#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hwp s GLU 3 N 0.00 0.56 0.56 1.61 2.56 -1.26 -5.16 118.70 117.58 1hwp s GLU 3 Ca 0.00 -0.08 -0.20 0.00 0.00 0.00 0.00 54.97 54.69 1hwp s GLU 3 Cb 0.00 0.09 -0.06 0.00 2.00 0.00 0.00 34.13 36.17 1hwp s GLU 3 CO 0.00 -0.84 1.08 -2.37 -0.56 0.00 0.00 175.26 172.57 1hwp n THR 4 N 4.37 3.59 0.00 -1.70 5.66 -1.26 -5.01 114.28 119.93 1hwp n THR 4 Ca 0.09 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.59 1hwp n THR 4 Cb 0.59 -1.29 0.00 0.00 -1.55 0.00 0.00 70.33 68.08 1hwp n THR 4 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1hwp s ALA 6 N -2.59 -0.70 -0.33 0.00 0.00 -1.26 -5.12 121.76 111.75 1hwp s ALA 6 Ca 0.00 0.79 -0.29 0.00 0.00 0.00 0.00 51.96 52.46 1hwp s ALA 6 Cb 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 23.12 22.66 1hwp s ALA 6 CO 0.00 -0.14 1.38 0.42 0.00 0.00 0.00 175.76 177.42 1hwp s ILE 7 N 0.13 4.01 0.45 0.00 -1.09 -1.26 -4.99 121.20 118.44 1hwp s ILE 7 Ca -0.00 1.10 -0.24 0.00 -2.23 0.00 0.00 60.65 59.28 1hwp s ILE 7 Cb -0.02 -4.13 -0.08 0.00 -1.58 0.00 0.00 42.46 36.65 1hwp s ILE 7 CO 0.00 -0.56 1.22 -2.16 -1.23 0.00 0.00 174.94 172.21 1hwp s PRO 8 N 4.51 3.79 0.83 2.79 0.04 -1.26 -5.05 135.00 140.65 1hwp s PRO 8 Ca 0.60 1.94 -0.08 0.00 0.04 0.00 0.00 61.00 63.49 1hwp s PRO 8 Cb -0.16 -2.52 0.15 0.00 0.04 0.00 0.00 34.50 32.00 1hwp s PRO 8 CO 0.27 -0.57 1.14 0.00 0.04 0.00 0.00 177.00 177.88 1hwp s ALA 9 N -1.42 3.00 0.28 8.56 0.00 -1.26 -4.53 121.76 126.40 1hwp s ALA 9 Ca 0.62 -1.41 -0.29 0.00 0.00 0.00 0.00 51.96 50.87 1hwp s ALA 9 Cb -0.33 -2.41 -0.10 0.00 0.00 0.00 0.00 23.12 20.29 1hwp s ALA 9 CO 0.40 -1.87 1.21 -1.25 0.00 0.00 0.00 175.76 174.26 1hwp s PRO 10 N -5.48 4.49 0.01 0.00 0.04 -1.26 -4.83 135.00 127.97 1hwp s PRO 10 Ca 0.69 2.01 0.03 0.00 0.04 0.00 0.00 61.00 63.77 1hwp s PRO 10 Cb -0.05 -3.15 -0.01 0.00 0.04 0.00 0.00 34.50 31.33 1hwp s PRO 10 CO 0.48 -0.02 -0.10 -0.59 0.04 0.00 0.00 177.00 176.81 1hwp s PHE 11 N -0.93 0.87 -0.23 0.56 -0.12 -1.04 -4.92 117.98 112.16 1hwp s PHE 11 Ca 0.48 -0.26 -0.10 0.00 -0.05 0.00 0.00 56.93 57.00 1hwp s PHE 11 Cb -0.36 -0.54 -0.05 0.00 -0.63 0.00 0.00 43.02 41.45 1hwp s PHE 11 CO 0.45 -0.01 0.14 0.99 -0.05 0.00 0.00 175.22 176.74 1hwp s THR 12 N -0.58 5.16 0.10 -4.49 2.01 -1.26 -0.59 115.64 116.00 1hwp s THR 12 Ca 0.01 0.11 -0.02 0.00 0.31 0.00 0.00 61.69 62.09 1hwp s THR 12 Cb -0.06 -3.40 -0.03 0.00 0.01 0.00 0.00 72.50 69.02 1hwp s THR 12 CO 0.00 0.36 0.06 -0.13 -0.69 0.00 0.00 174.62 174.22 1hwp s ARG 13 N 1.05 0.83 0.77 4.92 0.52 -0.22 -4.90 118.95 121.92 1hwp s ARG 13 Ca 0.07 -1.30 -0.05 0.00 -0.52 0.00 0.00 55.73 53.92 1hwp s ARG 13 Cb -0.14 0.25 0.13 0.00 0.52 0.00 0.00 34.95 35.72 1hwp s ARG 13 CO 0.04 -0.23 1.07 1.03 0.02 0.00 0.00 175.30 177.24 1hwp s ARG 14 N -3.98 1.51 -0.14 3.54 1.81 -0.34 -2.11 118.95 119.24 1hwp s ARG 14 Ca 0.16 -0.82 -0.04 0.00 -1.72 0.00 0.00 55.73 53.31 1hwp s ARG 14 Cb 0.07 -2.20 0.07 0.00 -0.45 0.00 0.00 34.95 32.44 1hwp s ARG 14 CO -0.03 -1.64 0.18 0.42 -0.68 0.00 0.00 175.30 173.55 1hwp s ILE 15 N -3.33 -0.27 0.18 1.52 1.01 -1.26 -1.07 121.20 117.98 1hwp s ILE 15 Ca 0.67 0.12 0.10 0.00 0.00 0.00 0.00 60.65 61.54 1hwp s ILE 15 Cb -0.06 -0.48 -0.04 0.00 0.01 0.00 0.00 42.46 41.89 1hwp s ILE 15 CO 0.46 -0.04 -0.22 0.68 0.00 0.00 0.00 174.94 175.83 1hwp s VAL 16 N 2.30 2.18 -0.02 2.92 -7.23 -1.01 -0.04 120.40 119.49 1hwp s VAL 16 Ca 0.04 -1.98 0.01 0.00 -1.81 0.00 0.00 61.98 58.24 1hwp s VAL 16 Cb -0.14 -2.02 0.03 0.00 0.56 0.00 0.00 36.38 34.80 1hwp s VAL 16 CO -0.09 -0.17 0.36 0.61 -0.31 0.00 0.00 175.10 175.50 1hwp n GLY 17 N 0.30 -0.36 0.00 2.32 0.00 -1.16 -0.17 105.19 106.12 1hwp n GLY 17 Ca -0.13 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1hwp n GLY 17 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1hwp n ARG 18 N -0.10 0.00 -2.66 1.61 3.00 -1.26 -4.40 116.66 112.85 1hwp n ARG 18 Ca -0.04 0.00 -0.17 0.00 -0.00 0.00 0.00 57.85 57.63 1hwp n ARG 18 Cb 0.41 0.00 -0.00 0.00 0.00 0.00 0.00 32.46 32.87 1hwp n ARG 18 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1hwp n ASP 19 N 0.00 -4.61 -0.48 6.15 10.43 -1.26 -1.13 116.55 125.65 1hwp n ASP 19 Ca 0.00 -0.01 -0.06 0.00 2.57 0.00 0.00 54.79 57.29 1hwp n ASP 19 Cb 0.00 -3.85 -0.03 0.00 1.84 0.00 0.00 41.12 39.08 1hwp n ASP 19 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1hwp n GLY 20 N -1.01 0.78 3.83 0.44 0.00 -1.26 -4.99 105.19 102.98 1hwp n GLY 20 Ca -0.14 -0.24 -0.36 0.00 0.00 0.00 0.00 46.02 45.28 1hwp n GLY 20 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hwp s LEU 21 N -1.43 4.34 0.36 0.99 1.43 -0.28 -4.45 118.68 119.64 1hwp s LEU 21 Ca 0.00 1.29 0.02 0.00 -1.03 0.00 0.00 54.13 54.41 1hwp s LEU 21 Cb 0.00 -3.45 -0.02 0.00 0.03 0.00 0.00 46.19 42.75 1hwp s LEU 21 CO 0.00 0.06 0.54 0.00 0.23 0.00 0.00 176.35 177.18 1hwp s VAL 23 N -2.30 5.35 0.29 0.00 0.11 0.94 -0.27 120.40 124.52 1hwp s VAL 23 Ca 0.42 0.40 -0.16 0.00 -2.93 0.00 0.00 61.98 59.72 1hwp s VAL 23 Cb -0.10 -3.53 0.02 0.00 -1.53 0.00 0.00 36.38 31.24 1hwp s VAL 23 CO 0.34 0.50 0.62 1.51 -3.33 0.00 0.00 175.10 174.75 1hwp s ASP 24 N -0.26 -0.05 -0.17 3.54 -4.77 -0.74 -4.55 116.67 109.68 1hwp s ASP 24 Ca 0.15 -0.89 -0.18 0.00 -3.30 0.00 0.00 52.55 48.33 1hwp s ASP 24 Cb -0.13 0.69 -0.04 0.00 -1.09 0.00 0.00 42.92 42.36 1hwp s ASP 24 CO 0.04 -1.33 0.48 -0.69 0.70 0.00 0.00 175.17 174.37 1hwp s VAL 25 N -3.60 5.16 -0.05 2.11 1.01 -0.86 -1.62 120.40 122.54 1hwp s VAL 25 Ca 0.18 0.91 -0.38 0.00 0.00 0.00 0.00 61.98 62.68 1hwp s VAL 25 Cb -0.03 -3.81 -0.16 0.00 0.00 0.00 0.00 36.38 32.37 1hwp s VAL 25 CO 0.10 0.25 1.51 -1.14 0.00 0.00 0.00 175.10 175.81 1hwp n ARG 26 N 4.29 1.18 -1.19 2.72 0.63 -1.13 -1.11 116.66 122.04 1hwp n ARG 26 Ca -0.06 0.43 -0.10 0.00 -0.92 0.00 0.00 57.85 57.20 1hwp n ARG 26 Cb 0.51 -2.09 -0.04 0.00 0.45 0.00 0.00 32.46 31.29 1hwp n ARG 26 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1hwp n ASN 27 N 3.68 -4.59 -2.26 6.15 4.13 -1.26 -2.71 115.26 118.40 1hwp n ASN 27 Ca 0.21 0.24 -0.14 0.00 1.68 0.00 0.00 54.58 56.57 1hwp n ASN 27 Cb 0.17 -3.53 -0.02 0.00 -1.54 0.00 0.00 39.78 34.86 1hwp n ASN 27 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1hwp n GLY 28 N 0.17 -0.18 3.60 7.41 0.00 -0.27 -4.91 105.19 111.02 1hwp n GLY 28 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 1hwp n GLY 28 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1hwp s TYR 29 N -2.64 3.09 -1.73 1.61 4.12 -1.10 -4.89 117.35 115.81 1hwp s TYR 29 Ca 0.00 0.76 0.00 0.00 0.02 0.00 0.00 57.07 57.85 1hwp s TYR 29 Cb 0.00 -3.59 0.00 0.00 -1.52 0.00 0.00 41.96 36.85 1hwp s TYR 29 CO 0.00 -0.80 0.56 -0.40 0.02 0.00 0.00 175.55 174.94 1hwp n ASP 30 N 6.69 0.17 -4.79 2.29 3.85 -1.26 -4.82 116.55 118.68 1hwp n ASP 30 Ca 0.06 -1.30 -0.35 0.00 -0.71 0.00 0.00 54.79 52.50 1hwp n ASP 30 Cb 0.48 -0.09 -0.04 0.00 -1.35 0.00 0.00 41.12 40.13 1hwp n ASP 30 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.20 176.61 1hwp s THR 31 N -1.73 3.80 0.81 2.12 -4.23 -1.26 -4.87 115.64 110.27 1hwp s THR 31 Ca 0.00 1.21 -0.12 0.00 -1.18 0.00 0.00 61.69 61.60 1hwp s THR 31 Cb 0.00 -3.54 0.09 0.00 1.34 0.00 0.00 72.50 70.39 1hwp s THR 31 CO 0.00 -0.16 1.15 -1.81 -0.54 0.00 0.00 174.62 173.26 1hwp s ASP 32 N -1.84 3.80 0.00 3.99 -0.00 -1.26 -3.21 116.67 118.15 1hwp s ASP 32 Ca 0.64 2.13 0.00 0.00 -0.00 0.00 0.00 52.55 55.32 1hwp s ASP 32 Cb -0.18 -2.56 0.00 0.00 -0.00 0.00 0.00 42.92 40.18 1hwp s ASP 32 CO 0.22 -2.51 0.00 0.61 -0.00 0.00 0.00 175.17 173.49 1hwp n GLY 33 N -0.15 2.80 3.67 0.21 0.00 -0.36 -4.97 105.19 106.40 1hwp n GLY 33 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1hwp n GLY 33 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hwp s THR 34 N -1.77 2.88 0.93 2.61 2.01 -1.20 -4.70 115.64 116.40 1hwp s THR 34 Ca 0.00 0.00 -0.12 0.00 0.31 0.00 0.00 61.69 61.89 1hwp s THR 34 Cb 0.00 -3.00 0.15 0.00 0.01 0.00 0.00 72.50 69.66 1hwp s THR 34 CO 0.00 -0.00 1.09 -2.16 -0.69 0.00 0.00 174.62 172.86 1hwp s PRO 35 N 4.06 0.97 -0.08 4.92 0.04 -1.26 -0.55 135.00 143.10 1hwp s PRO 35 Ca 0.87 0.84 -0.01 0.00 0.04 0.00 0.00 61.00 62.74 1hwp s PRO 35 Cb -0.44 -1.77 -0.03 0.00 0.04 0.00 0.00 34.50 32.29 1hwp s PRO 35 CO 0.41 -2.44 -0.01 0.42 0.04 0.00 0.00 177.00 175.42 1hwp s ILE 36 N -2.88 4.21 0.20 0.56 1.01 -0.08 -2.85 121.20 121.38 1hwp s ILE 36 Ca 0.64 -0.31 -0.05 0.00 0.00 0.00 0.00 60.65 60.93 1hwp s ILE 36 Cb -0.19 -2.77 -0.03 0.00 0.01 0.00 0.00 42.46 39.48 1hwp s ILE 36 CO 0.58 0.59 0.24 0.00 0.00 0.00 0.00 174.94 176.34 1hwp s GLN 37 N -0.93 1.26 0.26 2.79 1.03 -0.64 -1.05 119.66 122.38 1hwp s GLN 37 Ca 0.14 -1.45 -0.20 0.00 0.04 0.00 0.00 55.36 53.88 1hwp s GLN 37 Cb -0.11 0.33 -0.09 0.00 0.03 0.00 0.00 33.01 33.17 1hwp s GLN 37 CO 0.03 -0.45 0.78 -1.17 -2.54 0.00 0.00 175.29 171.94 1hwp s LEU 38 N -3.09 4.29 -0.27 2.60 2.96 0.25 -1.79 118.68 123.64 1hwp s LEU 38 Ca 0.30 1.50 -0.26 0.00 -0.22 0.00 0.00 54.13 55.45 1hwp s LEU 38 Cb 0.05 -3.77 0.12 0.00 0.50 0.00 0.00 46.19 43.09 1hwp s LEU 38 CO 0.09 -0.03 1.03 0.86 -1.32 0.00 0.00 176.35 176.97 1hwp s TRP 39 N -1.62 -0.47 -0.26 5.38 -0.11 0.63 -0.32 118.94 122.17 1hwp s TRP 39 Ca 0.46 1.11 -0.42 0.00 1.22 0.00 0.00 56.10 58.47 1hwp s TRP 39 Cb -0.16 0.37 -0.18 0.00 -1.50 0.00 0.00 33.47 32.00 1hwp s TRP 39 CO 0.21 -0.24 1.54 -2.30 -4.62 0.00 0.00 176.95 171.53 1hwp n PRO 40 N 2.06 0.58 -0.67 5.86 -0.02 -1.26 -0.72 135.00 140.84 1hwp n PRO 40 Ca -0.12 0.21 -0.32 0.00 -2.02 0.00 0.00 63.50 61.25 1hwp n PRO 40 Cb 0.56 -1.80 0.17 0.00 -0.02 0.00 0.00 33.50 32.41 1hwp n PRO 40 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1hwp n GLY 42 N 2.09 2.89 3.56 0.00 0.00 -1.26 -5.02 105.19 107.45 1hwp n GLY 42 Ca 0.01 -1.15 -0.40 0.00 0.00 0.00 0.00 46.02 44.48 1hwp n GLY 42 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hwp s THR 43 N -2.00 3.48 -0.28 2.61 2.01 -1.26 -4.86 115.64 115.34 1hwp s THR 43 Ca 0.00 0.32 -0.19 0.00 0.31 0.00 0.00 61.69 62.12 1hwp s THR 43 Cb 0.00 -4.13 0.12 0.00 0.01 0.00 0.00 72.50 68.50 1hwp s THR 43 CO 0.00 -1.04 0.92 0.00 -0.69 0.00 0.00 174.62 173.81 1hwp s GLN 44 N 6.53 0.52 0.20 4.92 -2.07 -1.26 -5.06 119.66 123.43 1hwp s GLN 44 Ca 0.61 0.77 -0.13 0.00 -1.82 0.00 0.00 55.36 54.80 1hwp s GLN 44 Cb -0.12 0.17 0.23 0.00 -1.09 0.00 0.00 33.01 32.19 1hwp s GLN 44 CO 0.21 -0.09 1.68 -0.09 -1.32 0.00 0.00 175.29 175.68 1hwp h ARG 45 N 5.58 0.12 -0.47 9.60 2.43 -1.91 0.81 114.38 130.54 1hwp h ARG 45 Ca -0.29 -0.01 0.14 0.00 -0.81 0.00 0.00 59.98 59.01 1hwp h ARG 45 Cb 1.19 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 1hwp h ARG 45 CO 0.15 0.08 0.62 -2.95 -1.51 0.00 0.00 179.97 176.36 1hwp h ASN 46 N 0.12 0.00 0.58 -3.80 7.08 -1.91 0.72 115.58 118.38 1hwp h ASN 46 Ca 0.28 0.00 -0.15 0.00 -3.08 0.00 0.00 56.30 53.35 1hwp h ASN 46 Cb 0.43 0.00 -0.03 0.00 -2.08 0.00 0.00 38.32 36.64 1hwp h ASN 46 CO -0.45 0.00 -1.54 0.00 -2.08 0.00 0.00 177.43 173.36 1hwp n GLN 47 N -3.45 0.63 -2.80 4.14 6.02 0.23 -2.03 117.38 120.12 1hwp n GLN 47 Ca 0.09 0.14 -0.40 0.00 -0.01 0.00 0.00 57.00 56.82 1hwp n GLN 47 Cb 0.80 -1.75 -0.06 0.00 1.02 0.00 0.00 30.24 30.25 1hwp n GLN 47 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1hwp s GLN 48 N -3.00 4.78 -0.05 -1.09 -0.21 0.25 -4.51 119.66 115.83 1hwp s GLN 48 Ca -0.04 1.41 0.00 0.00 0.02 0.00 0.00 55.36 56.75 1hwp s GLN 48 Cb 0.09 -3.23 0.02 0.00 1.00 0.00 0.00 33.01 30.90 1hwp s GLN 48 CO 0.82 0.51 -0.03 -1.58 -2.12 0.00 0.00 175.29 172.89 1hwp s TRP 49 N -1.22 0.67 -0.19 0.91 0.52 -0.90 -4.33 118.94 114.41 1hwp s TRP 49 Ca 0.41 -0.17 -0.15 0.00 0.02 0.00 0.00 56.10 56.21 1hwp s TRP 49 Cb -0.25 -0.67 -0.04 0.00 -1.15 0.00 0.00 33.47 31.36 1hwp s TRP 49 CO 0.30 -0.23 0.34 0.99 0.02 0.00 0.00 176.95 178.38 1hwp s THR 50 N 1.24 5.25 -0.17 2.01 2.01 -0.37 -1.06 115.64 124.55 1hwp s THR 50 Ca -0.06 0.62 -0.11 0.00 0.31 0.00 0.00 61.69 62.45 1hwp s THR 50 Cb -0.14 -3.68 -0.05 0.00 0.01 0.00 0.00 72.50 68.65 1hwp s THR 50 CO -0.02 0.31 0.19 -0.36 -0.69 0.00 0.00 174.62 174.05 1hwp s PHE 51 N 0.97 3.47 0.31 4.92 0.40 0.24 -1.95 117.98 126.34 1hwp s PHE 51 Ca 0.17 0.46 0.09 0.00 -0.60 0.00 0.00 56.93 57.06 1hwp s PHE 51 Cb -0.14 -2.17 -0.04 0.00 0.51 0.00 0.00 43.02 41.17 1hwp s PHE 51 CO 0.06 0.37 0.06 0.71 0.70 0.00 0.00 175.22 177.13 1hwp s TYR 52 N 0.07 2.69 0.18 0.36 1.51 -0.53 -2.50 117.35 119.13 1hwp s TYR 52 Ca 0.12 -0.32 -0.11 0.00 -1.01 0.00 0.00 57.07 55.75 1hwp s TYR 52 Cb -0.12 -1.43 0.09 0.00 -0.11 0.00 0.00 41.96 40.39 1hwp s TYR 52 CO 0.01 0.48 1.73 -0.97 -1.11 0.00 0.00 175.55 175.69 1hwp h ASN 53 N 1.73 0.88 0.00 2.29 -1.24 -1.88 -2.30 115.58 115.05 1hwp h ASN 53 Ca -0.44 -0.18 0.00 0.00 0.71 0.00 0.00 56.30 56.39 1hwp h ASN 53 Cb 1.25 -0.23 0.00 0.00 0.73 0.00 0.00 38.32 40.07 1hwp h ASN 53 CO 0.63 0.82 0.22 -2.24 -1.29 0.00 0.00 177.43 175.57 1hwp h ASP 54 N 0.88 0.00 0.00 1.15 3.04 -1.96 -3.44 116.42 116.10 1hwp h ASP 54 Ca 0.21 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.00 1hwp h ASP 54 Cb 0.23 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.52 1hwp h ASP 54 CO -0.01 0.00 0.00 1.17 -2.04 0.00 0.00 179.24 178.36 1hwp n LYS 55 N -2.34 0.00 -4.06 4.15 3.00 -0.86 -4.95 118.16 113.10 1hwp n LYS 55 Ca -0.01 0.00 -0.22 0.00 -0.00 0.00 0.00 58.31 58.08 1hwp n LYS 55 Cb 0.26 -0.02 -0.04 0.00 0.00 0.00 0.00 35.03 35.23 1hwp n LYS 55 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1hwp s THR 56 N -2.00 4.31 -0.04 3.15 -4.23 -1.25 -1.07 115.64 114.51 1hwp s THR 56 Ca 0.00 -1.40 0.00 0.00 -1.18 0.00 0.00 61.69 59.12 1hwp s THR 56 Cb 0.00 -3.37 0.03 0.00 1.34 0.00 0.00 72.50 70.49 1hwp s THR 56 CO 0.00 -0.32 -0.00 -0.63 -0.54 0.00 0.00 174.62 173.12 1hwp s ILE 57 N -2.16 0.26 -0.05 2.99 1.01 -1.26 -1.45 121.20 120.54 1hwp s ILE 57 Ca 0.34 0.07 -0.19 0.00 0.00 0.00 0.00 60.65 60.88 1hwp s ILE 57 Cb -0.08 -0.36 0.04 0.00 0.01 0.00 0.00 42.46 42.07 1hwp s ILE 57 CO 0.25 0.18 0.42 0.00 0.00 0.00 0.00 174.94 175.79 1hwp s ARG 58 N 1.23 0.73 0.16 2.79 1.70 -0.82 0.22 118.95 124.96 1hwp s ARG 58 Ca -0.07 0.05 0.11 0.00 -0.47 0.00 0.00 55.73 55.35 1hwp s ARG 58 Cb -0.13 0.34 -0.04 0.00 -0.57 0.00 0.00 34.95 34.54 1hwp s ARG 58 CO -0.02 -0.20 -0.25 0.45 -1.08 0.00 0.00 175.30 174.20 1hwp s SER 59 N -1.03 3.37 0.00 -2.89 0.15 -1.25 -1.24 113.70 110.82 1hwp s SER 59 Ca -0.11 -0.81 0.00 0.00 0.70 0.00 0.00 55.95 55.73 1hwp s SER 59 Cb -0.04 -0.24 0.00 0.00 -1.71 0.00 0.00 66.02 64.04 1hwp s SER 59 CO 0.05 0.15 0.00 0.23 1.20 0.00 0.00 173.24 174.87 1hwp n MET 60 N 0.58 -0.97 0.00 5.44 2.81 -1.26 -1.90 117.12 121.82 1hwp n MET 60 Ca -0.15 0.23 0.00 0.00 -1.81 0.00 0.00 57.70 55.97 1hwp n MET 60 Cb 0.55 -4.57 0.00 0.00 -0.71 0.00 0.00 33.22 28.49 1hwp n MET 60 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1hwp n GLY 61 N -0.48 3.29 3.57 3.03 0.00 -1.26 -5.02 105.19 108.32 1hwp n GLY 61 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1hwp n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hwp s LYS 62 N -0.60 3.62 0.54 1.61 -0.14 -0.80 -4.71 119.74 119.26 1hwp s LYS 62 Ca 0.00 0.20 -0.18 0.00 -1.36 0.00 0.00 55.97 54.63 1hwp s LYS 62 Cb 0.00 -3.87 -0.13 0.00 -1.68 0.00 0.00 37.83 32.15 1hwp s LYS 62 CO 0.00 -1.02 0.00 0.00 -0.76 0.00 0.00 175.35 173.58 1hwp s MET 64 N -1.29 3.05 0.23 0.00 1.75 0.13 -0.81 119.30 122.37 1hwp s MET 64 Ca 0.59 -1.16 0.08 0.00 -1.25 0.00 0.00 55.69 53.95 1hwp s MET 64 Cb -0.48 -4.15 -0.04 0.00 2.84 0.00 0.00 34.83 33.01 1hwp s MET 64 CO 0.64 -1.20 0.03 0.95 -0.65 0.00 0.00 175.02 174.79 1hwp s THR 65 N 2.22 3.70 -1.60 10.11 -4.23 0.42 -4.69 115.64 121.58 1hwp s THR 65 Ca 0.10 -1.67 0.00 0.00 -1.18 0.00 0.00 61.69 58.94 1hwp s THR 65 Cb -0.22 -2.94 0.02 0.00 1.34 0.00 0.00 72.50 70.69 1hwp s THR 65 CO 0.09 -0.28 0.82 0.00 -0.54 0.00 0.00 174.62 174.71 1hwp n ALA 66 N -0.69 2.51 -0.49 3.99 0.00 -0.12 -0.81 120.51 124.89 1hwp n ALA 66 Ca -0.08 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1hwp n ALA 66 Cb 0.58 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.02 1hwp n ALA 66 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1hwp n ASN 67 N -0.26 0.00 -4.52 0.00 5.15 -1.25 -4.37 115.26 110.01 1hwp n ASN 67 Ca 0.01 0.00 -0.32 0.00 -0.60 0.00 0.00 54.58 53.67 1hwp n ASN 67 Cb 0.12 0.00 0.15 0.00 -0.53 0.00 0.00 39.78 39.51 1hwp n ASN 67 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1hwp n GLY 68 N 0.00 -1.35 2.85 8.20 0.00 -1.26 -4.99 105.19 108.63 1hwp n GLY 68 Ca 0.00 -0.75 -0.28 0.00 0.00 0.00 0.00 46.02 44.99 1hwp n GLY 68 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1hwp s LEU 69 N -3.52 1.71 0.00 0.99 1.98 -1.26 -4.67 118.68 113.91 1hwp s LEU 69 Ca 0.61 -0.84 0.00 0.00 -2.89 0.00 0.00 54.13 51.01 1hwp s LEU 69 Cb -0.22 -0.87 0.00 0.00 0.66 0.00 0.00 46.19 45.77 1hwp s LEU 69 CO 0.63 -0.24 0.00 -3.20 -1.89 0.00 0.00 176.35 171.66 1hwp n ASN 70 N 4.88 0.00 -0.74 3.68 5.15 -1.26 -5.00 115.26 121.98 1hwp n ASN 70 Ca -0.11 0.00 -0.08 0.00 -0.60 0.00 0.00 54.58 53.79 1hwp n ASN 70 Cb 0.47 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.69 1hwp n ASN 70 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1hwp n SER 71 N 0.00 0.07 0.00 1.20 7.64 -1.26 -0.27 113.62 121.00 1hwp n SER 71 Ca 0.00 0.06 0.00 0.00 1.01 0.00 0.00 58.87 59.94 1hwp n SER 71 Cb 0.00 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 1hwp n SER 71 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1hwp n GLY 72 N 1.14 1.40 3.67 0.23 0.00 0.17 -4.97 105.19 106.83 1hwp n GLY 72 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 1hwp n GLY 72 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hwp s SER 73 N -1.61 7.07 0.93 1.61 1.04 0.62 -4.80 113.70 118.56 1hwp s SER 73 Ca 0.00 1.56 -0.12 0.00 0.48 0.00 0.00 55.95 57.87 1hwp s SER 73 Cb 0.00 -2.54 0.15 0.00 0.10 0.00 0.00 66.02 63.72 1hwp s SER 73 CO 0.00 -0.65 1.12 -0.72 0.98 0.00 0.00 173.24 173.97 1hwp s TYR 74 N 2.95 2.42 0.16 5.02 -0.85 -1.26 0.40 117.35 126.18 1hwp s TYR 74 Ca 0.50 0.93 0.05 0.00 -0.52 0.00 0.00 57.07 58.02 1hwp s TYR 74 Cb -0.19 -3.33 -0.04 0.00 0.38 0.00 0.00 41.96 38.79 1hwp s TYR 74 CO 0.13 -2.47 0.12 0.42 -1.52 0.00 0.00 175.55 172.23 1hwp s ILE 75 N -3.17 4.42 0.36 -3.49 1.01 -1.17 -3.86 121.20 115.30 1hwp s ILE 75 Ca 0.64 -1.08 -0.17 0.00 0.00 0.00 0.00 60.65 60.04 1hwp s ILE 75 Cb -0.16 -3.24 0.05 0.00 0.01 0.00 0.00 42.46 39.12 1hwp s ILE 75 CO 0.55 -0.09 0.79 0.00 0.00 0.00 0.00 174.94 176.19 1hwp s MET 76 N -3.02 2.12 -0.08 2.79 0.23 0.00 -0.90 119.30 120.44 1hwp s MET 76 Ca 0.30 -1.33 0.01 0.00 -1.03 0.00 0.00 55.69 53.64 1hwp s MET 76 Cb -0.10 0.61 -0.03 0.00 -1.53 0.00 0.00 34.83 33.78 1hwp s MET 76 CO 0.23 -0.99 -0.08 0.96 -2.03 0.00 0.00 175.02 173.11 1hwp s ILE 77 N -2.58 3.57 0.07 3.16 -4.36 0.28 -0.43 121.20 120.91 1hwp s ILE 77 Ca 0.15 -0.52 -0.17 0.00 -0.26 0.00 0.00 60.65 59.85 1hwp s ILE 77 Cb -0.05 -2.46 0.03 0.00 1.25 0.00 0.00 42.46 41.23 1hwp s ILE 77 CO 0.10 0.58 0.40 -0.89 0.24 0.00 0.00 174.94 175.37 1hwp s THR 78 N -0.61 0.06 0.13 8.37 2.01 0.01 -1.22 115.64 124.40 1hwp s THR 78 Ca 0.09 -0.53 -0.34 0.00 0.31 0.00 0.00 61.69 61.23 1hwp s THR 78 Cb -0.12 -1.04 -0.17 0.00 0.01 0.00 0.00 72.50 71.18 1hwp s THR 78 CO 0.02 -0.29 0.93 -0.67 -0.69 0.00 0.00 174.62 173.91 1hwp n ASP 79 N 0.23 0.10 -0.21 3.53 2.03 -1.26 -2.16 116.55 118.80 1hwp n ASP 79 Ca -0.17 1.14 -0.07 0.00 0.52 0.00 0.00 54.79 56.21 1hwp n ASP 79 Cb 0.61 -1.04 0.03 0.00 -0.72 0.00 0.00 41.12 40.01 1hwp n ASP 79 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1hwp h SER 81 N 0.81 -0.91 0.58 0.00 0.02 -1.99 -2.84 113.55 109.22 1hwp h SER 81 Ca 0.21 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1hwp h SER 81 Cb 0.03 0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1hwp h SER 81 CO -0.04 -0.52 0.00 0.35 -1.14 0.00 0.00 176.83 175.49 1hwp n THR 82 N -4.56 0.95 -1.70 -2.27 -2.24 -1.24 -4.79 114.28 98.42 1hwp n THR 82 Ca -0.10 0.26 -0.43 0.00 -2.27 0.00 0.00 64.05 61.51 1hwp n THR 82 Cb 0.35 -1.11 -0.03 0.00 -2.10 0.00 0.00 70.33 67.44 1hwp n THR 82 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hwp n ALA 83 N -1.64 2.38 -1.55 6.98 0.00 -0.81 -4.84 120.51 121.04 1hwp n ALA 83 Ca 0.03 0.37 -0.51 0.00 0.00 0.00 0.00 53.44 53.33 1hwp n ALA 83 Cb 0.19 -2.53 -0.06 0.00 0.00 0.00 0.00 19.45 17.05 1hwp n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1hwp n ALA 84 N 4.56 0.88 -0.12 0.00 0.00 -1.26 -4.81 120.51 119.75 1hwp n ALA 84 Ca 0.17 0.07 -0.01 0.00 0.00 0.00 0.00 53.44 53.67 1hwp n ALA 84 Cb 0.35 -2.51 0.00 0.00 0.00 0.00 0.00 19.45 17.29 1hwp n ALA 84 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1hwp n GLU 85 N 7.47 -0.09 0.08 0.00 0.00 -1.26 0.19 120.64 127.03 1hwp n GLU 85 Ca 0.34 0.48 -0.10 0.00 0.00 0.00 0.00 57.16 57.88 1hwp n GLU 85 Cb 0.24 -0.71 -0.12 0.00 0.00 0.00 0.00 31.44 30.85 1hwp n GLU 85 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 1hwp h ASP 86 N 0.00 0.15 0.00 4.31 5.19 -1.96 -3.30 116.42 120.81 1hwp h ASP 86 Ca 0.10 -0.16 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 1hwp h ASP 86 Cb 0.17 -0.05 0.00 0.00 0.18 0.00 0.00 39.33 39.64 1hwp h ASP 86 CO -0.31 1.11 0.00 0.00 -3.12 0.00 0.00 179.24 176.93 1hwp n ALA 87 N -2.41 2.22 0.01 3.45 0.00 0.13 -2.98 120.51 120.92 1hwp n ALA 87 Ca -0.03 -0.05 0.01 0.00 0.00 0.00 0.00 53.44 53.37 1hwp n ALA 87 Cb 0.96 -1.14 -0.02 0.00 0.00 0.00 0.00 19.45 19.25 1hwp n ALA 87 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1hwp n THR 88 N -0.70 0.00 -2.77 0.00 5.66 -1.10 -0.95 114.28 114.42 1hwp n THR 88 Ca 0.07 -0.07 -0.41 0.00 -3.05 0.00 0.00 64.05 60.58 1hwp n THR 88 Cb 0.03 0.48 -0.04 0.00 -1.55 0.00 0.00 70.33 69.25 1hwp n THR 88 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1hwp s LYS 89 N -2.09 4.63 0.18 1.09 -0.14 -1.16 -4.46 119.74 117.79 1hwp s LYS 89 Ca -0.01 1.37 0.06 0.00 -1.36 0.00 0.00 55.97 56.04 1hwp s LYS 89 Cb 0.01 -3.40 -0.05 0.00 -1.68 0.00 0.00 37.83 32.72 1hwp s LYS 89 CO 0.09 0.14 -0.12 -1.58 -0.76 0.00 0.00 175.35 173.12 1hwp s TRP 90 N 0.30 1.50 -0.04 3.18 0.52 -0.23 -4.08 118.94 120.08 1hwp s TRP 90 Ca 0.47 -0.66 0.03 0.00 0.02 0.00 0.00 56.10 55.95 1hwp s TRP 90 Cb -0.22 -0.72 0.01 0.00 -1.15 0.00 0.00 33.47 31.38 1hwp s TRP 90 CO 0.28 0.23 -0.11 -2.00 0.02 0.00 0.00 176.95 175.37 1hwp s GLU 91 N -3.69 1.29 -0.55 4.98 2.56 0.84 -4.83 118.70 119.29 1hwp s GLU 91 Ca 0.20 -0.36 0.04 0.00 0.00 0.00 0.00 54.97 54.85 1hwp s GLU 91 Cb 0.01 -1.14 0.14 0.00 2.00 0.00 0.00 34.13 35.13 1hwp s GLU 91 CO 0.04 0.09 0.30 0.14 -0.56 0.00 0.00 175.26 175.27 1hwp s VAL 92 N 0.38 2.58 0.57 3.70 -7.23 -1.26 -0.97 120.40 118.17 1hwp s VAL 92 Ca -0.07 -3.48 -0.15 0.00 -1.81 0.00 0.00 61.98 56.47 1hwp s VAL 92 Cb -0.12 -2.78 -0.05 0.00 0.56 0.00 0.00 36.38 33.99 1hwp s VAL 92 CO 0.02 -0.85 1.02 -0.76 -0.31 0.00 0.00 175.10 174.22 1hwp s LEU 93 N -0.49 3.50 0.00 1.32 1.02 -1.07 -4.91 118.68 118.04 1hwp s LEU 93 Ca 0.19 1.64 0.03 0.00 0.02 0.00 0.00 54.13 56.00 1hwp s LEU 93 Cb -0.22 -4.51 0.12 0.00 0.02 0.00 0.00 46.19 41.60 1hwp s LEU 93 CO -0.03 -0.89 1.04 2.30 0.02 0.00 0.00 176.35 178.79 1hwp n ILE 94 N -1.99 1.64 1.19 -0.59 -5.35 -1.26 -1.73 119.36 111.27 1hwp n ILE 94 Ca 0.07 0.41 0.04 0.00 -0.27 0.00 0.00 62.75 63.01 1hwp n ILE 94 Cb 0.54 -1.37 0.27 0.00 -1.74 0.00 0.00 39.64 37.34 1hwp n ILE 94 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1hwp n ASP 95 N -1.45 0.00 -2.56 7.28 10.43 -1.26 -4.83 116.55 124.16 1hwp n ASP 95 Ca 0.01 -0.91 -0.11 0.00 2.57 0.00 0.00 54.79 56.34 1hwp n ASP 95 Cb 0.03 0.00 0.06 0.00 1.84 0.00 0.00 41.12 43.05 1hwp n ASP 95 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1hwp n GLY 96 N 0.14 -0.07 3.20 0.44 0.00 -0.70 -4.88 105.19 103.31 1hwp n GLY 96 Ca 0.07 -0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 1hwp n GLY 96 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hwp s SER 97 N -3.82 -0.32 -0.90 1.61 1.04 -1.23 0.07 113.70 110.15 1hwp s SER 97 Ca 0.03 0.62 -0.07 0.00 0.48 0.00 0.00 55.95 57.01 1hwp s SER 97 Cb -0.01 0.63 0.23 0.00 0.10 0.00 0.00 66.02 66.96 1hwp s SER 97 CO 0.47 -0.11 0.82 -0.63 0.98 0.00 0.00 173.24 174.77 1hwp s ILE 98 N 0.14 4.99 0.27 -1.02 1.01 -1.26 -2.61 121.20 122.72 1hwp s ILE 98 Ca -0.00 -3.32 -0.24 0.00 0.00 0.00 0.00 60.65 57.09 1hwp s ILE 98 Cb -0.02 -4.08 -0.09 0.00 0.01 0.00 0.00 42.46 38.28 1hwp s ILE 98 CO 0.00 -1.07 0.85 -0.51 0.00 0.00 0.00 174.94 174.22 1hwp s ILE 99 N -0.82 4.35 -0.53 2.92 2.07 -0.15 -2.21 121.20 126.83 1hwp s ILE 99 Ca 0.25 1.63 -0.19 0.00 -1.41 0.00 0.00 60.65 60.92 1hwp s ILE 99 Cb -0.11 -3.97 0.07 0.00 0.13 0.00 0.00 42.46 38.58 1hwp s ILE 99 CO -0.09 0.20 0.67 0.21 -1.91 0.00 0.00 174.94 174.02 1hwp s ASN 100 N -1.58 6.22 0.00 4.50 3.84 0.32 -0.12 114.94 128.12 1hwp s ASN 100 Ca 0.46 -1.00 0.00 0.00 0.21 0.00 0.00 52.86 52.53 1hwp s ASN 100 Cb -0.18 -2.30 0.00 0.00 -0.55 0.00 0.00 41.25 38.21 1hwp s ASN 100 CO 0.23 -0.97 0.00 -2.65 -2.79 0.00 0.00 177.10 170.92 1hwp n PRO 101 N 6.32 0.00 -0.29 0.43 -0.02 -1.26 -0.01 135.00 140.17 1hwp n PRO 101 Ca -0.07 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.39 1hwp n PRO 101 Cb 0.45 -0.17 0.01 0.00 -0.02 0.00 0.00 33.50 33.76 1hwp n PRO 101 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1hwp n SER 102 N 0.00 -0.54 0.21 2.55 2.88 -1.26 -2.49 113.62 114.97 1hwp n SER 102 Ca 0.00 1.29 -0.09 0.00 -1.33 0.00 0.00 58.87 58.74 1hwp n SER 102 Cb 0.00 -0.27 -0.04 0.00 -0.75 0.00 0.00 64.21 63.15 1hwp n SER 102 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1hwp h SER 103 N 0.00 -0.49 0.00 -3.46 4.64 -1.82 -3.48 113.55 108.94 1hwp h SER 103 Ca 0.23 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1hwp h SER 103 Cb 0.41 0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1hwp h SER 103 CO -0.72 -0.19 0.00 0.61 -0.87 0.00 0.00 176.83 175.66 1hwp n GLY 104 N -0.05 0.80 3.86 -0.77 0.00 0.99 -5.06 105.19 104.96 1hwp n GLY 104 Ca -0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 1hwp n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hwp s LEU 105 N 0.00 4.01 0.10 0.99 1.02 -1.26 -4.48 118.68 119.07 1hwp s LEU 105 Ca 0.00 1.18 0.10 0.00 0.02 0.00 0.00 54.13 55.43 1hwp s LEU 105 Cb 0.00 -4.00 -0.04 0.00 0.02 0.00 0.00 46.19 42.18 1hwp s LEU 105 CO 0.00 -0.25 -0.26 0.68 0.02 0.00 0.00 176.35 176.54 1hwp s VAL 106 N -2.08 2.24 -0.58 -1.59 -7.23 -0.89 -0.52 120.40 109.76 1hwp s VAL 106 Ca 0.52 -1.62 -0.28 0.00 -1.81 0.00 0.00 61.98 58.79 1hwp s VAL 106 Cb -0.10 -1.95 -0.11 0.00 0.56 0.00 0.00 36.38 34.78 1hwp s VAL 106 CO 0.22 0.19 2.45 0.80 -0.31 0.00 0.00 175.10 178.45 1hwp n MET 107 N 1.20 0.87 -4.38 4.82 1.56 -0.94 -2.23 117.12 118.03 1hwp n MET 107 Ca -0.18 0.05 -0.34 0.00 -0.27 0.00 0.00 57.70 56.97 1hwp n MET 107 Cb 0.53 -2.91 -0.09 0.00 2.15 0.00 0.00 33.22 32.89 1hwp n MET 107 CO 0.00 0.00 0.00 0.99 -0.73 0.00 0.00 175.97 176.23 1hwp s THR 108 N 10.86 4.21 -0.71 1.12 2.01 -0.23 -4.53 115.64 128.37 1hwp s THR 108 Ca 1.08 -0.36 -0.01 0.00 0.31 0.00 0.00 61.69 62.71 1hwp s THR 108 Cb -0.49 -2.79 0.18 0.00 0.01 0.00 0.00 72.50 69.41 1hwp s THR 108 CO 0.34 0.55 0.53 0.00 -0.69 0.00 0.00 174.62 175.35 1hwp s ALA 109 N -0.93 3.79 0.13 7.40 0.00 -1.09 -2.44 121.76 128.61 1hwp s ALA 109 Ca 0.15 -3.51 -0.18 0.00 0.00 0.00 0.00 51.96 48.41 1hwp s ALA 109 Cb -0.11 -2.61 0.03 0.00 0.00 0.00 0.00 23.12 20.42 1hwp s ALA 109 CO 0.04 -2.12 1.08 -2.30 0.00 0.00 0.00 175.76 172.47 1hwp n PRO 110 N 2.92 -0.26 -4.49 0.00 -0.02 -1.26 -4.49 135.00 127.40 1hwp n PRO 110 Ca 0.13 1.07 -0.24 0.00 -2.02 0.00 0.00 63.50 62.44 1hwp n PRO 110 Cb 0.37 -1.57 -0.10 0.00 -0.02 0.00 0.00 33.50 32.17 1hwp n PRO 110 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1hwp s SER 111 N -5.32 3.34 -0.46 2.55 0.15 -1.26 -4.99 113.70 107.71 1hwp s SER 111 Ca -0.09 -1.17 0.03 0.00 0.70 0.00 0.00 55.95 55.42 1hwp s SER 111 Cb 0.10 -0.27 0.46 0.00 -1.71 0.00 0.00 66.02 64.60 1hwp s SER 111 CO 0.46 -0.23 1.60 0.61 1.20 0.00 0.00 173.24 176.88 1hwp n GLY 112 N -0.69 6.06 3.83 9.45 0.00 -1.26 -4.91 105.19 117.68 1hwp n GLY 112 Ca -0.05 -2.40 -0.37 0.00 0.00 0.00 0.00 46.02 43.19 1hwp n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hwp s ALA 113 N -3.68 3.65 0.24 4.61 0.00 -1.26 -4.85 121.76 120.48 1hwp s ALA 113 Ca 0.57 -0.15 -0.31 0.00 0.00 0.00 0.00 51.96 52.07 1hwp s ALA 113 Cb 0.46 -2.46 -0.13 0.00 0.00 0.00 0.00 23.12 20.98 1hwp s ALA 113 CO 0.02 0.47 1.38 0.45 0.00 0.00 0.00 175.76 178.07 1hwp n SER 114 N 1.53 2.65 0.00 0.00 2.88 -1.26 -0.72 113.62 118.70 1hwp n SER 114 Ca -0.11 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.58 1hwp n SER 114 Cb 0.52 -1.42 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 1hwp n SER 114 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1hwp n ARG 115 N 1.88 0.00 -1.76 -1.46 0.63 0.57 -5.00 116.66 111.52 1hwp n ARG 115 Ca 0.11 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.62 1hwp n ARG 115 Cb 0.31 -0.91 -0.03 0.00 0.45 0.00 0.00 32.46 32.28 1hwp n ARG 115 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 1hwp s THR 116 N -2.65 3.13 0.25 5.15 2.01 0.10 -4.55 115.64 119.09 1hwp s THR 116 Ca 0.00 0.20 -0.30 0.00 0.31 0.00 0.00 61.69 61.91 1hwp s THR 116 Cb 0.00 -3.13 -0.09 0.00 0.01 0.00 0.00 72.50 69.29 1hwp s THR 116 CO 0.00 -0.02 1.12 0.28 -0.69 0.00 0.00 174.62 175.32 1hwp s THR 117 N 4.23 3.54 0.75 -0.82 -1.32 -1.26 0.86 115.64 121.62 1hwp s THR 117 Ca 0.84 1.46 -0.07 0.00 -1.21 0.00 0.00 61.69 62.71 1hwp s THR 117 Cb -0.40 -3.93 0.09 0.00 -1.51 0.00 0.00 72.50 66.75 1hwp s THR 117 CO 0.38 0.31 1.07 -0.76 -2.21 0.00 0.00 174.62 173.41 1hwp s LEU 118 N -1.07 2.82 -0.23 9.08 2.01 -0.22 -4.76 118.68 126.31 1hwp s LEU 118 Ca 0.47 0.31 -0.29 0.00 0.01 0.00 0.00 54.13 54.63 1hwp s LEU 118 Cb -0.32 -2.81 0.16 0.00 0.01 0.00 0.00 46.19 43.23 1hwp s LEU 118 CO 0.40 -1.83 1.18 -1.48 1.01 0.00 0.00 176.35 175.63 1hwp s LEU 119 N -5.34 -0.21 0.19 1.79 0.05 -1.02 -3.05 118.68 111.08 1hwp s LEU 119 Ca 0.63 0.25 -0.30 0.00 0.05 0.00 0.00 54.13 54.76 1hwp s LEU 119 Cb -0.09 1.48 -0.09 0.00 -2.05 0.00 0.00 46.19 45.45 1hwp s LEU 119 CO 0.46 -0.18 1.32 -0.76 -0.55 0.00 0.00 176.35 176.64 1hwp s LEU 120 N -0.93 4.41 0.09 1.48 2.01 0.16 -1.07 118.68 124.84 1hwp s LEU 120 Ca 0.04 2.39 -0.13 0.00 0.01 0.00 0.00 54.13 56.44 1hwp s LEU 120 Cb -0.01 -3.61 0.02 0.00 0.01 0.00 0.00 46.19 42.60 1hwp s LEU 120 CO -0.04 -0.54 0.30 -1.61 1.01 0.00 0.00 176.35 175.47 1hwp s GLU 121 N 0.01 0.93 -0.46 1.70 0.41 -0.95 -0.66 118.70 119.68 1hwp s GLU 121 Ca 0.57 -0.75 -0.35 0.00 -0.41 0.00 0.00 54.97 54.03 1hwp s GLU 121 Cb -0.36 0.40 -0.13 0.00 -1.78 0.00 0.00 34.13 32.25 1hwp s GLU 121 CO 0.37 -0.33 2.26 0.09 -0.49 0.00 0.00 175.26 177.17 1hwp n ASN 122 N 0.03 1.70 -4.65 -0.19 4.13 -1.26 -2.09 115.26 112.92 1hwp n ASN 122 Ca -0.16 0.35 -0.49 0.00 1.68 0.00 0.00 54.58 55.96 1hwp n ASN 122 Cb 0.62 -1.19 -0.05 0.00 -1.54 0.00 0.00 39.78 37.62 1hwp n ASN 122 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1hwp n ASN 123 N 10.07 3.20 0.00 6.41 5.15 -1.26 -4.79 115.26 134.04 1hwp n ASN 123 Ca 0.46 0.85 0.00 0.00 -0.60 0.00 0.00 54.58 55.30 1hwp n ASN 123 Cb 0.19 -1.35 0.00 0.00 -0.53 0.00 0.00 39.78 38.09 1hwp n ASN 123 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1hwp n ILE 124 N 5.57 0.00 -1.72 -1.44 -5.35 -1.26 -5.06 119.36 110.10 1hwp n ILE 124 Ca 0.26 -0.32 -0.01 0.00 -0.27 0.00 0.00 62.75 62.41 1hwp n ILE 124 Cb 0.29 1.15 0.00 0.00 -1.74 0.00 0.00 39.64 39.34 1hwp n ILE 124 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1hwp n HIS 125 N -0.37 -0.36 -4.40 4.28 8.25 -1.26 -4.76 115.22 116.60 1hwp n HIS 125 Ca 0.00 0.13 -0.25 0.00 -0.26 0.00 0.00 57.72 57.34 1hwp n HIS 125 Cb 0.04 -2.30 -0.11 0.00 1.12 0.00 0.00 29.99 28.73 1hwp n HIS 125 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1hwp s ALA 126 N -3.03 2.38 0.60 -1.41 0.00 -1.26 -4.07 121.76 114.98 1hwp s ALA 126 Ca 0.03 -1.61 0.30 0.00 0.00 0.00 0.00 51.96 50.68 1hwp s ALA 126 Cb -0.00 -0.28 1.73 0.00 0.00 0.00 0.00 23.12 24.57 1hwp s ALA 126 CO 0.10 0.36 2.11 0.00 0.00 0.00 0.00 175.76 178.33 1hwp h ALA 127 N 3.14 1.69 -0.62 0.00 0.00 -0.99 0.35 119.26 122.82 1hwp h ALA 127 Ca -0.44 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.38 1hwp h ALA 127 Cb 1.21 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1hwp h ALA 127 CO 0.50 -0.27 0.05 0.66 0.00 0.00 0.00 179.25 180.19 1hwp h SER 128 N 0.00 1.02 -0.82 0.00 4.64 -1.83 -2.65 113.55 113.91 1hwp h SER 128 Ca 0.07 -0.26 -0.48 0.00 -0.47 0.00 0.00 61.79 60.65 1hwp h SER 128 Cb 0.45 -0.27 -0.20 0.00 -0.31 0.00 0.00 62.40 62.08 1hwp h SER 128 CO -0.00 1.04 0.59 0.00 -0.87 0.00 0.00 176.83 177.58 1hwp n GLN 129 N -4.20 2.21 -3.99 4.77 6.02 0.12 -2.68 117.38 119.64 1hwp n GLN 129 Ca 0.04 -2.30 -0.30 0.00 -0.01 0.00 0.00 57.00 54.42 1hwp n GLN 129 Cb 0.31 -1.93 -0.16 0.00 1.02 0.00 0.00 30.24 29.48 1hwp n GLN 129 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1hwp s GLY 130 N -0.44 1.28 0.11 1.08 0.00 -1.00 -4.56 107.32 103.79 1hwp s GLY 130 Ca 0.46 -1.24 0.07 0.00 0.00 0.00 0.00 44.72 44.01 1hwp s GLY 130 CO -0.07 0.73 -0.16 -0.98 0.00 0.00 0.00 173.10 172.61 1hwp s TRP 131 N 1.39 1.50 -0.12 1.90 0.52 0.11 -4.05 118.94 120.18 1hwp s TRP 131 Ca -0.02 -0.48 -0.03 0.00 0.02 0.00 0.00 56.10 55.58 1hwp s TRP 131 Cb -0.17 -0.80 0.05 0.00 -1.15 0.00 0.00 33.47 31.40 1hwp s TRP 131 CO -0.08 0.16 0.06 0.99 0.02 0.00 0.00 176.95 178.10 1hwp s THR 132 N -1.63 0.03 -0.18 2.01 2.01 0.76 -3.85 115.64 114.80 1hwp s THR 132 Ca 0.06 0.00 -0.25 0.00 0.31 0.00 0.00 61.69 61.81 1hwp s THR 132 Cb -0.08 -0.50 -0.01 0.00 0.01 0.00 0.00 72.50 71.92 1hwp s THR 132 CO 0.04 -0.07 0.83 0.54 -0.69 0.00 0.00 174.62 175.27 1hwp s VAL 133 N 2.10 4.87 -0.15 3.82 0.11 -1.26 -2.42 120.40 127.47 1hwp s VAL 133 Ca 0.03 1.63 -0.34 0.00 -2.93 0.00 0.00 61.98 60.37 1hwp s VAL 133 Cb -0.15 -4.14 0.13 0.00 -1.53 0.00 0.00 36.38 30.70 1hwp s VAL 133 CO -0.07 0.02 1.14 -0.94 -3.33 0.00 0.00 175.10 171.92 1hwp s SER 134 N 1.17 -0.19 0.27 3.54 1.04 -0.23 -4.90 113.70 114.41 1hwp s SER 134 Ca 0.38 0.00 0.23 0.00 0.48 0.00 0.00 55.95 57.04 1hwp s SER 134 Cb -0.16 0.20 0.11 0.00 0.10 0.00 0.00 66.02 66.26 1hwp s SER 134 CO 0.12 -0.32 1.22 0.78 0.98 0.00 0.00 173.24 176.02 1hwp h ASN 135 N 2.00 0.00 -3.21 7.02 4.21 -1.90 -0.90 115.58 122.80 1hwp h ASN 135 Ca -0.12 -0.00 -0.75 0.00 1.21 0.00 0.00 56.30 56.64 1hwp h ASN 135 Cb 1.18 0.00 -0.22 0.00 -1.12 0.00 0.00 38.32 38.16 1hwp h ASN 135 CO 0.25 0.00 0.35 -0.62 -1.29 0.00 0.00 177.43 176.12 1hwp s ASP 136 N -5.59 6.65 -0.00 5.81 3.68 -1.26 -4.86 116.67 121.09 1hwp s ASP 136 Ca 0.02 -2.32 0.00 0.00 2.13 0.00 0.00 52.55 52.38 1hwp s ASP 136 Cb 0.08 -2.29 0.01 0.00 -1.45 0.00 0.00 42.92 39.27 1hwp s ASP 136 CO 0.75 -0.81 0.53 1.33 0.13 0.00 0.00 175.17 177.10 1hwp n VAL 137 N 4.69 0.02 -3.83 1.11 0.24 -1.26 -4.73 118.33 114.58 1hwp n VAL 137 Ca 0.15 -0.01 -0.36 0.00 -2.04 0.00 0.00 64.34 62.07 1hwp n VAL 137 Cb 0.47 -0.48 -0.13 0.00 -1.47 0.00 0.00 33.84 32.23 1hwp n VAL 137 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1hwp s GLN 138 N -1.04 3.06 0.75 7.34 -1.52 -1.26 -5.02 119.66 121.96 1hwp s GLN 138 Ca 0.00 -0.86 -0.14 0.00 -1.95 0.00 0.00 55.36 52.41 1hwp s GLN 138 Cb 0.00 -3.22 0.05 0.00 -0.22 0.00 0.00 33.01 29.62 1hwp s GLN 138 CO 0.00 -0.40 1.20 -1.25 -0.25 0.00 0.00 175.29 174.59 1hwp s PRO 139 N 1.45 2.03 -0.13 2.91 0.04 -1.26 -5.01 135.00 135.04 1hwp s PRO 139 Ca 0.02 1.74 -0.10 0.00 0.04 0.00 0.00 61.00 62.71 1hwp s PRO 139 Cb -0.17 -1.82 -0.05 0.00 0.04 0.00 0.00 34.50 32.50 1hwp s PRO 139 CO -0.00 -1.91 0.20 0.96 0.04 0.00 0.00 177.00 176.29 1hwp s ILE 140 N -2.04 5.39 0.21 0.56 -5.25 -1.26 -4.92 121.20 113.89 1hwp s ILE 140 Ca 0.74 0.35 -0.30 0.00 -0.99 0.00 0.00 60.65 60.44 1hwp s ILE 140 Cb -0.29 -3.50 -0.08 0.00 2.95 0.00 0.00 42.46 41.54 1hwp s ILE 140 CO 0.47 0.53 1.07 0.00 -1.79 0.00 0.00 174.94 175.22 1hwp s ALA 141 N -0.47 3.37 -0.07 2.27 0.00 -1.26 -3.29 121.76 122.30 1hwp s ALA 141 Ca 0.15 0.79 -0.31 0.00 0.00 0.00 0.00 51.96 52.59 1hwp s ALA 141 Cb -0.13 -3.32 0.08 0.00 0.00 0.00 0.00 23.12 19.76 1hwp s ALA 141 CO 0.04 -0.12 0.73 0.99 0.00 0.00 0.00 175.76 177.40 1hwp s THR 142 N -0.64 0.00 -0.13 0.00 2.01 0.16 -2.41 115.64 114.63 1hwp s THR 142 Ca 0.46 0.00 -0.09 0.00 0.31 0.00 0.00 61.69 62.37 1hwp s THR 142 Cb -0.29 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.17 1hwp s THR 142 CO 0.36 0.00 0.19 -0.76 -0.69 0.00 0.00 174.62 173.72 1hwp s LEU 143 N -1.13 4.34 -1.05 4.42 1.43 -0.33 -0.86 118.68 125.50 1hwp s LEU 143 Ca -0.09 0.48 -0.14 0.00 -1.03 0.00 0.00 54.13 53.35 1hwp s LEU 143 Cb -0.00 -2.17 0.20 0.00 0.03 0.00 0.00 46.19 44.24 1hwp s LEU 143 CO 0.08 0.31 1.17 -0.63 0.23 0.00 0.00 176.35 177.51 1hwp s ILE 144 N -0.53 5.29 -0.33 -0.59 -1.09 -1.26 -1.83 121.20 120.86 1hwp s ILE 144 Ca 0.15 -2.54 -0.29 0.00 -2.23 0.00 0.00 60.65 55.73 1hwp s ILE 144 Cb -0.12 -4.73 0.01 0.00 -1.58 0.00 0.00 42.46 36.03 1hwp s ILE 144 CO 0.04 -1.39 1.21 -0.69 -1.23 0.00 0.00 174.94 172.88 1hwp s VAL 145 N 0.92 4.27 0.00 2.92 1.01 -0.53 -0.79 120.40 128.20 1hwp s VAL 145 Ca 0.33 1.43 0.00 0.00 0.00 0.00 0.00 61.98 63.74 1hwp s VAL 145 Cb -0.06 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 32.02 1hwp s VAL 145 CO -0.06 -0.55 0.00 0.61 0.00 0.00 0.00 175.10 175.11 1hwp n GLY 146 N 4.24 1.16 3.61 4.51 0.00 0.96 -0.28 105.19 119.39 1hwp n GLY 146 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 1hwp n GLY 146 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1hwp n TYR 147 N 0.00 0.89 -4.16 1.61 9.36 -1.26 -3.31 117.16 120.29 1hwp n TYR 147 Ca 0.00 0.48 -0.38 0.00 3.32 0.00 0.00 57.90 61.32 1hwp n TYR 147 Cb 0.00 -2.17 -0.04 0.00 -0.63 0.00 0.00 39.34 36.51 1hwp n TYR 147 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 1hwp n ASN 148 N -0.16 -1.59 -2.01 2.98 6.94 -1.26 -0.61 115.26 119.55 1hwp n ASN 148 Ca 0.12 -1.25 -0.01 0.00 -0.02 0.00 0.00 54.58 53.42 1hwp n ASN 148 Cb 0.44 -1.52 -0.00 0.00 -2.36 0.00 0.00 39.78 36.34 1hwp n ASN 148 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1hwp n GLU 149 N -4.70 -2.31 -3.60 -3.83 4.71 -1.21 -4.88 120.64 104.82 1hwp n GLU 149 Ca -0.21 0.05 -0.34 0.00 -0.01 0.00 0.00 57.16 56.66 1hwp n GLU 149 Cb 0.60 -4.40 -0.05 0.00 -1.01 0.00 0.00 31.44 26.58 1hwp n GLU 149 CO 0.00 0.00 0.00 1.41 0.09 0.00 0.00 177.13 178.63 1hwp s MET 150 N -4.04 3.71 -0.07 3.49 1.75 0.22 -4.52 119.30 119.85 1hwp s MET 150 Ca 0.00 0.10 -0.13 0.00 -1.25 0.00 0.00 55.69 54.41 1hwp s MET 150 Cb 0.00 -2.94 -0.05 0.00 2.84 0.00 0.00 34.83 34.68 1hwp s MET 150 CO 0.00 0.53 0.32 0.00 -0.65 0.00 0.00 175.02 175.22 1hwp s LEU 152 N -0.65 4.37 -0.02 0.00 2.96 0.03 -1.13 118.68 124.23 1hwp s LEU 152 Ca 0.20 2.52 0.02 0.00 -0.22 0.00 0.00 54.13 56.65 1hwp s LEU 152 Cb -0.15 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 42.94 1hwp s LEU 152 CO 0.09 -0.85 -0.06 -1.10 -1.32 0.00 0.00 176.35 173.11 1hwp s GLN 153 N 2.02 2.66 -0.11 1.98 -0.21 0.50 -4.53 119.66 121.97 1hwp s GLN 153 Ca 0.72 -0.64 -0.10 0.00 0.02 0.00 0.00 55.36 55.36 1hwp s GLN 153 Cb -0.41 -2.56 -0.05 0.00 1.00 0.00 0.00 33.01 30.99 1hwp s GLN 153 CO 0.32 0.63 0.23 0.00 -2.12 0.00 0.00 175.29 174.34 1hwp s ALA 154 N -0.94 3.77 0.00 6.09 0.00 0.10 -2.80 121.76 127.98 1hwp s ALA 154 Ca 0.16 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.60 1hwp s ALA 154 Cb -0.11 -2.16 0.00 0.00 0.00 0.00 0.00 23.12 20.85 1hwp s ALA 154 CO 0.06 0.45 0.00 0.09 0.00 0.00 0.00 175.76 176.36 1hwp n ASN 155 N 2.35 0.00 -4.74 0.00 3.02 -1.25 -4.79 115.26 109.84 1hwp n ASN 155 Ca -0.17 0.00 -0.24 0.00 -0.03 0.00 0.00 54.58 54.14 1hwp n ASN 155 Cb 0.54 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.64 1hwp n ASN 155 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1hwp s GLY 156 N 0.00 2.23 0.17 7.41 0.00 -1.26 -5.01 107.32 110.86 1hwp s GLY 156 Ca 0.00 -2.03 -0.32 0.00 0.00 0.00 0.00 44.72 42.37 1hwp s GLY 156 CO 0.00 -1.86 1.78 -2.21 0.00 0.00 0.00 173.10 170.80 1hwp n GLU 157 N -1.23 2.79 -0.29 2.90 2.13 -1.26 -0.19 120.64 125.48 1hwp n GLU 157 Ca -0.01 1.01 0.00 0.00 0.66 0.00 0.00 57.16 58.82 1hwp n GLU 157 Cb 0.64 -2.88 0.00 0.00 0.27 0.00 0.00 31.44 29.47 1hwp n GLU 157 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1hwp n ASN 158 N 4.74 0.00 -4.89 4.31 5.03 -1.22 -4.99 115.26 118.25 1hwp n ASN 158 Ca 0.17 0.00 -0.29 0.00 0.87 0.00 0.00 54.58 55.33 1hwp n ASN 158 Cb 0.36 -0.40 0.03 0.00 -1.02 0.00 0.00 39.78 38.75 1hwp n ASN 158 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.26 175.63 1hwp s ASN 159 N -3.30 5.63 0.31 6.41 0.02 0.73 -4.71 114.94 120.03 1hwp s ASN 159 Ca 0.00 1.05 0.00 0.00 -1.02 0.00 0.00 52.86 52.89 1hwp s ASN 159 Cb 0.00 -1.96 0.00 0.00 0.02 0.00 0.00 41.25 39.31 1hwp s ASN 159 CO 0.00 -1.16 0.00 -3.20 0.02 0.00 0.00 177.10 172.76 1hwp n ASN 160 N -2.82 -0.58 -3.33 -1.22 2.85 -1.26 -2.39 115.26 106.50 1hwp n ASN 160 Ca 0.06 -0.02 0.02 0.00 -0.11 0.00 0.00 54.58 54.54 1hwp n ASN 160 Cb 0.57 0.00 -0.02 0.00 1.24 0.00 0.00 39.78 41.56 1hwp n ASN 160 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 1hwp s VAL 161 N -0.31 -0.92 0.30 3.44 -7.23 -1.26 -3.94 120.40 110.49 1hwp s VAL 161 Ca 0.00 0.00 0.03 0.00 -1.81 0.00 0.00 61.98 60.20 1hwp s VAL 161 Cb 0.00 -1.00 -0.06 0.00 0.56 0.00 0.00 36.38 35.88 1hwp s VAL 161 CO 0.00 0.00 0.08 -1.66 -0.31 0.00 0.00 175.10 173.21 1hwp s TRP 162 N 2.85 1.78 -0.11 2.82 -2.14 -1.12 -3.13 118.94 119.89 1hwp s TRP 162 Ca 0.09 -1.06 -0.30 0.00 2.66 0.00 0.00 56.10 57.50 1hwp s TRP 162 Cb -0.13 -1.12 -0.03 0.00 -3.10 0.00 0.00 33.47 29.09 1hwp s TRP 162 CO -0.19 -0.14 1.29 1.41 -2.66 0.00 0.00 176.95 176.66 1hwp s MET 163 N -3.95 4.26 0.14 3.25 1.75 -1.26 -0.37 119.30 123.11 1hwp s MET 163 Ca 0.37 1.74 0.08 0.00 -1.25 0.00 0.00 55.69 56.63 1hwp s MET 163 Cb 0.08 -3.72 -0.04 0.00 2.84 0.00 0.00 34.83 34.00 1hwp s MET 163 CO 0.15 -0.65 -0.19 -1.21 -0.65 0.00 0.00 175.02 172.47 1hwp s GLU 164 N 3.14 1.21 -0.26 4.11 0.41 -0.29 -4.90 118.70 122.12 1hwp s GLU 164 Ca 0.57 -1.30 -0.38 0.00 -0.41 0.00 0.00 54.97 53.45 1hwp s GLU 164 Cb -0.24 -1.34 -0.14 0.00 -1.78 0.00 0.00 34.13 30.62 1hwp s GLU 164 CO 0.19 0.29 1.85 -0.25 -0.49 0.00 0.00 175.26 176.84 1hwp n ASP 165 N 0.62 2.55 -4.52 -0.19 9.92 -1.26 -1.87 116.55 121.80 1hwp n ASP 165 Ca -0.16 0.95 -0.51 0.00 -0.53 0.00 0.00 54.79 54.54 1hwp n ASP 165 Cb 0.56 -1.20 -0.05 0.00 -0.64 0.00 0.00 41.12 39.79 1hwp n ASP 165 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1hwp s ASP 167 N -0.23 0.73 0.00 0.00 -1.08 -1.26 -4.98 116.67 109.85 1hwp s ASP 167 Ca 0.76 -0.28 0.00 0.00 -0.52 0.00 0.00 52.55 52.51 1hwp s ASP 167 Cb -0.99 0.91 0.00 0.00 -1.46 0.00 0.00 42.92 41.38 1hwp s ASP 167 CO 0.54 -0.34 0.28 1.33 0.52 0.00 0.00 175.17 177.50 1hwp n VAL 168 N 5.34 0.00 -0.01 1.11 0.24 -1.26 -2.39 118.33 121.36 1hwp n VAL 168 Ca -0.02 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.27 1hwp n VAL 168 Cb 0.49 -0.29 -0.01 0.00 -1.47 0.00 0.00 33.84 32.56 1hwp n VAL 168 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1hwp n THR 169 N -0.27 0.13 -2.10 3.34 -2.24 -1.26 -4.98 114.28 106.90 1hwp n THR 169 Ca 0.00 -0.07 -0.43 0.00 -2.27 0.00 0.00 64.05 61.28 1hwp n THR 169 Cb 0.02 -0.83 -0.03 0.00 -2.10 0.00 0.00 70.33 67.40 1hwp n THR 169 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1hwp s SER 170 N -3.56 6.25 0.60 3.42 0.15 -1.01 -4.86 113.70 114.70 1hwp s SER 170 Ca -0.02 1.49 0.40 0.00 0.70 0.00 0.00 55.95 58.52 1hwp s SER 170 Cb 0.01 -2.53 2.16 0.00 -1.71 0.00 0.00 66.02 63.95 1hwp s SER 170 CO 0.07 -1.38 2.22 -0.37 1.20 0.00 0.00 173.24 174.97 1hwp h VAL 171 N 6.34 0.00 0.00 4.45 -1.51 -1.94 -0.85 116.25 122.74 1hwp h VAL 171 Ca -0.33 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.14 1hwp h VAL 171 Cb 1.15 0.88 0.00 0.00 -2.13 0.00 0.00 31.29 31.20 1hwp h VAL 171 CO 1.01 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 177.35 1hwp n GLN 172 N -2.91 0.01 0.00 5.19 6.02 -1.26 -1.41 117.38 123.02 1hwp n GLN 172 Ca -0.03 0.27 0.05 0.00 -0.01 0.00 0.00 57.00 57.28 1hwp n GLN 172 Cb 0.08 -1.50 0.01 0.00 1.02 0.00 0.00 30.24 29.85 1hwp n GLN 172 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1hwp n GLN 173 N -1.49 1.72 -2.80 -1.09 6.02 -0.33 0.02 117.38 119.43 1hwp n GLN 173 Ca 0.03 -0.70 -0.43 0.00 -0.01 0.00 0.00 57.00 55.90 1hwp n GLN 173 Cb 0.15 -1.09 -0.04 0.00 1.02 0.00 0.00 30.24 30.28 1hwp n GLN 173 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1hwp s GLN 174 N -1.19 3.36 -0.14 -1.09 -0.21 -0.50 -4.26 119.66 115.63 1hwp s GLN 174 Ca 0.09 -0.18 -0.06 0.00 0.02 0.00 0.00 55.36 55.23 1hwp s GLN 174 Cb 0.08 -4.04 -0.04 0.00 1.00 0.00 0.00 33.01 30.01 1hwp s GLN 174 CO 0.21 -1.50 0.06 -1.58 -2.12 0.00 0.00 175.29 170.36 1hwp s TRP 175 N 4.08 3.31 -0.34 0.91 0.52 -0.03 -2.27 118.94 125.11 1hwp s TRP 175 Ca 0.32 0.21 -0.09 0.00 0.02 0.00 0.00 56.10 56.57 1hwp s TRP 175 Cb -0.12 -1.96 0.02 0.00 -1.15 0.00 0.00 33.47 30.26 1hwp s TRP 175 CO 0.20 0.38 0.15 0.00 0.02 0.00 0.00 176.95 177.71 1hwp s ALA 176 N -0.33 3.19 -0.68 0.98 0.00 -0.02 -0.66 121.76 124.23 1hwp s ALA 176 Ca 0.09 -1.61 -0.25 0.00 0.00 0.00 0.00 51.96 50.19 1hwp s ALA 176 Cb -0.12 -2.40 0.04 0.00 0.00 0.00 0.00 23.12 20.65 1hwp s ALA 176 CO 0.02 -1.19 1.14 -0.51 0.00 0.00 0.00 175.76 175.21 1hwp s LEU 177 N 1.52 3.67 0.44 0.00 1.43 -1.21 -2.22 118.68 122.32 1hwp s LEU 177 Ca 0.02 -0.58 -0.23 0.00 -1.03 0.00 0.00 54.13 52.32 1hwp s LEU 177 Cb -0.18 -2.59 -0.08 0.00 0.03 0.00 0.00 46.19 43.37 1hwp s LEU 177 CO 0.05 -1.63 1.07 -0.36 0.23 0.00 0.00 176.35 175.72 1hwp s PHE 178 N 4.96 3.09 0.44 0.29 0.08 -0.40 -4.19 117.98 122.25 1hwp s PHE 178 Ca 0.31 1.60 0.40 0.00 0.12 0.00 0.00 56.93 59.36 1hwp s PHE 178 Cb -0.11 -3.17 2.04 0.00 -0.57 0.00 0.00 43.02 41.21 1hwp s PHE 178 CO 0.15 -0.89 2.21 -0.44 -0.10 0.00 0.00 175.22 176.15 1hwp h ASP 179 N 2.10 0.00 0.00 1.36 5.19 -1.90 -1.64 116.42 121.53 1hwp h ASP 179 Ca -0.49 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.92 1hwp h ASP 179 Cb 1.22 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.73 1hwp h ASP 179 CO 0.61 0.00 0.00 -0.90 -3.12 0.00 0.00 179.24 175.83 1hwp n ASP 180 N -3.03 0.39 -0.81 6.45 5.68 -1.26 -3.50 116.55 120.47 1hwp n ASP 180 Ca -0.02 -1.62 -0.11 0.00 -0.50 0.00 0.00 54.79 52.55 1hwp n ASP 180 Cb 0.14 -0.20 -0.05 0.00 -1.14 0.00 0.00 41.12 39.88 1hwp n ASP 180 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1hwp n ARG 181 N -0.21 -0.78 -4.21 0.11 5.12 -0.62 -4.43 116.66 111.64 1hwp n ARG 181 Ca 0.00 0.86 -0.23 0.00 -1.93 0.00 0.00 57.85 56.56 1hwp n ARG 181 Cb 0.10 -4.82 -0.06 0.00 -1.16 0.00 0.00 32.46 26.51 1hwp n ARG 181 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1hwp s THR 182 N -2.37 3.58 -0.25 0.55 -4.23 -1.21 -0.94 115.64 110.77 1hwp s THR 182 Ca 0.00 -1.75 0.02 0.00 -1.18 0.00 0.00 61.69 58.78 1hwp s THR 182 Cb 0.00 -3.00 0.05 0.00 1.34 0.00 0.00 72.50 70.89 1hwp s THR 182 CO 0.00 -0.33 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.02 1hwp s ILE 183 N -2.30 2.32 0.27 2.99 1.01 -1.26 -1.27 121.20 122.95 1hwp s ILE 183 Ca 0.33 -1.43 0.10 0.00 0.00 0.00 0.00 60.65 59.65 1hwp s ILE 183 Cb -0.06 -2.28 -0.05 0.00 0.01 0.00 0.00 42.46 40.08 1hwp s ILE 183 CO 0.22 0.08 -0.16 -0.13 0.00 0.00 0.00 174.94 174.95 1hwp s ARG 184 N 1.17 1.60 -0.03 2.79 0.52 -0.94 -0.07 118.95 123.99 1hwp s ARG 184 Ca -0.05 -1.75 -0.30 0.00 -0.52 0.00 0.00 55.73 53.10 1hwp s ARG 184 Cb -0.18 -1.54 -0.05 0.00 0.52 0.00 0.00 34.95 33.69 1hwp s ARG 184 CO -0.06 0.24 1.49 0.08 0.02 0.00 0.00 175.30 177.07 1hwp s VAL 185 N -2.69 3.66 0.18 3.52 1.01 -1.19 -0.84 120.40 124.06 1hwp s VAL 185 Ca 0.28 0.96 -0.14 0.00 0.00 0.00 0.00 61.98 63.09 1hwp s VAL 185 Cb -0.02 -3.62 0.10 0.00 0.00 0.00 0.00 36.38 32.84 1hwp s VAL 185 CO 0.13 -0.04 1.71 -1.13 0.00 0.00 0.00 175.10 175.77 1hwp h ASN 186 N 8.45 -0.06 -0.45 3.32 -1.24 -1.75 0.12 115.58 123.98 1hwp h ASN 186 Ca -0.37 0.09 0.09 0.00 0.71 0.00 0.00 56.30 56.82 1hwp h ASN 186 Cb 1.17 0.14 -0.09 0.00 0.73 0.00 0.00 38.32 40.27 1hwp h ASN 186 CO 0.93 -0.00 -0.17 -1.13 -1.29 0.00 0.00 177.43 175.77 1hwp h ASN 187 N 0.19 -0.60 -2.92 1.15 -1.24 -1.82 -3.34 115.58 106.99 1hwp h ASN 187 Ca 0.23 0.16 -0.58 0.00 0.71 0.00 0.00 56.30 56.82 1hwp h ASN 187 Cb 0.32 0.35 -0.40 0.00 0.73 0.00 0.00 38.32 39.32 1hwp h ASN 187 CO -0.33 -0.21 -0.80 -0.44 -1.29 0.00 0.00 177.43 174.37 1hwp s SER 188 N -5.17 3.40 0.00 1.15 0.01 -0.38 -4.98 113.70 107.73 1hwp s SER 188 Ca -0.14 -2.02 0.00 0.00 1.31 0.00 0.00 55.95 55.10 1hwp s SER 188 Cb 0.15 -0.60 0.00 0.00 0.21 0.00 0.00 66.02 65.78 1hwp s SER 188 CO 0.71 -0.34 0.34 0.54 0.41 0.00 0.00 173.24 174.89 1hwp n ARG 189 N 4.30 0.54 0.08 12.44 5.12 0.29 -3.09 116.66 136.35 1hwp n ARG 189 Ca 0.05 0.00 0.11 0.00 -1.93 0.00 0.00 57.85 56.09 1hwp n ARG 189 Cb 0.38 -1.26 -0.03 0.00 -1.16 0.00 0.00 32.46 30.39 1hwp n ARG 189 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1hwp n GLY 190 N 0.35 -1.39 3.25 -0.13 0.00 -1.26 -4.84 105.19 101.16 1hwp n GLY 190 Ca 0.00 -0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 1hwp n GLY 190 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1hwp s LEU 191 N -5.23 2.37 0.13 0.99 2.34 -1.18 -1.64 118.68 116.46 1hwp s LEU 191 Ca -0.02 -0.49 0.03 0.00 0.06 0.00 0.00 54.13 53.70 1hwp s LEU 191 Cb 0.10 -1.52 -0.04 0.00 -0.56 0.00 0.00 46.19 44.18 1hwp s LEU 191 CO 0.81 0.11 0.23 0.00 -1.06 0.00 0.00 176.35 176.43 1hwp s VAL 193 N -1.68 3.15 0.21 0.00 1.01 0.90 -3.00 120.40 120.99 1hwp s VAL 193 Ca 0.34 0.10 0.05 0.00 0.00 0.00 0.00 61.98 62.46 1hwp s VAL 193 Cb -0.11 -3.38 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 1hwp s VAL 193 CO 0.27 -0.35 0.26 -0.89 0.00 0.00 0.00 175.10 174.39 1hwp s THR 194 N 10.65 4.92 0.29 3.92 2.01 -1.19 -4.41 115.64 131.83 1hwp s THR 194 Ca 0.86 -1.06 0.08 0.00 0.31 0.00 0.00 61.69 61.88 1hwp s THR 194 Cb -0.17 -3.62 -0.04 0.00 0.01 0.00 0.00 72.50 68.69 1hwp s THR 194 CO 0.25 -0.25 0.11 -0.55 -0.69 0.00 0.00 174.62 173.49 1hwp s SER 195 N -3.66 4.88 -0.00 3.53 0.15 -1.25 -0.38 113.70 116.97 1hwp s SER 195 Ca 0.33 -0.58 0.21 0.00 0.70 0.00 0.00 55.95 56.62 1hwp s SER 195 Cb -0.09 -0.95 -0.22 0.00 -1.71 0.00 0.00 66.02 63.05 1hwp s SER 195 CO 0.27 -0.13 0.86 0.59 1.20 0.00 0.00 173.24 176.03 1hwp n ASN 196 N -1.08 0.85 -2.30 5.45 4.13 -0.36 -4.91 115.26 117.03 1hwp n ASN 196 Ca -0.05 -0.84 -0.02 0.00 1.68 0.00 0.00 54.58 55.36 1hwp n ASN 196 Cb 0.59 1.10 0.01 0.00 -1.54 0.00 0.00 39.78 39.95 1hwp n ASN 196 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1hwp n GLY 197 N 1.47 0.89 0.30 7.41 0.00 -1.26 -4.97 105.19 109.02 1hwp n GLY 197 Ca 0.03 -1.05 0.09 0.00 0.00 0.00 0.00 46.02 45.09 1hwp n GLY 197 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1hwp n TYR 198 N -0.41 0.27 -4.28 1.61 4.02 -1.26 -4.94 117.16 112.17 1hwp n TYR 198 Ca -0.01 -0.91 -0.27 0.00 -0.01 0.00 0.00 57.90 56.71 1hwp n TYR 198 Cb 0.33 -0.18 -0.09 0.00 -0.02 0.00 0.00 39.34 39.38 1hwp n TYR 198 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1hwp s VAL 199 N -2.63 3.27 0.80 -0.72 0.11 -1.26 -4.91 120.40 115.05 1hwp s VAL 199 Ca 0.32 -1.63 -0.15 0.00 -2.93 0.00 0.00 61.98 57.59 1hwp s VAL 199 Cb 0.27 -2.62 0.01 0.00 -1.53 0.00 0.00 36.38 32.50 1hwp s VAL 199 CO 0.05 -0.11 0.70 -1.20 -3.33 0.00 0.00 175.10 171.20 1hwp n SER 200 N 0.00 -0.73 0.00 3.54 7.64 -1.26 -1.84 113.62 120.96 1hwp n SER 200 Ca -0.10 0.53 0.00 0.00 1.01 0.00 0.00 58.87 60.31 1hwp n SER 200 Cb 0.55 -1.30 0.00 0.00 -1.01 0.00 0.00 64.21 62.45 1hwp n SER 200 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1hwp n LYS 201 N -1.67 0.00 -1.85 1.43 5.02 0.66 -4.94 118.16 116.80 1hwp n LYS 201 Ca 0.10 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.97 1hwp n LYS 201 Cb 0.51 -3.43 -0.03 0.00 -0.02 0.00 0.00 35.03 32.05 1hwp n LYS 201 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1hwp s ASP 202 N -2.55 6.54 0.32 4.39 1.01 -0.77 -4.76 116.67 120.86 1hwp s ASP 202 Ca 0.00 2.59 -0.29 0.00 0.71 0.00 0.00 52.55 55.56 1hwp s ASP 202 Cb 0.00 -2.57 -0.10 0.00 1.01 0.00 0.00 42.92 41.26 1hwp s ASP 202 CO 0.00 -0.93 1.33 -0.76 0.21 0.00 0.00 175.17 175.03 1hwp s LEU 203 N 2.61 4.42 0.13 1.23 1.43 -1.26 -1.69 118.68 125.54 1hwp s LEU 203 Ca 0.76 2.70 0.03 0.00 -1.03 0.00 0.00 54.13 56.60 1hwp s LEU 203 Cb -0.42 -3.65 -0.04 0.00 0.03 0.00 0.00 46.19 42.11 1hwp s LEU 203 CO 0.34 -0.57 0.19 -0.63 0.23 0.00 0.00 176.35 175.90 1hwp s ILE 204 N -0.99 4.91 0.00 -0.59 1.01 -0.68 -1.23 121.20 123.63 1hwp s ILE 204 Ca 0.50 -0.80 0.00 0.00 0.00 0.00 0.00 60.65 60.35 1hwp s ILE 204 Cb -0.40 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 38.59 1hwp s ILE 204 CO 0.52 -0.03 0.00 1.33 0.00 0.00 0.00 174.94 176.76 1hwp n VAL 205 N -0.21 0.00 -2.77 2.92 0.24 0.49 -3.99 118.33 115.01 1hwp n VAL 205 Ca -0.07 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.11 1hwp n VAL 205 Cb 0.53 0.00 0.02 0.00 -1.47 0.00 0.00 33.84 32.92 1hwp n VAL 205 CO 0.00 0.00 0.00 -0.38 -2.14 0.00 0.00 176.83 174.31 1hwp n ILE 206 N 0.00 0.76 -0.25 1.34 5.41 -1.00 -3.19 119.36 122.42 1hwp n ILE 206 Ca 0.00 -3.41 -0.25 0.00 1.00 0.00 0.00 62.75 60.10 1hwp n ILE 206 Cb 0.00 0.45 0.24 0.00 -0.71 0.00 0.00 39.64 39.61 1hwp n ILE 206 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1hwp n ARG 207 N 0.01 -4.23 -1.64 0.38 1.74 -1.16 -3.39 116.66 108.37 1hwp n ARG 207 Ca 0.13 -1.21 -0.30 0.00 -0.77 0.00 0.00 57.85 55.70 1hwp n ARG 207 Cb 0.78 -1.53 0.07 0.00 -1.02 0.00 0.00 32.46 30.77 1hwp n ARG 207 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1hwp s LYS 208 N -4.72 2.46 -0.23 5.56 2.47 -1.26 -1.36 119.74 122.66 1hwp s LYS 208 Ca 0.55 0.66 -0.20 0.00 -1.56 0.00 0.00 55.97 55.42 1hwp s LYS 208 Cb -0.09 -1.96 -0.02 0.00 -1.46 0.00 0.00 37.83 34.29 1hwp s LYS 208 CO 0.46 -1.36 0.58 0.00 0.16 0.00 0.00 175.35 175.19 1hwp n GLN 210 N 5.32 0.00 -1.01 0.00 6.02 -1.26 -4.97 117.38 121.48 1hwp n GLN 210 Ca -0.02 -0.45 -0.00 0.00 -0.01 0.00 0.00 57.00 56.51 1hwp n GLN 210 Cb 0.50 -0.43 -0.00 0.00 1.02 0.00 0.00 30.24 31.32 1hwp n GLN 210 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1hwp n GLY 211 N 0.00 0.45 3.64 1.08 0.00 -1.26 -4.90 105.19 104.20 1hwp n GLY 211 Ca 0.00 -0.11 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 1hwp n GLY 211 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hwp n LEU 212 N -0.04 4.23 0.04 0.99 4.32 -1.26 -0.76 117.00 124.53 1hwp n LEU 212 Ca -0.00 0.78 0.05 0.00 -0.02 0.00 0.00 56.01 56.81 1hwp n LEU 212 Cb 0.08 -1.43 0.23 0.00 -1.62 0.00 0.00 43.42 40.68 1hwp n LEU 212 CO 0.01 -1.71 0.65 0.00 -1.22 0.00 0.00 177.39 175.11 1hwp n ALA 213 N -1.96 1.22 0.21 -1.18 0.00 -1.26 -0.93 120.51 116.61 1hwp n ALA 213 Ca 0.14 0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.74 1hwp n ALA 213 Cb 0.48 -1.15 0.06 0.00 0.00 0.00 0.00 19.45 18.84 1hwp n ALA 213 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1hwp h THR 214 N 0.00 0.00 -0.50 0.00 1.35 -1.88 -3.31 112.91 108.57 1hwp h THR 214 Ca 0.00 -0.91 0.00 0.00 -0.55 0.00 0.00 66.41 64.95 1hwp h THR 214 Cb 0.09 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.03 1hwp h THR 214 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 1hwp n GLN 215 N -2.66 2.89 -3.47 4.72 6.02 -0.11 -3.84 117.38 120.94 1hwp n GLN 215 Ca 0.01 -2.10 -0.43 0.00 -0.01 0.00 0.00 57.00 54.47 1hwp n GLN 215 Cb 0.53 -1.67 -0.10 0.00 1.02 0.00 0.00 30.24 30.02 1hwp n GLN 215 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1hwp s ARG 216 N -1.67 2.95 -0.14 -1.09 3.52 -1.24 -4.30 118.95 116.97 1hwp s ARG 216 Ca 0.38 -1.09 0.00 0.00 -0.13 0.00 0.00 55.73 54.89 1hwp s ARG 216 Cb 0.24 -3.97 -0.01 0.00 -1.56 0.00 0.00 34.95 29.64 1hwp s ARG 216 CO 0.20 -0.80 -0.14 -1.58 -0.81 0.00 0.00 175.30 172.17 1hwp s TRP 217 N 1.65 2.79 -0.20 5.12 0.52 -0.12 -3.26 118.94 125.44 1hwp s TRP 217 Ca 0.04 -0.85 -0.04 0.00 0.02 0.00 0.00 56.10 55.27 1hwp s TRP 217 Cb -0.20 -1.87 -0.02 0.00 -1.15 0.00 0.00 33.47 30.23 1hwp s TRP 217 CO 0.09 -0.35 -0.02 0.12 0.02 0.00 0.00 176.95 176.81 1hwp s PHE 218 N 0.61 3.00 -0.94 -1.98 5.36 -0.62 -4.64 117.98 118.77 1hwp s PHE 218 Ca -0.08 -0.61 -0.21 0.00 -0.96 0.00 0.00 56.93 55.07 1hwp s PHE 218 Cb -0.16 -2.08 0.10 0.00 -0.34 0.00 0.00 43.02 40.54 1hwp s PHE 218 CO 0.03 -0.33 1.23 -0.06 -1.46 0.00 0.00 175.22 174.63 1hwp s PHE 219 N 1.11 2.88 0.34 10.12 0.40 -1.26 -1.50 117.98 130.07 1hwp s PHE 219 Ca 0.02 -1.13 -0.28 0.00 -0.60 0.00 0.00 56.93 54.95 1hwp s PHE 219 Cb -0.14 -4.43 -0.12 0.00 0.51 0.00 0.00 43.02 38.83 1hwp s PHE 219 CO 0.01 -1.66 1.28 -1.71 0.70 0.00 0.00 175.22 173.83 1hwp n ASN 220 N 7.47 2.71 0.00 1.36 2.85 -0.34 -4.83 115.26 124.47 1hwp n ASN 220 Ca 0.25 1.20 0.03 0.00 -0.11 0.00 0.00 54.58 55.95 1hwp n ASN 220 Cb 0.50 -1.48 0.16 0.00 1.24 0.00 0.00 39.78 40.19 1hwp n ASN 220 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1hwp n SER 221 N 0.76 0.00 -0.03 1.20 3.41 -1.26 -1.39 113.62 116.31 1hwp n SER 221 Ca 0.05 0.26 0.13 0.00 -0.26 0.00 0.00 58.87 59.05 1hwp n SER 221 Cb 0.36 -0.33 0.48 0.00 -0.26 0.00 0.00 64.21 64.46 1hwp n SER 221 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1hwp n ASP 222 N -1.33 0.30 0.00 4.04 5.75 -1.26 -4.90 116.55 119.14 1hwp n ASP 222 Ca 0.03 -0.03 0.00 0.00 -0.01 0.00 0.00 54.79 54.77 1hwp n ASP 222 Cb 0.06 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.02 1hwp n ASP 222 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1hwp n GLY 223 N 1.45 0.83 3.56 6.12 0.00 -0.49 -4.99 105.19 111.67 1hwp n GLY 223 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 1hwp n GLY 223 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hwp s SER 224 N -2.24 4.81 -0.88 1.61 1.04 -1.24 -0.48 113.70 116.32 1hwp s SER 224 Ca 0.00 -0.04 -0.19 0.00 0.48 0.00 0.00 55.95 56.20 1hwp s SER 224 Cb 0.00 -1.50 0.13 0.00 0.10 0.00 0.00 66.02 64.75 1hwp s SER 224 CO 0.00 0.28 1.06 -0.69 0.98 0.00 0.00 173.24 174.87 1hwp s VAL 225 N -0.30 4.79 0.13 5.02 1.01 -1.26 -1.20 120.40 128.59 1hwp s VAL 225 Ca 0.05 -1.54 -0.24 0.00 0.00 0.00 0.00 61.98 60.25 1hwp s VAL 225 Cb -0.13 -4.73 -0.07 0.00 0.00 0.00 0.00 36.38 31.45 1hwp s VAL 225 CO 0.02 -1.44 0.73 -0.69 0.00 0.00 0.00 175.10 173.72 1hwp s VAL 226 N 2.54 4.48 -0.03 2.92 1.01 -0.56 -2.63 120.40 128.14 1hwp s VAL 226 Ca 0.29 1.59 -0.30 0.00 0.00 0.00 0.00 61.98 63.56 1hwp s VAL 226 Cb -0.07 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.20 1hwp s VAL 226 CO -0.07 0.52 1.00 0.21 0.00 0.00 0.00 175.10 176.76 1hwp s ASN 227 N -1.05 7.32 0.01 3.32 3.84 -0.01 -1.59 114.94 126.77 1hwp s ASN 227 Ca 0.34 1.64 -0.25 0.00 0.21 0.00 0.00 52.86 54.81 1hwp s ASN 227 Cb -0.22 -2.57 -0.17 0.00 -0.55 0.00 0.00 41.25 37.74 1hwp s ASN 227 CO 0.24 -0.33 1.31 -0.07 -2.79 0.00 0.00 177.10 175.46 1hwp h LEU 228 N 7.15 -0.21 0.16 3.21 3.38 -1.85 -3.31 115.31 123.84 1hwp h LEU 228 Ca -0.38 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.35 1hwp h LEU 228 Cb 1.20 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.97 1hwp h LEU 228 CO 0.78 0.14 -0.40 0.50 0.09 0.00 0.00 178.44 179.56 1hwp h LYS 229 N -0.59 -0.60 -5.08 1.13 1.63 -1.81 -3.37 116.57 107.88 1hwp h LYS 229 Ca -0.03 0.04 -0.63 0.00 -0.85 0.00 0.00 60.65 59.19 1hwp h LYS 229 Cb 0.44 0.14 -0.15 0.00 -0.60 0.00 0.00 32.23 32.05 1hwp h LYS 229 CO 0.04 -0.40 -0.38 -1.54 -3.45 0.00 0.00 179.45 173.73 1hwp s SER 230 N -4.05 6.17 0.00 4.20 1.04 -1.25 -4.94 113.70 114.87 1hwp s SER 230 Ca -0.13 0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.48 1hwp s SER 230 Cb 0.04 -2.16 0.00 0.00 0.10 0.00 0.00 66.02 64.00 1hwp s SER 230 CO 0.46 -0.08 0.39 0.35 0.98 0.00 0.00 173.24 175.33 1hwp n THR 231 N 4.88 0.21 -2.14 2.02 -2.24 -1.25 -3.99 114.28 111.77 1hwp n THR 231 Ca -0.11 0.09 -0.37 0.00 -2.27 0.00 0.00 64.05 61.39 1hwp n THR 231 Cb 0.51 -1.09 0.01 0.00 -2.10 0.00 0.00 70.33 67.66 1hwp n THR 231 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1hwp s ARG 232 N -1.78 3.44 0.24 -0.78 3.00 -1.26 -4.62 118.95 117.19 1hwp s ARG 232 Ca 0.00 1.82 0.08 0.00 0.00 0.00 0.00 55.73 57.63 1hwp s ARG 232 Cb 0.00 -2.21 -0.04 0.00 0.00 0.00 0.00 34.95 32.70 1hwp s ARG 232 CO 0.00 -0.83 0.03 0.08 0.00 0.00 0.00 175.30 174.58 1hwp s VAL 233 N -1.56 3.70 -0.08 3.52 1.01 -0.75 -0.83 120.40 125.41 1hwp s VAL 233 Ca 0.69 -1.69 -0.25 0.00 0.00 0.00 0.00 61.98 60.73 1hwp s VAL 233 Cb -0.30 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.10 1hwp s VAL 233 CO 0.35 -0.30 0.80 0.00 0.00 0.00 0.00 175.10 175.94 1hwp s MET 234 N -3.51 4.43 0.28 2.72 0.23 -1.08 0.35 119.30 122.72 1hwp s MET 234 Ca 0.31 1.04 0.03 0.00 -1.03 0.00 0.00 55.69 56.03 1hwp s MET 234 Cb -0.07 -3.48 -0.03 0.00 -1.53 0.00 0.00 34.83 29.71 1hwp s MET 234 CO 0.20 -0.06 0.24 0.16 -2.03 0.00 0.00 175.02 173.53 1hwp s ASP 235 N 0.94 0.96 -0.57 -1.18 1.47 0.15 -4.73 116.67 113.70 1hwp s ASP 235 Ca 0.41 -1.56 -0.22 0.00 1.18 0.00 0.00 52.55 52.35 1hwp s ASP 235 Cb -0.18 0.50 0.06 0.00 -0.34 0.00 0.00 42.92 42.95 1hwp s ASP 235 CO 0.19 -1.00 0.85 -0.69 0.68 0.00 0.00 175.17 175.20 1hwp s VAL 236 N -3.72 4.52 -0.45 2.11 1.01 -0.79 -1.24 120.40 121.84 1hwp s VAL 236 Ca 0.39 -0.19 -0.45 0.00 0.00 0.00 0.00 61.98 61.73 1hwp s VAL 236 Cb 0.04 -4.52 -0.19 0.00 0.00 0.00 0.00 36.38 31.71 1hwp s VAL 236 CO 0.20 -1.14 1.75 1.17 0.00 0.00 0.00 175.10 177.09 1hwp n LYS 237 N 7.13 0.25 -0.33 2.72 3.00 -1.06 0.10 118.16 129.97 1hwp n LYS 237 Ca -0.03 0.09 0.00 0.00 -0.00 0.00 0.00 58.31 58.37 1hwp n LYS 237 Cb 0.46 -1.65 0.00 0.00 0.00 0.00 0.00 35.03 33.84 1hwp n LYS 237 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1hwp n GLU 238 N 5.08 0.00 0.00 1.64 1.02 -1.26 -2.52 120.64 124.60 1hwp n GLU 238 Ca 0.35 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.49 1hwp n GLU 238 Cb -0.01 -4.15 0.00 0.00 -0.02 0.00 0.00 31.44 27.26 1hwp n GLU 238 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1hwp n SER 239 N 0.00 0.00 -4.56 1.62 7.64 0.12 -4.95 113.62 113.49 1hwp n SER 239 Ca 0.00 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.63 1hwp n SER 239 Cb 0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.15 1hwp n SER 239 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1hwp s ASP 240 N -0.51 4.81 0.58 6.43 2.15 -1.05 -4.78 116.67 124.31 1hwp s ASP 240 Ca 0.00 -0.29 0.28 0.00 0.43 0.00 0.00 52.55 52.98 1hwp s ASP 240 Cb 0.00 -2.55 1.53 0.00 -0.30 0.00 0.00 42.92 41.60 1hwp s ASP 240 CO 0.00 -2.99 1.99 0.58 -0.17 0.00 0.00 175.17 174.57 1hwp h VAL 241 N 7.35 0.45 0.00 1.11 2.07 -1.93 -0.47 116.25 124.83 1hwp h VAL 241 Ca 0.01 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 1hwp h VAL 241 Cb 1.04 0.72 -0.00 0.00 -1.52 0.00 0.00 31.29 31.52 1hwp h VAL 241 CO 1.16 0.00 -0.11 0.77 0.02 0.00 0.00 177.57 179.41 1hwp h SER 242 N 0.00 0.00 -0.01 0.57 4.64 -1.93 -1.53 113.55 115.29 1hwp h SER 242 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1hwp h SER 242 Cb 0.89 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.98 1hwp h SER 242 CO -0.00 0.11 0.08 -0.07 -0.87 0.00 0.00 176.83 176.08 1hwp h LEU 243 N 0.00 0.00 -2.64 5.97 3.38 -1.43 -3.46 115.31 117.13 1hwp h LEU 243 Ca -0.00 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.67 1hwp h LEU 243 Cb 0.20 0.00 0.17 0.00 0.09 0.00 0.00 40.66 41.12 1hwp h LEU 243 CO 0.01 0.00 -0.88 0.00 0.09 0.00 0.00 178.44 177.66 1hwp n GLN 244 N -3.09 -2.02 -3.56 1.13 6.02 -0.58 -5.02 117.38 110.26 1hwp n GLN 244 Ca -0.03 0.76 -0.01 0.00 -0.01 0.00 0.00 57.00 57.71 1hwp n GLN 244 Cb 0.14 -5.39 -0.05 0.00 1.02 0.00 0.00 30.24 25.96 1hwp n GLN 244 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 1hwp s GLU 245 N -4.82 0.42 -0.11 -1.09 -1.05 -1.26 -4.72 118.70 106.07 1hwp s GLU 245 Ca 0.46 0.87 -0.03 0.00 -0.15 0.00 0.00 54.97 56.12 1hwp s GLU 245 Cb -0.09 0.32 -0.03 0.00 -0.44 0.00 0.00 34.13 33.88 1hwp s GLU 245 CO 0.77 -0.11 -0.01 0.08 0.95 0.00 0.00 175.26 176.94 1hwp s VAL 246 N 1.96 4.22 0.38 1.83 1.01 -1.18 -2.57 120.40 126.04 1hwp s VAL 246 Ca -0.07 -0.27 0.06 0.00 0.00 0.00 0.00 61.98 61.71 1hwp s VAL 246 Cb -0.06 -2.80 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 1hwp s VAL 246 CO -0.17 0.56 0.23 0.27 0.00 0.00 0.00 175.10 175.99 1hwp s ILE 247 N -0.43 0.20 -0.05 2.22 -4.36 -0.37 -1.68 121.20 116.72 1hwp s ILE 247 Ca 0.08 -2.00 -0.14 0.00 -0.26 0.00 0.00 60.65 58.33 1hwp s ILE 247 Cb -0.12 -2.40 -0.05 0.00 1.25 0.00 0.00 42.46 41.14 1hwp s ILE 247 CO 0.02 0.00 0.35 0.27 0.24 0.00 0.00 174.94 175.83 1hwp s ILE 248 N -3.29 5.15 -0.17 8.37 -4.36 -0.68 0.30 121.20 126.51 1hwp s ILE 248 Ca 0.33 0.71 -0.28 0.00 -0.26 0.00 0.00 60.65 61.15 1hwp s ILE 248 Cb 0.02 -3.66 0.08 0.00 1.25 0.00 0.00 42.46 40.14 1hwp s ILE 248 CO 0.23 0.54 0.74 0.12 0.24 0.00 0.00 174.94 176.82 1hwp s PHE 249 N -0.73 -0.69 -0.10 1.37 5.36 0.15 -0.25 117.98 123.10 1hwp s PHE 249 Ca 0.21 1.47 -0.40 0.00 -0.96 0.00 0.00 56.93 57.25 1hwp s PHE 249 Cb -0.15 0.34 -0.19 0.00 -0.34 0.00 0.00 43.02 42.69 1hwp s PHE 249 CO 0.10 -0.46 1.32 -0.35 -1.46 0.00 0.00 175.22 174.37 1hwp n PRO 250 N 1.81 0.46 -1.68 10.12 -0.04 -1.26 -1.81 135.00 142.60 1hwp n PRO 250 Ca -0.16 0.17 -0.49 0.00 -0.04 0.00 0.00 63.50 62.98 1hwp n PRO 250 Cb 0.56 -1.73 -0.05 0.00 -0.04 0.00 0.00 33.50 32.24 1hwp n PRO 250 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1hwp n ALA 251 N 2.69 0.78 0.30 0.55 0.00 -1.26 -4.84 120.51 118.72 1hwp n ALA 251 Ca 0.22 0.31 0.05 0.00 0.00 0.00 0.00 53.44 54.03 1hwp n ALA 251 Cb 0.09 -2.45 -0.07 0.00 0.00 0.00 0.00 19.45 17.02 1hwp n ALA 251 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1hwp n THR 252 N 4.91 0.00 -1.10 0.00 -2.24 -1.26 -4.99 114.28 109.60 1hwp n THR 252 Ca 0.23 -0.25 -0.03 0.00 -2.27 0.00 0.00 64.05 61.72 1hwp n THR 252 Cb 0.27 0.68 -0.01 0.00 -2.10 0.00 0.00 70.33 69.17 1hwp n THR 252 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hwp n GLY 253 N 1.51 0.64 3.96 3.38 0.00 -1.26 -5.03 105.19 108.39 1hwp n GLY 253 Ca 0.00 -0.79 -0.24 0.00 0.00 0.00 0.00 46.02 44.99 1hwp n GLY 253 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hwp s ASN 254 N -2.84 6.33 0.49 1.61 0.01 -1.26 -5.02 114.94 114.26 1hwp s ASN 254 Ca 0.00 0.14 0.22 0.00 -0.71 0.00 0.00 52.86 52.51 1hwp s ASN 254 Cb 0.00 -1.89 1.27 0.00 0.41 0.00 0.00 41.25 41.04 1hwp s ASN 254 CO 0.00 -0.01 1.96 1.55 -1.51 0.00 0.00 177.10 179.09 1hwp h PRO 255 N 1.71 0.16 0.00 -0.60 0.13 -1.96 -1.81 132.00 129.62 1hwp h PRO 255 Ca -0.50 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1hwp h PRO 255 Cb 1.21 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1hwp h PRO 255 CO 0.65 0.11 0.00 0.27 -0.23 0.00 0.00 178.00 178.80 1hwp n ASN 256 N -4.41 0.00 0.00 1.44 6.94 -1.26 -1.00 115.26 116.97 1hwp n ASN 256 Ca 0.12 -0.66 0.00 0.00 -0.02 0.00 0.00 54.58 54.02 1hwp n ASN 256 Cb 0.61 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.03 1hwp n ASN 256 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1hwp n GLN 257 N -0.76 0.48 -3.09 -3.83 6.02 -0.68 -1.89 117.38 113.63 1hwp n GLN 257 Ca 0.06 -0.34 -0.36 0.00 -0.01 0.00 0.00 57.00 56.34 1hwp n GLN 257 Cb 0.03 -0.83 -0.06 0.00 1.02 0.00 0.00 30.24 30.40 1hwp n GLN 257 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1hwp s GLN 258 N -0.17 4.26 -0.04 -1.09 -0.21 -0.17 -4.38 119.66 117.86 1hwp s GLN 258 Ca 0.00 0.89 -0.04 0.00 0.02 0.00 0.00 55.36 56.23 1hwp s GLN 258 Cb 0.00 -2.86 0.01 0.00 1.00 0.00 0.00 33.01 31.16 1hwp s GLN 258 CO 0.00 0.38 0.11 -1.58 -2.12 0.00 0.00 175.29 172.08 1hwp s TRP 259 N -1.54 -0.12 -0.17 0.91 0.52 0.37 -4.15 118.94 114.75 1hwp s TRP 259 Ca 0.44 0.31 0.01 0.00 0.02 0.00 0.00 56.10 56.87 1hwp s TRP 259 Cb -0.17 0.02 0.02 0.00 -1.15 0.00 0.00 33.47 32.20 1hwp s TRP 259 CO 0.21 -0.07 -0.19 0.50 0.02 0.00 0.00 176.95 177.42 1hwp s ARG 260 N 0.20 2.85 -0.60 4.98 6.06 0.61 -4.73 118.95 128.31 1hwp s ARG 260 Ca -0.01 -0.78 -0.22 0.00 -2.50 0.00 0.00 55.73 52.22 1hwp s ARG 260 Cb -0.02 -2.47 0.07 0.00 0.06 0.00 0.00 34.95 32.58 1hwp s ARG 260 CO -0.01 -0.21 0.88 -0.08 -2.50 0.00 0.00 175.30 173.38 1hwp s THR 261 N 1.32 4.48 -0.04 4.11 -1.32 -1.26 -1.45 115.64 121.47 1hwp s THR 261 Ca 0.05 -0.32 -0.12 0.00 -1.21 0.00 0.00 61.69 60.09 1hwp s THR 261 Cb -0.13 -4.57 -0.05 0.00 -1.51 0.00 0.00 72.50 66.24 1hwp s THR 261 CO -0.12 -1.25 0.32 -1.10 -2.21 0.00 0.00 174.62 170.26 1hwp s GLN 262 N 3.66 3.78 0.46 7.08 -1.52 -0.76 -4.90 119.66 127.47 1hwp s GLN 262 Ca 0.22 0.23 -0.04 0.00 -1.95 0.00 0.00 55.36 53.82 1hwp s GLN 262 Cb -0.17 -3.22 0.06 0.00 -0.22 0.00 0.00 33.01 29.46 1hwp s GLN 262 CO 0.12 0.70 0.13 1.33 -0.25 0.00 0.00 175.29 177.32 1hwp n VAL 263 N 1.94 0.00 0.00 1.09 0.24 -1.26 -1.19 118.33 119.15 1hwp n VAL 263 Ca -0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 1hwp n VAL 263 Cb 0.53 -0.15 0.00 0.00 -1.47 0.00 0.00 33.84 32.75 1hwp n VAL 263 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04