#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 3.62 0.39 0.00 -1.94 -1.26 -5.06 119.30 115.05 3hpy s MET 3 Ca 0.00 -0.45 0.04 0.00 -1.71 0.00 0.00 55.69 53.56 3hpy s MET 3 Cb 0.00 -3.78 -0.03 0.00 2.01 0.00 0.00 34.83 33.03 3hpy s MET 3 CO 0.00 -0.44 0.10 0.95 -0.01 0.00 0.00 175.02 175.63 3hpy s THR 4 N 1.89 0.76 0.00 2.05 -4.23 -1.26 -4.96 115.64 109.89 3hpy s THR 4 Ca 0.09 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.60 3hpy s THR 4 Cb -0.17 -2.44 0.00 0.00 1.34 0.00 0.00 72.50 71.23 3hpy s THR 4 CO 0.11 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.80 3hpy n GLY 5 N -0.88 3.79 3.64 3.99 0.00 -1.26 -4.41 105.19 110.06 3hpy n GLY 5 Ca -0.06 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 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 4.42 -0.17 1.61 1.01 -1.26 -0.33 120.40 125.68 3hpy s VAL 6 Ca 0.00 1.64 -0.20 0.00 0.00 0.00 0.00 61.98 63.42 3hpy s VAL 6 Cb 0.00 -4.32 -0.17 0.00 0.00 0.00 0.00 36.38 31.89 3hpy s VAL 6 CO 0.00 -0.44 0.31 -0.07 0.00 0.00 0.00 175.10 174.90 3hpy h LEU 7 N 10.19 0.00 -7.64 3.92 3.38 -1.37 -3.45 115.31 120.34 3hpy h LEU 7 Ca -0.22 -0.54 0.11 0.00 0.09 0.00 0.00 57.88 57.32 3hpy h LEU 7 Cb 1.07 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.74 3hpy h LEU 7 CO 1.03 1.15 0.36 0.00 0.09 0.00 0.00 178.44 181.07 3hpy s ARG 8 N -2.23 1.38 0.17 1.13 1.70 -1.21 -4.76 118.95 115.13 3hpy s ARG 8 Ca -0.21 -0.72 -0.31 0.00 -0.47 0.00 0.00 55.73 54.02 3hpy s ARG 8 Cb 0.02 0.50 -0.10 0.00 -0.57 0.00 0.00 34.95 34.80 3hpy s ARG 8 CO 0.52 -0.63 1.50 -2.14 -1.08 0.00 0.00 175.30 173.47 3hpy s PRO 9 N -3.55 4.25 -0.22 3.89 0.02 -1.26 -1.63 135.00 136.51 3hpy s PRO 9 Ca 0.10 2.28 0.02 0.00 0.02 0.00 0.00 61.00 63.42 3hpy s PRO 9 Cb -0.03 -3.17 -0.20 0.00 0.02 0.00 0.00 34.50 31.12 3hpy s PRO 9 CO 0.01 -0.53 -0.04 0.41 -0.33 0.00 0.00 177.00 176.51 3hpy n GLY 10 N 3.39 -0.48 3.54 0.52 0.00 0.23 -4.72 105.19 107.66 3hpy n GLY 10 Ca 0.12 -0.21 -0.09 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.53 -0.35 -0.15 1.61 -3.43 -1.06 -4.05 115.29 105.32 3hpy s HIS 11 Ca -0.29 0.37 0.00 0.00 -0.80 0.00 0.00 55.06 54.34 3hpy s HIS 11 Cb 0.08 0.50 0.03 0.00 -1.43 0.00 0.00 32.58 31.77 3hpy s HIS 11 CO 0.66 -0.45 -0.10 0.00 -2.00 0.00 0.00 174.74 172.86 3hpy s ALA 12 N -2.33 1.64 -0.44 -1.38 0.00 -0.00 -0.68 121.76 118.58 3hpy s ALA 12 Ca 0.02 -0.84 -0.20 0.00 0.00 0.00 0.00 51.96 50.95 3hpy s ALA 12 Cb -0.01 -1.07 0.03 0.00 0.00 0.00 0.00 23.12 22.07 3hpy s ALA 12 CO -0.05 -0.56 0.59 -1.14 0.00 0.00 0.00 175.76 174.60 3hpy s GLN 13 N 1.57 3.21 0.04 0.00 2.00 -0.09 -2.08 119.66 124.31 3hpy s GLN 13 Ca 0.03 -0.53 0.08 0.00 -2.00 0.00 0.00 55.36 52.94 3hpy s GLN 13 Cb -0.14 -3.97 -0.03 0.00 0.80 0.00 0.00 33.01 29.67 3hpy s GLN 13 CO -0.09 -0.99 -0.23 0.08 -0.50 0.00 0.00 175.29 173.56 3hpy s VAL 14 N 2.63 2.40 -0.13 1.34 1.01 -0.28 0.26 120.40 127.63 3hpy s VAL 14 Ca 0.19 -1.29 -0.05 0.00 0.00 0.00 0.00 61.98 60.84 3hpy s VAL 14 Cb -0.15 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 3hpy s VAL 14 CO 0.17 0.37 0.04 0.00 0.00 0.00 0.00 175.10 175.67 3hpy s ARG 15 N -1.27 3.44 0.15 2.72 1.70 -0.62 -1.69 118.95 123.38 3hpy s ARG 15 Ca 0.13 -0.36 0.11 0.00 -0.47 0.00 0.00 55.73 55.13 3hpy s ARG 15 Cb -0.10 -3.00 -0.04 0.00 -0.57 0.00 0.00 34.95 31.24 3hpy s ARG 15 CO 0.03 0.53 -0.23 0.14 -1.08 0.00 0.00 175.30 174.68 3hpy s VAL 16 N -0.37 2.46 0.18 4.99 -7.23 -0.66 -3.46 120.40 116.31 3hpy s VAL 16 Ca 0.08 -1.79 -0.08 0.00 -1.81 0.00 0.00 61.98 58.39 3hpy s VAL 16 Cb -0.12 -2.13 0.02 0.00 0.56 0.00 0.00 36.38 34.71 3hpy s VAL 16 CO 0.02 0.02 1.59 -0.07 -0.31 0.00 0.00 175.10 176.34 3hpy h LEU 17 N 3.58 0.95 -7.59 1.32 3.38 -1.84 -1.88 115.31 113.24 3hpy h LEU 17 Ca -0.49 -0.35 -0.62 0.00 0.09 0.00 0.00 57.88 56.51 3hpy h LEU 17 Cb 1.18 -0.26 -0.39 0.00 0.09 0.00 0.00 40.66 41.28 3hpy h LEU 17 CO 0.44 1.12 -0.77 0.21 0.09 0.00 0.00 178.44 179.53 3hpy s ASN 18 N -6.72 4.16 0.13 -0.43 3.84 -1.26 -4.73 114.94 109.94 3hpy s ASN 18 Ca -0.11 -1.52 -0.20 0.00 0.21 0.00 0.00 52.86 51.24 3hpy s ASN 18 Cb 0.13 -1.27 -0.02 0.00 -0.55 0.00 0.00 41.25 39.54 3hpy s ASN 18 CO 0.86 -0.30 1.70 0.25 -2.79 0.00 0.00 177.10 176.82 3hpy h LEU 19 N 7.88 -0.20 -0.32 3.21 6.46 -1.95 -0.95 115.31 129.44 3hpy h LEU 19 Ca -0.14 0.06 0.07 0.00 -0.12 0.00 0.00 57.88 57.75 3hpy h LEU 19 Cb 1.05 0.13 -0.07 0.00 -0.73 0.00 0.00 40.66 41.04 3hpy h LEU 19 CO 0.45 -0.07 -0.12 -0.33 -0.62 0.00 0.00 178.44 177.75 3hpy h GLU 20 N 0.00 -0.05 0.00 1.25 3.07 -1.98 0.41 114.58 117.27 3hpy h GLU 20 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.97 3hpy h GLU 20 Cb 0.16 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 3hpy h GLU 20 CO -0.22 -0.04 0.00 1.05 -1.40 0.00 0.00 179.01 178.40 3hpy h GLU 21 N -0.06 0.00 -0.04 2.33 4.11 -1.96 -2.24 114.58 116.72 3hpy h GLU 21 Ca 0.16 0.00 -0.23 0.00 0.07 0.00 0.00 59.36 59.36 3hpy h GLU 21 Cb 0.30 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.56 3hpy h GLU 21 CO -0.36 0.00 -0.91 0.78 0.07 0.00 0.00 179.01 178.59 3hpy h GLY 22 N 3.32 0.64 0.86 1.06 0.00 0.39 -1.38 103.07 107.95 3hpy h GLY 22 Ca 0.00 -1.04 -0.01 0.00 0.00 0.00 0.00 47.33 46.28 3hpy h GLY 22 CO 0.00 0.92 -0.11 -2.22 0.00 0.00 0.00 176.54 175.13 3hpy h ILE 23 N 0.35 0.81 -0.23 2.60 2.04 0.08 -1.82 117.51 121.35 3hpy h ILE 23 Ca -0.08 -0.29 0.04 0.00 1.00 0.00 0.00 64.86 65.53 3hpy h ILE 23 Cb 1.54 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 38.57 3hpy h ILE 23 CO 0.17 0.06 0.01 -0.74 0.00 0.00 0.00 178.15 177.66 3hpy h HIS 24 N -0.46 0.02 0.87 1.37 2.76 -1.46 -1.68 115.15 116.57 3hpy h HIS 24 Ca -0.03 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.11 3hpy h HIS 24 Cb 0.35 0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.34 3hpy h HIS 24 CO -0.02 -0.02 -0.46 0.35 -1.30 0.00 0.00 177.93 176.49 3hpy h PHE 25 N 0.09 -1.20 0.00 5.26 3.04 -1.20 0.20 116.94 123.13 3hpy h PHE 25 Ca 0.11 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.04 3hpy h PHE 25 Cb 0.13 0.41 0.00 0.00 2.56 0.00 0.00 35.95 39.05 3hpy h PHE 25 CO -0.18 -0.72 0.00 1.88 -2.02 0.00 0.00 178.31 177.28 3hpy h TYR 26 N -1.22 0.00 0.00 0.41 0.05 -1.33 0.13 116.97 115.02 3hpy h TYR 26 Ca -0.12 0.00 -0.42 0.00 0.05 0.00 0.00 58.73 58.25 3hpy h TYR 26 Cb 0.95 0.00 -0.07 0.00 1.01 0.00 0.00 36.73 38.62 3hpy h TYR 26 CO -0.05 0.00 -2.51 -2.13 -1.05 0.00 0.00 178.16 172.43 3hpy n ARG 27 N -2.63 0.63 0.02 4.88 0.63 -0.63 -0.64 116.66 118.92 3hpy n ARG 27 Ca -0.00 0.19 0.07 0.00 -0.92 0.00 0.00 57.85 57.19 3hpy n ARG 27 Cb 0.17 -1.51 -0.10 0.00 0.45 0.00 0.00 32.46 31.47 3hpy n ARG 27 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 3hpy n ASN 28 N -3.59 0.41 -0.06 6.15 5.03 0.68 -3.44 115.26 120.43 3hpy n ASN 28 Ca -0.49 0.16 -0.06 0.00 0.87 0.00 0.00 54.58 55.06 3hpy n ASN 28 Cb 0.96 1.12 -0.02 0.00 -1.02 0.00 0.00 39.78 40.81 3hpy n ASN 28 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 3hpy n VAL 29 N -2.54 1.12 0.27 2.41 0.31 0.34 -4.24 118.33 116.00 3hpy n VAL 29 Ca -0.06 0.23 0.16 0.00 -0.01 0.00 0.00 64.34 64.66 3hpy n VAL 29 Cb 0.66 -2.11 0.65 0.00 -0.91 0.00 0.00 33.84 32.14 3hpy n VAL 29 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 3hpy h LEU 30 N -0.72 0.00 0.26 7.52 5.85 -1.36 -0.28 115.31 126.58 3hpy h LEU 30 Ca 0.00 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 3hpy h LEU 30 Cb 0.72 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.75 3hpy h LEU 30 CO 0.00 0.03 -0.05 0.61 -0.34 0.00 0.00 178.44 178.69 3hpy n GLY 31 N 0.05 0.32 3.85 3.75 0.00 -1.19 -0.37 105.19 111.59 3hpy n GLY 31 Ca 0.01 -0.83 -0.32 0.00 0.00 0.00 0.00 46.02 44.88 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 -0.56 3.72 -0.31 0.99 1.02 0.19 -4.23 118.68 119.49 3hpy s LEU 32 Ca 0.00 1.48 -0.16 0.00 0.02 0.00 0.00 54.13 55.47 3hpy s LEU 32 Cb 0.00 -4.39 -0.02 0.00 0.02 0.00 0.00 46.19 41.80 3hpy s LEU 32 CO 0.00 -0.51 0.42 -0.69 0.02 0.00 0.00 176.35 175.59 3hpy s VAL 33 N -2.50 5.12 0.32 -1.59 1.01 0.37 -4.39 120.40 118.75 3hpy s VAL 33 Ca 0.57 0.42 -0.29 0.00 0.00 0.00 0.00 61.98 62.69 3hpy s VAL 33 Cb -0.10 -3.81 -0.10 0.00 0.00 0.00 0.00 36.38 32.37 3hpy s VAL 33 CO 0.29 -0.01 1.28 -0.70 0.00 0.00 0.00 175.10 175.96 3hpy s GLU 34 N 2.17 4.40 0.00 2.72 2.12 -1.26 -1.36 118.70 127.49 3hpy s GLU 34 Ca 0.16 2.16 0.00 0.00 0.36 0.00 0.00 54.97 57.65 3hpy s GLU 34 Cb -0.16 -3.09 0.00 0.00 0.26 0.00 0.00 34.13 31.14 3hpy s GLU 34 CO 0.11 -0.13 0.18 -2.37 -0.54 0.00 0.00 175.26 172.51 3hpy n THR 35 N 0.87 0.00 0.00 -1.70 5.66 0.37 -4.93 114.28 114.55 3hpy n THR 35 Ca -0.00 -0.23 0.00 0.00 -3.05 0.00 0.00 64.05 60.77 3hpy n THR 35 Cb 0.42 1.42 0.00 0.00 -1.55 0.00 0.00 70.33 70.63 3hpy n THR 35 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3hpy n GLY 36 N 0.10 2.74 2.64 1.09 0.00 -1.24 -4.96 105.19 105.57 3hpy n GLY 36 Ca 0.00 -0.74 -0.24 0.00 0.00 0.00 0.00 46.02 45.04 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 0.04 0.00 1.61 0.52 -1.26 0.27 118.95 118.14 3hpy s ARG 37 Ca 0.00 0.09 0.00 0.00 -0.52 0.00 0.00 55.73 55.30 3hpy s ARG 37 Cb 0.00 -1.31 0.00 0.00 0.52 0.00 0.00 34.95 34.16 3hpy s ARG 37 CO 0.00 -0.53 0.00 -0.40 0.02 0.00 0.00 175.30 174.39 3hpy n ASP 38 N 5.28 -0.14 0.04 0.23 5.68 -0.80 -4.95 116.55 121.89 3hpy n ASP 38 Ca -0.06 -0.83 0.14 0.00 -0.50 0.00 0.00 54.79 53.54 3hpy n ASP 38 Cb 0.49 0.00 0.52 0.00 -1.14 0.00 0.00 41.12 41.00 3hpy n ASP 38 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 3hpy n ASP 39 N -2.71 0.32 -0.22 -1.12 5.75 -1.26 -3.28 116.55 114.02 3hpy n ASP 39 Ca 0.00 0.50 0.14 0.00 -0.01 0.00 0.00 54.79 55.41 3hpy n ASP 39 Cb 0.00 -0.57 0.53 0.00 -1.03 0.00 0.00 41.12 40.06 3hpy n ASP 39 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3hpy n GLN 40 N -1.78 0.94 -0.60 0.11 6.02 -1.26 -4.91 117.38 115.90 3hpy n GLN 40 Ca 0.06 -0.45 0.00 0.00 -0.01 0.00 0.00 57.00 56.61 3hpy n GLN 40 Cb 0.37 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.14 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 1.26 0.65 3.84 1.08 0.00 -1.21 -5.01 105.19 105.81 3hpy n GLY 41 Ca 0.15 -0.44 -0.37 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.94 3.77 -0.12 1.61 0.52 -1.26 -4.63 118.95 117.91 3hpy s ARG 42 Ca 0.00 0.18 0.01 0.00 -0.52 0.00 0.00 55.73 55.40 3hpy s ARG 42 Cb 0.00 -3.23 -0.01 0.00 0.52 0.00 0.00 34.95 32.23 3hpy s ARG 42 CO 0.00 0.68 -0.15 0.54 0.02 0.00 0.00 175.30 176.39 3hpy s VAL 43 N -0.90 2.84 -0.02 3.52 0.11 -1.06 -1.90 120.40 123.00 3hpy s VAL 43 Ca 0.20 -0.74 -0.09 0.00 -2.93 0.00 0.00 61.98 58.43 3hpy s VAL 43 Cb -0.15 -2.18 -0.05 0.00 -1.53 0.00 0.00 36.38 32.48 3hpy s VAL 43 CO 0.09 0.53 0.27 -0.31 -3.33 0.00 0.00 175.10 172.36 3hpy s TYR 44 N 0.35 3.61 0.18 1.54 1.51 0.14 -2.30 117.35 122.39 3hpy s TYR 44 Ca -0.13 0.66 0.03 0.00 -1.01 0.00 0.00 57.07 56.63 3hpy s TYR 44 Cb -0.16 -2.05 -0.05 0.00 -0.11 0.00 0.00 41.96 39.59 3hpy s TYR 44 CO 0.06 0.64 -0.02 -0.06 -1.11 0.00 0.00 175.55 175.07 3hpy s PHE 45 N -1.20 1.32 0.13 2.71 0.40 0.17 0.14 117.98 121.65 3hpy s PHE 45 Ca 0.24 -0.94 -0.17 0.00 -0.60 0.00 0.00 56.93 55.46 3hpy s PHE 45 Cb -0.14 -0.74 0.04 0.00 0.51 0.00 0.00 43.02 42.69 3hpy s PHE 45 CO 0.13 -0.11 0.43 -1.59 0.70 0.00 0.00 175.22 174.78 3hpy s LYS 46 N -3.87 1.11 0.32 0.44 -2.85 -0.46 -0.61 119.74 113.81 3hpy s LYS 46 Ca 0.24 -0.69 -0.27 0.00 -1.00 0.00 0.00 55.97 54.25 3hpy s LYS 46 Cb 0.05 0.49 -0.10 0.00 -2.06 0.00 0.00 37.83 36.21 3hpy s LYS 46 CO 0.05 -0.44 0.98 0.00 0.10 0.00 0.00 175.35 176.03 3hpy h TRP 48 N 3.28 0.27 0.00 0.00 5.08 -1.82 -2.18 115.95 120.58 3hpy h TRP 48 Ca -0.47 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.51 3hpy h TRP 48 Cb 1.20 -0.08 0.00 0.00 -3.00 0.00 0.00 29.16 27.27 3hpy h TRP 48 CO 0.60 0.09 -0.39 -3.47 -1.28 0.00 0.00 178.44 174.00 3hpy n ASP 49 N -4.42 0.47 -4.80 0.11 2.03 -1.26 -4.44 116.55 104.24 3hpy n ASP 49 Ca 0.14 0.08 -0.29 0.00 0.52 0.00 0.00 54.79 55.25 3hpy n ASP 49 Cb 0.65 -0.02 0.13 0.00 -0.72 0.00 0.00 41.12 41.16 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 -3.05 1.25 -0.04 -0.67 2.02 -0.82 -4.75 118.70 112.63 3hpy s GLU 50 Ca 0.10 0.26 0.09 0.00 0.02 0.00 0.00 54.97 55.45 3hpy s GLU 50 Cb 0.16 -1.85 -0.14 0.00 0.10 0.00 0.00 34.13 32.40 3hpy s GLU 50 CO 0.66 -2.12 0.15 0.54 0.02 0.00 0.00 175.26 174.51 3hpy n ARG 51 N -3.71 1.11 -2.72 1.61 1.74 -1.26 -3.67 116.66 109.75 3hpy n ARG 51 Ca 0.07 -0.06 -0.33 0.00 -0.77 0.00 0.00 57.85 56.76 3hpy n ARG 51 Cb 0.59 -1.24 -0.06 0.00 -1.02 0.00 0.00 32.46 30.73 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 -3.53 6.85 0.31 0.55 1.01 -1.26 0.02 116.67 120.62 3hpy s ASP 52 Ca -0.04 1.64 0.05 0.00 0.71 0.00 0.00 52.55 54.91 3hpy s ASP 52 Cb 0.05 -2.52 0.83 0.00 1.01 0.00 0.00 42.92 42.29 3hpy s ASP 52 CO 0.41 -0.41 1.59 -0.74 0.21 0.00 0.00 175.17 176.23 3hpy h HIS 53 N 1.66 0.19 -3.29 4.23 2.76 -1.03 -3.44 115.15 116.23 3hpy h HIS 53 Ca -0.48 0.06 -0.06 0.00 -2.20 0.00 0.00 60.37 57.69 3hpy h HIS 53 Cb 1.18 0.07 -0.14 0.00 1.55 0.00 0.00 27.41 30.08 3hpy h HIS 53 CO 0.62 -0.38 -0.07 -1.54 -1.30 0.00 0.00 177.93 175.26 3hpy s SER 54 N -4.95 -0.26 0.00 3.26 1.04 -1.26 -4.53 113.70 107.00 3hpy s SER 54 Ca -0.12 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.08 3hpy s SER 54 Cb 0.29 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.88 3hpy s SER 54 CO 0.78 -0.81 0.00 0.00 0.98 0.00 0.00 173.24 174.18 3hpy s TYR 56 N 0.00 -0.18 -0.05 0.00 5.04 -0.84 -0.82 117.35 120.50 3hpy s TYR 56 Ca 0.00 0.55 0.01 0.00 -2.44 0.00 0.00 57.07 55.20 3hpy s TYR 56 Cb 0.00 -0.14 0.02 0.00 0.35 0.00 0.00 41.96 42.19 3hpy s TYR 56 CO 0.00 -0.21 -0.05 0.42 -1.34 0.00 0.00 175.55 174.37 3hpy s ILE 57 N 1.61 0.58 0.11 3.14 1.09 -0.88 0.41 121.20 127.26 3hpy s ILE 57 Ca -0.05 -0.15 0.05 0.00 -1.10 0.00 0.00 60.65 59.41 3hpy s ILE 57 Cb -0.12 -0.60 -0.04 0.00 -1.06 0.00 0.00 42.46 40.64 3hpy s ILE 57 CO -0.06 0.24 0.01 0.27 -0.10 0.00 0.00 174.94 175.29 3hpy s ILE 58 N 0.90 4.01 -0.07 2.92 -4.36 -0.97 -1.13 121.20 122.50 3hpy s ILE 58 Ca -0.11 -1.06 -0.03 0.00 -0.26 0.00 0.00 60.65 59.19 3hpy s ILE 58 Cb -0.14 -2.93 0.04 0.00 1.25 0.00 0.00 42.46 40.67 3hpy s ILE 58 CO 0.00 0.07 0.13 -0.60 0.24 0.00 0.00 174.94 174.78 3hpy s ARG 59 N -2.46 0.03 -0.48 0.37 3.52 -0.68 -2.55 118.95 116.69 3hpy s ARG 59 Ca 0.26 0.44 -0.27 0.00 -0.13 0.00 0.00 55.73 56.03 3hpy s ARG 59 Cb -0.11 -0.27 -0.04 0.00 -1.56 0.00 0.00 34.95 32.96 3hpy s ARG 59 CO 0.19 -0.25 2.07 -2.00 -0.81 0.00 0.00 175.30 174.50 3hpy s GLU 60 N 1.79 2.63 0.37 5.12 2.12 -1.25 -1.65 118.70 127.82 3hpy s GLU 60 Ca -0.02 1.18 0.08 0.00 0.36 0.00 0.00 54.97 56.57 3hpy s GLU 60 Cb -0.12 -4.42 -0.06 0.00 0.26 0.00 0.00 34.13 29.80 3hpy s GLU 60 CO -0.05 -2.70 0.07 0.00 -0.54 0.00 0.00 175.26 172.04 3hpy s ALA 61 N 9.66 3.33 0.54 6.30 0.00 -0.71 -4.92 121.76 135.97 3hpy s ALA 61 Ca 0.83 -2.02 0.31 0.00 0.00 0.00 0.00 51.96 51.08 3hpy s ALA 61 Cb -0.18 -0.35 1.80 0.00 0.00 0.00 0.00 23.12 24.39 3hpy s ALA 61 CO 0.26 -0.02 2.22 0.22 0.00 0.00 0.00 175.76 178.44 3hpy h ASP 62 N 1.68 0.00 -5.35 0.00 -0.00 -1.92 -3.39 116.42 107.45 3hpy h ASP 62 Ca -0.43 0.00 -0.27 0.00 -0.00 0.00 0.00 57.03 56.33 3hpy h ASP 62 Cb 1.25 0.00 -0.15 0.00 -0.00 0.00 0.00 39.33 40.43 3hpy h ASP 62 CO 0.69 0.03 -0.61 0.28 -0.00 0.00 0.00 179.24 179.63 3hpy s THR 63 N -4.43 0.13 0.46 2.25 -1.32 -1.26 -4.99 115.64 106.48 3hpy s THR 63 Ca -0.04 -2.00 0.04 0.00 -1.21 0.00 0.00 61.69 58.47 3hpy s THR 63 Cb 0.14 -2.53 0.01 0.00 -1.51 0.00 0.00 72.50 68.62 3hpy s THR 63 CO 0.54 0.00 0.65 0.00 -2.21 0.00 0.00 174.62 173.60 3hpy s ALA 64 N -4.04 4.08 0.00 11.08 0.00 -1.26 -4.50 121.76 127.12 3hpy s ALA 64 Ca 0.39 -1.38 0.00 0.00 0.00 0.00 0.00 51.96 50.97 3hpy s ALA 64 Cb 0.07 -1.91 0.00 0.00 0.00 0.00 0.00 23.12 21.28 3hpy s ALA 64 CO 0.13 -0.44 0.00 0.41 0.00 0.00 0.00 175.76 175.86 3hpy n GLY 65 N -2.05 0.65 3.46 0.00 0.00 -1.22 -4.94 105.19 101.08 3hpy n GLY 65 Ca 0.05 -2.12 -0.33 0.00 0.00 0.00 0.00 46.02 43.63 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 -1.12 3.25 -0.15 -0.61 2.07 -1.26 -1.59 121.20 121.80 3hpy s ILE 66 Ca 0.00 -0.62 -0.23 0.00 -1.41 0.00 0.00 60.65 58.38 3hpy s ILE 66 Cb 0.00 -2.33 -0.21 0.00 0.13 0.00 0.00 42.46 40.05 3hpy s ILE 66 CO 0.00 0.56 0.52 0.44 -1.91 0.00 0.00 174.94 174.55 3hpy h ASP 67 N 5.92 0.00 -4.98 4.50 3.32 -0.55 -3.49 116.42 121.14 3hpy h ASP 67 Ca -0.38 -0.73 0.02 0.00 0.02 0.00 0.00 57.03 55.95 3hpy h ASP 67 Cb 1.18 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.62 3hpy h ASP 67 CO 0.54 1.05 0.25 0.72 -1.72 0.00 0.00 179.24 180.08 3hpy s PHE 68 N -2.18 -0.43 -0.10 4.55 -0.12 -1.19 -4.41 117.98 114.09 3hpy s PHE 68 Ca -0.19 0.18 -0.00 0.00 -0.05 0.00 0.00 56.93 56.87 3hpy s PHE 68 Cb -0.00 0.59 0.02 0.00 -0.63 0.00 0.00 43.02 43.00 3hpy s PHE 68 CO 0.57 -0.90 -0.07 0.12 -0.05 0.00 0.00 175.22 174.89 3hpy s PHE 69 N -3.71 1.34 0.21 3.49 2.19 -0.95 -0.91 117.98 119.64 3hpy s PHE 69 Ca 0.04 -0.62 0.07 0.00 0.33 0.00 0.00 56.93 56.75 3hpy s PHE 69 Cb -0.02 -1.13 -0.04 0.00 -1.31 0.00 0.00 43.02 40.52 3hpy s PHE 69 CO -0.08 -0.45 0.08 0.20 1.83 0.00 0.00 175.22 176.80 3hpy s GLY 70 N 1.58 1.63 -0.07 13.12 0.00 0.15 -0.93 107.32 122.80 3hpy s GLY 70 Ca 0.02 -1.40 0.03 0.00 0.00 0.00 0.00 44.72 43.37 3hpy s GLY 70 CO -0.06 -1.43 -0.15 -1.36 0.00 0.00 0.00 173.10 170.11 3hpy s PHE 71 N -1.95 1.68 0.22 1.90 0.08 0.12 0.75 117.98 120.78 3hpy s PHE 71 Ca 0.30 -0.64 -0.29 0.00 0.12 0.00 0.00 56.93 56.43 3hpy s PHE 71 Cb -0.09 -1.20 -0.09 0.00 -0.57 0.00 0.00 43.02 41.08 3hpy s PHE 71 CO 0.22 -0.31 0.89 0.21 -0.10 0.00 0.00 175.22 176.13 3hpy s LYS 72 N 0.60 4.77 0.43 0.44 2.20 -0.64 -2.00 119.74 125.54 3hpy s LYS 72 Ca -0.15 1.39 0.07 0.00 -0.36 0.00 0.00 55.97 56.92 3hpy s LYS 72 Cb -0.16 -3.27 -0.03 0.00 -1.51 0.00 0.00 37.83 32.86 3hpy s LYS 72 CO 0.05 0.53 0.27 0.14 -0.36 0.00 0.00 175.35 175.98 3hpy s VAL 73 N -1.18 2.35 0.12 4.02 -7.23 0.27 -1.22 120.40 117.53 3hpy s VAL 73 Ca 0.40 -1.55 -0.30 0.00 -1.81 0.00 0.00 61.98 58.72 3hpy s VAL 73 Cb -0.25 -2.90 -0.08 0.00 0.56 0.00 0.00 36.38 33.71 3hpy s VAL 73 CO 0.30 0.00 1.59 0.25 -0.31 0.00 0.00 175.10 176.93 3hpy h LEU 74 N 1.21 -1.22 -8.18 1.32 5.85 -1.00 -3.43 115.31 109.86 3hpy h LEU 74 Ca -0.42 0.14 -0.11 0.00 0.84 0.00 0.00 57.88 58.34 3hpy h LEU 74 Cb 1.26 0.47 -0.02 0.00 0.37 0.00 0.00 40.66 42.74 3hpy h LEU 74 CO 0.64 -0.46 0.12 1.51 -0.34 0.00 0.00 178.44 179.91 3hpy s ASP 75 N -4.77 0.35 0.27 1.25 1.47 -1.26 -5.02 116.67 108.97 3hpy s ASP 75 Ca -0.16 -1.29 -0.01 0.00 1.18 0.00 0.00 52.55 52.26 3hpy s ASP 75 Cb 0.08 0.80 0.44 0.00 -0.34 0.00 0.00 42.92 43.90 3hpy s ASP 75 CO 0.64 -1.58 1.89 0.11 0.68 0.00 0.00 175.17 176.90 3hpy h LYS 76 N 2.03 1.11 -0.95 2.11 1.57 -1.91 0.15 116.57 120.68 3hpy h LYS 76 Ca -0.31 -0.07 0.01 0.00 -1.87 0.00 0.00 60.65 58.41 3hpy h LYS 76 Cb 1.25 -0.25 -0.05 0.00 0.08 0.00 0.00 32.23 33.26 3hpy h LYS 76 CO 0.41 0.73 0.62 0.00 -0.57 0.00 0.00 179.45 180.63 3hpy h ALA 77 N 1.47 1.20 -0.37 3.86 0.00 -2.00 -1.08 119.26 122.34 3hpy h ALA 77 Ca 0.43 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 55.18 3hpy h ALA 77 Cb 0.19 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3hpy h ALA 77 CO -0.17 0.61 -0.11 1.15 0.00 0.00 0.00 179.25 180.73 3hpy h THR 78 N 1.29 1.28 0.09 0.00 2.02 -1.59 -1.85 112.91 114.16 3hpy h THR 78 Ca 0.35 -1.20 0.02 0.00 0.77 0.00 0.00 66.41 66.35 3hpy h THR 78 Cb -0.13 1.28 -0.04 0.00 -1.74 0.00 0.00 68.15 67.52 3hpy h THR 78 CO -0.07 0.40 -0.33 0.25 0.37 0.00 0.00 175.52 176.13 3hpy h LEU 79 N 0.53 -0.96 -0.47 2.58 5.85 -0.36 0.17 115.31 122.65 3hpy h LEU 79 Ca 0.09 0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.98 3hpy h LEU 79 Cb 0.63 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 41.98 3hpy h LEU 79 CO 0.04 -0.41 0.20 -0.33 -0.34 0.00 0.00 178.44 177.60 3hpy h GLU 80 N -0.54 0.38 -0.39 1.25 4.39 -1.21 -0.32 114.58 118.14 3hpy h GLU 80 Ca 0.04 -0.02 0.07 0.00 0.34 0.00 0.00 59.36 59.79 3hpy h GLU 80 Cb 0.58 -0.09 -0.07 0.00 -0.10 0.00 0.00 28.75 29.08 3hpy h GLU 80 CO -0.21 0.25 -0.02 -0.22 -1.16 0.00 0.00 179.01 177.65 3hpy h LYS 81 N 0.39 0.07 -0.40 2.33 3.11 -0.57 -1.26 116.57 120.24 3hpy h LYS 81 Ca 0.21 -0.00 -0.15 0.00 -2.81 0.00 0.00 60.65 57.90 3hpy h LYS 81 Cb 0.18 -0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.38 3hpy h LYS 81 CO -0.19 0.05 -0.34 -0.07 -2.81 0.00 0.00 179.45 176.09 3hpy h LEU 82 N 0.08 0.97 -0.39 5.20 3.38 -0.14 -2.08 115.31 122.33 3hpy h LEU 82 Ca 0.19 -0.42 0.06 0.00 0.09 0.00 0.00 57.88 57.80 3hpy h LEU 82 Cb 0.28 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.70 3hpy h LEU 82 CO -0.34 1.21 0.06 -0.78 0.09 0.00 0.00 178.44 178.69 3hpy h ASP 83 N 0.77 -0.02 -0.89 -0.43 -0.00 -0.63 -0.11 116.42 115.09 3hpy h ASP 83 Ca 0.07 0.07 0.00 0.00 -0.00 0.00 0.00 57.03 57.18 3hpy h ASP 83 Cb 0.92 0.10 -0.04 0.00 -0.00 0.00 0.00 39.33 40.31 3hpy h ASP 83 CO 0.09 0.03 0.58 0.00 -0.00 0.00 0.00 179.24 179.93 3hpy h ALA 84 N 1.30 1.14 0.00 -0.78 0.00 -1.06 -1.83 119.26 118.02 3hpy h ALA 84 Ca 0.19 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 3hpy h ALA 84 Cb 0.23 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3hpy h ALA 84 CO -0.26 0.56 -0.41 -0.44 0.00 0.00 0.00 179.25 178.70 3hpy h ASP 85 N 1.22 0.00 -0.22 0.00 3.32 -0.71 -0.03 116.42 120.00 3hpy h ASP 85 Ca 0.33 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 57.19 3hpy h ASP 85 Cb -0.11 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.44 3hpy h ASP 85 CO -0.07 0.41 -0.56 -0.07 -1.72 0.00 0.00 179.24 177.23 3hpy h LEU 86 N 0.00 0.91 -0.16 1.55 3.38 -0.35 -2.03 115.31 118.62 3hpy h LEU 86 Ca -0.00 -0.50 -0.21 0.00 0.09 0.00 0.00 57.88 57.26 3hpy h LEU 86 Cb 0.75 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 41.25 3hpy h LEU 86 CO 0.05 1.28 -0.70 1.56 0.09 0.00 0.00 178.44 180.73 3hpy h GLN 87 N 0.62 0.76 -0.21 1.13 4.20 -1.06 -0.52 115.11 120.03 3hpy h GLN 87 Ca 0.01 -0.60 -0.01 0.00 0.06 0.00 0.00 58.65 58.11 3hpy h GLN 87 Cb 1.16 0.12 -0.01 0.00 0.30 0.00 0.00 27.48 29.05 3hpy h GLN 87 CO 0.12 1.21 0.10 0.00 -0.67 0.00 0.00 178.83 179.60 3hpy h ALA 88 N 0.55 1.78 0.00 3.87 0.00 -1.01 0.58 119.26 125.04 3hpy h ALA 88 Ca -0.04 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 3hpy h ALA 88 Cb 1.33 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3hpy h ALA 88 CO 0.15 0.18 -0.30 -0.92 0.00 0.00 0.00 179.25 178.36 3hpy h TYR 89 N 0.29 0.00 0.00 0.00 3.20 -1.20 -3.47 116.97 115.79 3hpy h TYR 89 Ca 0.08 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.95 3hpy h TYR 89 Cb 0.04 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.31 3hpy h TYR 89 CO 0.00 0.30 0.00 0.41 -1.64 0.00 0.00 178.16 177.23 3hpy n GLY 90 N 0.06 0.94 3.81 1.82 0.00 0.20 -5.09 105.19 106.92 3hpy n GLY 90 Ca -0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 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 4.44 -0.06 0.99 1.43 -0.24 -4.99 118.68 120.25 3hpy s LEU 91 Ca 0.00 1.38 -0.21 0.00 -1.03 0.00 0.00 54.13 54.28 3hpy s LEU 91 Cb 0.00 -3.32 -0.04 0.00 0.03 0.00 0.00 46.19 42.86 3hpy s LEU 91 CO 0.00 0.14 0.60 -0.89 0.23 0.00 0.00 176.35 176.42 3hpy s THR 92 N -1.34 5.05 0.13 5.49 2.01 -1.26 -3.82 115.64 121.90 3hpy s THR 92 Ca 0.37 1.23 0.09 0.00 0.31 0.00 0.00 61.69 63.69 3hpy s THR 92 Cb -0.18 -3.94 -0.04 0.00 0.01 0.00 0.00 72.50 68.35 3hpy s THR 92 CO 0.21 0.33 -0.14 0.42 -0.69 0.00 0.00 174.62 174.75 3hpy s THR 93 N 0.44 3.04 -0.11 -0.82 -4.23 -1.26 -4.41 115.64 108.30 3hpy s THR 93 Ca 0.32 -1.50 0.03 0.00 -1.18 0.00 0.00 61.69 59.36 3hpy s THR 93 Cb -0.17 -2.43 0.01 0.00 1.34 0.00 0.00 72.50 71.24 3hpy s THR 93 CO 0.15 0.05 -0.21 -0.89 -0.54 0.00 0.00 174.62 173.18 3hpy s THR 94 N -1.31 1.90 -0.56 3.99 2.01 0.97 -4.96 115.64 117.68 3hpy s THR 94 Ca 0.20 -0.91 -0.17 0.00 0.31 0.00 0.00 61.69 61.13 3hpy s THR 94 Cb -0.10 -1.67 0.12 0.00 0.01 0.00 0.00 72.50 70.86 3hpy s THR 94 CO 0.12 0.52 0.57 -0.60 -0.69 0.00 0.00 174.62 174.55 3hpy s ARG 95 N 0.59 3.02 -0.03 4.92 6.06 -1.26 -0.24 118.95 132.01 3hpy s ARG 95 Ca -0.14 -1.59 -0.30 0.00 -2.50 0.00 0.00 55.73 51.20 3hpy s ARG 95 Cb -0.17 -4.29 -0.04 0.00 0.06 0.00 0.00 34.95 30.51 3hpy s ARG 95 CO 0.04 -1.40 1.23 0.42 -2.50 0.00 0.00 175.30 173.09 3hpy s ILE 96 N 1.94 4.14 0.66 4.11 1.09 0.00 -4.92 121.20 128.22 3hpy s ILE 96 Ca 0.06 1.49 -0.17 0.00 -1.10 0.00 0.00 60.65 60.93 3hpy s ILE 96 Cb -0.28 -3.96 -0.00 0.00 -1.06 0.00 0.00 42.46 37.16 3hpy s ILE 96 CO 0.04 0.02 1.23 -2.16 -0.10 0.00 0.00 174.94 173.97 3hpy s PRO 97 N 2.02 2.54 0.25 2.79 0.04 -1.26 -1.46 135.00 139.92 3hpy s PRO 97 Ca 0.57 1.85 -0.30 0.00 0.04 0.00 0.00 61.00 63.17 3hpy s PRO 97 Cb -0.26 -1.87 -0.10 0.00 0.04 0.00 0.00 34.50 32.31 3hpy s PRO 97 CO 0.24 -1.55 1.40 0.00 0.04 0.00 0.00 177.00 177.14 3hpy s ALA 98 N -1.71 3.60 0.00 8.56 0.00 -1.26 -2.58 121.76 128.37 3hpy s ALA 98 Ca 0.77 1.28 0.00 0.00 0.00 0.00 0.00 51.96 54.01 3hpy s ALA 98 Cb -0.32 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.27 3hpy s ALA 98 CO 0.40 -0.69 0.00 0.41 0.00 0.00 0.00 175.76 175.87 3hpy n GLY 99 N 2.12 2.96 0.37 0.00 0.00 -0.23 -4.84 105.19 105.57 3hpy n GLY 99 Ca 0.06 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.22 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 1.52 0.69 -5.93 1.61 4.22 -1.75 -3.37 114.58 111.58 3hpy h GLU 100 Ca 0.00 -0.04 -0.68 0.00 0.08 0.00 0.00 59.36 58.72 3hpy h GLU 100 Cb 0.00 -0.16 -0.17 0.00 0.50 0.00 0.00 28.75 28.93 3hpy h GLU 100 CO 0.00 0.46 -0.64 -1.64 -2.18 0.00 0.00 179.01 175.00 3hpy s MET 101 N -5.75 3.02 0.26 1.92 -1.94 -1.26 -5.07 119.30 110.47 3hpy s MET 101 Ca -0.10 -0.45 -0.30 0.00 -1.71 0.00 0.00 55.69 53.12 3hpy s MET 101 Cb 0.24 -2.76 -0.14 0.00 2.01 0.00 0.00 34.83 34.18 3hpy s MET 101 CO 0.80 0.64 1.26 1.28 -0.01 0.00 0.00 175.02 178.98 3hpy n LEU 102 N 2.34 2.67 -1.05 -0.03 4.77 -1.26 -1.81 117.00 122.62 3hpy n LEU 102 Ca -0.18 1.16 -0.08 0.00 -0.03 0.00 0.00 56.01 56.88 3hpy n LEU 102 Cb 0.53 -1.38 -0.03 0.00 -2.33 0.00 0.00 43.42 40.21 3hpy n LEU 102 CO 0.29 -0.81 -0.08 -0.62 -1.33 0.00 0.00 177.39 174.84 3hpy n GLU 103 N 1.39 -1.35 -4.32 3.23 -0.58 -1.26 -4.92 120.64 112.83 3hpy n GLU 103 Ca 0.10 0.51 -0.31 0.00 -0.42 0.00 0.00 57.16 57.04 3hpy n GLU 103 Cb 0.31 -4.55 -0.10 0.00 -0.57 0.00 0.00 31.44 26.53 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 -1.58 3.59 0.82 2.62 2.01 -0.75 -1.29 115.64 121.06 3hpy s THR 104 Ca 0.00 -1.01 -0.06 0.00 0.31 0.00 0.00 61.69 60.93 3hpy s THR 104 Cb 0.00 -2.63 0.17 0.00 0.01 0.00 0.00 72.50 70.05 3hpy s THR 104 CO 0.00 0.24 1.13 -0.83 -0.69 0.00 0.00 174.62 174.47 3hpy s GLY 105 N -1.87 1.77 0.58 4.40 0.00 -0.73 -1.07 107.32 110.40 3hpy s GLY 105 Ca 0.20 -1.62 -0.19 0.00 0.00 0.00 0.00 44.72 43.11 3hpy s GLY 105 CO 0.12 -0.94 1.20 -1.83 0.00 0.00 0.00 173.10 171.64 3hpy s GLU 106 N -5.44 3.07 0.07 2.90 -1.05 -1.26 -4.48 118.70 112.50 3hpy s GLU 106 Ca 0.70 1.81 0.03 0.00 -0.15 0.00 0.00 54.97 57.36 3hpy s GLU 106 Cb -0.04 -1.97 -0.03 0.00 -0.44 0.00 0.00 34.13 31.65 3hpy s GLU 106 CO 0.48 -1.12 -0.09 1.03 0.95 0.00 0.00 175.26 176.50 3hpy s ARG 107 N -3.28 0.69 -0.26 -4.83 0.52 -0.53 -4.40 118.95 106.85 3hpy s ARG 107 Ca 0.76 -0.96 -0.12 0.00 -0.52 0.00 0.00 55.73 54.89 3hpy s ARG 107 Cb -0.30 -0.42 -0.05 0.00 0.52 0.00 0.00 34.95 34.71 3hpy s ARG 107 CO 0.33 0.07 0.25 0.08 0.02 0.00 0.00 175.30 176.05 3hpy s VAL 108 N -1.91 5.28 -0.03 3.52 1.01 0.14 -0.82 120.40 127.59 3hpy s VAL 108 Ca -0.02 0.33 0.07 0.00 0.00 0.00 0.00 61.98 62.36 3hpy s VAL 108 Cb -0.06 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.71 3hpy s VAL 108 CO -0.00 0.25 -0.23 -0.60 0.00 0.00 0.00 175.10 174.52 3hpy s ARG 109 N 1.61 2.24 0.18 2.72 3.52 0.67 -0.51 118.95 129.38 3hpy s ARG 109 Ca 0.10 -0.87 -0.07 0.00 -0.13 0.00 0.00 55.73 54.77 3hpy s ARG 109 Cb -0.15 -2.13 -0.02 0.00 -1.56 0.00 0.00 34.95 31.09 3hpy s ARG 109 CO 0.09 0.56 0.24 -0.59 -0.81 0.00 0.00 175.30 174.79 3hpy s PHE 110 N -0.61 0.61 -0.09 5.12 -0.12 -0.63 -0.02 117.98 122.24 3hpy s PHE 110 Ca 0.10 -0.95 0.00 0.00 -0.05 0.00 0.00 56.93 56.03 3hpy s PHE 110 Cb -0.10 -0.19 -0.03 0.00 -0.63 0.00 0.00 43.02 42.07 3hpy s PHE 110 CO -0.00 -0.71 -0.08 -2.00 -0.05 0.00 0.00 175.22 172.38 3hpy s GLU 111 N -4.02 2.96 0.50 1.99 2.12 -1.26 -0.93 118.70 120.05 3hpy s GLU 111 Ca 0.23 -0.57 -0.01 0.00 0.36 0.00 0.00 54.97 54.97 3hpy s GLU 111 Cb 0.04 -2.63 0.00 0.00 0.26 0.00 0.00 34.13 31.81 3hpy s GLU 111 CO 0.04 0.53 0.75 -0.51 -0.54 0.00 0.00 175.26 175.52 3hpy s LEU 112 N -0.46 3.49 0.57 2.70 1.43 -0.57 -4.93 118.68 120.91 3hpy s LEU 112 Ca 0.07 0.36 0.26 0.00 -1.03 0.00 0.00 54.13 53.78 3hpy s LEU 112 Cb -0.12 -3.22 1.64 0.00 0.03 0.00 0.00 46.19 44.52 3hpy s LEU 112 CO 0.02 -0.86 2.20 -0.65 0.23 0.00 0.00 176.35 177.30 3hpy h PRO 113 N 0.20 0.00 0.00 1.29 0.11 -1.88 0.69 132.00 132.42 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 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3hpy h PRO 113 CO 0.58 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.24 3hpy n SER 114 N -4.05 0.00 0.00 -2.05 3.41 -1.20 -4.64 113.62 105.10 3hpy n SER 114 Ca -0.02 -0.49 0.00 0.00 -0.26 0.00 0.00 58.87 58.10 3hpy n SER 114 Cb 0.13 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 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 0.86 1.70 3.76 5.00 0.00 0.24 -1.75 105.19 114.99 3hpy n GLY 115 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.38 3.94 -0.09 1.61 3.76 -1.26 -4.34 115.29 116.53 3hpy s HIS 116 Ca 0.00 1.79 -0.22 0.00 -0.15 0.00 0.00 55.06 56.48 3hpy s HIS 116 Cb 0.00 -2.90 -0.04 0.00 1.11 0.00 0.00 32.58 30.76 3hpy s HIS 116 CO 0.00 0.46 0.63 -0.51 -0.85 0.00 0.00 174.74 174.47 3hpy s LEU 117 N -1.07 4.30 0.06 0.89 1.43 -1.26 -1.51 118.68 121.51 3hpy s LEU 117 Ca 0.39 1.06 0.07 0.00 -1.03 0.00 0.00 54.13 54.62 3hpy s LEU 117 Cb -0.25 -2.96 -0.03 0.00 0.03 0.00 0.00 46.19 42.98 3hpy s LEU 117 CO 0.29 -0.09 -0.14 -0.63 0.23 0.00 0.00 176.35 176.01 3hpy s ILE 118 N 0.80 3.06 0.08 -0.59 -1.09 -0.11 -2.25 121.20 121.11 3hpy s ILE 118 Ca 0.34 -1.17 0.07 0.00 -2.23 0.00 0.00 60.65 57.66 3hpy s ILE 118 Cb -0.17 -2.34 -0.03 0.00 -1.58 0.00 0.00 42.46 38.34 3hpy s ILE 118 CO 0.15 0.27 -0.19 -1.61 -1.23 0.00 0.00 174.94 172.33 3hpy s GLU 119 N -1.68 1.14 -0.06 2.79 2.02 -0.10 -1.61 118.70 121.20 3hpy s GLU 119 Ca 0.17 -1.04 0.01 0.00 0.02 0.00 0.00 54.97 54.13 3hpy s GLU 119 Cb -0.11 -1.31 0.02 0.00 0.10 0.00 0.00 34.13 32.83 3hpy s GLU 119 CO 0.08 0.31 -0.05 -0.51 0.02 0.00 0.00 175.26 175.11 3hpy s LEU 120 N -1.61 1.21 0.05 1.80 1.02 0.34 0.15 118.68 121.64 3hpy s LEU 120 Ca 0.05 -0.16 -0.04 0.00 0.02 0.00 0.00 54.13 54.01 3hpy s LEU 120 Cb -0.09 -0.54 -0.02 0.00 0.02 0.00 0.00 46.19 45.56 3hpy s LEU 120 CO 0.03 -0.08 0.05 -0.72 0.02 0.00 0.00 176.35 175.65 3hpy s TYR 121 N 1.17 0.34 -0.16 0.29 1.13 -0.85 0.25 117.35 119.52 3hpy s TYR 121 Ca -0.07 -0.77 0.04 0.00 -1.41 0.00 0.00 57.07 54.86 3hpy s TYR 121 Cb -0.14 -0.24 -0.05 0.00 -1.10 0.00 0.00 41.96 40.43 3hpy s TYR 121 CO -0.01 -0.39 0.17 0.00 -2.51 0.00 0.00 175.55 172.80 3hpy n ALA 122 N 0.38 2.48 -2.42 9.51 0.00 -1.26 -0.56 120.51 128.64 3hpy n ALA 122 Ca -0.16 -0.12 -0.27 0.00 0.00 0.00 0.00 53.44 52.89 3hpy n ALA 122 Cb 0.60 -0.15 -0.16 0.00 0.00 0.00 0.00 19.45 19.74 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 -1.58 1.69 -0.30 0.00 2.02 -1.26 -4.80 118.70 114.46 3hpy s GLU 123 Ca 0.01 -0.76 -0.17 0.00 0.02 0.00 0.00 54.97 54.07 3hpy s GLU 123 Cb 0.03 -1.64 0.18 0.00 0.10 0.00 0.00 34.13 32.80 3hpy s GLU 123 CO 0.18 0.45 1.13 0.21 0.02 0.00 0.00 175.26 177.24 3hpy s LYS 124 N -0.53 0.18 0.17 1.61 2.20 -1.26 -1.78 119.74 120.32 3hpy s LYS 124 Ca 0.08 0.42 -0.33 0.00 -0.36 0.00 0.00 55.97 55.78 3hpy s LYS 124 Cb -0.08 0.23 -0.16 0.00 -1.51 0.00 0.00 37.83 36.31 3hpy s LYS 124 CO -0.01 -0.06 1.15 2.41 -0.36 0.00 0.00 175.35 178.49 3hpy n THR 125 N 4.57 0.88 -3.15 3.43 -1.04 -0.41 -4.69 114.28 113.87 3hpy n THR 125 Ca -0.09 -0.22 -0.42 0.00 -2.04 0.00 0.00 64.05 61.28 3hpy n THR 125 Cb 0.54 -0.80 -0.07 0.00 -1.82 0.00 0.00 70.33 68.18 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 5.56 0.00 0.00 0.00 0.31 0.10 -4.93 118.33 119.37 3hpy n VAL 127 Ca -0.02 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 3hpy n VAL 127 Cb 0.49 0.47 0.00 0.00 -0.91 0.00 0.00 33.84 33.88 3hpy n VAL 127 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3hpy n GLY 128 N 1.38 -0.22 1.67 2.92 0.00 -0.22 -4.68 105.19 106.03 3hpy n GLY 128 Ca -0.00 -1.82 -0.01 0.00 0.00 0.00 0.00 46.02 44.18 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 -0.77 4.50 0.00 1.61 2.04 -1.24 -4.49 115.26 116.90 3hpy n ASN 129 Ca 0.00 -3.21 0.00 0.00 -0.44 0.00 0.00 54.58 50.93 3hpy n ASN 129 Cb 0.00 -0.69 0.00 0.00 -2.53 0.00 0.00 39.78 36.56 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 -0.25 1.76 3.69 4.83 0.00 -1.26 -4.68 105.19 109.28 3hpy n GLY 130 Ca 0.35 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.06 4.24 0.74 -0.61 1.01 -1.26 -5.08 121.20 117.18 3hpy s ILE 131 Ca 0.00 -0.53 -0.16 0.00 0.00 0.00 0.00 60.65 59.96 3hpy s ILE 131 Cb 0.00 -2.88 -0.03 0.00 0.01 0.00 0.00 42.46 39.56 3hpy s ILE 131 CO 0.00 0.41 0.55 -0.24 0.00 0.00 0.00 174.94 175.66 3hpy n SER 132 N 1.48 -1.15 -0.28 3.58 2.88 -1.26 -4.90 113.62 113.98 3hpy n SER 132 Ca -0.15 0.58 0.13 0.00 -1.33 0.00 0.00 58.87 58.10 3hpy n SER 132 Cb 0.53 -1.23 0.40 0.00 -0.75 0.00 0.00 64.21 63.16 3hpy n SER 132 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 3hpy n GLU 133 N -0.87 0.95 -4.51 -1.46 1.02 -1.26 -4.23 120.64 110.28 3hpy n GLU 133 Ca 0.10 -0.56 -0.27 0.00 -0.02 0.00 0.00 57.16 56.41 3hpy n GLU 133 Cb 0.50 -1.49 -0.17 0.00 -0.02 0.00 0.00 31.44 30.27 3hpy n GLU 133 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3hpy s VAL 134 N -2.43 1.33 -1.34 2.62 0.11 -1.26 -4.77 120.40 114.66 3hpy s VAL 134 Ca 0.26 -0.56 -0.01 0.00 -2.93 0.00 0.00 61.98 58.75 3hpy s VAL 134 Cb 0.19 -1.22 0.00 0.00 -1.53 0.00 0.00 36.38 33.83 3hpy s VAL 134 CO 0.49 0.40 0.64 0.59 -3.33 0.00 0.00 175.10 173.89 3hpy n ASN 135 N 4.06 -1.05 -4.76 3.54 3.02 -1.26 -4.90 115.26 113.91 3hpy n ASN 135 Ca -0.20 -0.87 -0.39 0.00 -0.03 0.00 0.00 54.58 53.10 3hpy n ASN 135 Cb 0.51 -3.80 0.02 0.00 -0.61 0.00 0.00 39.78 35.90 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 -6.14 3.51 0.65 3.52 0.04 -1.26 -4.95 135.00 130.38 3hpy s PRO 136 Ca 0.02 2.15 -0.08 0.00 0.04 0.00 0.00 61.00 63.14 3hpy s PRO 136 Cb -0.01 -2.45 0.02 0.00 0.04 0.00 0.00 34.50 32.10 3hpy s PRO 136 CO 0.83 -0.86 0.99 0.00 0.04 0.00 0.00 177.00 178.00 3hpy s ALA 137 N -1.33 3.12 0.36 8.56 0.00 -1.26 -4.97 121.76 126.23 3hpy s ALA 137 Ca 0.65 -0.62 0.20 0.00 0.00 0.00 0.00 51.96 52.20 3hpy s ALA 137 Cb -0.38 -2.75 1.04 0.00 0.00 0.00 0.00 23.12 21.03 3hpy s ALA 137 CO 0.47 -1.03 1.93 -1.00 0.00 0.00 0.00 175.76 176.13 3hpy h PRO 138 N -0.44 0.00 0.00 0.00 0.13 -2.03 -3.47 132.00 126.19 3hpy h PRO 138 Ca -0.45 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.79 3hpy h PRO 138 Cb 1.27 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.38 3hpy h PRO 138 CO 0.62 0.24 0.35 -2.67 -0.23 0.00 0.00 178.00 176.31 3hpy n TRP 139 N -3.83 -0.81 -3.60 1.56 4.27 -1.26 -5.16 117.44 108.61 3hpy n TRP 139 Ca -0.02 -0.60 -0.04 0.00 -3.89 0.00 0.00 57.50 52.95 3hpy n TRP 139 Cb 0.34 0.29 -0.00 0.00 -1.36 0.00 0.00 31.31 30.57 3hpy n TRP 139 CO 0.00 0.00 0.00 0.27 -2.29 0.00 0.00 177.69 175.67 3hpy n ASN 140 N -0.88 -0.55 -0.03 -0.67 6.94 -1.26 -5.02 115.26 113.79 3hpy n ASN 140 Ca -0.00 -1.61 0.23 0.00 -0.02 0.00 0.00 54.58 53.17 3hpy n ASN 140 Cb 0.31 0.99 0.72 0.00 -2.36 0.00 0.00 39.78 39.44 3hpy n ASN 140 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3hpy h ALA 141 N 1.74 2.48 -0.88 -2.53 0.00 -2.00 -0.61 119.26 117.46 3hpy h ALA 141 Ca -0.10 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 54.93 3hpy h ALA 141 Cb 0.41 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.18 3hpy h ALA 141 CO 0.13 -0.81 0.57 1.96 0.00 0.00 0.00 179.25 181.10 3hpy h GLN 142 N 0.00 0.66 0.00 0.00 4.20 -1.96 -0.12 115.11 117.89 3hpy h GLN 142 Ca 0.29 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.96 3hpy h GLN 142 Cb 1.27 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.91 3hpy h GLN 142 CO -0.00 0.43 0.00 -0.09 -0.67 0.00 0.00 178.83 178.50 3hpy h ARG 143 N 0.68 0.00 -0.19 1.46 2.43 -1.45 -2.24 114.38 115.06 3hpy h ARG 143 Ca 0.44 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.61 3hpy h ARG 143 Cb 0.71 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.26 3hpy h ARG 143 CO -0.19 0.00 0.00 0.39 -1.51 0.00 0.00 179.97 178.66 3hpy n GLU 144 N -2.87 1.74 -2.82 0.20 1.02 -0.07 -4.71 120.64 113.14 3hpy n GLU 144 Ca -0.01 -1.70 -0.43 0.00 -0.02 0.00 0.00 57.16 55.00 3hpy n GLU 144 Cb 0.14 -1.30 -0.04 0.00 -0.02 0.00 0.00 31.44 30.22 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 -1.10 2.69 0.00 -0.32 2.46 -0.84 -4.87 115.29 113.30 3hpy s HIS 145 Ca 0.22 -0.27 0.00 0.00 0.47 0.00 0.00 55.06 55.48 3hpy s HIS 145 Cb 0.13 -4.23 0.00 0.00 -0.13 0.00 0.00 32.58 28.36 3hpy s HIS 145 CO 0.19 -1.56 0.00 0.41 -2.47 0.00 0.00 174.74 171.31 3hpy n GLY 146 N 5.24 0.12 0.28 1.59 0.00 -1.26 -3.31 105.19 107.86 3hpy n GLY 146 Ca -0.01 -0.97 -0.03 0.00 0.00 0.00 0.00 46.02 45.01 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 1.12 -5.85 -0.61 2.04 -1.10 -3.45 117.51 109.65 3hpy h ILE 147 Ca 0.00 -0.31 -0.18 0.00 1.00 0.00 0.00 64.86 65.37 3hpy h ILE 147 Cb 0.00 0.12 0.01 0.00 -0.74 0.00 0.00 36.82 36.20 3hpy h ILE 147 CO 0.00 0.17 -0.41 0.00 0.00 0.00 0.00 178.15 177.91 3hpy n ALA 148 N -2.32 -2.60 -0.99 1.87 0.00 0.50 -4.92 120.51 112.04 3hpy n ALA 148 Ca 0.08 -0.10 -0.29 0.00 0.00 0.00 0.00 53.44 53.13 3hpy n ALA 148 Cb 0.08 -1.39 0.18 0.00 0.00 0.00 0.00 19.45 18.32 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 -3.76 0.36 -0.07 0.00 0.04 -1.25 -4.90 135.00 125.43 3hpy s PRO 149 Ca 0.02 0.76 0.13 0.00 0.04 0.00 0.00 61.00 61.95 3hpy s PRO 149 Cb -0.01 -1.71 -0.23 0.00 0.04 0.00 0.00 34.50 32.59 3hpy s PRO 149 CO 0.80 -2.84 0.58 -0.89 0.04 0.00 0.00 177.00 174.69 3hpy n ILE 150 N -4.29 1.58 -3.48 0.56 -0.00 0.11 -3.96 119.36 109.89 3hpy n ILE 150 Ca 0.06 -0.80 -0.09 0.00 -0.00 0.00 0.00 62.75 61.91 3hpy n ILE 150 Cb 0.56 -0.96 -0.02 0.00 -0.00 0.00 0.00 39.64 39.21 3hpy n ILE 150 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3hpy s GLN 151 N -2.58 0.94 -0.54 0.38 -2.07 -1.26 -3.82 119.66 110.72 3hpy s GLN 151 Ca -0.05 -0.34 -0.28 0.00 -1.82 0.00 0.00 55.36 52.86 3hpy s GLN 151 Cb 0.08 0.44 0.02 0.00 -1.09 0.00 0.00 33.01 32.46 3hpy s GLN 151 CO 0.83 -0.41 1.25 -1.17 -1.32 0.00 0.00 175.29 174.47 3hpy s LEU 152 N -2.54 3.48 0.02 2.60 2.96 -1.26 -1.27 118.68 122.67 3hpy s LEU 152 Ca 0.04 0.28 -0.18 0.00 -0.22 0.00 0.00 54.13 54.05 3hpy s LEU 152 Cb -0.01 -3.25 -0.27 0.00 0.50 0.00 0.00 46.19 43.16 3hpy s LEU 152 CO -0.10 -1.49 1.08 -0.78 -1.32 0.00 0.00 176.35 173.74 3hpy h ASP 153 N 9.93 0.69 0.00 3.68 3.58 -1.05 -3.43 116.42 129.83 3hpy h ASP 153 Ca -0.25 -0.81 0.00 0.00 0.42 0.00 0.00 57.03 56.39 3hpy h ASP 153 Cb 1.07 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.90 3hpy h ASP 153 CO 1.17 1.43 0.00 0.00 -2.88 0.00 0.00 179.24 178.95 3hpy n HIS 154 N -4.01 0.00 -3.58 0.28 1.44 -1.19 -4.55 115.22 103.61 3hpy n HIS 154 Ca -0.12 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.48 3hpy n HIS 154 Cb 0.83 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.90 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 -2.76 1.78 0.08 0.00 0.20 0.41 -1.99 118.68 116.39 3hpy s LEU 156 Ca 0.02 -0.53 0.03 0.00 0.69 0.00 0.00 54.13 54.34 3hpy s LEU 156 Cb 0.01 -1.23 -0.04 0.00 -0.43 0.00 0.00 46.19 44.50 3hpy s LEU 156 CO -0.12 -0.05 0.10 -0.76 -0.29 0.00 0.00 176.35 175.23 3hpy s LEU 157 N 1.45 3.87 -0.16 -0.68 2.01 -0.37 -1.33 118.68 123.47 3hpy s LEU 157 Ca 0.05 0.02 0.01 0.00 0.01 0.00 0.00 54.13 54.22 3hpy s LEU 157 Cb -0.13 -2.54 0.01 0.00 0.01 0.00 0.00 46.19 43.55 3hpy s LEU 157 CO -0.11 0.16 -0.19 -0.31 1.01 0.00 0.00 176.35 176.91 3hpy s TYR 158 N -1.43 2.75 -0.00 0.29 1.51 -0.34 -1.40 117.35 118.72 3hpy s TYR 158 Ca 0.30 -1.44 -0.29 0.00 -1.01 0.00 0.00 57.07 54.63 3hpy s TYR 158 Cb -0.12 -1.89 0.10 0.00 -0.11 0.00 0.00 41.96 39.94 3hpy s TYR 158 CO 0.23 -0.69 1.08 0.20 -1.11 0.00 0.00 175.55 175.26 3hpy s GLY 159 N 1.08 -0.35 0.81 0.71 0.00 -1.15 -2.05 107.32 106.36 3hpy s GLY 159 Ca -0.00 0.80 -0.11 0.00 0.00 0.00 0.00 44.72 45.40 3hpy s GLY 159 CO -0.07 0.23 1.10 2.56 0.00 0.00 0.00 173.10 176.91 3hpy s PRO 160 N -2.83 1.98 -0.88 2.90 0.04 0.55 -1.94 135.00 134.81 3hpy s PRO 160 Ca 0.10 0.66 -0.05 0.00 0.04 0.00 0.00 61.00 61.75 3hpy s PRO 160 Cb 0.00 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.63 3hpy s PRO 160 CO -0.04 -1.70 0.74 0.09 0.04 0.00 0.00 177.00 176.13 3hpy n ASN 161 N -3.49 -6.63 0.02 6.66 3.02 -1.26 -3.22 115.26 110.36 3hpy n ASN 161 Ca 0.07 -0.52 -0.07 0.00 -0.03 0.00 0.00 54.58 54.03 3hpy n ASN 161 Cb 0.56 -4.29 0.10 0.00 -0.61 0.00 0.00 39.78 35.54 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 -0.38 1.32 -0.08 2.41 1.08 -1.90 -2.91 117.51 117.06 3hpy h ILE 162 Ca -0.34 -1.72 0.03 0.00 -0.39 0.00 0.00 64.86 62.44 3hpy h ILE 162 Cb 1.19 1.73 -0.04 0.00 -3.07 0.00 0.00 36.82 36.63 3hpy h ILE 162 CO 0.37 0.53 -0.12 0.00 -0.69 0.00 0.00 178.15 178.24 3hpy h ALA 163 N 1.09 -0.07 -0.87 1.87 0.00 -1.91 0.15 119.26 119.52 3hpy h ALA 163 Ca 0.02 0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3hpy h ALA 163 Cb 1.00 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 3hpy h ALA 163 CO 0.09 -0.59 0.54 0.93 0.00 0.00 0.00 179.25 180.22 3hpy h GLU 164 N -0.17 1.17 -0.65 0.00 5.08 -1.94 -1.52 114.58 116.56 3hpy h GLU 164 Ca 0.07 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3hpy h GLU 164 Cb 0.27 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 3hpy h GLU 164 CO -0.18 0.81 0.42 0.28 -1.00 0.00 0.00 179.01 179.33 3hpy h VAL 165 N 1.19 1.17 -0.11 3.13 2.07 -1.17 -2.43 116.25 120.11 3hpy h VAL 165 Ca 0.31 -0.34 0.03 0.00 0.82 0.00 0.00 66.70 67.52 3hpy h VAL 165 Cb -0.08 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 29.90 3hpy h VAL 165 CO -0.06 0.17 -0.05 -0.61 0.02 0.00 0.00 177.57 177.04 3hpy h GLN 166 N 0.88 -0.04 -0.57 1.57 4.15 -0.07 -1.89 115.11 119.14 3hpy h GLN 166 Ca 0.24 0.00 0.11 0.00 0.77 0.00 0.00 58.65 59.77 3hpy h GLN 166 Cb -0.08 0.01 -0.09 0.00 0.21 0.00 0.00 27.48 27.53 3hpy h GLN 166 CO -0.05 -0.03 0.05 0.87 -1.93 0.00 0.00 178.83 177.74 3hpy h LYS 167 N -0.04 0.16 -0.50 1.69 1.57 -0.89 0.35 116.57 118.90 3hpy h LYS 167 Ca 0.06 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 3hpy h LYS 167 Cb 0.13 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 3hpy h LYS 167 CO -0.13 0.11 0.23 0.82 -0.57 0.00 0.00 179.45 179.91 3hpy h ILE 168 N 0.17 1.20 -0.24 1.86 2.04 -1.16 0.57 117.51 121.94 3hpy h ILE 168 Ca 0.30 -0.57 -0.04 0.00 1.00 0.00 0.00 64.86 65.55 3hpy h ILE 168 Cb 0.46 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 3hpy h ILE 168 CO -0.44 0.22 0.00 -0.26 0.00 0.00 0.00 178.15 177.67 3hpy h PHE 169 N 0.66 0.46 0.00 1.37 -1.00 -0.39 0.09 116.94 118.15 3hpy h PHE 169 Ca 0.17 -0.08 -0.13 0.00 2.81 0.00 0.00 57.97 60.74 3hpy h PHE 169 Cb 0.13 -0.12 -0.02 0.00 3.61 0.00 0.00 35.95 39.55 3hpy h PHE 169 CO -0.00 0.60 -0.93 1.79 -1.61 0.00 0.00 178.31 178.15 3hpy h THR 170 N 0.20 0.70 0.00 -1.55 1.35 -0.29 0.18 112.91 113.51 3hpy h THR 170 Ca 0.07 -2.12 0.00 0.00 -0.55 0.00 0.00 66.41 63.81 3hpy h THR 170 Cb 0.41 2.24 0.00 0.00 -1.73 0.00 0.00 68.15 69.07 3hpy h THR 170 CO 0.01 0.40 -1.57 -0.62 -0.25 0.00 0.00 175.52 173.49 3hpy n GLU 171 N -3.07 0.49 -0.00 4.72 1.02 0.20 -4.41 120.64 119.59 3hpy n GLU 171 Ca -0.03 -0.12 -0.01 0.00 -0.02 0.00 0.00 57.16 56.98 3hpy n GLU 171 Cb 0.78 -1.49 -0.00 0.00 -0.02 0.00 0.00 31.44 30.71 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 -1.94 0.05 1.47 2.62 0.31 -0.09 -4.80 118.33 115.96 3hpy n VAL 172 Ca -0.01 -0.02 0.11 0.00 -0.01 0.00 0.00 64.34 64.41 3hpy n VAL 172 Cb 0.46 -1.22 0.45 0.00 -0.91 0.00 0.00 33.84 32.62 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 -2.89 1.17 -1.01 7.52 7.99 -0.53 -4.93 117.00 124.32 3hpy n LEU 173 Ca -0.02 -0.48 -0.10 0.00 -0.01 0.00 0.00 56.01 55.41 3hpy n LEU 173 Cb 0.51 -0.07 -0.01 0.00 -0.11 0.00 0.00 43.42 43.75 3hpy n LEU 173 CO 0.00 0.24 -0.12 0.61 -1.51 0.00 0.00 177.39 176.62 3hpy n GLY 174 N 1.04 0.23 3.98 -0.72 0.00 -0.97 -4.48 105.19 104.28 3hpy n GLY 174 Ca 0.16 -0.51 -0.21 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.45 2.46 -0.05 1.61 0.40 0.60 -4.70 117.98 115.85 3hpy s PHE 175 Ca 0.00 -0.16 -0.18 0.00 -0.60 0.00 0.00 56.93 56.00 3hpy s PHE 175 Cb 0.00 -2.74 0.03 0.00 0.51 0.00 0.00 43.02 40.83 3hpy s PHE 175 CO 0.00 -1.05 0.40 1.52 0.70 0.00 0.00 175.22 176.79 3hpy s TYR 176 N -2.81 -0.32 -0.05 0.36 -0.85 -0.64 -4.13 117.35 108.92 3hpy s TYR 176 Ca 0.59 0.58 -0.30 0.00 -0.52 0.00 0.00 57.07 57.43 3hpy s TYR 176 Cb -0.09 0.16 -0.05 0.00 0.38 0.00 0.00 41.96 42.37 3hpy s TYR 176 CO 0.39 -0.40 1.42 -1.17 -1.52 0.00 0.00 175.55 174.27 3hpy s LEU 177 N -1.00 4.29 -0.26 -3.49 0.20 -1.26 -1.96 118.68 115.20 3hpy s LEU 177 Ca -0.10 2.04 -0.09 0.00 0.69 0.00 0.00 54.13 56.67 3hpy s LEU 177 Cb -0.04 -3.55 -0.15 0.00 -0.43 0.00 0.00 46.19 42.02 3hpy s LEU 177 CO 0.05 -0.76 -0.21 0.52 -0.29 0.00 0.00 176.35 175.65 3hpy n VAL 178 N 4.97 1.53 -3.82 1.68 0.31 -0.03 -4.07 118.33 118.89 3hpy n VAL 178 Ca 0.14 -0.43 -0.11 0.00 -0.01 0.00 0.00 64.34 63.93 3hpy n VAL 178 Cb 0.44 -1.73 -0.08 0.00 -0.91 0.00 0.00 33.84 31.55 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 -2.50 0.72 0.00 5.55 2.02 -1.19 -1.27 118.70 122.03 3hpy s GLU 179 Ca -0.36 -0.59 -0.10 0.00 0.02 0.00 0.00 54.97 53.95 3hpy s GLU 179 Cb 0.12 0.30 0.01 0.00 0.10 0.00 0.00 34.13 34.65 3hpy s GLU 179 CO 0.56 -0.21 0.20 -0.98 0.02 0.00 0.00 175.26 174.84 3hpy s ARG 180 N -2.51 0.57 -0.34 1.61 1.70 -0.56 -0.86 118.95 118.55 3hpy s ARG 180 Ca -0.05 -0.38 -0.10 0.00 -0.47 0.00 0.00 55.73 54.73 3hpy s ARG 180 Cb -0.01 0.24 0.01 0.00 -0.57 0.00 0.00 34.95 34.62 3hpy s ARG 180 CO -0.03 -0.15 0.17 0.08 -1.08 0.00 0.00 175.30 174.29 3hpy s VAL 181 N -1.55 4.49 0.03 4.99 1.01 -0.49 -1.18 120.40 127.69 3hpy s VAL 181 Ca -0.13 -0.70 -0.30 0.00 0.00 0.00 0.00 61.98 60.85 3hpy s VAL 181 Cb -0.06 -3.41 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 3hpy s VAL 181 CO 0.02 -0.09 1.29 -0.76 0.00 0.00 0.00 175.10 175.56 3hpy s LEU 182 N 1.56 4.33 0.83 3.92 1.02 0.91 -0.98 118.68 130.28 3hpy s LEU 182 Ca 0.03 2.05 -0.12 0.00 0.02 0.00 0.00 54.13 56.12 3hpy s LEU 182 Cb -0.18 -3.57 0.09 0.00 0.02 0.00 0.00 46.19 42.55 3hpy s LEU 182 CO 0.06 -0.60 1.11 -0.94 0.02 0.00 0.00 176.35 176.00 3hpy s SER 183 N 1.41 4.24 0.50 2.29 1.04 -0.97 -1.41 113.70 120.80 3hpy s SER 183 Ca 0.61 1.16 -0.16 0.00 0.48 0.00 0.00 55.95 58.04 3hpy s SER 183 Cb -0.30 -1.84 -0.13 0.00 0.10 0.00 0.00 66.02 63.84 3hpy s SER 183 CO 0.27 -2.11 -0.17 -2.65 0.98 0.00 0.00 173.24 169.56 3hpy n PRO 184 N -3.51 0.00 -0.89 4.02 -0.02 -1.26 -4.57 135.00 128.77 3hpy n PRO 184 Ca 0.07 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.24 3hpy n PRO 184 Cb 0.57 -0.90 -0.02 0.00 -0.02 0.00 0.00 33.50 33.14 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 2.34 -0.88 0.00 2.55 -0.08 -1.26 -3.97 116.55 115.25 3hpy n ASP 185 Ca 0.06 0.71 0.00 0.00 -1.51 0.00 0.00 54.79 54.05 3hpy n ASP 185 Cb 0.43 -0.61 0.00 0.00 2.34 0.00 0.00 41.12 43.29 3hpy n ASP 185 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3hpy n GLY 186 N 1.30 0.56 3.42 0.27 0.00 -1.26 -5.02 105.19 104.45 3hpy n GLY 186 Ca 0.11 -0.12 -0.47 0.00 0.00 0.00 0.00 46.02 45.54 3hpy n GLY 186 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hpy n ASP 187 N 0.00 -1.00 -3.60 1.61 8.00 -1.25 -4.96 116.55 115.34 3hpy n ASP 187 Ca 0.00 1.13 -0.08 0.00 0.71 0.00 0.00 54.79 56.55 3hpy n ASP 187 Cb 0.00 -0.99 -0.05 0.00 -0.02 0.00 0.00 41.12 40.07 3hpy n ASP 187 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3hpy s SER 188 N -0.95 -0.26 -0.17 -2.24 1.04 -1.26 -5.02 113.70 104.83 3hpy s SER 188 Ca 0.63 0.28 -0.28 0.00 0.48 0.00 0.00 55.95 57.05 3hpy s SER 188 Cb -0.90 0.22 -0.00 0.00 0.10 0.00 0.00 66.02 65.44 3hpy s SER 188 CO 0.57 -0.25 0.98 -1.81 0.98 0.00 0.00 173.24 173.71 3hpy s ASP 189 N -1.13 7.12 0.06 7.02 1.01 -1.26 -2.28 116.67 127.21 3hpy s ASP 189 Ca 0.02 1.39 0.11 0.00 0.71 0.00 0.00 52.55 54.78 3hpy s ASP 189 Cb -0.01 -2.53 -0.19 0.00 1.01 0.00 0.00 42.92 41.20 3hpy s ASP 189 CO -0.02 -0.53 1.00 -0.03 0.21 0.00 0.00 175.17 175.81 3hpy h MET 190 N 7.30 0.00 -3.46 8.23 1.85 -1.38 -3.45 114.93 124.02 3hpy h MET 190 Ca -0.26 0.00 -0.18 0.00 -0.61 0.00 0.00 59.70 58.66 3hpy h MET 190 Cb 1.11 0.00 -0.24 0.00 0.43 0.00 0.00 31.60 32.89 3hpy h MET 190 CO 0.90 0.70 -0.54 0.20 -0.40 0.00 0.00 176.91 177.77 3hpy s GLY 191 N -4.86 -0.04 -0.02 1.39 0.00 -1.17 0.03 107.32 102.64 3hpy s GLY 191 Ca -0.01 0.18 -0.00 0.00 0.00 0.00 0.00 44.72 44.89 3hpy s GLY 191 CO 0.82 0.10 0.04 -0.42 0.00 0.00 0.00 173.10 173.63 3hpy s ILE 192 N -0.45 -0.05 -0.33 0.90 1.01 0.18 -1.40 121.20 121.05 3hpy s ILE 192 Ca -0.05 0.19 -0.03 0.00 0.00 0.00 0.00 60.65 60.76 3hpy s ILE 192 Cb -0.04 -0.09 0.06 0.00 0.01 0.00 0.00 42.46 42.41 3hpy s ILE 192 CO 0.01 0.08 0.06 0.26 0.00 0.00 0.00 174.94 175.35 3hpy s TRP 193 N 0.96 3.35 -0.03 3.97 0.51 -0.04 -1.24 118.94 126.42 3hpy s TRP 193 Ca -0.08 -1.97 -0.02 0.00 -2.12 0.00 0.00 56.10 51.91 3hpy s TRP 193 Cb -0.11 -2.42 -0.04 0.00 -0.81 0.00 0.00 33.47 30.08 3hpy s TRP 193 CO -0.03 -0.84 0.11 -0.51 -0.51 0.00 0.00 176.95 175.17 3hpy s LEU 194 N 1.24 4.06 0.06 2.99 1.43 -0.00 -0.85 118.68 127.60 3hpy s LEU 194 Ca -0.01 0.24 0.07 0.00 -1.03 0.00 0.00 54.13 53.40 3hpy s LEU 194 Cb -0.20 -2.29 -0.03 0.00 0.03 0.00 0.00 46.19 43.70 3hpy s LEU 194 CO -0.01 0.30 -0.19 -0.55 0.23 0.00 0.00 176.35 176.12 3hpy s SER 195 N -1.61 2.33 -0.15 2.29 0.15 -0.83 0.25 113.70 116.13 3hpy s SER 195 Ca 0.22 -0.57 0.15 0.00 0.70 0.00 0.00 55.95 56.45 3hpy s SER 195 Cb -0.12 -0.16 0.40 0.00 -1.71 0.00 0.00 66.02 64.42 3hpy s SER 195 CO 0.13 0.10 1.19 0.00 1.20 0.00 0.00 173.24 175.86 3hpy n SER 197 N -0.73 0.11 -1.03 0.00 3.41 -1.26 -4.72 113.62 109.41 3hpy n SER 197 Ca 0.15 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.80 3hpy n SER 197 Cb 0.80 0.00 0.24 0.00 -0.26 0.00 0.00 64.21 64.99 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 1.08 -2.93 7.33 1.44 -1.26 -4.63 115.22 116.25 3hpy n HIS 198 Ca 0.00 -1.10 -0.29 0.00 -2.01 0.00 0.00 57.72 54.32 3hpy n HIS 198 Cb 0.00 -0.39 -0.02 0.00 0.12 0.00 0.00 29.99 29.70 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 -2.96 3.67 0.48 -1.40 1.02 -1.26 -3.39 119.74 115.89 3hpy s LYS 199 Ca 0.44 0.26 0.18 0.00 0.02 0.00 0.00 55.97 56.87 3hpy s LYS 199 Cb 0.37 -2.45 1.19 0.00 -0.52 0.00 0.00 37.83 36.41 3hpy s LYS 199 CO 0.07 -0.02 1.99 -0.39 -0.92 0.00 0.00 175.35 176.08 3hpy h VAL 200 N 0.90 0.83 -1.18 3.17 -1.51 -1.91 -3.43 116.25 113.13 3hpy h VAL 200 Ca -0.47 -0.08 0.18 0.00 -1.23 0.00 0.00 66.70 65.10 3hpy h VAL 200 Cb 1.19 0.59 -0.29 0.00 -2.13 0.00 0.00 31.29 30.65 3hpy h VAL 200 CO 0.64 0.04 0.82 -1.38 -1.23 0.00 0.00 177.57 176.46 3hpy s HIS 201 N -5.23 -0.13 -0.25 5.19 0.00 -1.26 -4.60 115.29 109.01 3hpy s HIS 201 Ca -0.06 0.28 0.18 0.00 -3.00 0.00 0.00 55.06 52.45 3hpy s HIS 201 Cb 0.20 0.47 -0.26 0.00 -4.00 0.00 0.00 32.58 28.99 3hpy s HIS 201 CO 0.74 -0.09 0.50 -0.25 -1.00 0.00 0.00 174.74 174.64 3hpy n ASP 202 N 1.21 0.84 -3.55 7.38 8.00 0.14 -4.74 116.55 125.83 3hpy n ASP 202 Ca -0.07 -0.26 -0.13 0.00 0.71 0.00 0.00 54.79 55.04 3hpy n ASP 202 Cb 0.58 1.60 -0.05 0.00 -0.02 0.00 0.00 41.12 43.22 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 -3.09 0.00 0.04 0.53 2.07 -1.07 -3.98 121.20 115.70 3hpy s ILE 203 Ca -0.03 0.00 -0.02 0.00 -1.41 0.00 0.00 60.65 59.19 3hpy s ILE 203 Cb 0.12 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.68 3hpy s ILE 203 CO 0.75 0.00 0.00 0.00 -1.91 0.00 0.00 174.94 173.78 3hpy s ALA 204 N -1.41 0.26 0.02 1.50 0.00 -0.84 -0.82 121.76 120.47 3hpy s ALA 204 Ca -0.04 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.05 3hpy s ALA 204 Cb -0.00 0.24 -0.01 0.00 0.00 0.00 0.00 23.12 23.34 3hpy s ALA 204 CO 0.03 -0.31 -0.06 -0.06 0.00 0.00 0.00 175.76 175.36 3hpy s PHE 205 N -2.97 0.55 -0.06 0.00 0.40 -0.37 -1.23 117.98 114.29 3hpy s PHE 205 Ca -0.02 -0.27 0.03 0.00 -0.60 0.00 0.00 56.93 56.07 3hpy s PHE 205 Cb 0.01 -0.34 0.01 0.00 0.51 0.00 0.00 43.02 43.21 3hpy s PHE 205 CO -0.06 -0.04 -0.14 0.08 0.70 0.00 0.00 175.22 175.75 3hpy s VAL 206 N -0.68 1.27 0.06 -0.44 1.01 -0.50 -0.65 120.40 120.48 3hpy s VAL 206 Ca -0.03 -0.58 -0.34 0.00 0.00 0.00 0.00 61.98 61.03 3hpy s VAL 206 Cb -0.06 -1.12 -0.13 0.00 0.00 0.00 0.00 36.38 35.07 3hpy s VAL 206 CO 0.00 0.38 1.72 1.21 0.00 0.00 0.00 175.10 178.41 3hpy n GLU 207 N 3.54 2.23 -3.70 2.72 4.07 0.10 -2.95 120.64 126.64 3hpy n GLU 207 Ca -0.21 0.81 -0.12 0.00 -0.06 0.00 0.00 57.16 57.58 3hpy n GLU 207 Cb 0.52 -2.62 -0.10 0.00 -0.06 0.00 0.00 31.44 29.18 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 2.29 -0.57 0.31 4.31 5.04 -0.82 -4.83 117.35 123.08 3hpy s TYR 208 Ca 0.84 1.30 0.03 0.00 -2.44 0.00 0.00 57.07 56.80 3hpy s TYR 208 Cb -0.66 0.23 0.60 0.00 0.35 0.00 0.00 41.96 42.48 3hpy s TYR 208 CO 0.43 -0.30 1.89 -1.35 -1.34 0.00 0.00 175.55 174.88 3hpy h PRO 209 N 6.13 0.92 -6.82 4.97 0.11 -1.93 0.16 132.00 135.53 3hpy h PRO 209 Ca -0.31 -0.06 -0.48 0.00 0.11 0.00 0.00 66.00 65.27 3hpy h PRO 209 Cb 1.18 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 32.06 3hpy h PRO 209 CO 0.24 0.61 0.19 -2.00 -0.21 0.00 0.00 178.00 176.83 3hpy s GLU 210 N -5.86 4.14 0.15 1.05 2.56 -1.26 -4.59 118.70 114.89 3hpy s GLU 210 Ca -0.11 0.88 0.07 0.00 0.00 0.00 0.00 54.97 55.81 3hpy s GLU 210 Cb 0.21 -2.43 -0.04 0.00 2.00 0.00 0.00 34.13 33.86 3hpy s GLU 210 CO 0.80 0.14 -0.05 -1.59 -0.56 0.00 0.00 175.26 173.99 3hpy s LYS 211 N -2.86 2.24 -0.00 4.30 -2.85 -1.26 -3.72 119.74 115.59 3hpy s LYS 211 Ca 0.55 -1.11 0.00 0.00 -1.00 0.00 0.00 55.97 54.41 3hpy s LYS 211 Cb -0.11 -2.30 0.00 0.00 -2.06 0.00 0.00 37.83 33.36 3hpy s LYS 211 CO 0.17 0.47 0.00 0.41 0.10 0.00 0.00 175.35 176.50 3hpy n GLY 212 N 0.20 0.48 3.75 0.59 0.00 -0.72 -4.94 105.19 104.54 3hpy n GLY 212 Ca -0.11 -0.06 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.18 4.68 -0.29 1.61 -0.14 -0.87 -4.70 119.74 119.86 3hpy s LYS 213 Ca 0.00 1.66 -0.06 0.00 -1.36 0.00 0.00 55.97 56.21 3hpy s LYS 213 Cb 0.00 -3.26 0.02 0.00 -1.68 0.00 0.00 37.83 32.90 3hpy s LYS 213 CO 0.00 0.24 0.06 -1.17 -0.76 0.00 0.00 175.35 173.72 3hpy s LEU 214 N -0.85 3.80 -0.10 3.17 1.98 -1.26 -1.20 118.68 124.22 3hpy s LEU 214 Ca 0.46 -0.81 -0.23 0.00 -2.89 0.00 0.00 54.13 50.65 3hpy s LEU 214 Cb -0.29 -1.84 -0.20 0.00 0.66 0.00 0.00 46.19 44.53 3hpy s LEU 214 CO 0.35 -0.20 0.78 -0.74 -1.89 0.00 0.00 176.35 174.65 3hpy h HIS 215 N 8.19 -0.04 -1.23 5.38 -0.00 -1.54 -3.46 115.15 122.44 3hpy h HIS 215 Ca -0.30 -0.00 0.26 0.00 -0.00 0.00 0.00 60.37 60.32 3hpy h HIS 215 Cb 1.12 0.01 -0.23 0.00 -0.00 0.00 0.00 27.41 28.31 3hpy h HIS 215 CO 0.60 0.65 0.88 -3.38 -0.00 0.00 0.00 177.93 176.68 3hpy s HIS 216 N -2.70 -0.09 -0.04 5.26 -3.43 -1.13 -4.29 115.29 108.86 3hpy s HIS 216 Ca -0.15 0.10 -0.01 0.00 -0.80 0.00 0.00 55.06 54.19 3hpy s HIS 216 Cb -0.01 0.50 -0.04 0.00 -1.43 0.00 0.00 32.58 31.60 3hpy s HIS 216 CO 0.56 -0.11 0.05 0.00 -2.00 0.00 0.00 174.74 173.24 3hpy s SER 218 N -1.34 3.70 -0.05 0.00 0.15 0.19 -1.15 113.70 115.21 3hpy s SER 218 Ca 0.18 -0.42 0.06 0.00 0.70 0.00 0.00 55.95 56.47 3hpy s SER 218 Cb -0.12 -0.59 -0.02 0.00 -1.71 0.00 0.00 66.02 63.59 3hpy s SER 218 CO 0.08 0.27 -0.23 -0.36 1.20 0.00 0.00 173.24 174.21 3hpy s PHE 219 N -0.86 2.49 0.17 3.44 0.40 0.16 -0.38 117.98 123.39 3hpy s PHE 219 Ca 0.13 -0.56 -0.27 0.00 -0.60 0.00 0.00 56.93 55.63 3hpy s PHE 219 Cb -0.10 -1.60 -0.08 0.00 0.51 0.00 0.00 43.02 41.75 3hpy s PHE 219 CO 0.04 -0.11 0.85 -1.17 0.70 0.00 0.00 175.22 175.52 3hpy s LEU 220 N -0.32 4.59 0.29 -0.37 2.96 -0.40 -0.90 118.68 124.52 3hpy s LEU 220 Ca 0.01 1.74 0.10 0.00 -0.22 0.00 0.00 54.13 55.76 3hpy s LEU 220 Cb -0.13 -3.42 -0.05 0.00 0.50 0.00 0.00 46.19 43.10 3hpy s LEU 220 CO 0.02 0.14 -0.05 -0.76 -1.32 0.00 0.00 176.35 174.39 3hpy s LEU 221 N -0.92 2.99 0.04 -0.68 1.02 0.31 -0.71 118.68 120.74 3hpy s LEU 221 Ca 0.39 -0.83 -0.16 0.00 0.02 0.00 0.00 54.13 53.55 3hpy s LEU 221 Cb -0.24 -1.47 -0.29 0.00 0.02 0.00 0.00 46.19 44.21 3hpy s LEU 221 CO 0.28 -0.05 1.08 -0.33 0.02 0.00 0.00 176.35 177.35 3hpy h GLU 222 N 1.96 0.60 -3.62 1.70 4.39 -1.95 -3.41 114.58 114.25 3hpy h GLU 222 Ca -0.43 -0.81 -0.07 0.00 0.34 0.00 0.00 59.36 58.39 3hpy h GLU 222 Cb 1.25 0.27 -0.08 0.00 -0.10 0.00 0.00 28.75 30.09 3hpy h GLU 222 CO 0.62 1.37 -0.07 -1.54 -1.16 0.00 0.00 179.01 178.22 3hpy s SER 223 N -7.38 0.04 0.25 1.42 1.04 -1.26 -4.94 113.70 102.87 3hpy s SER 223 Ca -0.10 -1.00 -0.05 0.00 0.48 0.00 0.00 55.95 55.28 3hpy s SER 223 Cb 0.05 0.63 0.29 0.00 0.10 0.00 0.00 66.02 67.09 3hpy s SER 223 CO 0.92 -1.22 1.91 -0.25 0.98 0.00 0.00 173.24 175.59 3hpy h TRP 224 N 2.20 1.21 0.00 5.02 -0.00 -1.95 0.13 115.95 122.56 3hpy h TRP 224 Ca -0.26 0.03 -0.05 0.00 -0.00 0.00 0.00 58.89 58.61 3hpy h TRP 224 Cb 1.25 -0.41 -0.01 0.00 -0.00 0.00 0.00 29.16 30.00 3hpy h TRP 224 CO 0.62 0.72 -0.23 0.93 -0.00 0.00 0.00 178.44 180.48 3hpy h GLU 225 N 1.27 0.00 0.00 2.65 5.08 -2.00 -1.15 114.58 120.43 3hpy h GLU 225 Ca 0.38 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.68 3hpy h GLU 225 Cb -0.06 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 3hpy h GLU 225 CO -0.11 0.23 -0.27 1.96 -1.00 0.00 0.00 179.01 179.82 3hpy h GLN 226 N 0.00 0.00 -0.33 2.33 1.08 -1.37 -2.28 115.11 114.53 3hpy h GLN 226 Ca -0.00 0.00 -0.17 0.00 -1.45 0.00 0.00 58.65 57.03 3hpy h GLN 226 Cb 0.44 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.87 3hpy h GLN 226 CO 0.03 0.27 -0.47 0.28 -0.95 0.00 0.00 178.83 177.99 3hpy h VAL 227 N 0.00 1.27 0.09 -0.54 2.07 -0.76 -1.52 116.25 116.86 3hpy h VAL 227 Ca -0.00 -1.65 -0.00 0.00 0.82 0.00 0.00 66.70 65.87 3hpy h VAL 227 Cb 0.77 1.51 0.00 0.00 -1.52 0.00 0.00 31.29 32.04 3hpy h VAL 227 CO 0.03 0.54 -0.04 0.25 0.02 0.00 0.00 177.57 178.37 3hpy h LEU 228 N 0.71 -0.10 -1.30 2.57 5.85 -1.21 -1.64 115.31 120.19 3hpy h LEU 228 Ca 0.04 -0.06 0.09 0.00 0.84 0.00 0.00 57.88 58.79 3hpy h LEU 228 Cb 1.06 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.06 3hpy h LEU 228 CO 0.11 -0.01 0.53 -0.09 -0.34 0.00 0.00 178.44 178.65 3hpy h ARG 229 N -0.20 0.76 -0.44 1.25 2.43 -1.35 0.13 114.38 116.96 3hpy h ARG 229 Ca -0.01 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 3hpy h ARG 229 Cb 0.16 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 3hpy h ARG 229 CO 0.02 0.50 0.25 0.00 -1.51 0.00 0.00 179.97 179.23 3hpy h ALA 230 N 1.58 0.57 -0.36 2.80 0.00 -0.87 0.49 119.26 123.48 3hpy h ALA 230 Ca 0.38 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.23 3hpy h ALA 230 Cb 0.42 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3hpy h ALA 230 CO -0.15 0.08 0.19 0.78 0.00 0.00 0.00 179.25 180.16 3hpy h GLY 231 N 0.58 0.49 0.99 0.00 0.00 0.11 0.96 103.07 106.20 3hpy h GLY 231 Ca 0.16 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.34 3hpy h GLY 231 CO -0.03 0.12 0.24 -0.55 0.00 0.00 0.00 176.54 176.32 3hpy h ASP 232 N 0.40 0.43 -0.94 0.19 3.32 -0.56 -1.82 116.42 117.44 3hpy h ASP 232 Ca 0.15 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.17 3hpy h ASP 232 Cb 0.03 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 39.43 3hpy h ASP 232 CO -0.08 0.33 0.60 0.40 -1.72 0.00 0.00 179.24 178.76 3hpy h ILE 233 N 0.49 1.25 -0.70 0.35 2.04 -0.51 -0.68 117.51 119.75 3hpy h ILE 233 Ca 0.13 -0.49 0.02 0.00 1.00 0.00 0.00 64.86 65.52 3hpy h ILE 233 Cb -0.03 -0.11 -0.04 0.00 -0.74 0.00 0.00 36.82 35.90 3hpy h ILE 233 CO -0.03 0.25 0.46 0.24 0.00 0.00 0.00 178.15 179.07 3hpy h MET 234 N 1.28 0.89 -0.29 2.37 2.86 -0.20 -2.28 114.93 119.57 3hpy h MET 234 Ca 0.34 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.86 3hpy h MET 234 Cb -0.11 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.34 3hpy h MET 234 CO -0.07 0.59 -0.08 1.03 1.06 0.00 0.00 176.91 179.44 3hpy h SER 235 N 0.92 0.57 -0.30 1.22 0.87 -0.67 0.28 113.55 116.43 3hpy h SER 235 Ca 0.27 -0.37 0.09 0.00 -1.23 0.00 0.00 61.79 60.54 3hpy h SER 235 Cb -0.06 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.73 3hpy h SER 235 CO -0.07 0.82 0.22 0.24 -0.53 0.00 0.00 176.83 177.50 3hpy h MET 236 N 0.32 0.01 -0.47 2.24 2.07 -0.93 0.20 114.93 118.38 3hpy h MET 236 Ca 0.07 -0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.70 3hpy h MET 236 Cb 0.57 -0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.30 3hpy h MET 236 CO 0.03 0.01 0.00 0.09 1.07 0.00 0.00 176.91 178.11 3hpy n ASN 237 N -4.45 5.03 -3.90 1.22 4.13 -0.88 -4.95 115.26 111.46 3hpy n ASN 237 Ca 0.04 -2.92 -0.31 0.00 1.68 0.00 0.00 54.58 53.07 3hpy n ASN 237 Cb 0.38 -0.63 -0.01 0.00 -1.54 0.00 0.00 39.78 37.98 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 0.27 -3.58 -2.70 3.52 1.02 0.06 -4.92 120.64 114.31 3hpy n GLU 238 Ca 0.25 0.43 -0.42 0.00 -0.02 0.00 0.00 57.16 57.40 3hpy n GLU 238 Cb 1.07 -5.18 -0.03 0.00 -0.02 0.00 0.00 31.44 27.28 3hpy n GLU 238 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3hpy s VAL 239 N -3.16 4.84 -0.02 2.62 1.01 0.93 -4.99 120.40 121.64 3hpy s VAL 239 Ca 0.63 2.05 -0.30 0.00 0.00 0.00 0.00 61.98 64.35 3hpy s VAL 239 Cb -0.34 -4.31 -0.05 0.00 0.00 0.00 0.00 36.38 31.68 3hpy s VAL 239 CO 0.77 0.13 1.48 0.20 0.00 0.00 0.00 175.10 177.68 3hpy s ASN 240 N 1.03 6.78 -0.17 3.32 0.02 -1.26 -4.63 114.94 120.03 3hpy s ASN 240 Ca 0.51 2.15 -0.06 0.00 -1.02 0.00 0.00 52.86 54.44 3hpy s ASN 240 Cb -0.21 -2.55 -0.04 0.00 0.02 0.00 0.00 41.25 38.47 3hpy s ASN 240 CO 0.26 -0.79 0.05 -0.69 0.02 0.00 0.00 177.10 175.95 3hpy s VAL 241 N 2.90 4.66 -0.05 1.60 1.01 -1.26 -0.28 120.40 128.98 3hpy s VAL 241 Ca 0.66 -0.09 -0.01 0.00 0.00 0.00 0.00 61.98 62.54 3hpy s VAL 241 Cb -0.32 -3.08 -0.01 0.00 0.00 0.00 0.00 36.38 32.98 3hpy s VAL 241 CO 0.27 0.49 0.09 -0.78 0.00 0.00 0.00 175.10 175.17 3hpy h ASP 242 N 6.46 -0.04 -3.14 3.32 3.58 0.19 -3.46 116.42 123.33 3hpy h ASP 242 Ca -0.38 0.00 -0.58 0.00 0.42 0.00 0.00 57.03 56.48 3hpy h ASP 242 Cb 1.18 0.01 -0.36 0.00 1.72 0.00 0.00 39.33 41.88 3hpy h ASP 242 CO 0.67 0.22 -0.83 -0.51 -2.88 0.00 0.00 179.24 175.92 3hpy s ILE 243 N -1.53 1.44 0.80 2.25 1.10 -1.06 -4.96 121.20 119.24 3hpy s ILE 243 Ca -0.01 -0.55 -0.12 0.00 -0.51 0.00 0.00 60.65 59.46 3hpy s ILE 243 Cb 0.00 -1.37 0.19 0.00 0.15 0.00 0.00 42.46 41.43 3hpy s ILE 243 CO 0.02 0.44 0.42 0.61 -2.11 0.00 0.00 174.94 174.32 3hpy n GLY 244 N 4.78 -2.93 3.68 1.50 0.00 -1.26 -1.84 105.19 109.12 3hpy n GLY 244 Ca -0.16 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.49 3hpy n GLY 244 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hpy s PRO 245 N -3.59 4.14 0.10 1.61 0.04 -1.26 -4.52 135.00 131.52 3hpy s PRO 245 Ca 0.33 2.58 -0.06 0.00 0.04 0.00 0.00 61.00 63.89 3hpy s PRO 245 Cb -0.06 -3.74 0.02 0.00 0.04 0.00 0.00 34.50 30.77 3hpy s PRO 245 CO 0.27 -0.87 0.32 -2.37 0.04 0.00 0.00 177.00 174.40 3hpy n THR 246 N 4.95 0.00 -5.08 1.26 5.66 -0.60 -4.99 114.28 115.48 3hpy n THR 246 Ca 0.18 -0.27 -0.32 0.00 -3.05 0.00 0.00 64.05 60.60 3hpy n THR 246 Cb 0.39 0.31 -0.14 0.00 -1.55 0.00 0.00 70.33 69.33 3hpy n THR 246 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 3hpy s ARG 247 N -2.02 2.28 0.25 1.09 6.06 -1.26 0.07 118.95 125.42 3hpy s ARG 247 Ca 0.07 -0.83 -0.11 0.00 -2.50 0.00 0.00 55.73 52.36 3hpy s ARG 247 Cb -0.01 -2.20 -0.07 0.00 0.06 0.00 0.00 34.95 32.72 3hpy s ARG 247 CO 0.03 0.59 0.59 -1.01 -2.50 0.00 0.00 175.30 173.00 3hpy s HIS 248 N -0.69 3.42 -0.12 5.12 3.76 -1.05 0.12 115.29 125.86 3hpy s HIS 248 Ca 0.11 0.94 -0.28 0.00 -0.15 0.00 0.00 55.06 55.68 3hpy s HIS 248 Cb -0.10 -2.31 -0.26 0.00 1.11 0.00 0.00 32.58 31.02 3hpy s HIS 248 CO 0.00 0.22 0.84 0.78 -0.85 0.00 0.00 174.74 175.73 3hpy h GLY 249 N 2.43 0.03 -5.79 -2.22 0.00 -0.97 -2.99 103.07 93.56 3hpy h GLY 249 Ca -0.47 -0.07 -0.67 0.00 0.00 0.00 0.00 47.33 46.12 3hpy h GLY 249 CO 0.68 0.06 0.85 -0.62 0.00 0.00 0.00 176.54 177.51 3hpy n VAL 250 N -4.60 0.28 0.00 4.60 0.31 -0.93 -0.38 118.33 117.62 3hpy n VAL 250 Ca -0.10 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 3hpy n VAL 250 Cb 0.48 -1.37 0.00 0.00 -0.91 0.00 0.00 33.84 32.04 3hpy n VAL 250 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 3hpy n THR 251 N 4.16 0.00 -0.94 2.52 -2.24 -1.26 -3.78 114.28 112.73 3hpy n THR 251 Ca 0.22 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.00 3hpy n THR 251 Cb 0.21 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.44 3hpy n THR 251 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3hpy n ARG 252 N -1.88 -1.60 -2.53 -0.78 1.74 0.49 -3.85 116.66 108.26 3hpy n ARG 252 Ca 0.00 0.40 -0.43 0.00 -0.77 0.00 0.00 57.85 57.05 3hpy n ARG 252 Cb 0.00 -4.77 -0.02 0.00 -1.02 0.00 0.00 32.46 26.65 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 -2.00 1.84 0.42 -0.13 0.00 -1.25 -4.20 107.32 102.00 3hpy s GLY 253 Ca 0.00 0.41 -0.24 0.00 0.00 0.00 0.00 44.72 44.88 3hpy s GLY 253 CO 0.00 2.28 1.14 0.00 0.00 0.00 0.00 173.10 176.52 3hpy s THR 255 N -1.50 0.00 -0.13 0.00 -1.32 0.11 -2.01 115.64 110.78 3hpy s THR 255 Ca 0.59 -0.83 -0.09 0.00 -1.21 0.00 0.00 61.69 60.16 3hpy s THR 255 Cb -0.28 -2.73 0.04 0.00 -1.51 0.00 0.00 72.50 68.02 3hpy s THR 255 CO 0.35 0.00 0.32 -0.63 -2.21 0.00 0.00 174.62 172.45 3hpy s ILE 256 N -2.48 -0.02 -0.17 5.08 1.01 -1.12 -1.55 121.20 121.95 3hpy s ILE 256 Ca 0.17 0.08 -0.05 0.00 0.00 0.00 0.00 60.65 60.84 3hpy s ILE 256 Cb -0.04 -0.48 -0.03 0.00 0.01 0.00 0.00 42.46 41.92 3hpy s ILE 256 CO 0.08 0.03 0.01 -0.31 0.00 0.00 0.00 174.94 174.75 3hpy s TYR 257 N 0.89 3.11 0.27 3.97 2.02 -0.77 -2.92 117.35 123.92 3hpy s TYR 257 Ca -0.06 -0.20 0.02 0.00 -0.37 0.00 0.00 57.07 56.46 3hpy s TYR 257 Cb -0.07 -2.03 -0.04 0.00 -0.40 0.00 0.00 41.96 39.42 3hpy s TYR 257 CO -0.06 -0.01 0.13 0.00 -1.57 0.00 0.00 175.55 174.04 3hpy s ALA 258 N 0.51 1.76 0.04 3.71 0.00 -1.05 0.20 121.76 126.93 3hpy s ALA 258 Ca -0.00 -1.79 0.08 0.00 0.00 0.00 0.00 51.96 50.24 3hpy s ALA 258 Cb -0.14 1.15 -0.03 0.00 0.00 0.00 0.00 23.12 24.11 3hpy s ALA 258 CO 0.02 -0.50 -0.22 -1.58 0.00 0.00 0.00 175.76 173.48 3hpy s TRP 259 N -3.74 2.45 0.52 0.00 0.51 0.61 -1.55 118.94 117.74 3hpy s TRP 259 Ca 0.37 -0.33 -0.03 0.00 -2.12 0.00 0.00 56.10 53.99 3hpy s TRP 259 Cb 0.06 -1.43 -0.00 0.00 -0.81 0.00 0.00 33.47 31.29 3hpy s TRP 259 CO 0.15 0.20 0.79 0.16 -0.51 0.00 0.00 176.95 177.74 3hpy s ASP 260 N -1.36 5.75 0.61 2.95 -4.77 0.65 -4.42 116.67 116.09 3hpy s ASP 260 Ca 0.13 0.54 0.25 0.00 -3.30 0.00 0.00 52.55 50.17 3hpy s ASP 260 Cb -0.10 -1.67 0.92 0.00 -1.09 0.00 0.00 42.92 40.98 3hpy s ASP 260 CO 0.04 -0.87 1.35 -0.65 0.70 0.00 0.00 175.17 175.74 3hpy h PRO 261 N 0.11 0.00 -0.02 2.11 0.11 -1.91 0.73 132.00 133.13 3hpy h PRO 261 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3hpy h PRO 261 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3hpy h PRO 261 CO 0.59 0.00 -0.28 0.43 -0.21 0.00 0.00 178.00 178.54 3hpy n SER 262 N -3.23 2.25 0.00 -2.05 7.64 -1.26 -4.96 113.62 112.01 3hpy n SER 262 Ca 0.20 -1.63 0.00 0.00 1.01 0.00 0.00 58.87 58.45 3hpy n SER 262 Cb 1.40 0.30 0.00 0.00 -1.01 0.00 0.00 64.21 64.90 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 1.30 0.74 3.64 0.23 0.00 0.25 -4.83 105.19 106.53 3hpy n GLY 263 Ca 0.10 0.00 -0.43 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 -2.51 6.92 0.24 1.61 0.02 -1.25 -4.70 114.94 115.27 3hpy s ASN 264 Ca 0.00 1.18 -0.30 0.00 -1.02 0.00 0.00 52.86 52.72 3hpy s ASN 264 Cb 0.00 -2.54 -0.09 0.00 0.02 0.00 0.00 41.25 38.64 3hpy s ASN 264 CO 0.00 -0.87 1.11 -0.60 0.02 0.00 0.00 177.10 176.77 3hpy s ARG 265 N 3.64 4.61 0.28 -0.60 3.52 -1.26 -0.25 118.95 128.89 3hpy s ARG 265 Ca 0.48 1.79 0.02 0.00 -0.13 0.00 0.00 55.73 57.89 3hpy s ARG 265 Cb -0.14 -3.22 -0.06 0.00 -1.56 0.00 0.00 34.95 29.98 3hpy s ARG 265 CO 0.15 0.14 0.07 -0.59 -0.81 0.00 0.00 175.30 174.26 3hpy s PHE 266 N -0.78 1.71 0.01 5.12 -0.12 -0.60 -3.16 117.98 120.17 3hpy s PHE 266 Ca 0.47 -1.07 0.01 0.00 -0.05 0.00 0.00 56.93 56.29 3hpy s PHE 266 Cb -0.31 -1.06 -0.01 0.00 -0.63 0.00 0.00 43.02 41.01 3hpy s PHE 266 CO 0.39 -0.17 -0.04 -2.00 -0.05 0.00 0.00 175.22 173.35 3hpy s GLU 267 N -3.96 0.31 -0.24 1.99 2.12 -0.30 -2.54 118.70 116.09 3hpy s GLU 267 Ca 0.36 -0.37 0.02 0.00 0.36 0.00 0.00 54.97 55.34 3hpy s GLU 267 Cb 0.08 -0.15 0.05 0.00 0.26 0.00 0.00 34.13 34.37 3hpy s GLU 267 CO 0.14 0.03 -0.09 0.95 -0.54 0.00 0.00 175.26 175.74 3hpy s THR 268 N -0.70 1.85 0.27 -1.70 -4.23 -1.15 0.38 115.64 110.36 3hpy s THR 268 Ca -0.06 -1.34 0.03 0.00 -1.18 0.00 0.00 61.69 59.15 3hpy s THR 268 Cb -0.05 -1.99 -0.04 0.00 1.34 0.00 0.00 72.50 71.77 3hpy s THR 268 CO -0.00 0.02 0.20 0.72 -0.54 0.00 0.00 174.62 175.01 3hpy s PHE 269 N 1.27 1.48 0.15 3.99 -0.71 -0.08 -2.78 117.98 121.29 3hpy s PHE 269 Ca -0.06 -1.50 -0.23 0.00 -1.04 0.00 0.00 56.93 54.10 3hpy s PHE 269 Cb -0.19 -0.67 0.07 0.00 -1.21 0.00 0.00 43.02 41.03 3hpy s PHE 269 CO -0.06 -0.73 0.59 0.00 -1.34 0.00 0.00 175.22 173.68 3hpy s MET 270 N -3.80 1.25 0.16 1.99 0.23 -0.85 0.12 119.30 118.39 3hpy s MET 270 Ca 0.39 -0.45 0.00 0.00 -1.03 0.00 0.00 55.69 54.61 3hpy s MET 270 Cb 0.05 0.58 0.00 0.00 -1.53 0.00 0.00 34.83 33.92 3hpy s MET 270 CO 0.20 -0.54 0.00 0.41 -2.03 0.00 0.00 175.02 173.06 3hpy n GLY 271 N -0.30 -1.87 0.00 3.16 0.00 -1.26 -1.63 105.19 103.28 3hpy n GLY 271 Ca -0.17 -1.96 0.00 0.00 0.00 0.00 0.00 46.02 43.89 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 -0.01 2.45 0.00 -0.02 0.00 -1.25 -4.68 105.19 101.68 3hpy n GLY 272 Ca 0.00 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.00 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 0.23 -2.18 -3.70 1.61 0.18 -1.25 -5.01 117.16 107.03 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 0.11 2.60 0.54 -3.48 3.76 -1.26 -4.23 115.29 113.33 3hpy s HIS 274 Ca 0.00 -2.94 -0.17 0.00 -0.15 0.00 0.00 55.06 51.79 3hpy s HIS 274 Cb 0.00 -2.00 -0.06 0.00 1.11 0.00 0.00 32.58 31.63 3hpy s HIS 274 CO 0.00 -0.66 1.04 -1.25 -0.85 0.00 0.00 174.74 173.02 3hpy s PRO 275 N -0.87 3.58 0.24 8.40 0.04 -1.22 -4.99 135.00 140.18 3hpy s PRO 275 Ca 0.28 1.21 0.08 0.00 0.04 0.00 0.00 61.00 62.61 3hpy s PRO 275 Cb -0.01 -2.07 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 3hpy s PRO 275 CO -0.18 -0.59 -0.14 0.71 0.04 0.00 0.00 177.00 176.84 3hpy s TYR 276 N -2.34 1.89 0.59 0.56 2.02 -1.26 -4.13 117.35 114.68 3hpy s TYR 276 Ca 0.64 -0.55 0.30 0.00 -0.37 0.00 0.00 57.07 57.09 3hpy s TYR 276 Cb -0.15 -0.91 1.63 0.00 -0.40 0.00 0.00 41.96 42.13 3hpy s TYR 276 CO 0.30 0.42 1.91 -1.35 -1.57 0.00 0.00 175.55 175.26 3hpy h PRO 277 N 2.43 0.00 -0.01 -1.71 0.11 -1.98 -0.40 132.00 130.44 3hpy h PRO 277 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 3hpy h PRO 277 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3hpy h PRO 277 CO 0.63 0.00 -0.03 -0.40 -0.21 0.00 0.00 178.00 177.99 3hpy n ASP 278 N -2.82 1.33 -4.84 -2.05 5.75 -1.26 -4.92 116.55 107.74 3hpy n ASP 278 Ca -0.02 -1.38 -0.33 0.00 -0.01 0.00 0.00 54.79 53.05 3hpy n ASP 278 Cb 0.33 0.01 -0.06 0.00 -1.03 0.00 0.00 41.12 40.37 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 -2.07 3.43 0.07 2.11 4.12 -0.16 -5.07 117.35 119.79 3hpy s TYR 279 Ca 0.37 1.27 -0.22 0.00 0.02 0.00 0.00 57.07 58.51 3hpy s TYR 279 Cb 0.21 -2.56 -0.07 0.00 -1.52 0.00 0.00 41.96 38.02 3hpy s TYR 279 CO 0.36 0.14 0.64 -1.21 0.02 0.00 0.00 175.55 175.51 3hpy s GLU 280 N -2.77 4.34 0.62 -0.62 0.41 -1.26 -4.97 118.70 114.46 3hpy s GLU 280 Ca 0.52 0.87 -0.18 0.00 -0.41 0.00 0.00 54.97 55.77 3hpy s GLU 280 Cb -0.12 -3.28 -0.02 0.00 -1.78 0.00 0.00 34.13 28.93 3hpy s GLU 280 CO 0.18 0.53 1.23 -1.25 -0.49 0.00 0.00 175.26 175.45 3hpy s PRO 281 N -0.80 2.79 0.16 0.39 0.04 -1.26 -5.01 135.00 131.31 3hpy s PRO 281 Ca 0.32 1.87 -0.04 0.00 0.04 0.00 0.00 61.00 63.19 3hpy s PRO 281 Cb -0.20 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 3hpy s PRO 281 CO 0.21 -1.36 0.38 -0.51 0.04 0.00 0.00 177.00 175.76 3hpy s LEU 282 N -4.25 4.25 0.07 -3.56 1.43 -0.39 -4.96 118.68 111.26 3hpy s LEU 282 Ca 0.78 0.55 0.07 0.00 -1.03 0.00 0.00 54.13 54.50 3hpy s LEU 282 Cb -0.32 -3.28 -0.03 0.00 0.03 0.00 0.00 46.19 42.59 3hpy s LEU 282 CO 0.36 0.03 -0.19 -0.44 0.23 0.00 0.00 176.35 176.34 3hpy s SER 283 N -2.61 2.24 -0.05 2.29 0.01 -1.26 -1.50 113.70 112.83 3hpy s SER 283 Ca 0.40 -0.58 0.05 0.00 1.31 0.00 0.00 55.95 57.14 3hpy s SER 283 Cb -0.12 -0.14 -0.01 0.00 0.21 0.00 0.00 66.02 65.96 3hpy s SER 283 CO 0.26 0.07 -0.21 0.26 0.41 0.00 0.00 173.24 174.03 3hpy s TRP 284 N -0.99 2.08 0.51 2.43 0.52 -0.33 -4.97 118.94 118.19 3hpy s TRP 284 Ca 0.05 -0.61 -0.19 0.00 0.02 0.00 0.00 56.10 55.37 3hpy s TRP 284 Cb -0.09 -1.38 -0.07 0.00 -1.15 0.00 0.00 33.47 30.78 3hpy s TRP 284 CO 0.03 -0.19 1.05 0.95 0.02 0.00 0.00 176.95 178.80 3hpy s THR 285 N -0.07 3.78 0.15 2.01 -4.23 -1.26 -0.06 115.64 115.96 3hpy s THR 285 Ca -0.04 1.04 -0.16 0.00 -1.18 0.00 0.00 61.69 61.35 3hpy s THR 285 Cb -0.13 -3.43 0.01 0.00 1.34 0.00 0.00 72.50 70.30 3hpy s THR 285 CO 0.03 -0.30 1.81 0.22 -0.54 0.00 0.00 174.62 175.84 3hpy h TYR 286 N 1.27 0.50 -0.10 3.99 3.20 -1.50 -2.52 116.97 121.80 3hpy h TYR 286 Ca -0.49 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.39 3hpy h TYR 286 Cb 1.22 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 39.32 3hpy h TYR 286 CO 0.57 0.31 0.04 0.38 -1.64 0.00 0.00 178.16 177.82 3hpy h ASP 287 N 0.53 0.12 -0.49 -2.11 3.04 -1.93 -1.60 116.42 113.98 3hpy h ASP 287 Ca 0.15 -0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.93 3hpy h ASP 287 Cb -0.06 -0.03 0.00 0.00 -1.04 0.00 0.00 39.33 38.20 3hpy h ASP 287 CO -0.03 0.11 0.00 -3.20 -2.04 0.00 0.00 179.24 174.08 3hpy n ASN 288 N -4.50 4.33 0.29 4.15 2.85 -0.97 -4.49 115.26 116.92 3hpy n ASN 288 Ca -0.01 -2.55 0.18 0.00 -0.11 0.00 0.00 54.58 52.09 3hpy n ASN 288 Cb 0.10 -0.58 0.82 0.00 1.24 0.00 0.00 39.78 41.36 3hpy n ASN 288 CO 0.00 0.00 0.00 0.15 -2.11 0.00 0.00 177.26 175.30 3hpy h PHE 289 N 3.21 0.00 -0.74 1.20 3.57 -1.04 -2.78 116.94 120.36 3hpy h PHE 289 Ca 0.00 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 3hpy h PHE 289 Cb 1.44 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 40.15 3hpy h PHE 289 CO 0.74 0.01 0.33 0.00 -2.23 0.00 0.00 178.31 177.16 3hpy h ALA 290 N 1.99 1.19 -0.07 2.41 0.00 -1.83 -0.30 119.26 122.64 3hpy h ALA 290 Ca -0.00 -0.16 -0.15 0.00 0.00 0.00 0.00 54.91 54.59 3hpy h ALA 290 Cb 0.38 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3hpy h ALA 290 CO 0.00 0.61 -0.63 0.37 0.00 0.00 0.00 179.25 179.60 3hpy h GLN 291 N 1.06 0.27 0.00 0.00 4.15 -1.52 0.23 115.11 119.30 3hpy h GLN 291 Ca 0.25 -0.19 -0.12 0.00 0.77 0.00 0.00 58.65 59.36 3hpy h GLN 291 Cb 0.15 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.85 3hpy h GLN 291 CO -0.03 0.81 -0.56 0.78 -1.93 0.00 0.00 178.83 177.90 3hpy h GLY 292 N 1.45 0.00 0.00 2.39 0.00 -1.30 -2.98 103.07 102.63 3hpy h GLY 292 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 3hpy h GLY 292 CO 0.10 0.00 -0.01 -2.00 0.00 0.00 0.00 176.54 174.63 3hpy h LEU 293 N 0.00 0.00 -8.71 3.11 7.12 -0.99 0.06 115.31 115.91 3hpy h LEU 293 Ca -0.01 0.00 -0.64 0.00 0.13 0.00 0.00 57.88 57.36 3hpy h LEU 293 Cb 1.06 0.00 -0.23 0.00 -0.53 0.00 0.00 40.66 40.96 3hpy h LEU 293 CO 0.07 0.13 -0.68 -0.62 -0.13 0.00 0.00 178.44 177.22 3hpy s ASP 294 N -3.67 4.70 -0.15 1.25 -1.08 0.80 -3.98 116.67 114.54 3hpy s ASP 294 Ca -0.00 -0.21 -0.11 0.00 -0.52 0.00 0.00 52.55 51.71 3hpy s ASP 294 Cb 0.00 -1.79 -0.06 0.00 -1.46 0.00 0.00 42.92 39.62 3hpy s ASP 294 CO 0.01 0.10 -0.06 0.22 0.52 0.00 0.00 175.17 175.95 3hpy h TYR 295 N 7.24 0.00 -0.36 -5.34 3.20 0.11 -3.25 116.97 118.58 3hpy h TYR 295 Ca -0.34 0.00 0.07 0.00 3.14 0.00 0.00 58.73 61.60 3hpy h TYR 295 Cb 1.18 0.00 -0.09 0.00 1.54 0.00 0.00 36.73 39.37 3hpy h TYR 295 CO 0.56 0.27 -0.34 -1.00 -1.64 0.00 0.00 178.16 176.02 3hpy h PRO 296 N -1.00 -0.27 0.00 1.82 0.13 -1.88 -3.47 132.00 127.32 3hpy h PRO 296 Ca -0.06 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 3hpy h PRO 296 Cb 0.58 0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.78 3hpy h PRO 296 CO -0.04 -0.18 0.00 1.04 -0.23 0.00 0.00 178.00 178.59