LEU 177 Ca -0.14 1.92 -0.12 0.00 0.69 0.00 0.00 54.13 56.49 3hpy s LEU 177 Cb -0.07 -3.54 -0.16 0.00 -0.43 0.00 0.00 46.19 41.99 3hpy s LEU 177 CO 0.02 -0.80 -0.12 0.52 -0.29 0.00 0.00 176.35 175.69 3hpy n VAL 178 N 5.29 1.55 -3.99 1.68 0.31 0.11 -4.04 118.33 119.24 3hpy n VAL 178 Ca 0.15 -0.38 -0.09 0.00 -0.01 0.00 0.00 64.34 64.02 3hpy n VAL 178 Cb 0.44 -1.80 -0.10 0.00 -0.91 0.00 0.00 33.84 31.47 3hpy n VAL 178 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3hpy s GLU 179 N -2.48 0.49 0.04 5.55 2.02 -1.15 -0.87 118.70 122.30 3hpy s GLU 179 Ca -0.34 -0.83 -0.02 0.00 0.02 0.00 0.00 54.97 53.80 3hpy s GLU 179 Cb 0.11 0.18 -0.03 0.00 0.10 0.00 0.00 34.13 34.49 3hpy s GLU 179 CO 0.57 -0.10 0.01 -0.98 0.02 0.00 0.00 175.26 174.78 3hpy s ARG 180 N -2.53 0.56 -0.26 1.61 1.70 -0.20 -1.76 118.95 118.06 3hpy s ARG 180 Ca -0.06 -0.98 0.02 0.00 -0.47 0.00 0.00 55.73 54.24 3hpy s ARG 180 Cb -0.02 0.20 0.05 0.00 -0.57 0.00 0.00 34.95 34.62 3hpy s ARG 180 CO -0.05 -0.12 -0.10 0.08 -1.08 0.00 0.00 175.30 174.04 3hpy s VAL 181 N -3.13 2.29 0.79 4.99 1.01 -0.48 0.11 120.40 125.98 3hpy s VAL 181 Ca -0.00 -1.54 -0.14 0.00 0.00 0.00 0.00 61.98 60.30 3hpy s VAL 181 Cb 0.02 -2.31 0.05 0.00 0.00 0.00 0.00 36.38 34.14 3hpy s VAL 181 CO -0.07 0.01 1.04 0.18 0.00 0.00 0.00 175.10 176.26 3hpy n LEU 182 N 4.48 3.61 -4.88 3.92 4.32 0.24 -0.40 117.00 128.29 3hpy n LEU 182 Ca -0.15 0.59 -0.31 0.00 -0.02 0.00 0.00 56.01 56.13 3hpy n LEU 182 Cb 0.43 -1.44 -0.04 0.00 -1.62 0.00 0.00 43.42 40.75 3hpy n LEU 182 CO 0.22 -2.02 0.32 -0.94 -1.22 0.00 0.00 177.39 173.75 3hpy s SER 183 N -1.94 6.57 0.03 -1.43 1.04 -0.66 -3.38 113.70 113.94 3hpy s SER 183 Ca 0.72 1.00 -0.07 0.00 0.48 0.00 0.00 55.95 58.08 3hpy s SER 183 Cb -0.30 -2.26 -0.01 0.00 0.10 0.00 0.00 66.02 63.54 3hpy s SER 183 CO 0.52 -0.23 0.40 -2.65 0.98 0.00 0.00 173.24 172.26 3hpy n PRO 184 N -0.76 -0.09 0.00 4.02 -0.02 -1.26 -3.92 135.00 132.97 3hpy n PRO 184 Ca 0.01 0.39 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 3hpy n PRO 184 Cb 0.53 -0.58 0.00 0.00 -0.02 0.00 0.00 33.50 33.44 3hpy n PRO 184 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3hpy n ASP 185 N -3.81 0.00 0.18 2.55 4.64 -1.26 -4.84 116.55 114.02 3hpy n ASP 185 Ca 0.00 -0.41 0.13 0.00 -1.38 0.00 0.00 54.79 53.14 3hpy n ASP 185 Cb 0.05 0.00 0.64 0.00 -1.04 0.00 0.00 41.12 40.78 3hpy n ASP 185 CO 0.00 0.00 0.00 1.23 -0.82 0.00 0.00 177.20 177.61 3hpy h GLY 186 N 0.00 0.00 -6.04 0.27 0.00 -2.00 -3.46 103.07 91.84 3hpy h GLY 186 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 3hpy h GLY 186 CO 0.00 0.00 -1.00 1.22 0.00 0.00 0.00 176.54 176.76 3hpy n ASP 187 N -2.43 -6.76 -0.63 0.19 9.92 -1.25 -5.02 116.55 110.57 3hpy n ASP 187 Ca -0.00 0.48 0.00 0.00 -0.53 0.00 0.00 54.79 54.74 3hpy n ASP 187 Cb 0.13 -2.82 0.00 0.00 -0.64 0.00 0.00 41.12 37.79 3hpy n ASP 187 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 3hpy n SER 188 N 0.60 0.00 -4.41 -2.24 3.41 -1.26 -4.93 113.62 104.79 3hpy n SER 188 Ca -0.01 -0.63 -0.33 0.00 -0.26 0.00 0.00 58.87 57.64 3hpy n SER 188 Cb 0.44 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.26 3hpy n SER 188 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3hpy s ASP 189 N -0.16 4.21 0.09 4.04 1.01 -1.26 -1.65 116.67 122.94 3hpy s ASP 189 Ca 0.00 -0.27 0.24 0.00 0.71 0.00 0.00 52.55 53.23 3hpy s ASP 189 Cb 0.00 -1.63 0.23 0.00 1.01 0.00 0.00 42.92 42.54 3hpy s ASP 189 CO 0.00 0.17 1.21 0.23 0.21 0.00 0.00 175.17 176.99 3hpy n MET 190 N 3.47 0.28 -3.67 8.23 2.81 0.47 -4.80 117.12 123.91 3hpy n MET 190 Ca -0.18 0.05 -0.14 0.00 -1.81 0.00 0.00 57.70 55.61 3hpy n MET 190 Cb 0.53 -1.64 -0.08 0.00 -0.71 0.00 0.00 33.22 31.31 3hpy n MET 190 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 3hpy s GLY 191 N -3.64 -0.40 0.01 3.03 0.00 -1.18 -0.94 107.32 104.20 3hpy s GLY 191 Ca 0.05 1.30 0.01 0.00 0.00 0.00 0.00 44.72 46.08 3hpy s GLY 191 CO 0.75 1.05 -0.04 -0.26 0.00 0.00 0.00 173.10 174.61 3hpy s ILE 192 N -0.28 0.24 -0.25 0.90 -4.36 0.19 -1.38 121.20 116.26 3hpy s ILE 192 Ca -0.04 -0.44 0.01 0.00 -0.26 0.00 0.00 60.65 59.92 3hpy s ILE 192 Cb -0.03 -0.27 0.06 0.00 1.25 0.00 0.00 42.46 43.48 3hpy s ILE 192 CO 0.03 -0.13 -0.05 0.26 0.24 0.00 0.00 174.94 175.29 3hpy s TRP 193 N -0.57 2.66 0.03 1.37 0.51 -0.73 -0.41 118.94 121.81 3hpy s TRP 193 Ca -0.04 -1.98 0.01 0.00 -2.12 0.00 0.00 56.10 51.97 3hpy s TRP 193 Cb -0.04 -1.76 -0.04 0.00 -0.81 0.00 0.00 33.47 30.81 3hpy s TRP 193 CO -0.00 -0.82 0.09 -0.51 -0.51 0.00 0.00 176.95 175.20 3hpy s LEU 194 N 1.30 3.88 0.05 2.99 1.43 -0.40 -0.71 118.68 127.22 3hpy s LEU 194 Ca -0.05 0.09 0.05 0.00 -1.03 0.00 0.00 54.13 53.20 3hpy s LEU 194 Cb -0.19 -2.39 -0.02 0.00 0.03 0.00 0.00 46.19 43.62 3hpy s LEU 194 CO -0.07 0.23 -0.14 -0.55 0.23 0.00 0.00 176.35 176.05 3hpy s SER 195 N -2.02 1.67 -0.14 2.29 0.15 -0.43 0.15 113.70 115.36 3hpy s SER 195 Ca 0.26 -0.49 0.14 0.00 0.70 0.00 0.00 55.95 56.56 3hpy s SER 195 Cb -0.12 -0.09 0.35 0.00 -1.71 0.00 0.00 66.02 64.44 3hpy s SER 195 CO 0.18 0.01 1.17 0.00 1.20 0.00 0.00 173.24 175.80 3hpy n SER 197 N -0.93 3.16 -0.61 0.00 3.41 -1.26 -4.76 113.62 112.62 3hpy n SER 197 Ca 0.15 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.85 3hpy n SER 197 Cb 0.73 0.00 0.22 0.00 -0.26 0.00 0.00 64.21 64.90 3hpy n SER 197 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hpy n HIS 198 N 0.00 0.62 -3.01 7.33 1.44 -1.26 -4.58 115.22 115.76 3hpy n HIS 198 Ca 0.00 -0.90 -0.32 0.00 -2.01 0.00 0.00 57.72 54.49 3hpy n HIS 198 Cb 0.00 -0.25 -0.05 0.00 0.12 0.00 0.00 29.99 29.81 3hpy n HIS 198 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 3hpy s LYS 199 N -2.78 3.93 0.30 -1.40 1.02 -1.26 -3.30 119.74 116.26 3hpy s LYS 199 Ca 0.38 0.63 0.05 0.00 0.02 0.00 0.00 55.97 57.05 3hpy s LYS 199 Cb 0.31 -2.40 0.73 0.00 -0.52 0.00 0.00 37.83 35.95 3hpy s LYS 199 CO 0.07 0.07 1.77 -0.39 -0.92 0.00 0.00 175.35 175.96 3hpy h VAL 200 N 1.64 0.71 -1.74 3.17 -1.51 -1.92 -3.44 116.25 113.16 3hpy h VAL 200 Ca -0.48 -0.26 0.03 0.00 -1.23 0.00 0.00 66.70 64.76 3hpy h VAL 200 Cb 1.18 -0.12 -0.24 0.00 -2.13 0.00 0.00 31.29 29.98 3hpy h VAL 200 CO 0.65 0.14 0.35 -1.38 -1.23 0.00 0.00 177.57 176.10 3hpy s HIS 201 N -5.86 -0.57 -0.20 5.19 0.00 -1.26 -4.62 115.29 107.97 3hpy s HIS 201 Ca -0.11 1.33 0.17 0.00 -3.00 0.00 0.00 55.06 53.44 3hpy s HIS 201 Cb 0.25 0.35 -0.24 0.00 -4.00 0.00 0.00 32.58 28.94 3hpy s HIS 201 CO 0.80 -0.31 0.44 -0.25 -1.00 0.00 0.00 174.74 174.43 3hpy n ASP 202 N 2.13 1.09 -3.55 7.38 8.00 0.12 -4.71 116.55 127.01 3hpy n ASP 202 Ca -0.13 -0.21 -0.11 0.00 0.71 0.00 0.00 54.79 55.05 3hpy n ASP 202 Cb 0.56 1.58 -0.04 0.00 -0.02 0.00 0.00 41.12 43.20 3hpy n ASP 202 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3hpy s ILE 203 N -3.01 0.00 0.07 0.53 2.07 -1.07 -4.10 121.20 115.69 3hpy s ILE 203 Ca -0.03 0.00 -0.06 0.00 -1.41 0.00 0.00 60.65 59.15 3hpy s ILE 203 Cb 0.11 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.69 3hpy s ILE 203 CO 0.69 0.00 0.11 0.00 -1.91 0.00 0.00 174.94 173.83 3hpy s ALA 204 N -1.73 0.03 0.03 1.50 0.00 -0.78 -1.28 121.76 119.54 3hpy s ALA 204 Ca -0.01 -0.81 0.02 0.00 0.00 0.00 0.00 51.96 51.16 3hpy s ALA 204 Cb -0.01 0.40 -0.02 0.00 0.00 0.00 0.00 23.12 23.49 3hpy s ALA 204 CO -0.01 -0.45 -0.07 -0.06 0.00 0.00 0.00 175.76 175.17 3hpy s PHE 205 N -3.79 0.63 -0.07 0.00 0.40 0.45 -1.45 117.98 114.13 3hpy s PHE 205 Ca 0.05 -0.41 0.01 0.00 -0.60 0.00 0.00 56.93 55.98 3hpy s PHE 205 Cb 0.06 -0.38 0.02 0.00 0.51 0.00 0.00 43.02 43.22 3hpy s PHE 205 CO -0.10 -0.07 -0.08 0.08 0.70 0.00 0.00 175.22 175.75 3hpy s VAL 206 N -1.11 0.91 -0.01 -0.44 1.01 -0.17 -0.64 120.40 119.95 3hpy s VAL 206 Ca -0.07 -0.30 -0.32 0.00 0.00 0.00 0.00 61.98 61.28 3hpy s VAL 206 Cb -0.08 -0.89 -0.10 0.00 0.00 0.00 0.00 36.38 35.30 3hpy s VAL 206 CO 0.00 0.32 1.92 1.21 0.00 0.00 0.00 175.10 178.56 3hpy n GLU 207 N 4.27 2.56 -3.76 2.72 4.07 -0.11 -1.23 120.64 129.16 3hpy n GLU 207 Ca -0.19 0.94 -0.13 0.00 -0.06 0.00 0.00 57.16 57.71 3hpy n GLU 207 Cb 0.51 -2.84 -0.11 0.00 -0.06 0.00 0.00 31.44 28.94 3hpy n GLU 207 CO 0.00 0.00 0.00 -0.47 -0.06 0.00 0.00 177.13 176.60 3hpy s TYR 208 N 4.17 -0.36 0.14 4.31 5.04 0.14 -4.80 117.35 126.00 3hpy s TYR 208 Ca 0.90 0.86 -0.23 0.00 -2.44 0.00 0.00 57.07 56.16 3hpy s TYR 208 Cb -0.55 0.12 0.01 0.00 0.35 0.00 0.00 41.96 41.89 3hpy s TYR 208 CO 0.46 -0.20 1.63 -1.35 -1.34 0.00 0.00 175.55 174.75 3hpy h PRO 209 N 5.46 -0.27 -6.51 4.97 0.11 -1.93 -0.32 132.00 133.51 3hpy h PRO 209 Ca -0.27 0.02 -0.53 0.00 0.11 0.00 0.00 66.00 65.33 3hpy h PRO 209 Cb 1.19 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 3hpy h PRO 209 CO 0.30 -0.18 0.47 -1.21 -0.21 0.00 0.00 178.00 177.16 3hpy s GLU 210 N -6.07 4.53 0.52 1.05 2.02 -1.26 -4.58 118.70 114.91 3hpy s GLU 210 Ca -0.15 1.62 -0.13 0.00 0.02 0.00 0.00 54.97 56.34 3hpy s GLU 210 Cb 0.11 -3.37 -0.06 0.00 0.10 0.00 0.00 34.13 30.91 3hpy s GLU 210 CO 0.67 -0.08 0.93 0.15 0.02 0.00 0.00 175.26 176.96 3hpy s LYS 211 N 0.64 3.77 -0.17 1.61 1.02 -1.26 -4.03 119.74 121.32 3hpy s LYS 211 Ca 0.54 0.72 0.00 0.00 0.02 0.00 0.00 55.97 57.25 3hpy s LYS 211 Cb -0.26 -2.20 0.00 0.00 -0.52 0.00 0.00 37.83 34.85 3hpy s LYS 211 CO 0.30 -0.30 0.00 0.41 -0.92 0.00 0.00 175.35 174.84 3hpy n GLY 212 N -1.92 0.34 3.73 -3.33 0.00 -0.22 -4.93 105.19 98.85 3hpy n GLY 212 Ca 0.05 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3hpy n GLY 212 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hpy s LYS 213 N -1.45 4.40 -0.20 1.61 -0.14 -1.06 -4.69 119.74 118.21 3hpy s LYS 213 Ca 0.00 1.97 -0.08 0.00 -1.36 0.00 0.00 55.97 56.50 3hpy s LYS 213 Cb 0.00 -3.24 -0.04 0.00 -1.68 0.00 0.00 37.83 32.86 3hpy s LYS 213 CO 0.00 -0.27 0.09 -1.17 -0.76 0.00 0.00 175.35 173.24 3hpy s LEU 214 N 0.38 3.88 -0.20 3.17 1.98 -1.26 -1.16 118.68 125.47 3hpy s LEU 214 Ca 0.58 0.07 -0.22 0.00 -2.89 0.00 0.00 54.13 51.67 3hpy s LEU 214 Cb -0.35 -2.00 -0.20 0.00 0.66 0.00 0.00 46.19 44.31 3hpy s LEU 214 CO 0.34 0.13 0.28 -0.74 -1.89 0.00 0.00 176.35 174.47 3hpy h HIS 215 N 7.03 0.00 -1.26 5.38 -0.00 -1.38 -3.47 115.15 121.45 3hpy h HIS 215 Ca -0.38 0.00 0.29 0.00 -0.00 0.00 0.00 60.37 60.29 3hpy h HIS 215 Cb 1.17 0.00 -0.20 0.00 -0.00 0.00 0.00 27.41 28.38 3hpy h HIS 215 CO 0.60 1.39 0.90 -3.38 -0.00 0.00 0.00 177.93 177.44 3hpy s HIS 216 N -2.34 -0.07 0.18 5.26 -3.43 -1.16 -4.18 115.29 109.56 3hpy s HIS 216 Ca -0.27 0.04 0.05 0.00 -0.80 0.00 0.00 55.06 54.08 3hpy s HIS 216 Cb 0.05 0.51 -0.04 0.00 -1.43 0.00 0.00 32.58 31.67 3hpy s HIS 216 CO 0.59 -0.11 0.21 0.00 -2.00 0.00 0.00 174.74 173.43 3hpy s SER 218 N -3.36 1.59 -0.05 0.00 0.15 0.39 -1.14 113.70 111.28 3hpy s SER 218 Ca 0.32 -0.25 0.05 0.00 0.70 0.00 0.00 55.95 56.78 3hpy s SER 218 Cb -0.10 -0.23 -0.02 0.00 -1.71 0.00 0.00 66.02 63.96 3hpy s SER 218 CO 0.25 0.15 -0.21 -0.36 1.20 0.00 0.00 173.24 174.28 3hpy s PHE 219 N -0.23 2.53 0.18 3.44 0.40 0.22 -0.20 117.98 124.32 3hpy s PHE 219 Ca 0.03 -0.43 -0.22 0.00 -0.60 0.00 0.00 56.93 55.71 3hpy s PHE 219 Cb -0.06 -1.60 -0.08 0.00 0.51 0.00 0.00 43.02 41.79 3hpy s PHE 219 CO -0.00 -0.02 0.73 -1.17 0.70 0.00 0.00 175.22 175.46 3hpy s LEU 220 N -0.46 4.49 0.23 -0.37 2.96 -0.56 -1.75 118.68 123.22 3hpy s LEU 220 Ca 0.05 1.51 0.11 0.00 -0.22 0.00 0.00 54.13 55.59 3hpy s LEU 220 Cb -0.12 -3.36 -0.05 0.00 0.50 0.00 0.00 46.19 43.17 3hpy s LEU 220 CO 0.01 0.15 -0.20 -0.76 -1.32 0.00 0.00 176.35 174.23 3hpy s LEU 221 N -1.46 2.57 0.04 -0.68 1.02 0.19 -0.03 118.68 120.33 3hpy s LEU 221 Ca 0.38 -0.89 -0.27 0.00 0.02 0.00 0.00 54.13 53.36 3hpy s LEU 221 Cb -0.20 -1.21 -0.17 0.00 0.02 0.00 0.00 46.19 44.63 3hpy s LEU 221 CO 0.23 0.08 1.47 -0.33 0.02 0.00 0.00 176.35 177.83 3hpy h GLU 222 N 2.77 -0.42 -4.27 1.70 4.39 -1.93 -3.40 114.58 113.42 3hpy h GLU 222 Ca -0.44 0.03 -0.23 0.00 0.34 0.00 0.00 59.36 59.06 3hpy h GLU 222 Cb 1.23 0.10 -0.11 0.00 -0.10 0.00 0.00 28.75 29.86 3hpy h GLU 222 CO 0.53 -0.17 -0.37 -1.54 -1.16 0.00 0.00 179.01 176.30 3hpy s SER 223 N -4.94 0.48 0.40 1.42 1.04 -1.26 -4.90 113.70 105.94 3hpy s SER 223 Ca -0.15 -1.34 0.07 0.00 0.48 0.00 0.00 55.95 55.00 3hpy s SER 223 Cb 0.03 0.53 0.84 0.00 0.10 0.00 0.00 66.02 67.52 3hpy s SER 223 CO 0.60 -1.06 2.05 -0.25 0.98 0.00 0.00 173.24 175.56 3hpy h TRP 224 N 2.33 0.53 -0.14 5.02 -0.00 -1.94 -1.52 115.95 120.23 3hpy h TRP 224 Ca -0.30 0.01 -0.09 0.00 -0.00 0.00 0.00 58.89 58.51 3hpy h TRP 224 Cb 1.25 -0.18 -0.01 0.00 -0.00 0.00 0.00 29.16 30.22 3hpy h TRP 224 CO 0.82 0.34 -0.30 0.93 -0.00 0.00 0.00 178.44 180.24 3hpy h GLU 225 N 0.56 0.28 -0.28 2.65 5.08 -2.00 -1.68 114.58 119.19 3hpy h GLU 225 Ca 0.15 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.34 3hpy h GLU 225 Cb -0.04 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 3hpy h GLU 225 CO -0.03 0.56 -0.09 1.96 -1.00 0.00 0.00 179.01 180.41 3hpy h GLN 226 N 0.25 0.46 -0.59 2.33 1.08 -1.69 -0.71 115.11 116.24 3hpy h GLN 226 Ca 0.03 -0.12 -0.07 0.00 -1.45 0.00 0.00 58.65 57.05 3hpy h GLN 226 Cb 0.66 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 28.01 3hpy h GLN 226 CO 0.05 0.56 0.10 0.28 -0.95 0.00 0.00 178.83 178.87 3hpy h VAL 227 N 0.44 1.26 -0.40 -0.54 2.07 -1.03 0.96 116.25 119.00 3hpy h VAL 227 Ca 0.09 -0.99 -0.01 0.00 0.82 0.00 0.00 66.70 66.61 3hpy h VAL 227 Cb 0.43 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 3hpy h VAL 227 CO 0.02 0.36 0.20 0.25 0.02 0.00 0.00 177.57 178.42 3hpy h LEU 228 N 0.88 0.52 -0.73 2.57 5.85 -0.89 -1.68 115.31 121.84 3hpy h LEU 228 Ca 0.18 -0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.80 3hpy h LEU 228 Cb 0.42 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 3hpy h LEU 228 CO 0.01 0.50 0.46 -0.09 -0.34 0.00 0.00 178.44 178.98 3hpy h ARG 229 N 0.51 0.89 -0.54 1.25 2.43 -0.79 -0.58 114.38 117.55 3hpy h ARG 229 Ca 0.14 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 3hpy h ARG 229 Cb 0.11 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 3hpy h ARG 229 CO -0.02 0.59 0.23 0.00 -1.51 0.00 0.00 179.97 179.26 3hpy h ALA 230 N 1.30 1.40 -0.55 2.80 0.00 -0.53 -1.21 119.26 122.47 3hpy h ALA 230 Ca 0.28 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3hpy h ALA 230 Cb -0.02 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 3hpy h ALA 230 CO -0.10 0.46 0.31 0.78 0.00 0.00 0.00 179.25 180.71 3hpy h GLY 231 N 0.88 0.81 0.99 0.00 0.00 -0.18 -2.07 103.07 103.49 3hpy h GLY 231 Ca 0.19 -0.36 -0.06 0.00 0.00 0.00 0.00 47.33 47.10 3hpy h GLY 231 CO -0.02 0.35 0.08 -0.55 0.00 0.00 0.00 176.54 176.39 3hpy h ASP 232 N 0.74 0.80 -0.64 0.19 3.32 -0.64 -2.49 116.42 117.70 3hpy h ASP 232 Ca 0.19 -0.26 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 3hpy h ASP 232 Cb 0.03 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 3hpy h ASP 232 CO -0.03 0.86 0.30 0.40 -1.72 0.00 0.00 179.24 179.04 3hpy h ILE 233 N 0.71 1.22 -0.16 0.35 2.04 -1.04 -1.63 117.51 119.00 3hpy h ILE 233 Ca 0.15 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.35 3hpy h ILE 233 Cb 0.40 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 3hpy h ILE 233 CO 0.01 0.27 0.06 0.24 0.00 0.00 0.00 178.15 178.73 3hpy h MET 234 N 0.95 0.24 -0.73 2.37 2.86 -1.22 -2.11 114.93 117.29 3hpy h MET 234 Ca 0.23 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.84 3hpy h MET 234 Cb 0.13 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.72 3hpy h MET 234 CO -0.03 0.34 0.47 1.03 1.06 0.00 0.00 176.91 179.79 3hpy h SER 235 N 0.08 0.80 -0.36 1.22 0.87 -1.12 0.27 113.55 115.31 3hpy h SER 235 Ca 0.05 -0.01 0.05 0.00 -1.23 0.00 0.00 61.79 60.65 3hpy h SER 235 Cb 0.19 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 61.95 3hpy h SER 235 CO -0.00 0.57 0.25 0.24 -0.53 0.00 0.00 176.83 177.35 3hpy h MET 236 N 0.95 0.29 -0.62 2.24 2.07 -1.13 -1.79 114.93 116.93 3hpy h MET 236 Ca 0.28 -0.02 0.00 0.00 -2.07 0.00 0.00 59.70 57.89 3hpy h MET 236 Cb -0.05 -0.07 0.00 0.00 -1.87 0.00 0.00 31.60 29.61 3hpy h MET 236 CO -0.08 0.19 0.00 0.09 1.07 0.00 0.00 176.91 178.18 3hpy n ASN 237 N -4.48 4.49 -2.30 1.22 4.13 -0.73 -4.94 115.26 112.65 3hpy n ASN 237 Ca 0.04 -2.39 -0.18 0.00 1.68 0.00 0.00 54.58 53.73 3hpy n ASN 237 Cb 0.22 -0.54 -0.02 0.00 -1.54 0.00 0.00 39.78 37.90 3hpy n ASN 237 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 3hpy n GLU 238 N 1.06 -1.78 -2.23 3.52 -0.58 -0.68 -4.92 120.64 115.03 3hpy n GLU 238 Ca 0.24 0.92 -0.41 0.00 -0.42 0.00 0.00 57.16 57.50 3hpy n GLU 238 Cb 0.82 -5.53 -0.03 0.00 -0.57 0.00 0.00 31.44 26.13 3hpy n GLU 238 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3hpy s VAL 239 N -2.88 3.15 -0.25 2.62 1.01 0.87 -4.97 120.40 119.94 3hpy s VAL 239 Ca 0.00 1.01 -0.29 0.00 0.00 0.00 0.00 61.98 62.70 3hpy s VAL 239 Cb 0.00 -3.64 -0.00 0.00 0.00 0.00 0.00 36.38 32.74 3hpy s VAL 239 CO 0.00 0.18 1.26 0.20 0.00 0.00 0.00 175.10 176.74 3hpy s ASN 240 N 0.01 6.81 -0.16 3.32 -0.87 -1.26 -4.69 114.94 118.10 3hpy s ASN 240 Ca 0.53 1.37 -0.08 0.00 -1.57 0.00 0.00 52.86 53.12 3hpy s ASN 240 Cb -0.37 -2.54 -0.04 0.00 -0.02 0.00 0.00 41.25 38.28 3hpy s ASN 240 CO 0.42 -0.93 0.09 -0.69 -2.57 0.00 0.00 177.10 173.42 3hpy s VAL 241 N 3.96 5.10 0.00 1.60 1.01 -1.26 -0.26 120.40 130.55 3hpy s VAL 241 Ca 0.54 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.59 3hpy s VAL 241 Cb -0.18 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 32.92 3hpy s VAL 241 CO 0.19 0.51 0.00 -0.67 0.00 0.00 0.00 175.10 175.12 3hpy n ASP 242 N 3.03 0.00 -4.38 3.32 -0.08 0.43 -4.86 116.55 114.01 3hpy n ASP 242 Ca -0.17 0.00 -0.35 0.00 -1.51 0.00 0.00 54.79 52.76 3hpy n ASP 242 Cb 0.53 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.86 3hpy n ASP 242 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 3hpy s ILE 243 N 0.00 3.63 0.99 5.18 -4.36 -1.21 -4.99 121.20 120.44 3hpy s ILE 243 Ca 0.00 -0.42 -0.17 0.00 -0.26 0.00 0.00 60.65 59.80 3hpy s ILE 243 Cb 0.00 -2.63 0.26 0.00 1.25 0.00 0.00 42.46 41.33 3hpy s ILE 243 CO 0.00 0.44 0.65 0.61 0.24 0.00 0.00 174.94 176.88 3hpy n GLY 244 N 4.39 -3.58 3.66 6.27 0.00 -1.26 -0.88 105.19 113.78 3hpy n GLY 244 Ca -0.18 -1.33 -0.47 0.00 0.00 0.00 0.00 46.02 44.04 3hpy n GLY 244 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hpy n PRO 245 N -4.48 2.00 -3.86 1.61 -0.04 -1.25 -4.54 135.00 124.44 3hpy n PRO 245 Ca 0.10 0.72 -0.04 0.00 -0.04 0.00 0.00 63.50 64.24 3hpy n PRO 245 Cb 0.42 -2.48 0.01 0.00 -0.04 0.00 0.00 33.50 31.41 3hpy n PRO 245 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 3hpy s THR 246 N 1.38 0.00 -0.10 0.52 -1.32 -0.68 -4.95 115.64 110.49 3hpy s THR 246 Ca 0.82 -0.64 -0.08 0.00 -1.21 0.00 0.00 61.69 60.58 3hpy s THR 246 Cb -0.73 -2.77 -0.04 0.00 -1.51 0.00 0.00 72.50 67.45 3hpy s THR 246 CO 0.42 0.00 0.18 -0.60 -2.21 0.00 0.00 174.62 172.41 3hpy s ARG 247 N -2.32 3.51 -0.04 7.08 6.06 -1.26 0.65 118.95 132.62 3hpy s ARG 247 Ca 0.20 -0.06 -0.05 0.00 -2.50 0.00 0.00 55.73 53.31 3hpy s ARG 247 Cb -0.03 -3.19 -0.03 0.00 0.06 0.00 0.00 34.95 31.76 3hpy s ARG 247 CO 0.06 0.76 0.30 0.45 -2.50 0.00 0.00 175.30 174.37 3hpy h HIS 248 N 4.90 -0.18 0.00 5.12 3.86 -1.34 -3.48 115.15 124.03 3hpy h HIS 248 Ca -0.54 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.66 3hpy h HIS 248 Cb 1.23 0.06 0.00 0.00 1.06 0.00 0.00 27.41 29.76 3hpy h HIS 248 CO 0.75 -0.11 0.00 0.41 0.86 0.00 0.00 177.93 179.84 3hpy n GLY 249 N 1.14 2.72 0.28 2.45 0.00 -1.26 -4.75 105.19 105.78 3hpy n GLY 249 Ca -0.02 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.33 3hpy n GLY 249 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3hpy n VAL 250 N 0.00 0.00 -0.87 1.61 0.24 -1.26 -2.60 118.33 115.45 3hpy n VAL 250 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 3hpy n VAL 250 Cb 0.00 -0.25 0.00 0.00 -1.47 0.00 0.00 33.84 32.12 3hpy n VAL 250 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 3hpy n THR 251 N -0.07 0.00 -2.55 3.34 5.66 -1.26 -4.93 114.28 114.47 3hpy n THR 251 Ca 0.00 0.00 -0.20 0.00 -3.05 0.00 0.00 64.05 60.80 3hpy n THR 251 Cb 0.06 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.85 3hpy n THR 251 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 3hpy n ARG 252 N 0.00 -2.46 -4.57 1.09 1.74 -1.07 -4.35 116.66 107.05 3hpy n ARG 252 Ca 0.00 0.92 -0.22 0.00 -0.77 0.00 0.00 57.85 57.78 3hpy n ARG 252 Cb 0.06 -5.54 -0.15 0.00 -1.02 0.00 0.00 32.46 25.81 3hpy n ARG 252 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3hpy s GLY 253 N -2.30 0.71 0.84 -0.13 0.00 -1.26 -3.01 107.32 102.16 3hpy s GLY 253 Ca 0.08 -0.66 -0.11 0.00 0.00 0.00 0.00 44.72 44.03 3hpy s GLY 253 CO 0.10 -0.57 1.09 0.00 0.00 0.00 0.00 173.10 173.72 3hpy s THR 255 N -3.01 0.00 -0.03 0.00 -1.32 0.21 -3.34 115.64 108.15 3hpy s THR 255 Ca 0.62 -0.06 0.00 0.00 -1.21 0.00 0.00 61.69 61.04 3hpy s THR 255 Cb -0.16 -1.52 0.03 0.00 -1.51 0.00 0.00 72.50 69.34 3hpy s THR 255 CO 0.56 0.00 0.01 -0.63 -2.21 0.00 0.00 174.62 172.35 3hpy s ILE 256 N -2.23 0.11 -0.22 5.08 1.01 -0.87 -1.68 121.20 122.39 3hpy s ILE 256 Ca 0.13 0.12 -0.08 0.00 0.00 0.00 0.00 60.65 60.81 3hpy s ILE 256 Cb 0.03 -0.21 -0.04 0.00 0.01 0.00 0.00 42.46 42.25 3hpy s ILE 256 CO -0.04 0.12 0.09 -0.31 0.00 0.00 0.00 174.94 174.80 3hpy s TYR 257 N 0.99 3.21 0.24 3.97 2.02 -0.06 -2.43 117.35 125.28 3hpy s TYR 257 Ca -0.09 -0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.58 3hpy s TYR 257 Cb -0.13 -2.18 -0.05 0.00 -0.40 0.00 0.00 41.96 39.20 3hpy s TYR 257 CO -0.02 -0.04 0.08 0.00 -1.57 0.00 0.00 175.55 174.00 3hpy s ALA 258 N 0.98 1.63 0.02 3.71 0.00 -0.43 -0.42 121.76 127.24 3hpy s ALA 258 Ca 0.05 -1.81 0.06 0.00 0.00 0.00 0.00 51.96 50.25 3hpy s ALA 258 Cb -0.14 0.98 -0.03 0.00 0.00 0.00 0.00 23.12 23.93 3hpy s ALA 258 CO 0.03 -0.44 -0.15 -1.58 0.00 0.00 0.00 175.76 173.62 3hpy s TRP 259 N -3.76 2.64 0.76 0.00 0.51 0.64 -0.59 118.94 119.15 3hpy s TRP 259 Ca 0.35 -0.20 -0.11 0.00 -2.12 0.00 0.00 56.10 54.03 3hpy s TRP 259 Cb 0.07 -1.52 0.05 0.00 -0.81 0.00 0.00 33.47 31.26 3hpy s TRP 259 CO 0.12 0.26 1.08 0.34 -0.51 0.00 0.00 176.95 178.24 3hpy s ASP 260 N -1.28 4.68 0.57 2.95 3.68 0.10 -4.34 116.67 123.02 3hpy s ASP 260 Ca 0.14 1.77 0.36 0.00 2.13 0.00 0.00 52.55 56.95 3hpy s ASP 260 Cb -0.11 -2.50 1.68 0.00 -1.45 0.00 0.00 42.92 40.54 3hpy s ASP 260 CO 0.05 -1.92 2.08 -0.65 0.13 0.00 0.00 175.17 174.86 3hpy h PRO 261 N -1.05 0.00 -0.00 4.34 0.11 -1.92 -0.62 132.00 132.86 3hpy h PRO 261 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3hpy h PRO 261 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3hpy h PRO 261 CO 0.53 0.00 -0.51 0.43 -0.21 0.00 0.00 178.00 178.24 3hpy n SER 262 N -3.01 0.72 0.00 -2.05 7.64 -1.26 -4.95 113.62 110.71 3hpy n SER 262 Ca -0.01 -0.52 0.00 0.00 1.01 0.00 0.00 58.87 59.36 3hpy n SER 262 Cb 0.22 0.32 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 3hpy n SER 262 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hpy n GLY 263 N 1.46 1.05 3.66 0.23 0.00 -0.24 -4.77 105.19 106.58 3hpy n GLY 263 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 3hpy n GLY 263 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hpy s ASN 264 N -2.00 6.61 0.23 1.61 0.02 -1.26 -4.75 114.94 115.40 3hpy s ASN 264 Ca 0.00 0.74 -0.30 0.00 -1.02 0.00 0.00 52.86 52.28 3hpy s ASN 264 Cb 0.00 -2.32 -0.09 0.00 0.02 0.00 0.00 41.25 38.86 3hpy s ASN 264 CO 0.00 -0.23 0.95 -0.60 0.02 0.00 0.00 177.10 177.24 3hpy s ARG 265 N 1.79 4.84 0.15 -0.60 3.52 -1.26 0.00 118.95 127.40 3hpy s ARG 265 Ca 0.26 1.49 0.03 0.00 -0.13 0.00 0.00 55.73 57.39 3hpy s ARG 265 Cb -0.16 -3.28 -0.04 0.00 -1.56 0.00 0.00 34.95 29.90 3hpy s ARG 265 CO 0.10 0.49 -0.06 -0.59 -0.81 0.00 0.00 175.30 174.43 3hpy s PHE 266 N -1.09 1.19 -0.00 5.12 -0.12 0.24 -2.89 117.98 120.42 3hpy s PHE 266 Ca 0.42 -0.88 0.05 0.00 -0.05 0.00 0.00 56.93 56.47 3hpy s PHE 266 Cb -0.26 -0.65 -0.01 0.00 -0.63 0.00 0.00 43.02 41.47 3hpy s PHE 266 CO 0.32 -0.06 -0.17 -2.00 -0.05 0.00 0.00 175.22 173.26 3hpy s GLU 267 N -3.82 1.32 -0.17 1.99 2.12 -0.29 -1.31 118.70 118.53 3hpy s GLU 267 Ca 0.18 -0.65 0.01 0.00 0.36 0.00 0.00 54.97 54.87 3hpy s GLU 267 Cb 0.04 -1.29 0.02 0.00 0.26 0.00 0.00 34.13 33.16 3hpy s GLU 267 CO 0.01 0.35 -0.16 0.95 -0.54 0.00 0.00 175.26 175.87 3hpy s THR 268 N -0.48 1.76 0.32 -1.70 -4.23 -1.02 0.72 115.64 111.02 3hpy s THR 268 Ca 0.06 -0.81 -0.09 0.00 -1.18 0.00 0.00 61.69 59.68 3hpy s THR 268 Cb -0.07 -1.66 0.01 0.00 1.34 0.00 0.00 72.50 72.13 3hpy s THR 268 CO -0.00 0.44 0.55 0.72 -0.54 0.00 0.00 174.62 175.78 3hpy s PHE 269 N 1.40 0.64 0.21 3.99 -0.71 -0.72 -2.06 117.98 120.74 3hpy s PHE 269 Ca 0.04 -1.01 -0.20 0.00 -1.04 0.00 0.00 56.93 54.72 3hpy s PHE 269 Cb -0.13 0.20 0.04 0.00 -1.21 0.00 0.00 43.02 41.92 3hpy s PHE 269 CO -0.11 -1.19 0.60 0.00 -1.34 0.00 0.00 175.22 173.18 3hpy s MET 270 N -3.19 1.47 0.00 1.99 0.23 -1.21 0.56 119.30 119.14 3hpy s MET 270 Ca 0.25 -0.78 0.00 0.00 -1.03 0.00 0.00 55.69 54.12 3hpy s MET 270 Cb -0.02 0.57 0.00 0.00 -1.53 0.00 0.00 34.83 33.85 3hpy s MET 270 CO 0.15 -0.65 0.00 0.41 -2.03 0.00 0.00 175.02 172.90 3hpy n GLY 271 N -0.39 -2.63 0.00 3.16 0.00 -1.26 -2.30 105.19 101.78 3hpy n GLY 271 Ca -0.10 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.82 3hpy n GLY 271 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hpy n GLY 272 N -0.02 3.19 0.00 -0.02 0.00 -1.17 -4.79 105.19 102.39 3hpy n GLY 272 Ca 0.00 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.15 3hpy n GLY 272 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 3hpy n TYR 273 N -0.67 -3.12 -3.68 1.61 0.18 -1.26 -5.01 117.16 105.21 3hpy n TYR 273 Ca 0.00 0.00 -0.28 0.00 1.88 0.00 0.00 57.90 59.50 3hpy n TYR 273 Cb 0.00 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 38.85 3hpy n TYR 273 CO 0.00 0.00 0.00 -1.01 -2.08 0.00 0.00 176.86 173.77 3hpy s HIS 274 N 0.06 2.47 0.71 -3.48 3.76 -1.26 -4.25 115.29 113.30 3hpy s HIS 274 Ca 0.00 -2.88 -0.14 0.00 -0.15 0.00 0.00 55.06 51.89 3hpy s HIS 274 Cb 0.00 -1.93 0.03 0.00 1.11 0.00 0.00 32.58 31.79 3hpy s HIS 274 CO 0.00 -0.67 1.12 -1.25 -0.85 0.00 0.00 174.74 173.08 3hpy s PRO 275 N -0.76 2.51 0.09 8.40 0.04 -1.21 -4.99 135.00 139.07 3hpy s PRO 275 Ca 0.28 1.37 0.04 0.00 0.04 0.00 0.00 61.00 62.73 3hpy s PRO 275 Cb -0.02 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.58 3hpy s PRO 275 CO -0.17 -1.48 -0.10 0.71 0.04 0.00 0.00 177.00 176.00 3hpy s TYR 276 N -2.48 1.01 0.59 0.56 2.02 -1.26 -4.26 117.35 113.54 3hpy s TYR 276 Ca 0.66 -0.62 0.32 0.00 -0.37 0.00 0.00 57.07 57.06 3hpy s TYR 276 Cb -0.20 -0.56 1.28 0.00 -0.40 0.00 0.00 41.96 42.08 3hpy s TYR 276 CO 0.47 -0.01 1.58 -1.35 -1.57 0.00 0.00 175.55 174.67 3hpy h PRO 277 N 3.77 0.00 0.00 -1.71 0.11 -1.98 0.16 132.00 132.35 3hpy h PRO 277 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 3hpy h PRO 277 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3hpy h PRO 277 CO 0.50 0.00 -0.17 -0.40 -0.21 0.00 0.00 178.00 177.71 3hpy n ASP 278 N -3.59 0.24 -4.82 -2.05 5.75 -1.26 -4.90 116.55 105.91 3hpy n ASP 278 Ca 0.22 0.27 -0.33 0.00 -0.01 0.00 0.00 54.79 54.94 3hpy n ASP 278 Cb 1.30 -0.27 -0.04 0.00 -1.03 0.00 0.00 41.12 41.07 3hpy n ASP 278 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 3hpy s TYR 279 N -3.01 3.30 0.25 2.11 4.12 0.56 -5.05 117.35 119.62 3hpy s TYR 279 Ca 0.13 1.54 -0.16 0.00 0.02 0.00 0.00 57.07 58.60 3hpy s TYR 279 Cb 0.18 -2.87 -0.08 0.00 -1.52 0.00 0.00 41.96 37.67 3hpy s TYR 279 CO 0.59 -0.39 0.68 -1.21 0.02 0.00 0.00 175.55 175.25 3hpy s GLU 280 N -3.61 4.08 0.63 -0.62 0.41 -1.26 -4.95 118.70 113.38 3hpy s GLU 280 Ca 0.62 0.68 -0.16 0.00 -0.41 0.00 0.00 54.97 55.70 3hpy s GLU 280 Cb -0.11 -2.71 -0.01 0.00 -1.78 0.00 0.00 34.13 29.52 3hpy s GLU 280 CO 0.23 0.32 1.11 -1.25 -0.49 0.00 0.00 175.26 175.18 3hpy s PRO 281 N -2.40 2.93 0.36 0.39 0.04 -1.26 -4.99 135.00 130.06 3hpy s PRO 281 Ca 0.46 1.44 -0.03 0.00 0.04 0.00 0.00 61.00 62.91 3hpy s PRO 281 Cb -0.14 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 3hpy s PRO 281 CO 0.19 -1.16 0.61 -0.51 0.04 0.00 0.00 177.00 176.18 3hpy s LEU 282 N -4.63 3.93 0.09 -3.56 1.43 -0.05 -4.95 118.68 110.95 3hpy s LEU 282 Ca 0.68 0.68 0.03 0.00 -1.03 0.00 0.00 54.13 54.49 3hpy s LEU 282 Cb -0.21 -3.55 -0.04 0.00 0.03 0.00 0.00 46.19 42.43 3hpy s LEU 282 CO 0.38 -0.33 -0.09 -0.94 0.23 0.00 0.00 176.35 175.60 3hpy s SER 283 N -3.72 1.35 -0.03 2.29 1.04 -1.26 -1.03 113.70 112.33 3hpy s SER 283 Ca 0.43 -0.81 0.04 0.00 0.48 0.00 0.00 55.95 56.09 3hpy s SER 283 Cb -0.10 0.02 -0.00 0.00 0.10 0.00 0.00 66.02 66.04 3hpy s SER 283 CO 0.36 -0.28 -0.13 0.26 0.98 0.00 0.00 173.24 174.42 3hpy s TRP 284 N -2.49 1.30 0.34 5.02 0.52 0.12 -4.91 118.94 118.84 3hpy s TRP 284 Ca 0.05 -0.33 -0.26 0.00 0.02 0.00 0.00 56.10 55.58 3hpy s TRP 284 Cb -0.03 -0.88 -0.09 0.00 -1.15 0.00 0.00 33.47 31.32 3hpy s TRP 284 CO -0.01 -0.10 1.00 0.95 0.02 0.00 0.00 176.95 178.82 3hpy s THR 285 N 0.00 3.92 0.17 2.01 -4.23 -1.26 0.82 115.64 117.07 3hpy s THR 285 Ca -0.01 1.60 -0.23 0.00 -1.18 0.00 0.00 61.69 61.87 3hpy s THR 285 Cb -0.09 -3.89 0.06 0.00 1.34 0.00 0.00 72.50 69.92 3hpy s THR 285 CO 0.01 0.14 1.59 0.22 -0.54 0.00 0.00 174.62 176.04 3hpy h TYR 286 N 3.05 -0.95 -0.97 3.99 3.20 -1.83 -0.45 116.97 123.02 3hpy h TYR 286 Ca -0.47 0.06 0.04 0.00 3.14 0.00 0.00 58.73 61.50 3hpy h TYR 286 Cb 1.20 0.48 -0.06 0.00 1.54 0.00 0.00 36.73 39.89 3hpy h TYR 286 CO 0.60 -0.39 0.64 0.38 -1.64 0.00 0.00 178.16 177.74 3hpy h ASP 287 N -0.25 1.04 1.10 -2.11 3.04 -1.92 -0.02 116.42 117.31 3hpy h ASP 287 Ca 0.18 -0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.96 3hpy h ASP 287 Cb 0.55 -0.23 0.00 0.00 -1.04 0.00 0.00 39.33 38.60 3hpy h ASP 287 CO -0.57 0.70 0.00 -1.13 -2.04 0.00 0.00 179.24 176.21 3hpy h ASN 288 N 1.20 0.00 0.00 4.15 -0.73 -1.71 -3.55 115.58 114.95 3hpy h ASN 288 Ca 0.40 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.57 3hpy h ASN 288 Cb 0.05 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.64 3hpy h ASN 288 CO -0.13 0.00 0.00 0.33 -0.37 0.00 0.00 177.43 177.26