#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w3t s GLU 3 N 0.00 1.29 -0.18 0.54 2.02 0.11 -4.91 118.70 117.56 1w3t s GLU 3 Ca 0.00 -1.42 -0.03 0.00 0.02 0.00 0.00 54.97 53.54 1w3t s GLU 3 Cb 0.00 -1.34 -0.01 0.00 0.10 0.00 0.00 34.13 32.87 1w3t s GLU 3 CO 0.00 0.27 -0.06 0.42 0.02 0.00 0.00 175.26 175.91 1w3t s ILE 4 N -2.08 3.41 -0.12 -1.63 -1.09 -1.26 -1.79 121.20 116.63 1w3t s ILE 4 Ca 0.16 -0.51 0.00 0.00 -2.23 0.00 0.00 60.65 58.08 1w3t s ILE 4 Cb -0.06 -2.51 -0.01 0.00 -1.58 0.00 0.00 42.46 38.30 1w3t s ILE 4 CO 0.07 0.46 -0.14 -0.63 -1.23 0.00 0.00 174.94 173.47 1w3t s ILE 5 N 0.95 2.99 -0.19 2.92 1.01 -0.03 -1.36 121.20 127.49 1w3t s ILE 5 Ca -0.01 -0.69 -0.18 0.00 0.00 0.00 0.00 60.65 59.78 1w3t s ILE 5 Cb -0.15 -2.24 -0.03 0.00 0.01 0.00 0.00 42.46 40.05 1w3t s ILE 5 CO 0.00 0.53 0.49 -0.89 0.00 0.00 0.00 174.94 175.07 1w3t s THR 6 N 0.27 5.13 -0.86 2.92 2.01 -0.62 -1.73 115.64 122.76 1w3t s THR 6 Ca -0.10 0.89 -0.25 0.00 0.31 0.00 0.00 61.69 62.55 1w3t s THR 6 Cb -0.16 -3.81 0.05 0.00 0.01 0.00 0.00 72.50 68.59 1w3t s THR 6 CO 0.06 0.21 1.32 -2.16 -0.69 0.00 0.00 174.62 173.35 1w3t s PRO 7 N 1.49 3.37 0.23 4.92 0.04 -1.26 0.04 135.00 143.83 1w3t s PRO 7 Ca 0.23 -0.72 -0.30 0.00 0.04 0.00 0.00 61.00 60.26 1w3t s PRO 7 Cb -0.15 -4.71 -0.09 0.00 0.04 0.00 0.00 34.50 29.59 1w3t s PRO 7 CO 0.09 -2.13 1.22 -1.50 0.04 0.00 0.00 177.00 174.72 1w3t s ILE 8 N 5.17 3.34 0.39 0.56 2.07 -0.85 -4.40 121.20 127.47 1w3t s ILE 8 Ca 0.39 1.19 -0.26 0.00 -1.41 0.00 0.00 60.65 60.55 1w3t s ILE 8 Cb -0.05 -3.76 -0.09 0.00 0.13 0.00 0.00 42.46 38.69 1w3t s ILE 8 CO 0.03 0.22 1.30 -0.63 -1.91 0.00 0.00 174.94 173.95 1w3t s ILE 9 N -0.42 2.65 -0.33 2.00 1.01 -1.26 -3.29 121.20 121.56 1w3t s ILE 9 Ca 0.51 0.60 -0.14 0.00 0.00 0.00 0.00 60.65 61.62 1w3t s ILE 9 Cb -0.34 -3.36 -0.02 0.00 0.01 0.00 0.00 42.46 38.75 1w3t s ILE 9 CO 0.40 0.10 0.30 -0.89 0.00 0.00 0.00 174.94 174.86 1w3t s THR 10 N -1.24 5.22 0.17 2.92 2.01 -1.26 -4.92 115.64 118.55 1w3t s THR 10 Ca 0.55 -0.02 -0.27 0.00 0.31 0.00 0.00 61.69 62.26 1w3t s THR 10 Cb -0.38 -3.76 -0.08 0.00 0.01 0.00 0.00 72.50 68.29 1w3t s THR 10 CO 0.49 -0.03 0.85 -2.16 -0.69 0.00 0.00 174.62 173.08 1w3t s PRO 11 N 1.89 4.67 0.15 4.92 0.04 -1.26 -4.80 135.00 140.61 1w3t s PRO 11 Ca 0.09 1.28 0.09 0.00 0.04 0.00 0.00 61.00 62.51 1w3t s PRO 11 Cb -0.17 -3.29 -0.04 0.00 0.04 0.00 0.00 34.50 31.04 1w3t s PRO 11 CO 0.11 0.50 -0.13 -0.06 0.04 0.00 0.00 177.00 177.45 1w3t s PHE 12 N -0.96 2.59 0.86 0.56 0.40 -0.38 -0.61 117.98 120.44 1w3t s PHE 12 Ca 0.39 -0.24 -0.13 0.00 -0.60 0.00 0.00 56.93 56.35 1w3t s PHE 12 Cb -0.24 -1.31 0.12 0.00 0.51 0.00 0.00 43.02 42.10 1w3t s PHE 12 CO 0.28 0.46 1.22 0.95 0.70 0.00 0.00 175.22 178.84 1w3t s THR 13 N -1.46 2.00 0.32 0.64 -4.23 0.12 -1.22 115.64 111.81 1w3t s THR 13 Ca 0.22 -0.01 0.09 0.00 -1.18 0.00 0.00 61.69 60.81 1w3t s THR 13 Cb -0.10 -3.00 0.32 0.00 1.34 0.00 0.00 72.50 71.06 1w3t s THR 13 CO 0.13 0.00 1.77 0.50 -0.54 0.00 0.00 174.62 176.48 1w3t h LYS 14 N -1.24 0.64 -0.99 3.99 3.64 -1.96 -0.91 116.57 119.72 1w3t h LYS 14 Ca -0.45 -0.04 -0.37 0.00 -1.27 0.00 0.00 60.65 58.51 1w3t h LYS 14 Cb 1.30 -0.14 -0.22 0.00 -0.41 0.00 0.00 32.23 32.75 1w3t h LYS 14 CO 0.57 0.42 0.48 -0.40 -2.27 0.00 0.00 179.45 178.24 1w3t n ASP 15 N -4.77 3.57 -1.83 4.20 3.85 -1.26 -4.93 116.55 115.37 1w3t n ASP 15 Ca 0.24 -3.17 -0.14 0.00 -0.71 0.00 0.00 54.79 51.01 1w3t n ASP 15 Cb 0.66 -0.75 0.01 0.00 -1.35 0.00 0.00 41.12 39.69 1w3t n ASP 15 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 1w3t n ASN 16 N -0.69 -4.42 -4.61 -1.12 5.15 -0.35 -5.02 115.26 104.21 1w3t n ASN 16 Ca 0.44 -0.11 -0.24 0.00 -0.60 0.00 0.00 54.58 54.07 1w3t n ASN 16 Cb 1.36 -3.43 -0.08 0.00 -0.53 0.00 0.00 39.78 37.09 1w3t n ASN 16 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1w3t s ARG 17 N -5.01 2.17 0.17 1.20 0.52 -1.26 -4.87 118.95 111.88 1w3t s ARG 17 Ca 0.11 -1.42 -0.32 0.00 -0.52 0.00 0.00 55.73 53.58 1w3t s ARG 17 Cb -0.05 -2.12 -0.11 0.00 0.52 0.00 0.00 34.95 33.20 1w3t s ARG 17 CO 0.13 0.38 1.64 0.42 0.02 0.00 0.00 175.30 177.89 1w3t s ILE 18 N -2.20 2.43 -0.90 1.52 1.01 -1.26 0.13 121.20 121.92 1w3t s ILE 18 Ca 0.30 0.27 -0.18 0.00 0.00 0.00 0.00 60.65 61.03 1w3t s ILE 18 Cb -0.07 -3.17 0.14 0.00 0.01 0.00 0.00 42.46 39.36 1w3t s ILE 18 CO 0.18 0.02 1.07 -0.62 0.00 0.00 0.00 174.94 175.59 1w3t s ASP 19 N 1.33 6.61 0.32 3.58 -1.08 0.22 -4.76 116.67 122.88 1w3t s ASP 19 Ca 0.73 -2.04 -0.00 0.00 -0.52 0.00 0.00 52.55 50.71 1w3t s ASP 19 Cb -0.46 -2.38 0.52 0.00 -1.46 0.00 0.00 42.92 39.15 1w3t s ASP 19 CO 0.32 -1.03 1.98 0.11 0.52 0.00 0.00 175.17 177.07 1w3t h LYS 20 N 8.77 0.98 -0.19 4.34 1.57 -1.92 -1.79 116.57 128.33 1w3t h LYS 20 Ca 0.12 -0.06 -0.19 0.00 -1.87 0.00 0.00 60.65 58.64 1w3t h LYS 20 Cb 1.03 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.12 1w3t h LYS 20 CO 1.08 0.65 -0.65 0.93 -0.57 0.00 0.00 179.45 180.89 1w3t h GLU 21 N 1.01 0.72 -0.67 3.15 4.39 -1.98 -1.29 114.58 119.90 1w3t h GLU 21 Ca 0.27 -0.51 -0.04 0.00 0.34 0.00 0.00 59.36 59.42 1w3t h GLU 21 Cb -0.11 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 28.59 1w3t h GLU 21 CO -0.06 1.13 0.25 0.87 -1.16 0.00 0.00 179.01 180.05 1w3t h LYS 22 N 0.52 1.00 -0.40 2.33 1.57 -1.84 -2.29 116.57 117.47 1w3t h LYS 22 Ca -0.01 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.57 1w3t h LYS 22 Cb 1.25 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 33.37 1w3t h LYS 22 CO 0.13 0.83 0.18 1.25 -0.57 0.00 0.00 179.45 181.26 1w3t h LEU 23 N 0.98 0.54 -0.53 2.94 6.46 -1.09 -1.97 115.31 122.64 1w3t h LEU 23 Ca 0.23 -0.15 -0.02 0.00 -0.12 0.00 0.00 57.88 57.82 1w3t h LEU 23 Cb 0.21 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 39.98 1w3t h LEU 23 CO -0.02 0.54 0.26 0.11 -0.62 0.00 0.00 178.44 178.71 1w3t h LYS 24 N 0.50 0.76 -0.65 1.25 1.57 -1.11 0.46 116.57 119.34 1w3t h LYS 24 Ca 0.13 -0.11 0.02 0.00 -1.87 0.00 0.00 60.65 58.83 1w3t h LYS 24 Cb 0.15 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.29 1w3t h LYS 24 CO -0.01 0.62 0.41 0.82 -0.57 0.00 0.00 179.45 180.72 1w3t h ILE 25 N 0.71 1.11 0.04 1.86 2.04 -1.24 -0.48 117.51 121.54 1w3t h ILE 25 Ca 0.18 -0.28 -0.00 0.00 1.00 0.00 0.00 64.86 65.76 1w3t h ILE 25 Cb 0.11 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 36.40 1w3t h ILE 25 CO -0.02 0.15 -0.02 -0.74 0.00 0.00 0.00 178.15 177.52 1w3t h HIS 26 N 0.82 -0.05 -0.54 1.37 2.76 -1.05 -1.90 115.15 116.56 1w3t h HIS 26 Ca 0.26 -0.00 0.10 0.00 -2.20 0.00 0.00 60.37 58.52 1w3t h HIS 26 Cb -0.01 0.02 -0.08 0.00 1.55 0.00 0.00 27.41 28.89 1w3t h HIS 26 CO -0.04 0.33 0.12 0.00 -1.30 0.00 0.00 177.93 177.03 1w3t h ALA 27 N 0.48 0.62 -0.31 5.26 0.00 -0.75 -0.99 119.26 123.58 1w3t h ALA 27 Ca -0.01 0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1w3t h ALA 27 Cb 0.41 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1w3t h ALA 27 CO 0.01 -0.30 0.16 1.49 0.00 0.00 0.00 179.25 180.61 1w3t h GLU 28 N 0.25 0.31 -0.97 0.00 4.81 -1.04 -2.39 114.58 115.55 1w3t h GLU 28 Ca 0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1w3t h GLU 28 Cb 0.38 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.64 1w3t h GLU 28 CO -0.35 0.21 0.62 -0.97 -0.73 0.00 0.00 179.01 177.78 1w3t h ASN 29 N 0.32 1.13 0.42 1.04 -1.24 -0.82 -1.60 115.58 114.84 1w3t h ASN 29 Ca 0.13 -0.05 -0.02 0.00 0.71 0.00 0.00 56.30 57.07 1w3t h ASN 29 Cb 0.04 -0.28 0.00 0.00 0.73 0.00 0.00 38.32 38.81 1w3t h ASN 29 CO -0.08 0.84 -0.20 -0.07 -1.29 0.00 0.00 177.43 176.63 1w3t h LEU 30 N 1.32 -0.48 -0.54 0.34 3.38 -0.93 -0.21 115.31 118.18 1w3t h LEU 30 Ca 0.35 -0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.39 1w3t h LEU 30 Cb -0.11 0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.68 1w3t h LEU 30 CO -0.07 -0.28 0.07 0.40 0.09 0.00 0.00 178.44 178.65 1w3t h ILE 31 N -0.65 0.64 0.00 1.22 1.08 -1.36 -1.75 117.51 116.68 1w3t h ILE 31 Ca -0.06 -0.07 -0.01 0.00 -0.39 0.00 0.00 64.86 64.34 1w3t h ILE 31 Cb 0.48 0.42 -0.00 0.00 -3.07 0.00 0.00 36.82 34.66 1w3t h ILE 31 CO 0.10 0.04 -0.03 0.03 -0.69 0.00 0.00 178.15 177.59 1w3t h ARG 32 N 0.20 0.00 -0.32 2.37 3.08 -1.02 -0.96 114.38 117.73 1w3t h ARG 32 Ca 0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.33 1w3t h ARG 32 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 1w3t h ARG 32 CO -0.40 0.03 0.00 1.63 -1.07 0.00 0.00 179.97 180.16 1w3t n LYS 33 N -4.21 1.96 0.00 0.04 5.02 -0.12 -4.92 118.16 115.93 1w3t n LYS 33 Ca -0.03 -1.47 0.00 0.00 -2.02 0.00 0.00 58.31 54.80 1w3t n LYS 33 Cb 0.12 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 1w3t n LYS 33 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1w3t n GLY 34 N 1.21 0.78 3.76 0.72 0.00 -0.36 -4.62 105.19 106.68 1w3t n GLY 34 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1w3t n GLY 34 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1w3t s ILE 35 N -2.00 2.61 0.01 -0.61 -1.09 -0.78 -4.90 121.20 114.45 1w3t s ILE 35 Ca 0.00 0.57 -0.18 0.00 -2.23 0.00 0.00 60.65 58.81 1w3t s ILE 35 Cb 0.00 -3.36 -0.30 0.00 -1.58 0.00 0.00 42.46 37.22 1w3t s ILE 35 CO 0.00 0.12 1.02 0.44 -1.23 0.00 0.00 174.94 175.29 1w3t h ASP 36 N 4.02 0.68 -5.20 3.58 3.32 -1.56 -3.41 116.42 117.85 1w3t h ASP 36 Ca -0.48 -0.87 -0.08 0.00 0.02 0.00 0.00 57.03 55.62 1w3t h ASP 36 Cb 1.22 -0.22 -0.12 0.00 0.22 0.00 0.00 39.33 40.44 1w3t h ASP 36 CO 0.70 1.49 -0.23 -0.54 -1.72 0.00 0.00 179.24 178.93 1w3t s LYS 37 N -2.80 1.17 -0.11 3.56 1.02 -1.24 -4.91 119.74 116.43 1w3t s LYS 37 Ca -0.11 -1.06 0.03 0.00 0.02 0.00 0.00 55.97 54.84 1w3t s LYS 37 Cb 0.03 0.41 -0.00 0.00 -0.52 0.00 0.00 37.83 37.75 1w3t s LYS 37 CO 0.88 -0.45 -0.21 -0.51 -0.92 0.00 0.00 175.35 174.14 1w3t s LEU 38 N -2.93 2.23 -0.37 3.17 1.43 0.53 -1.59 118.68 121.16 1w3t s LEU 38 Ca 0.14 -0.52 -0.15 0.00 -1.03 0.00 0.00 54.13 52.57 1w3t s LEU 38 Cb 0.02 -1.46 -0.00 0.00 0.03 0.00 0.00 46.19 44.78 1w3t s LEU 38 CO -0.02 0.15 0.34 0.12 0.23 0.00 0.00 176.35 177.16 1w3t s PHE 39 N 0.44 3.21 -0.15 0.29 5.36 0.11 -0.27 117.98 126.96 1w3t s PHE 39 Ca -0.15 -0.21 -0.05 0.00 -0.96 0.00 0.00 56.93 55.56 1w3t s PHE 39 Cb -0.17 -2.65 -0.04 0.00 -0.34 0.00 0.00 43.02 39.82 1w3t s PHE 39 CO 0.06 -0.48 0.03 0.08 -1.46 0.00 0.00 175.22 173.45 1w3t s VAL 40 N 1.92 4.54 -0.65 3.12 1.01 0.83 -2.01 120.40 129.16 1w3t s VAL 40 Ca 0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 61.98 61.93 1w3t s VAL 40 Cb -0.17 -3.00 0.00 0.00 0.00 0.00 0.00 36.38 33.21 1w3t s VAL 40 CO 0.11 0.51 0.07 0.59 0.00 0.00 0.00 175.10 176.39 1w3t n ASN 41 N 3.11 -3.00 -2.44 3.32 3.02 -1.26 -0.67 115.26 117.34 1w3t n ASN 41 Ca -0.17 -0.04 -0.06 0.00 -0.03 0.00 0.00 54.58 54.28 1w3t n ASN 41 Cb 0.53 -2.18 0.04 0.00 -0.61 0.00 0.00 39.78 37.55 1w3t n ASN 41 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1w3t n GLY 42 N -1.02 -0.46 0.09 7.41 0.00 -1.26 -3.91 105.19 106.04 1w3t n GLY 42 Ca -0.08 -1.79 -0.09 0.00 0.00 0.00 0.00 46.02 44.06 1w3t n GLY 42 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1w3t h THR 43 N -0.88 0.87 -0.31 2.61 2.02 -1.95 0.06 112.91 115.33 1w3t h THR 43 Ca -0.08 -0.01 0.02 0.00 0.77 0.00 0.00 66.41 67.11 1w3t h THR 43 Cb 0.24 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 1w3t h THR 43 CO 0.07 0.01 0.21 0.74 0.37 0.00 0.00 175.52 176.91 1w3t h THR 44 N 0.04 1.02 -0.15 3.16 2.02 -1.90 0.17 112.91 117.28 1w3t h THR 44 Ca 0.08 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1w3t h THR 44 Cb 0.10 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.18 1w3t h THR 44 CO -0.14 0.06 0.00 0.61 0.37 0.00 0.00 175.52 176.42 1w3t n GLY 45 N -1.51 -0.25 3.26 2.16 0.00 -0.90 -4.36 105.19 103.60 1w3t n GLY 45 Ca 0.02 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.61 1w3t n GLY 45 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1w3t n LEU 46 N -0.06 -2.91 -0.21 0.99 4.77 0.60 -4.08 117.00 116.10 1w3t n LEU 46 Ca 0.08 -0.39 0.02 0.00 -0.03 0.00 0.00 56.01 55.68 1w3t n LEU 46 Cb 0.15 -2.97 0.12 0.00 -2.33 0.00 0.00 43.42 38.39 1w3t n LEU 46 CO 0.05 0.39 0.91 1.23 -1.33 0.00 0.00 177.39 178.64 1w3t h GLY 47 N -1.87 0.80 1.76 -0.72 0.00 -1.12 0.45 103.07 102.37 1w3t h GLY 47 Ca -0.55 -0.01 0.02 0.00 0.00 0.00 0.00 47.33 46.79 1w3t h GLY 47 CO 0.57 -0.15 0.10 -2.55 0.00 0.00 0.00 176.54 174.52 1w3t h PRO 48 N 0.24 0.00 -0.00 4.80 0.11 -1.83 -1.86 132.00 133.45 1w3t h PRO 48 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 1w3t h PRO 48 Cb 0.53 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.64 1w3t h PRO 48 CO -0.45 0.00 -0.07 0.43 -0.21 0.00 0.00 178.00 177.70 1w3t n SER 49 N -3.56 0.45 -4.85 -2.05 7.64 0.14 -4.88 113.62 106.51 1w3t n SER 49 Ca -0.01 -0.69 -0.37 0.00 1.01 0.00 0.00 58.87 58.81 1w3t n SER 49 Cb 0.19 -0.07 -0.07 0.00 -1.01 0.00 0.00 64.21 63.25 1w3t n SER 49 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1w3t s LEU 50 N -2.36 4.31 0.93 -3.43 1.43 -0.70 -5.11 118.68 113.75 1w3t s LEU 50 Ca 0.33 0.41 -0.12 0.00 -1.03 0.00 0.00 54.13 53.72 1w3t s LEU 50 Cb 0.20 -2.05 0.15 0.00 0.03 0.00 0.00 46.19 44.52 1w3t s LEU 50 CO 0.44 0.38 1.09 -0.94 0.23 0.00 0.00 176.35 177.56 1w3t s SER 51 N -0.84 3.16 0.31 2.29 1.04 -1.26 -4.80 113.70 113.60 1w3t s SER 51 Ca 0.14 1.36 0.04 0.00 0.48 0.00 0.00 55.95 57.97 1w3t s SER 51 Cb -0.12 -2.04 0.64 0.00 0.10 0.00 0.00 66.02 64.60 1w3t s SER 51 CO 0.03 -2.82 1.87 -0.65 0.98 0.00 0.00 173.24 172.65 1w3t h PRO 52 N -1.67 0.88 -0.55 4.02 0.11 -1.96 -1.38 132.00 131.44 1w3t h PRO 52 Ca -0.51 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.45 1w3t h PRO 52 Cb 1.30 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1w3t h PRO 52 CO 0.56 0.58 -0.04 0.93 -0.21 0.00 0.00 178.00 179.81 1w3t h GLU 53 N 0.90 0.98 -0.23 1.05 3.07 -1.99 -2.51 114.58 115.85 1w3t h GLU 53 Ca 0.45 -0.32 -0.13 0.00 -0.50 0.00 0.00 59.36 58.86 1w3t h GLU 53 Cb 0.48 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.29 1w3t h GLU 53 CO -0.21 0.99 -0.39 0.93 -1.40 0.00 0.00 179.01 178.93 1w3t h GLU 54 N 0.89 0.52 -1.00 2.33 5.08 -1.73 0.25 114.58 120.93 1w3t h GLU 54 Ca 0.15 -0.26 0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1w3t h GLU 54 Cb 0.58 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.78 1w3t h GLU 54 CO 0.03 0.83 0.66 0.87 -1.00 0.00 0.00 179.01 180.40 1w3t h LYS 55 N 0.43 1.29 -0.10 2.33 1.57 -1.00 0.13 116.57 121.21 1w3t h LYS 55 Ca 0.04 -0.08 -0.19 0.00 -1.87 0.00 0.00 60.65 58.55 1w3t h LYS 55 Cb 0.87 -0.29 0.01 0.00 0.08 0.00 0.00 32.23 32.90 1w3t h LYS 55 CO 0.07 0.85 -0.68 1.25 -0.57 0.00 0.00 179.45 180.37 1w3t h LEU 56 N 1.33 0.78 -0.91 2.94 5.85 -1.28 -2.39 115.31 121.61 1w3t h LEU 56 Ca 0.37 -0.66 0.08 0.00 0.84 0.00 0.00 57.88 58.51 1w3t h LEU 56 Cb -0.11 -0.23 -0.07 0.00 0.37 0.00 0.00 40.66 40.62 1w3t h LEU 56 CO -0.09 1.32 0.57 -0.08 -0.34 0.00 0.00 178.44 179.81 1w3t h GLU 57 N 0.30 0.97 -0.47 1.25 4.81 -0.47 -1.00 114.58 119.97 1w3t h GLU 57 Ca -0.06 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 1w3t h GLU 57 Cb 1.33 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 30.47 1w3t h GLU 57 CO 0.14 0.64 0.30 -0.91 -0.73 0.00 0.00 179.01 178.46 1w3t h ASN 58 N 1.00 0.54 -0.05 1.04 2.35 -0.60 -2.01 115.58 117.86 1w3t h ASN 58 Ca 0.41 -0.03 0.02 0.00 -0.55 0.00 0.00 56.30 56.16 1w3t h ASN 58 Cb 0.24 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 1w3t h ASN 58 CO -0.20 0.41 -0.08 0.25 -1.65 0.00 0.00 177.43 176.16 1w3t h LEU 59 N 0.63 -0.23 -0.94 1.61 5.85 -0.85 -1.15 115.31 120.22 1w3t h LEU 59 Ca 0.17 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 1w3t h LEU 59 Cb -0.06 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 1w3t h LEU 59 CO -0.04 -0.11 0.53 0.11 -0.34 0.00 0.00 178.44 178.60 1w3t h LYS 60 N -0.11 1.27 -0.26 1.25 1.57 -1.05 0.30 116.57 119.55 1w3t h LYS 60 Ca 0.05 -0.13 -0.13 0.00 -1.87 0.00 0.00 60.65 58.56 1w3t h LYS 60 Cb 0.18 -0.26 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 1w3t h LYS 60 CO -0.12 0.91 -0.36 0.00 -0.57 0.00 0.00 179.45 179.31 1w3t h ALA 61 N 1.30 0.39 -0.45 3.86 0.00 -1.13 -2.73 119.26 120.50 1w3t h ALA 61 Ca 0.33 -0.43 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1w3t h ALA 61 Cb -0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1w3t h ALA 61 CO -0.06 0.46 -0.20 0.28 0.00 0.00 0.00 179.25 179.73 1w3t h VAL 62 N 0.43 1.27 -0.55 0.00 2.07 -0.72 -2.72 116.25 116.03 1w3t h VAL 62 Ca 0.03 -1.36 0.16 0.00 0.82 0.00 0.00 66.70 66.35 1w3t h VAL 62 Cb 0.95 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.88 1w3t h VAL 62 CO 0.08 0.46 0.45 0.22 0.02 0.00 0.00 177.57 178.80 1w3t h TYR 63 N 0.78 0.00 -0.19 1.57 3.20 -0.36 0.19 116.97 122.16 1w3t h TYR 63 Ca 0.10 0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.03 1w3t h TYR 63 Cb 0.77 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.04 1w3t h TYR 63 CO 0.05 0.00 0.20 -0.44 -1.64 0.00 0.00 178.16 176.33 1w3t h ASP 64 N 0.00 0.00 0.00 -2.11 5.19 -1.16 -3.17 116.42 115.17 1w3t h ASP 64 Ca 0.26 0.00 -0.34 0.00 -0.62 0.00 0.00 57.03 56.33 1w3t h ASP 64 Cb 1.15 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 40.60 1w3t h ASP 64 CO -0.00 0.00 -2.30 0.52 -3.12 0.00 0.00 179.24 174.34 1w3t n VAL 65 N -3.89 1.30 -3.55 -1.35 0.31 0.62 -5.05 118.33 106.73 1w3t n VAL 65 Ca 0.02 -0.57 -0.16 0.00 -0.01 0.00 0.00 64.34 63.62 1w3t n VAL 65 Cb 0.33 -1.13 -0.06 0.00 -0.91 0.00 0.00 33.84 32.07 1w3t n VAL 65 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1w3t s THR 66 N -2.46 0.00 -2.20 2.52 -1.32 -0.86 -5.00 115.64 106.32 1w3t s THR 66 Ca -0.26 0.00 0.18 0.00 -1.21 0.00 0.00 61.69 60.40 1w3t s THR 66 Cb 0.07 -1.00 0.42 0.00 -1.51 0.00 0.00 72.50 70.48 1w3t s THR 66 CO 0.58 0.00 1.44 -0.46 -2.21 0.00 0.00 174.62 173.97 1w3t n ASN 67 N 1.25 2.09 -3.74 8.08 2.04 -1.26 -3.99 115.26 119.73 1w3t n ASN 67 Ca -0.17 -1.85 -0.42 0.00 -0.44 0.00 0.00 54.58 51.70 1w3t n ASN 67 Cb 0.57 -0.19 -0.00 0.00 -2.53 0.00 0.00 39.78 37.63 1w3t n ASN 67 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 1w3t n LYS 68 N 0.61 3.23 -4.67 -3.83 4.76 -1.26 -3.64 118.16 113.36 1w3t n LYS 68 Ca 0.16 -2.93 -0.24 0.00 -2.87 0.00 0.00 58.31 52.43 1w3t n LYS 68 Cb 0.37 -3.11 -0.16 0.00 -1.84 0.00 0.00 35.03 30.29 1w3t n LYS 68 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1w3t s ILE 69 N 2.01 1.20 -0.22 -0.18 1.01 -1.26 -0.34 121.20 123.41 1w3t s ILE 69 Ca 0.46 -0.59 -0.05 0.00 0.00 0.00 0.00 60.65 60.47 1w3t s ILE 69 Cb 0.13 -1.04 -0.02 0.00 0.01 0.00 0.00 42.46 41.54 1w3t s ILE 69 CO -0.06 0.35 -0.00 -0.63 0.00 0.00 0.00 174.94 174.61 1w3t s ILE 70 N 0.11 3.82 -0.42 2.92 1.01 0.63 -1.18 121.20 128.09 1w3t s ILE 70 Ca -0.04 -0.35 -0.15 0.00 0.00 0.00 0.00 60.65 60.11 1w3t s ILE 70 Cb -0.11 -2.74 0.03 0.00 0.01 0.00 0.00 42.46 39.65 1w3t s ILE 70 CO 0.02 0.41 0.33 0.12 0.00 0.00 0.00 174.94 175.81 1w3t s PHE 71 N 1.27 3.24 -0.08 3.97 5.36 -0.30 -0.12 117.98 131.31 1w3t s PHE 71 Ca 0.04 -0.64 -0.28 0.00 -0.96 0.00 0.00 56.93 55.09 1w3t s PHE 71 Cb -0.15 -2.72 -0.02 0.00 -0.34 0.00 0.00 43.02 39.79 1w3t s PHE 71 CO 0.01 -0.64 0.90 -1.14 -1.46 0.00 0.00 175.22 172.89 1w3t s GLN 72 N 1.70 4.44 0.00 10.12 -0.44 0.16 -0.81 119.66 134.83 1w3t s GLN 72 Ca 0.05 1.22 0.00 0.00 -2.50 0.00 0.00 55.36 54.14 1w3t s GLN 72 Cb -0.20 -3.51 0.00 0.00 -1.64 0.00 0.00 33.01 27.66 1w3t s GLN 72 CO 0.10 -0.17 0.41 1.33 0.50 0.00 0.00 175.29 177.45 1w3t n VAL 73 N 4.26 0.02 -1.38 1.34 0.24 0.23 -4.73 118.33 118.31 1w3t n VAL 73 Ca 0.05 -0.40 -0.30 0.00 -2.04 0.00 0.00 64.34 61.65 1w3t n VAL 73 Cb 0.50 1.20 0.12 0.00 -1.47 0.00 0.00 33.84 34.19 1w3t n VAL 73 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1w3t s GLY 74 N -0.02 1.61 0.00 7.63 0.00 -1.26 -4.44 107.32 110.84 1w3t s GLY 74 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 44.72 44.53 1w3t s GLY 74 CO 0.00 0.29 0.00 0.61 0.00 0.00 0.00 173.10 174.00 1w3t n GLY 75 N -1.63 -1.15 1.18 0.20 0.00 -1.26 -4.95 105.19 97.58 1w3t n GLY 75 Ca 0.07 -0.94 0.12 0.00 0.00 0.00 0.00 46.02 45.26 1w3t n GLY 75 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1w3t n LEU 76 N 0.00 3.47 -4.05 0.99 4.77 -1.26 -4.55 117.00 116.38 1w3t n LEU 76 Ca 0.00 -1.60 -0.32 0.00 -0.03 0.00 0.00 56.01 54.06 1w3t n LEU 76 Cb 0.00 -0.33 -0.14 0.00 -2.33 0.00 0.00 43.42 40.62 1w3t n LEU 76 CO 0.00 0.80 -0.27 0.21 -1.33 0.00 0.00 177.39 176.79 1w3t s ASN 77 N -1.29 4.90 0.38 -1.43 3.84 -1.26 -5.00 114.94 115.07 1w3t s ASN 77 Ca 0.42 -2.16 0.07 0.00 0.21 0.00 0.00 52.86 51.40 1w3t s ASN 77 Cb 0.23 -1.69 0.80 0.00 -0.55 0.00 0.00 41.25 40.04 1w3t s ASN 77 CO 0.31 -0.42 1.97 0.25 -2.79 0.00 0.00 177.10 176.42 1w3t h LEU 78 N 7.69 0.60 -0.88 3.21 5.85 -2.00 -1.39 115.31 128.39 1w3t h LEU 78 Ca -0.07 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.70 1w3t h LEU 78 Cb 1.02 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.87 1w3t h LEU 78 CO 0.58 0.38 0.56 0.44 -0.34 0.00 0.00 178.44 180.07 1w3t h ASP 79 N 0.68 0.93 -0.31 1.25 3.32 -1.97 0.13 116.42 120.44 1w3t h ASP 79 Ca 0.30 -0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.24 1w3t h ASP 79 Cb 0.30 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 1w3t h ASP 79 CO -0.10 0.63 -0.19 0.44 -1.72 0.00 0.00 179.24 178.31 1w3t h ASP 80 N 1.09 0.79 -0.26 6.45 3.32 -1.68 -1.66 116.42 124.46 1w3t h ASP 80 Ca 0.35 -0.27 -0.05 0.00 0.02 0.00 0.00 57.03 57.09 1w3t h ASP 80 Cb 0.03 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 1w3t h ASP 80 CO -0.12 0.97 -0.02 0.00 -1.72 0.00 0.00 179.24 178.34 1w3t h ALA 81 N 1.10 0.35 -0.65 3.45 0.00 -0.90 -1.33 119.26 121.28 1w3t h ALA 81 Ca 0.10 -0.24 0.10 0.00 0.00 0.00 0.00 54.91 54.87 1w3t h ALA 81 Cb 0.69 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.32 1w3t h ALA 81 CO 0.05 0.11 0.27 0.82 0.00 0.00 0.00 179.25 180.50 1w3t h ILE 82 N 0.23 0.79 -0.26 0.00 2.04 -0.71 -0.95 117.51 118.66 1w3t h ILE 82 Ca 0.07 -0.16 0.03 0.00 1.00 0.00 0.00 64.86 65.80 1w3t h ILE 82 Cb 0.46 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 1w3t h ILE 82 CO 0.02 0.09 0.06 -0.09 0.00 0.00 0.00 178.15 178.22 1w3t h ARG 83 N 0.47 0.16 -0.69 2.37 2.43 -1.03 0.71 114.38 118.80 1w3t h ARG 83 Ca 0.32 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.46 1w3t h ARG 83 Cb 0.38 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.87 1w3t h ARG 83 CO -0.30 0.10 0.35 -0.07 -1.51 0.00 0.00 179.97 178.54 1w3t h LEU 84 N 0.16 0.89 0.04 3.80 3.38 -0.87 0.21 115.31 122.92 1w3t h LEU 84 Ca 0.12 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1w3t h LEU 84 Cb 0.11 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1w3t h LEU 84 CO -0.15 0.76 -0.11 0.00 0.09 0.00 0.00 178.44 179.02 1w3t h ALA 85 N 1.17 -0.17 -0.68 1.53 0.00 -0.66 -1.93 119.26 118.53 1w3t h ALA 85 Ca 0.24 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 1w3t h ALA 85 Cb 0.09 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1w3t h ALA 85 CO -0.03 -0.62 0.11 0.87 0.00 0.00 0.00 179.25 179.58 1w3t h LYS 86 N -0.22 1.12 -0.13 0.00 1.57 -0.54 -2.13 116.57 116.24 1w3t h LYS 86 Ca 0.03 -0.30 0.04 0.00 -1.87 0.00 0.00 60.65 58.55 1w3t h LYS 86 Cb 0.25 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1w3t h LYS 86 CO -0.08 1.02 0.13 -0.07 -0.57 0.00 0.00 179.45 179.87 1w3t h LEU 87 N 1.04 0.00 -0.11 2.94 3.38 -0.36 -2.59 115.31 119.62 1w3t h LEU 87 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1w3t h LEU 87 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1w3t h LEU 87 CO 0.01 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 177.00 1w3t n SER 88 N -3.95 0.17 -0.31 -0.43 3.41 -0.75 -3.46 113.62 108.30 1w3t n SER 88 Ca 0.00 0.53 0.23 0.00 -0.26 0.00 0.00 58.87 59.38 1w3t n SER 88 Cb 0.24 -0.57 0.53 0.00 -0.26 0.00 0.00 64.21 64.15 1w3t n SER 88 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1w3t h LYS 89 N 0.00 0.35 -0.18 4.33 3.64 -1.57 -0.76 116.57 122.38 1w3t h LYS 89 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1w3t h LYS 89 Cb 0.37 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1w3t h LYS 89 CO 0.00 0.23 0.00 -0.25 -2.27 0.00 0.00 179.45 177.16 1w3t n ASP 90 N -4.58 1.17 -4.29 4.20 8.00 -1.22 -4.74 116.55 115.08 1w3t n ASP 90 Ca 0.25 -1.82 -0.33 0.00 0.71 0.00 0.00 54.79 53.60 1w3t n ASP 90 Cb 0.88 -0.12 -0.16 0.00 -0.02 0.00 0.00 41.12 41.71 1w3t n ASP 90 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1w3t s PHE 91 N -1.77 2.71 -1.35 1.24 0.40 -0.29 -5.04 117.98 113.88 1w3t s PHE 91 Ca 0.22 -0.87 -0.11 0.00 -0.60 0.00 0.00 56.93 55.57 1w3t s PHE 91 Cb 0.12 -1.80 0.12 0.00 0.51 0.00 0.00 43.02 41.96 1w3t s PHE 91 CO 0.17 -0.34 2.00 -3.47 0.70 0.00 0.00 175.22 174.28 1w3t n ASP 92 N 3.62 4.61 -4.91 1.36 2.03 -1.26 -4.94 116.55 117.06 1w3t n ASP 92 Ca -0.19 -3.00 -0.25 0.00 0.52 0.00 0.00 54.79 51.87 1w3t n ASP 92 Cb 0.53 -1.56 -0.00 0.00 -0.72 0.00 0.00 41.12 39.36 1w3t n ASP 92 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1w3t s ILE 93 N 1.59 1.78 0.08 5.18 -4.36 -1.26 -4.79 121.20 119.43 1w3t s ILE 93 Ca 0.43 -1.45 -0.14 0.00 -0.26 0.00 0.00 60.65 59.23 1w3t s ILE 93 Cb 0.11 -2.23 -0.20 0.00 1.25 0.00 0.00 42.46 41.39 1w3t s ILE 93 CO -0.03 0.00 1.24 0.58 0.24 0.00 0.00 174.94 176.97 1w3t h VAL 94 N 0.75 1.28 -1.44 8.37 2.07 -1.21 -3.48 116.25 122.60 1w3t h VAL 94 Ca -0.37 -2.10 0.39 0.00 0.82 0.00 0.00 66.70 65.45 1w3t h VAL 94 Cb 1.30 2.19 -0.11 0.00 -1.52 0.00 0.00 31.29 33.15 1w3t h VAL 94 CO 0.56 0.65 0.98 -0.83 0.02 0.00 0.00 177.57 178.95 1w3t s GLY 95 N -4.19 -0.38 0.45 2.17 0.00 -1.16 -4.25 107.32 99.96 1w3t s GLY 95 Ca -0.10 0.63 0.07 0.00 0.00 0.00 0.00 44.72 45.32 1w3t s GLY 95 CO 0.91 2.57 0.39 -0.26 0.00 0.00 0.00 173.10 176.71 1w3t s ILE 96 N -2.06 2.38 0.05 0.90 -4.36 -0.32 -1.15 121.20 116.64 1w3t s ILE 96 Ca 0.21 -1.39 -0.14 0.00 -0.26 0.00 0.00 60.65 59.08 1w3t s ILE 96 Cb 0.05 -2.76 0.02 0.00 1.25 0.00 0.00 42.46 41.01 1w3t s ILE 96 CO -0.05 0.00 0.31 0.00 0.24 0.00 0.00 174.94 175.44 1w3t s ALA 97 N -2.56 -0.68 -0.11 2.27 0.00 0.01 0.13 121.76 120.82 1w3t s ALA 97 Ca 0.45 -0.04 -0.10 0.00 0.00 0.00 0.00 51.96 52.27 1w3t s ALA 97 Cb -0.02 0.37 0.03 0.00 0.00 0.00 0.00 23.12 23.49 1w3t s ALA 97 CO 0.27 -0.44 0.30 0.45 0.00 0.00 0.00 175.76 176.33 1w3t s SER 98 N -2.20 -0.31 0.81 0.00 0.15 -0.99 -0.60 113.70 110.56 1w3t s SER 98 Ca -0.03 0.59 -0.12 0.00 0.70 0.00 0.00 55.95 57.09 1w3t s SER 98 Cb -0.00 0.60 0.08 0.00 -1.71 0.00 0.00 66.02 64.99 1w3t s SER 98 CO -0.05 -0.11 1.10 -0.72 1.20 0.00 0.00 173.24 174.67 1w3t s TYR 99 N 0.13 2.79 0.69 3.44 -0.85 -1.25 -1.25 117.35 121.05 1w3t s TYR 99 Ca -0.00 1.11 -0.14 0.00 -0.52 0.00 0.00 57.07 57.51 1w3t s TYR 99 Cb -0.02 -3.16 0.01 0.00 0.38 0.00 0.00 41.96 39.18 1w3t s TYR 99 CO 0.00 -1.84 1.12 0.00 -1.52 0.00 0.00 175.55 173.31 1w3t s ALA 100 N -3.17 2.37 -0.05 9.51 0.00 -1.25 -4.79 121.76 124.38 1w3t s ALA 100 Ca 0.61 0.57 -0.36 0.00 0.00 0.00 0.00 51.96 52.78 1w3t s ALA 100 Cb -0.14 -3.34 -0.14 0.00 0.00 0.00 0.00 23.12 19.49 1w3t s ALA 100 CO 0.54 -1.44 1.66 -2.30 0.00 0.00 0.00 175.76 174.22 1w3t n PRO 101 N -2.61 1.68 -2.07 0.00 -0.02 -1.26 -4.93 135.00 125.79 1w3t n PRO 101 Ca 0.11 0.61 -0.11 0.00 -2.02 0.00 0.00 63.50 62.08 1w3t n PRO 101 Cb 0.52 -2.35 0.04 0.00 -0.02 0.00 0.00 33.50 31.69 1w3t n PRO 101 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 1w3t n TYR 102 N 4.71 -2.67 0.00 6.00 0.18 -1.26 -4.73 117.16 119.38 1w3t n TYR 102 Ca 0.21 -1.18 0.00 0.00 1.88 0.00 0.00 57.90 58.82 1w3t n TYR 102 Cb 0.23 -0.33 0.00 0.00 -0.38 0.00 0.00 39.34 38.86 1w3t n TYR 102 CO 0.00 0.00 0.00 0.98 -2.08 0.00 0.00 176.86 175.76 1w3t n TYR 103 N -1.79 0.00 -2.13 -3.48 9.36 -1.23 -4.89 117.16 112.99 1w3t n TYR 103 Ca 0.09 0.00 -0.42 0.00 3.32 0.00 0.00 57.90 60.89 1w3t n TYR 103 Cb 0.34 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.03 1w3t n TYR 103 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 1w3t s TYR 104 N 0.00 2.38 0.64 2.98 1.51 -1.26 -4.97 117.35 118.62 1w3t s TYR 104 Ca 0.00 0.50 -0.11 0.00 -1.01 0.00 0.00 57.07 56.45 1w3t s TYR 104 Cb 0.00 -3.78 -0.03 0.00 -0.11 0.00 0.00 41.96 38.04 1w3t s TYR 104 CO 0.00 -3.12 1.04 -2.14 -1.11 0.00 0.00 175.55 170.22 1w3t s PRO 105 N 3.46 3.45 -1.40 -1.71 0.02 -1.26 -4.31 135.00 133.24 1w3t s PRO 105 Ca 0.68 0.81 -0.02 0.00 0.02 0.00 0.00 61.00 62.49 1w3t s PRO 105 Cb -0.31 -2.06 0.00 0.00 0.02 0.00 0.00 34.50 32.15 1w3t s PRO 105 CO 0.26 -0.69 0.40 0.54 -0.33 0.00 0.00 177.00 177.18 1w3t n ARG 106 N -2.81 -2.95 -2.46 5.54 1.74 -1.26 -4.98 116.66 109.48 1w3t n ARG 106 Ca 0.06 0.38 -0.40 0.00 -0.77 0.00 0.00 57.85 57.11 1w3t n ARG 106 Cb 0.54 -4.40 -0.04 0.00 -1.02 0.00 0.00 32.46 27.54 1w3t n ARG 106 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 1w3t s MET 107 N -6.61 4.61 0.56 5.56 -1.94 -1.26 -5.02 119.30 115.20 1w3t s MET 107 Ca 0.03 1.82 -0.19 0.00 -1.71 0.00 0.00 55.69 55.63 1w3t s MET 107 Cb -0.01 -3.20 -0.05 0.00 2.01 0.00 0.00 34.83 33.58 1w3t s MET 107 CO 0.90 0.15 1.16 -1.54 -0.01 0.00 0.00 175.02 175.68 1w3t s SER 108 N -0.65 5.51 0.33 3.03 1.04 -1.26 -4.85 113.70 116.84 1w3t s SER 108 Ca 0.46 2.27 0.08 0.00 0.48 0.00 0.00 55.95 59.25 1w3t s SER 108 Cb -0.32 -2.59 0.79 0.00 0.10 0.00 0.00 66.02 64.01 1w3t s SER 108 CO 0.40 -1.37 1.81 -0.08 0.98 0.00 0.00 173.24 174.98 1w3t h GLU 109 N 1.09 0.70 -0.54 4.02 4.81 -1.99 -0.52 114.58 122.15 1w3t h GLU 109 Ca -0.50 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 58.60 1w3t h GLU 109 Cb 1.28 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.48 1w3t h GLU 109 CO 0.56 0.46 -0.00 0.87 -0.73 0.00 0.00 179.01 180.17 1w3t h LYS 110 N 0.72 0.95 -0.15 1.92 1.57 -1.99 0.22 116.57 119.81 1w3t h LYS 110 Ca 0.54 -0.31 -0.18 0.00 -1.87 0.00 0.00 60.65 58.83 1w3t h LYS 110 Cb 0.90 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.12 1w3t h LYS 110 CO -0.31 0.97 -0.64 0.45 -0.57 0.00 0.00 179.45 179.35 1w3t h HIS 111 N 0.83 0.72 -0.36 -1.35 3.86 -1.73 -1.54 115.15 115.58 1w3t h HIS 111 Ca 0.15 -0.28 -0.04 0.00 -1.16 0.00 0.00 60.37 59.04 1w3t h HIS 111 Cb 0.54 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.87 1w3t h HIS 111 CO 0.04 1.04 0.05 -0.07 0.86 0.00 0.00 177.93 179.85 1w3t h LEU 112 N 0.40 0.58 -0.82 2.43 3.38 -0.62 -1.92 115.31 118.75 1w3t h LEU 112 Ca -0.01 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 1w3t h LEU 112 Cb 1.20 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 41.76 1w3t h LEU 112 CO 0.12 0.70 0.46 0.58 0.09 0.00 0.00 178.44 180.39 1w3t h VAL 113 N 0.44 1.24 -0.44 1.22 2.07 -0.47 -2.58 116.25 117.73 1w3t h VAL 113 Ca 0.11 -0.58 -0.12 0.00 0.82 0.00 0.00 66.70 66.93 1w3t h VAL 113 Cb 0.37 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 1w3t h VAL 113 CO 0.01 0.26 -0.20 0.50 0.02 0.00 0.00 177.57 178.16 1w3t h LYS 114 N 1.13 0.86 0.11 1.57 3.64 -1.06 -1.51 116.57 121.31 1w3t h LYS 114 Ca 0.29 -0.35 0.02 0.00 -1.27 0.00 0.00 60.65 59.34 1w3t h LYS 114 Cb 0.01 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.75 1w3t h LYS 114 CO -0.05 0.99 -0.32 -0.92 -2.27 0.00 0.00 179.45 176.88 1w3t h TYR 115 N 0.76 -0.87 -0.57 1.91 3.20 -1.06 -0.45 116.97 119.89 1w3t h TYR 115 Ca 0.11 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 61.91 1w3t h TYR 115 Cb 0.73 0.37 -0.02 0.00 1.54 0.00 0.00 36.73 39.35 1w3t h TYR 115 CO 0.04 -0.42 0.02 0.74 -1.64 0.00 0.00 178.16 176.89 1w3t h PHE 116 N -0.54 1.07 -0.61 -3.82 -1.00 -1.09 -2.72 116.94 108.24 1w3t h PHE 116 Ca 0.03 -0.18 -0.06 0.00 2.81 0.00 0.00 57.97 60.57 1w3t h PHE 116 Cb 0.57 -0.28 -0.03 0.00 3.61 0.00 0.00 35.95 39.82 1w3t h PHE 116 CO -0.29 0.96 0.14 0.87 -1.61 0.00 0.00 178.31 178.38 1w3t h LYS 117 N 0.88 0.96 -0.25 1.51 1.57 -1.24 0.22 116.57 120.20 1w3t h LYS 117 Ca 0.16 -0.21 0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1w3t h LYS 117 Cb 0.52 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.67 1w3t h LYS 117 CO 0.03 0.86 0.06 1.15 -0.57 0.00 0.00 179.45 180.98 1w3t h THR 118 N 0.92 0.90 -0.49 -0.16 2.02 -0.93 0.12 112.91 115.28 1w3t h THR 118 Ca 0.20 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.32 1w3t h THR 118 Cb 0.33 0.72 -0.02 0.00 -1.74 0.00 0.00 68.15 67.44 1w3t h THR 118 CO 0.00 0.03 0.31 -0.07 0.37 0.00 0.00 175.52 176.16 1w3t h LEU 119 N 0.17 0.57 -1.12 2.58 3.38 -1.10 -2.77 115.31 117.02 1w3t h LEU 119 Ca 0.11 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.08 1w3t h LEU 119 Cb 0.10 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 1w3t h LEU 119 CO -0.14 0.44 0.60 0.00 0.09 0.00 0.00 178.44 179.42 1w3t h GLU 121 N 1.17 0.16 -0.01 0.00 5.08 -0.51 -2.97 114.58 117.49 1w3t h GLU 121 Ca 0.35 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1w3t h GLU 121 Cb -0.04 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1w3t h GLU 121 CO -0.10 0.31 -0.63 1.33 -1.00 0.00 0.00 179.01 178.92 1w3t n VAL 122 N -4.29 0.00 -2.33 3.13 0.24 -1.04 -4.97 118.33 109.06 1w3t n VAL 122 Ca -0.01 -0.15 -0.42 0.00 -2.04 0.00 0.00 64.34 61.72 1w3t n VAL 122 Cb 0.26 1.06 -0.03 0.00 -1.47 0.00 0.00 33.84 33.65 1w3t n VAL 122 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1w3t s SER 123 N -2.67 7.01 0.00 -1.34 0.15 -0.63 -4.50 113.70 111.72 1w3t s SER 123 Ca 0.15 2.19 0.23 0.00 0.70 0.00 0.00 55.95 59.22 1w3t s SER 123 Cb 0.17 -2.59 0.94 0.00 -1.71 0.00 0.00 66.02 62.83 1w3t s SER 123 CO 0.67 -0.49 1.66 -0.81 1.20 0.00 0.00 173.24 175.47 1w3t n PRO 124 N 3.39 1.59 -4.32 5.44 -0.04 -1.26 -4.91 135.00 134.88 1w3t n PRO 124 Ca 0.08 -0.88 -0.17 0.00 -0.04 0.00 0.00 63.50 62.49 1w3t n PRO 124 Cb 0.45 -1.41 -0.10 0.00 -0.04 0.00 0.00 33.50 32.39 1w3t n PRO 124 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1w3t s HIS 125 N -1.88 1.54 0.44 0.54 3.76 -1.26 -4.96 115.29 113.47 1w3t s HIS 125 Ca 0.34 -1.04 -0.23 0.00 -0.15 0.00 0.00 55.06 53.98 1w3t s HIS 125 Cb 0.18 -0.91 -0.10 0.00 1.11 0.00 0.00 32.58 32.86 1w3t s HIS 125 CO 0.28 -0.17 0.96 -2.30 -0.85 0.00 0.00 174.74 172.66 1w3t n PRO 126 N -0.44 1.23 -4.73 8.40 -0.02 -1.26 -4.68 135.00 133.50 1w3t n PRO 126 Ca -0.03 0.44 -0.33 0.00 -2.02 0.00 0.00 63.50 61.56 1w3t n PRO 126 Cb 0.65 -2.01 -0.13 0.00 -0.02 0.00 0.00 33.50 31.99 1w3t n PRO 126 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1w3t s VAL 127 N -1.32 3.26 -0.08 -1.45 1.01 -1.26 -1.18 120.40 119.38 1w3t s VAL 127 Ca 0.65 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 62.03 1w3t s VAL 127 Cb -0.54 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.46 1w3t s VAL 127 CO 0.56 0.54 -0.10 -0.31 0.00 0.00 0.00 175.10 175.80 1w3t s TYR 128 N -0.04 2.86 0.00 5.22 1.51 0.12 -1.12 117.35 125.89 1w3t s TYR 128 Ca -0.02 -0.17 -0.26 0.00 -1.01 0.00 0.00 57.07 55.60 1w3t s TYR 128 Cb -0.14 -1.74 -0.04 0.00 -0.11 0.00 0.00 41.96 39.93 1w3t s TYR 128 CO 0.04 0.16 0.82 -1.17 -1.11 0.00 0.00 175.55 174.29 1w3t s LEU 129 N -0.47 4.39 -0.44 -1.29 2.96 -0.22 -2.35 118.68 121.26 1w3t s LEU 129 Ca 0.06 1.45 -0.06 0.00 -0.22 0.00 0.00 54.13 55.36 1w3t s LEU 129 Cb -0.12 -3.31 0.11 0.00 0.50 0.00 0.00 46.19 43.37 1w3t s LEU 129 CO 0.02 -0.11 0.28 -0.47 -1.32 0.00 0.00 176.35 174.74 1w3t s TYR 130 N 0.54 3.49 -0.30 5.38 5.04 -0.38 -0.34 117.35 130.78 1w3t s TYR 130 Ca 0.43 -2.09 -0.17 0.00 -2.44 0.00 0.00 57.07 52.80 1w3t s TYR 130 Cb -0.20 -3.34 -0.02 0.00 0.35 0.00 0.00 41.96 38.75 1w3t s TYR 130 CO 0.23 -0.98 0.47 1.21 -1.34 0.00 0.00 175.55 175.14 1w3t s ASN 131 N 2.27 6.33 -0.43 4.32 2.47 0.38 -3.89 114.94 126.38 1w3t s ASN 131 Ca 0.07 0.21 0.06 0.00 0.42 0.00 0.00 52.86 53.61 1w3t s ASN 131 Cb -0.25 -2.25 0.20 0.00 -1.45 0.00 0.00 41.25 37.50 1w3t s ASN 131 CO -0.02 -0.33 0.50 0.00 -3.72 0.00 0.00 177.10 173.52 1w3t n TYR 132 N 5.55 -1.62 -0.30 0.43 -0.00 -1.26 -0.60 117.16 119.36 1w3t n TYR 132 Ca -0.06 -2.83 0.04 0.00 -0.00 0.00 0.00 57.90 55.05 1w3t n TYR 132 Cb 0.50 0.50 0.18 0.00 -0.00 0.00 0.00 39.34 40.52 1w3t n TYR 132 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.86 175.51 1w3t h PRO 133 N 5.05 0.77 -0.37 2.98 0.11 -1.72 -1.46 132.00 137.36 1w3t h PRO 133 Ca 0.15 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 66.16 1w3t h PRO 133 Cb 0.95 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.88 1w3t h PRO 133 CO 0.31 0.51 -0.01 1.15 -0.21 0.00 0.00 178.00 179.74 1w3t h THR 134 N 0.79 1.26 -0.48 -1.15 2.02 -1.87 0.08 112.91 113.56 1w3t h THR 134 Ca 0.42 -1.02 -0.11 0.00 0.77 0.00 0.00 66.41 66.47 1w3t h THR 134 Cb 0.41 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 1w3t h THR 134 CO -0.26 0.34 -0.11 0.00 0.37 0.00 0.00 175.52 175.85 1w3t h ALA 135 N 0.86 0.66 0.00 6.16 0.00 -1.88 -3.34 119.26 121.73 1w3t h ALA 135 Ca 0.10 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1w3t h ALA 135 Cb 0.49 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1w3t h ALA 135 CO 0.02 0.57 -1.56 0.25 0.00 0.00 0.00 179.25 178.53 1w3t n THR 136 N -4.22 0.10 -0.66 0.00 -2.24 -0.58 -4.65 114.28 102.03 1w3t n THR 136 Ca 0.00 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1w3t n THR 136 Cb 0.39 0.16 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 1w3t n THR 136 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1w3t n GLY 137 N 1.31 0.80 3.06 3.38 0.00 0.01 -3.53 105.19 110.22 1w3t n GLY 137 Ca -0.01 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.83 1w3t n GLY 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1w3t s LYS 138 N -0.34 0.71 -0.19 1.61 -0.14 -1.23 -4.82 119.74 115.33 1w3t s LYS 138 Ca 0.00 -0.53 -0.05 0.00 -1.36 0.00 0.00 55.97 54.04 1w3t s LYS 138 Cb 0.00 -0.65 -0.02 0.00 -1.68 0.00 0.00 37.83 35.47 1w3t s LYS 138 CO 0.00 0.16 -0.01 0.34 -0.76 0.00 0.00 175.35 175.09 1w3t s ASP 139 N -0.76 4.83 -0.87 2.83 2.15 -1.26 -3.78 116.67 119.81 1w3t s ASP 139 Ca -0.00 -0.18 -0.06 0.00 0.43 0.00 0.00 52.55 52.73 1w3t s ASP 139 Cb -0.06 -1.82 0.22 0.00 -0.30 0.00 0.00 42.92 40.96 1w3t s ASP 139 CO 0.00 0.09 0.77 -0.63 -0.17 0.00 0.00 175.17 175.23 1w3t s ILE 140 N 0.85 4.84 0.82 4.11 -1.09 -1.26 -5.03 121.20 124.44 1w3t s ILE 140 Ca 0.00 -3.27 -0.14 0.00 -2.23 0.00 0.00 60.65 55.02 1w3t s ILE 140 Cb -0.14 -4.00 0.19 0.00 -1.58 0.00 0.00 42.46 36.93 1w3t s ILE 140 CO 0.02 -1.05 1.01 -0.90 -1.23 0.00 0.00 174.94 172.79 1w3t n ASP 141 N 3.02 -0.35 -0.07 3.58 5.68 -1.26 -4.58 116.55 122.57 1w3t n ASP 141 Ca 0.17 -1.30 0.05 0.00 -0.50 0.00 0.00 54.79 53.21 1w3t n ASP 141 Cb 0.40 -0.80 0.40 0.00 -1.14 0.00 0.00 41.12 39.98 1w3t n ASP 141 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1w3t h ALA 142 N -2.00 1.72 -0.11 2.12 0.00 -1.88 0.17 119.26 119.29 1w3t h ALA 142 Ca -0.34 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.42 1w3t h ALA 142 Cb 0.95 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1w3t h ALA 142 CO 0.23 0.22 -0.41 -0.22 0.00 0.00 0.00 179.25 179.08 1w3t h LYS 143 N 0.62 0.47 -0.43 0.00 3.64 -1.91 -1.44 116.57 117.52 1w3t h LYS 143 Ca 0.21 -0.36 -0.07 0.00 -1.27 0.00 0.00 60.65 59.16 1w3t h LYS 143 Cb 0.07 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1w3t h LYS 143 CO -0.05 0.99 -0.02 0.28 -2.27 0.00 0.00 179.45 178.37 1w3t h VAL 144 N 0.05 1.23 -0.29 2.00 2.07 -1.78 -0.60 116.25 118.94 1w3t h VAL 144 Ca -0.02 -0.98 -0.00 0.00 0.82 0.00 0.00 66.70 66.52 1w3t h VAL 144 Cb 1.04 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 1w3t h VAL 144 CO 0.09 0.34 0.16 0.00 0.02 0.00 0.00 177.57 178.18 1w3t h ALA 145 N 1.31 0.37 -0.56 1.67 0.00 -0.63 -0.83 119.26 120.59 1w3t h ALA 145 Ca 0.13 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1w3t h ALA 145 Cb 0.44 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1w3t h ALA 145 CO 0.02 -0.11 0.36 -0.22 0.00 0.00 0.00 179.25 179.30 1w3t h LYS 146 N 0.35 0.74 -0.67 0.00 3.64 -1.00 -0.79 116.57 118.85 1w3t h LYS 146 Ca 0.10 -0.05 0.08 0.00 -1.27 0.00 0.00 60.65 59.52 1w3t h LYS 146 Cb 0.05 -0.16 -0.07 0.00 -0.41 0.00 0.00 32.23 31.64 1w3t h LYS 146 CO -0.02 0.50 0.32 1.49 -2.27 0.00 0.00 179.45 179.48 1w3t h GLU 147 N 0.75 0.55 -0.64 1.90 4.81 -0.78 -2.07 114.58 119.11 1w3t h GLU 147 Ca 0.20 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.36 1w3t h GLU 147 Cb -0.07 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.16 1w3t h GLU 147 CO -0.04 0.36 0.23 0.82 -0.73 0.00 0.00 179.01 179.64 1w3t h ILE 148 N 0.56 1.24 0.00 2.32 2.04 -0.62 -3.47 117.51 119.59 1w3t h ILE 148 Ca 0.32 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.39 1w3t h ILE 148 Cb 0.33 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 1w3t h ILE 148 CO -0.26 0.31 0.00 0.61 0.00 0.00 0.00 178.15 178.81 1w3t n GLY 149 N -0.77 2.17 0.07 5.37 0.00 -0.35 -4.85 105.19 106.83 1w3t n GLY 149 Ca 0.04 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.07 1w3t n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w3t s PHE 151 N -0.90 3.64 -0.19 0.00 2.99 -1.26 -4.44 117.98 117.82 1w3t s PHE 151 Ca 0.02 1.62 0.17 0.00 0.00 0.00 0.00 56.93 58.75 1w3t s PHE 151 Cb 0.01 -3.07 0.06 0.00 0.00 0.00 0.00 43.02 40.02 1w3t s PHE 151 CO 0.02 0.00 1.32 1.15 -0.00 0.00 0.00 175.22 177.71 1w3t h THR 152 N 4.80 0.62 -2.70 0.64 2.02 -1.50 -3.46 112.91 113.33 1w3t h THR 152 Ca -0.41 -1.94 0.10 0.00 0.77 0.00 0.00 66.41 64.93 1w3t h THR 152 Cb 1.21 2.23 -0.02 0.00 -1.74 0.00 0.00 68.15 69.83 1w3t h THR 152 CO 0.75 0.36 0.47 -0.83 0.37 0.00 0.00 175.52 176.63 1w3t s GLY 153 N -4.48 0.19 -0.13 2.16 0.00 -1.24 -1.85 107.32 101.96 1w3t s GLY 153 Ca 0.03 -0.46 -0.11 0.00 0.00 0.00 0.00 44.72 44.17 1w3t s GLY 153 CO 0.75 1.33 0.34 0.54 0.00 0.00 0.00 173.10 176.07 1w3t s VAL 154 N -2.29 -0.00 -0.28 1.40 0.11 0.00 -1.06 120.40 118.28 1w3t s VAL 154 Ca 0.19 0.01 -0.07 0.00 -2.93 0.00 0.00 61.98 59.18 1w3t s VAL 154 Cb -0.03 -0.48 -0.01 0.00 -1.53 0.00 0.00 36.38 34.33 1w3t s VAL 154 CO 0.07 0.00 0.09 -0.75 -3.33 0.00 0.00 175.10 171.19 1w3t s LYS 155 N 0.29 3.32 -0.39 1.54 2.20 0.54 -0.73 119.74 126.52 1w3t s LYS 155 Ca -0.01 -0.70 -0.08 0.00 -0.36 0.00 0.00 55.97 54.81 1w3t s LYS 155 Cb -0.03 -3.38 0.06 0.00 -1.51 0.00 0.00 37.83 32.97 1w3t s LYS 155 CO -0.01 -0.35 0.20 0.34 -0.36 0.00 0.00 175.35 175.17 1w3t s ASP 156 N 1.56 5.53 -0.56 1.43 3.68 -0.01 -0.47 116.67 127.83 1w3t s ASP 156 Ca 0.04 -1.35 -0.12 0.00 2.13 0.00 0.00 52.55 53.25 1w3t s ASP 156 Cb -0.16 -1.95 0.14 0.00 -1.45 0.00 0.00 42.92 39.50 1w3t s ASP 156 CO 0.03 -0.45 0.47 -0.89 0.13 0.00 0.00 175.17 174.47 1w3t s THR 157 N 1.42 4.80 -0.17 1.71 2.01 0.23 -0.20 115.64 125.45 1w3t s THR 157 Ca 0.02 -1.82 -0.29 0.00 0.31 0.00 0.00 61.69 59.90 1w3t s THR 157 Cb -0.21 -4.09 0.11 0.00 0.01 0.00 0.00 72.50 68.32 1w3t s THR 157 CO 0.03 -0.86 0.93 -0.51 -0.69 0.00 0.00 174.62 173.52 1w3t s ILE 158 N 1.22 0.00 -0.72 1.82 2.07 -1.26 -4.14 121.20 120.19 1w3t s ILE 158 Ca 0.07 0.00 0.26 0.00 -1.41 0.00 0.00 60.65 59.57 1w3t s ILE 158 Cb -0.25 -1.00 0.29 0.00 0.13 0.00 0.00 42.46 41.63 1w3t s ILE 158 CO -0.00 0.00 1.77 -0.62 -1.91 0.00 0.00 174.94 174.18 1w3t n GLU 159 N 1.19 0.27 -2.82 3.50 1.02 -1.26 -4.67 120.64 117.87 1w3t n GLU 159 Ca -0.13 0.23 -0.43 0.00 -0.02 0.00 0.00 57.16 56.81 1w3t n GLU 159 Cb 0.57 -1.82 -0.03 0.00 -0.02 0.00 0.00 31.44 30.15 1w3t n GLU 159 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1w3t s ASN 160 N -4.58 6.50 0.61 1.62 2.47 -1.26 -4.88 114.94 115.42 1w3t s ASN 160 Ca 0.10 -1.67 0.35 0.00 0.42 0.00 0.00 52.86 52.06 1w3t s ASN 160 Cb 0.12 -2.45 2.00 0.00 -1.45 0.00 0.00 41.25 39.48 1w3t s ASN 160 CO 0.60 -1.26 2.28 -0.29 -3.72 0.00 0.00 177.10 174.71 1w3t h ILE 161 N 6.08 0.33 -0.45 -5.21 2.10 -2.00 -2.17 117.51 116.19 1w3t h ILE 161 Ca 0.07 -0.06 0.05 0.00 1.08 0.00 0.00 64.86 66.01 1w3t h ILE 161 Cb 1.03 1.04 -0.05 0.00 -1.09 0.00 0.00 36.82 37.76 1w3t h ILE 161 CO 1.20 0.01 0.18 0.40 -1.08 0.00 0.00 178.15 178.86 1w3t h ILE 162 N 0.00 0.88 -0.72 2.19 2.04 -1.99 0.74 117.51 120.66 1w3t h ILE 162 Ca -0.00 -0.12 0.02 0.00 1.00 0.00 0.00 64.86 65.76 1w3t h ILE 162 Cb 0.04 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 36.57 1w3t h ILE 162 CO 0.00 0.07 0.46 -0.74 0.00 0.00 0.00 178.15 177.94 1w3t h HIS 163 N 0.36 0.87 -0.18 1.37 2.76 -1.81 -0.90 115.15 117.61 1w3t h HIS 163 Ca 0.21 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.37 1w3t h HIS 163 Cb 0.18 -0.29 -0.01 0.00 1.55 0.00 0.00 27.41 28.85 1w3t h HIS 163 CO -0.14 0.52 0.00 1.15 -1.30 0.00 0.00 177.93 178.16 1w3t h THR 164 N 0.92 1.25 -0.73 6.26 2.02 -1.36 -3.02 112.91 118.25 1w3t h THR 164 Ca 0.28 -0.86 0.05 0.00 0.77 0.00 0.00 66.41 66.65 1w3t h THR 164 Cb -0.03 1.46 -0.04 0.00 -1.74 0.00 0.00 68.15 67.79 1w3t h THR 164 CO -0.09 0.26 0.48 -0.07 0.37 0.00 0.00 175.52 176.47 1w3t h LEU 165 N 0.08 0.72 -1.60 2.58 3.38 -0.59 -2.20 115.31 117.67 1w3t h LEU 165 Ca 0.05 -0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.17 1w3t h LEU 165 Cb 0.39 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 1w3t h LEU 165 CO 0.01 0.48 0.49 0.44 0.09 0.00 0.00 178.44 179.95 1w3t h ASP 166 N 0.82 0.37 -0.28 -0.43 3.32 -1.04 -0.80 116.42 118.39 1w3t h ASP 166 Ca 0.30 0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.42 1w3t h ASP 166 Cb 0.15 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.60 1w3t h ASP 166 CO -0.09 0.20 0.00 1.88 -1.72 0.00 0.00 179.24 179.50 1w3t h TYR 167 N 0.40 -0.01 -0.76 4.55 -1.99 -1.41 -0.05 116.97 117.70 1w3t h TYR 167 Ca 0.36 0.02 0.00 0.00 2.00 0.00 0.00 58.73 61.12 1w3t h TYR 167 Cb 0.84 0.05 -0.04 0.00 2.00 0.00 0.00 36.73 39.58 1w3t h TYR 167 CO -0.00 -0.04 0.49 -0.22 -0.00 0.00 0.00 178.16 178.39 1w3t h LYS 168 N 0.08 1.01 -0.35 4.88 1.63 -1.30 0.25 116.57 122.77 1w3t h LYS 168 Ca 0.13 -0.07 -0.03 0.00 -0.85 0.00 0.00 60.65 59.83 1w3t h LYS 168 Cb 0.17 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 31.57 1w3t h LYS 168 CO -0.22 0.68 0.10 -0.09 -3.45 0.00 0.00 179.45 176.47 1w3t h ARG 169 N 1.03 0.55 0.00 1.90 2.43 -0.75 -2.78 114.38 116.76 1w3t h ARG 169 Ca 0.28 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1w3t h ARG 169 Cb -0.10 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.37 1w3t h ARG 169 CO -0.06 0.59 -0.74 -0.07 -1.51 0.00 0.00 179.97 178.17 1w3t h LEU 170 N 0.42 0.00 -6.48 3.80 3.38 -0.96 -3.40 115.31 112.07 1w3t h LEU 170 Ca 0.11 -0.13 -0.59 0.00 0.09 0.00 0.00 57.88 57.36 1w3t h LEU 170 Cb 0.27 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 40.62 1w3t h LEU 170 CO -0.00 0.06 -0.83 0.59 0.09 0.00 0.00 178.44 178.35 1w3t n ASN 171 N -2.38 1.21 0.24 -0.43 3.02 0.87 -4.96 115.26 112.83 1w3t n ASN 171 Ca 0.02 -2.81 0.18 0.00 -0.03 0.00 0.00 54.58 51.93 1w3t n ASN 171 Cb 0.49 -0.64 0.89 0.00 -0.61 0.00 0.00 39.78 39.90 1w3t n ASN 171 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1w3t h PRO 172 N 5.07 0.00 -0.01 3.52 0.11 -1.72 -0.42 132.00 138.55 1w3t h PRO 172 Ca 0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.30 1w3t h PRO 172 Cb 0.83 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1w3t h PRO 172 CO 0.55 0.00 -0.15 0.09 -0.21 0.00 0.00 178.00 178.28 1w3t n ASN 173 N -3.58 1.55 -4.74 -2.05 3.02 -1.26 -4.92 115.26 103.28 1w3t n ASN 173 Ca 0.00 -1.33 -0.41 0.00 -0.03 0.00 0.00 54.58 52.81 1w3t n ASN 173 Cb 0.29 0.10 -0.04 0.00 -0.61 0.00 0.00 39.78 39.52 1w3t n ASN 173 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1w3t s MET 174 N -2.24 4.66 0.04 3.52 1.75 -0.17 -4.98 119.30 121.89 1w3t s MET 174 Ca 0.30 1.66 -0.31 0.00 -1.25 0.00 0.00 55.69 56.09 1w3t s MET 174 Cb 0.20 -3.28 -0.07 0.00 2.84 0.00 0.00 34.83 34.53 1w3t s MET 174 CO 0.42 0.19 1.43 -0.51 -0.65 0.00 0.00 175.02 175.90 1w3t s LEU 175 N -0.62 4.34 -0.20 4.11 1.43 -0.77 -4.86 118.68 122.10 1w3t s LEU 175 Ca 0.47 2.22 0.01 0.00 -1.03 0.00 0.00 54.13 55.80 1w3t s LEU 175 Cb -0.28 -3.57 0.04 0.00 0.03 0.00 0.00 46.19 42.40 1w3t s LEU 175 CO 0.35 -0.72 -0.14 -0.69 0.23 0.00 0.00 176.35 175.37 1w3t s VAL 176 N 2.07 1.88 0.11 -1.59 1.01 -1.26 -0.82 120.40 121.79 1w3t s VAL 176 Ca 0.65 -1.05 0.08 0.00 0.00 0.00 0.00 61.98 61.66 1w3t s VAL 176 Cb -0.34 -1.84 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 1w3t s VAL 176 CO 0.28 0.30 -0.15 -0.31 0.00 0.00 0.00 175.10 175.22 1w3t s TYR 177 N 1.32 2.61 0.13 5.22 1.51 0.09 -1.30 117.35 126.92 1w3t s TYR 177 Ca 0.00 -0.23 -0.07 0.00 -1.01 0.00 0.00 57.07 55.77 1w3t s TYR 177 Cb -0.15 -1.39 -0.06 0.00 -0.11 0.00 0.00 41.96 40.25 1w3t s TYR 177 CO -0.10 0.39 0.40 0.45 -1.11 0.00 0.00 175.55 175.58 1w3t s SER 178 N -2.10 6.55 -0.07 2.29 0.15 -0.51 -0.83 113.70 119.19 1w3t s SER 178 Ca 0.19 0.68 0.10 0.00 0.70 0.00 0.00 55.95 57.62 1w3t s SER 178 Cb -0.11 -2.13 0.43 0.00 -1.71 0.00 0.00 66.02 62.50 1w3t s SER 178 CO 0.11 0.09 1.27 0.61 1.20 0.00 0.00 173.24 176.51 1w3t n GLY 179 N 0.36 1.71 3.80 9.45 0.00 0.72 -1.16 105.19 120.07 1w3t n GLY 179 Ca -0.04 -0.50 -0.36 0.00 0.00 0.00 0.00 46.02 45.12 1w3t n GLY 179 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1w3t s SER 180 N -0.71 6.19 0.44 1.61 0.15 -1.26 -4.74 113.70 115.38 1w3t s SER 180 Ca 0.30 0.34 0.24 0.00 0.70 0.00 0.00 55.95 57.54 1w3t s SER 180 Cb 0.20 -2.03 0.80 0.00 -1.71 0.00 0.00 66.02 63.28 1w3t s SER 180 CO 0.14 0.32 1.77 0.44 1.20 0.00 0.00 173.24 177.11 1w3t h ASP 181 N 5.64 0.00 0.40 5.45 3.32 -1.92 -3.28 116.42 126.04 1w3t h ASP 181 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1w3t h ASP 181 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1w3t h ASP 181 CO 0.64 0.19 -0.14 0.23 -1.72 0.00 0.00 179.24 178.45 1w3t n MET 182 N -3.27 0.61 -0.26 3.56 2.81 -1.26 -3.54 117.12 115.77 1w3t n MET 182 Ca 0.01 -0.22 0.07 0.00 -1.81 0.00 0.00 57.70 55.75 1w3t n MET 182 Cb 0.46 -1.50 0.18 0.00 -0.71 0.00 0.00 33.22 31.66 1w3t n MET 182 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1w3t n LEU 183 N -1.00 3.15 0.08 4.03 4.77 -1.24 -4.72 117.00 122.07 1w3t n LEU 183 Ca 0.13 -2.66 -0.13 0.00 -0.03 0.00 0.00 56.01 53.32 1w3t n LEU 183 Cb 0.29 -0.38 -0.07 0.00 -2.33 0.00 0.00 43.42 40.93 1w3t n LEU 183 CO 0.25 0.68 0.83 0.40 -1.33 0.00 0.00 177.39 178.22 1w3t h ILE 184 N 1.32 0.88 -0.80 -0.08 2.04 -1.71 -0.09 117.51 119.07 1w3t h ILE 184 Ca 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 1w3t h ILE 184 Cb 1.08 0.88 -0.04 0.00 -0.74 0.00 0.00 36.82 38.00 1w3t h ILE 184 CO 0.10 0.00 0.47 0.00 0.00 0.00 0.00 178.15 178.72 1w3t h ALA 185 N 0.78 1.03 -0.09 1.87 0.00 -1.85 -2.47 119.26 118.52 1w3t h ALA 185 Ca -0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1w3t h ALA 185 Cb 0.12 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1w3t h ALA 185 CO 0.00 0.50 -0.01 1.15 0.00 0.00 0.00 179.25 180.90 1w3t h THR 186 N 1.11 1.26 -0.44 0.00 2.02 -1.84 -1.22 112.91 113.80 1w3t h THR 186 Ca 0.29 -0.84 0.06 0.00 0.77 0.00 0.00 66.41 66.69 1w3t h THR 186 Cb -0.02 1.64 -0.05 0.00 -1.74 0.00 0.00 68.15 67.98 1w3t h THR 186 CO -0.05 0.24 0.14 0.58 0.37 0.00 0.00 175.52 176.80 1w3t h VAL 187 N -0.13 0.85 -0.36 3.16 2.07 -1.01 -0.62 116.25 120.21 1w3t h VAL 187 Ca 0.03 -0.10 -0.09 0.00 0.82 0.00 0.00 66.70 67.35 1w3t h VAL 187 Cb 0.37 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 1w3t h VAL 187 CO 0.01 0.06 -0.13 0.00 0.02 0.00 0.00 177.57 177.52 1w3t h ALA 188 N 1.29 1.09 0.00 1.67 0.00 -1.36 -2.43 119.26 119.53 1w3t h ALA 188 Ca 0.21 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1w3t h ALA 188 Cb 0.21 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1w3t h ALA 188 CO -0.22 0.56 -0.17 0.77 0.00 0.00 0.00 179.25 180.19 1w3t h SER 189 N 0.58 0.00 -0.56 0.00 0.02 -0.24 -3.30 113.55 110.05 1w3t h SER 189 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1w3t h SER 189 Cb 0.57 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.11 1w3t h SER 189 CO 0.04 0.17 0.00 1.07 -1.14 0.00 0.00 176.83 176.96 1w3t n THR 190 N -3.22 1.12 -0.48 -2.27 5.66 -0.33 -4.95 114.28 109.81 1w3t n THR 190 Ca 0.02 -1.05 0.00 0.00 -3.05 0.00 0.00 64.05 59.97 1w3t n THR 190 Cb 0.49 0.44 0.00 0.00 -1.55 0.00 0.00 70.33 69.71 1w3t n THR 190 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1w3t n GLY 191 N 1.07 0.72 4.00 1.09 0.00 -1.21 -5.06 105.19 105.81 1w3t n GLY 191 Ca 0.19 -0.33 -0.18 0.00 0.00 0.00 0.00 46.02 45.70 1w3t n GLY 191 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1w3t s LEU 192 N 0.00 3.50 0.00 0.99 1.43 -0.93 -5.04 118.68 118.63 1w3t s LEU 192 Ca 0.00 -0.32 0.27 0.00 -1.03 0.00 0.00 54.13 53.04 1w3t s LEU 192 Cb 0.00 -2.65 0.80 0.00 0.03 0.00 0.00 46.19 44.37 1w3t s LEU 192 CO 0.00 -0.93 1.60 0.47 0.23 0.00 0.00 176.35 177.72 1w3t n ASP 193 N -2.04 1.09 0.00 2.29 8.00 -0.42 -4.63 116.55 120.84 1w3t n ASP 193 Ca 0.09 -0.97 0.00 0.00 0.71 0.00 0.00 54.79 54.61 1w3t n ASP 193 Cb 0.59 0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.81 1w3t n ASP 193 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1w3t n GLY 194 N 1.32 0.75 3.01 0.44 0.00 -1.25 -0.71 105.19 108.74 1w3t n GLY 194 Ca 0.13 -1.92 -0.12 0.00 0.00 0.00 0.00 46.02 44.11 1w3t n GLY 194 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1w3t s ASN 195 N -4.00 -0.11 -0.51 1.61 0.01 -0.74 -1.42 114.94 109.79 1w3t s ASN 195 Ca 0.00 0.20 -0.13 0.00 -0.71 0.00 0.00 52.86 52.22 1w3t s ASN 195 Cb 0.00 0.24 0.12 0.00 0.41 0.00 0.00 41.25 42.03 1w3t s ASN 195 CO 0.00 -0.07 0.43 -0.69 -1.51 0.00 0.00 177.10 175.26 1w3t s VAL 196 N -0.06 4.78 -0.27 1.60 1.01 -0.31 -0.85 120.40 126.29 1w3t s VAL 196 Ca -0.01 -1.59 -0.01 0.00 0.00 0.00 0.00 61.98 60.37 1w3t s VAL 196 Cb -0.01 -4.08 0.04 0.00 0.00 0.00 0.00 36.38 32.32 1w3t s VAL 196 CO 0.00 -0.81 -0.05 0.00 0.00 0.00 0.00 175.10 174.25 1w3t s ALA 197 N 1.50 2.72 0.33 5.51 0.00 -0.71 -4.24 121.76 126.87 1w3t s ALA 197 Ca 0.04 -1.62 0.08 0.00 0.00 0.00 0.00 51.96 50.46 1w3t s ALA 197 Cb -0.28 -1.77 0.79 0.00 0.00 0.00 0.00 23.12 21.86 1w3t s ALA 197 CO 0.02 -1.04 1.80 0.00 0.00 0.00 0.00 175.76 176.54 1w3t h ALA 198 N 7.97 1.77 0.00 0.00 0.00 -1.87 -0.90 119.26 126.23 1w3t h ALA 198 Ca -0.26 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1w3t h ALA 198 Cb 1.08 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1w3t h ALA 198 CO 0.54 -0.10 0.00 0.78 0.00 0.00 0.00 179.25 180.47 1w3t h GLY 199 N 0.72 0.00 2.00 0.00 0.00 -1.95 -1.49 103.07 102.36 1w3t h GLY 199 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1w3t h GLY 199 CO -0.32 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.08 1w3t n SER 200 N -2.48 0.10 -0.20 0.19 3.41 -0.34 -0.88 113.62 113.42 1w3t n SER 200 Ca 0.02 0.52 -0.10 0.00 -0.26 0.00 0.00 58.87 59.05 1w3t n SER 200 Cb 0.25 -0.54 0.02 0.00 -0.26 0.00 0.00 64.21 63.68 1w3t n SER 200 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1w3t h ASN 201 N 0.00 1.03 0.00 4.04 2.35 -1.43 -2.86 115.58 118.71 1w3t h ASN 201 Ca 0.00 -0.33 -0.15 0.00 -0.55 0.00 0.00 56.30 55.27 1w3t h ASN 201 Cb 0.28 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.34 1w3t h ASN 201 CO 0.00 1.11 -1.98 0.00 -1.65 0.00 0.00 177.43 174.92 1w3t n TYR 202 N -4.18 0.00 -2.96 1.19 0.18 -1.02 -4.65 117.16 105.73 1w3t n TYR 202 Ca 0.02 0.00 -0.21 0.00 1.88 0.00 0.00 57.90 59.59 1w3t n TYR 202 Cb 0.38 -0.61 -0.02 0.00 -0.38 0.00 0.00 39.34 38.70 1w3t n TYR 202 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1w3t n LEU 203 N -2.37 2.71 -0.29 -3.48 4.77 -0.06 -4.45 117.00 113.83 1w3t n LEU 203 Ca -0.15 -5.14 0.01 0.00 -0.03 0.00 0.00 56.01 50.71 1w3t n LEU 203 Cb 0.75 0.07 0.21 0.00 -2.33 0.00 0.00 43.42 42.13 1w3t n LEU 203 CO 0.36 2.23 1.26 1.55 -1.33 0.00 0.00 177.39 181.46 1w3t h PRO 204 N 2.95 1.07 -0.82 3.23 0.13 -1.69 -1.22 132.00 135.64 1w3t h PRO 204 Ca 0.11 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1w3t h PRO 204 Cb 0.81 -0.24 -0.04 0.00 0.13 0.00 0.00 31.00 31.66 1w3t h PRO 204 CO 0.66 0.71 0.52 0.93 -0.23 0.00 0.00 178.00 180.59 1w3t h GLU 205 N 1.10 1.08 -0.13 0.86 3.07 -1.88 -0.94 114.58 117.74 1w3t h GLU 205 Ca 0.34 -0.08 -0.02 0.00 -0.50 0.00 0.00 59.36 59.10 1w3t h GLU 205 Cb 0.00 -0.24 -0.00 0.00 -0.84 0.00 0.00 28.75 27.67 1w3t h GLU 205 CO -0.10 0.73 -0.01 0.28 -1.40 0.00 0.00 179.01 178.51 1w3t h VAL 206 N 1.11 1.26 -0.54 3.13 2.07 -1.60 -2.21 116.25 119.48 1w3t h VAL 206 Ca 0.30 -0.87 -0.07 0.00 0.82 0.00 0.00 66.70 66.88 1w3t h VAL 206 Cb -0.10 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1w3t h VAL 206 CO -0.06 0.25 0.07 0.71 0.02 0.00 0.00 177.57 178.56 1w3t h THR 207 N -0.04 1.26 -0.80 2.57 1.35 -1.09 -0.57 112.91 115.58 1w3t h THR 207 Ca 0.04 -1.00 -0.02 0.00 -0.55 0.00 0.00 66.41 64.88 1w3t h THR 207 Cb 0.39 0.85 -0.04 0.00 -1.73 0.00 0.00 68.15 67.62 1w3t h THR 207 CO 0.01 0.36 0.43 0.58 -0.25 0.00 0.00 175.52 176.65 1w3t h VAL 208 N 0.79 1.24 -0.51 6.82 2.07 -1.23 -2.57 116.25 122.86 1w3t h VAL 208 Ca 0.16 -0.60 -0.11 0.00 0.82 0.00 0.00 66.70 66.97 1w3t h VAL 208 Cb 0.44 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 1w3t h VAL 208 CO 0.01 0.27 -0.12 0.74 0.02 0.00 0.00 177.57 178.50 1w3t h THR 209 N 1.12 1.27 -0.27 2.57 2.02 -0.91 -0.71 112.91 118.00 1w3t h THR 209 Ca 0.28 -1.26 0.05 0.00 0.77 0.00 0.00 66.41 66.26 1w3t h THR 209 Cb 0.04 1.03 -0.05 0.00 -1.74 0.00 0.00 68.15 67.43 1w3t h THR 209 CO -0.04 0.44 -0.07 0.40 0.37 0.00 0.00 175.52 176.62 1w3t h ILE 210 N 0.84 0.72 -0.34 3.11 2.04 -1.10 -0.31 117.51 122.48 1w3t h ILE 210 Ca 0.13 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.99 1w3t h ILE 210 Cb 0.68 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.46 1w3t h ILE 210 CO 0.05 0.00 0.21 0.50 0.00 0.00 0.00 178.15 178.91 1w3t h LYS 211 N -0.00 0.45 -0.19 2.37 3.11 -1.14 -0.78 116.57 120.38 1w3t h LYS 211 Ca 0.13 -0.04 0.01 0.00 -2.81 0.00 0.00 60.65 57.94 1w3t h LYS 211 Cb 0.20 -0.10 -0.01 0.00 -1.00 0.00 0.00 32.23 31.32 1w3t h LYS 211 CO -0.28 0.32 0.11 -0.22 -2.81 0.00 0.00 179.45 176.58 1w3t h LYS 212 N 0.44 0.23 -0.32 1.90 3.64 -0.96 0.23 116.57 121.74 1w3t h LYS 212 Ca 0.12 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.51 1w3t h LYS 212 Cb -0.02 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 1w3t h LYS 212 CO -0.02 0.15 0.16 -0.07 -2.27 0.00 0.00 179.45 177.39 1w3t h LEU 213 N 0.24 0.23 -0.44 5.20 3.38 -0.75 -0.88 115.31 122.28 1w3t h LEU 213 Ca 0.07 0.02 0.07 0.00 0.09 0.00 0.00 57.88 58.12 1w3t h LEU 213 Cb -0.01 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.65 1w3t h LEU 213 CO -0.03 0.17 0.11 0.00 0.09 0.00 0.00 178.44 178.78 1w3t h ALA 214 N 1.17 0.50 0.00 1.53 0.00 -0.99 -0.07 119.26 121.40 1w3t h ALA 214 Ca 0.13 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1w3t h ALA 214 Cb 0.05 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1w3t h ALA 214 CO -0.09 -0.29 0.00 0.52 0.00 0.00 0.00 179.25 179.39 1w3t h MET 215 N 0.26 0.00 -0.00 0.00 2.86 -0.37 0.18 114.93 117.86 1w3t h MET 215 Ca 0.21 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.85 1w3t h MET 215 Cb 0.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1w3t h MET 215 CO -0.25 0.00 -0.00 0.39 1.06 0.00 0.00 176.91 178.10 1w3t n GLU 216 N -2.94 0.84 -1.79 1.72 1.02 -0.39 -4.92 120.64 114.18 1w3t n GLU 216 Ca 0.01 -0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 56.98 1w3t n GLU 216 Cb 0.31 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.19 1w3t n GLU 216 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1w3t n ARG 217 N -1.08 -1.20 -2.15 3.49 5.12 0.63 -4.92 116.66 116.54 1w3t n ARG 217 Ca 0.21 0.97 -0.42 0.00 -1.93 0.00 0.00 57.85 56.69 1w3t n ARG 217 Cb 0.15 -5.25 0.00 0.00 -1.16 0.00 0.00 32.46 26.20 1w3t n ARG 217 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1w3t n LYS 218 N -2.54 3.67 -0.12 5.56 5.02 -0.10 -4.83 118.16 124.81 1w3t n LYS 218 Ca -0.18 -3.33 -0.10 0.00 -2.02 0.00 0.00 58.31 52.68 1w3t n LYS 218 Cb 0.58 -2.92 -0.02 0.00 -0.02 0.00 0.00 35.03 32.65 1w3t n LYS 218 CO 0.00 0.00 0.00 0.97 -0.52 0.00 0.00 177.40 177.85 1w3t h ILE 219 N 3.57 1.23 -0.74 -0.18 6.09 -1.87 0.93 117.51 126.54 1w3t h ILE 219 Ca 0.49 -0.80 0.06 0.00 -1.37 0.00 0.00 64.86 63.24 1w3t h ILE 219 Cb 0.57 1.06 -0.06 0.00 0.47 0.00 0.00 36.82 38.86 1w3t h ILE 219 CO 1.65 0.27 0.43 0.44 -3.07 0.00 0.00 178.15 177.87 1w3t h ASP 220 N 0.43 0.64 -0.40 2.19 3.32 -1.97 0.29 116.42 120.93 1w3t h ASP 220 Ca 0.11 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.14 1w3t h ASP 220 Cb 0.33 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 1w3t h ASP 220 CO 0.00 0.41 0.05 -0.33 -1.72 0.00 0.00 179.24 177.65 1w3t h GLU 221 N 0.78 0.68 -0.68 3.56 5.08 -1.86 -1.19 114.58 120.95 1w3t h GLU 221 Ca 0.33 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.44 1w3t h GLU 221 Cb 0.21 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 1w3t h GLU 221 CO -0.19 0.74 0.19 0.00 -1.00 0.00 0.00 179.01 178.75 1w3t h ALA 222 N 0.91 0.89 -0.34 3.43 0.00 0.11 -2.65 119.26 121.61 1w3t h ALA 222 Ca 0.12 -0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 1w3t h ALA 222 Cb 0.40 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1w3t h ALA 222 CO 0.01 0.59 -0.36 -0.07 0.00 0.00 0.00 179.25 179.42 1w3t h LEU 223 N 1.00 0.83 -0.61 0.00 3.38 -0.19 0.19 115.31 119.92 1w3t h LEU 223 Ca 0.22 -0.36 0.03 0.00 0.09 0.00 0.00 57.88 57.85 1w3t h LEU 223 Cb 0.33 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 1w3t h LEU 223 CO -0.00 1.11 0.37 0.50 0.09 0.00 0.00 178.44 180.50 1w3t h LYS 224 N 0.66 0.71 -0.22 1.13 3.64 -1.03 0.56 116.57 122.02 1w3t h LYS 224 Ca 0.06 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.32 1w3t h LYS 224 Cb 0.91 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.57 1w3t h LYS 224 CO 0.08 0.47 -0.17 1.25 -2.27 0.00 0.00 179.45 178.81 1w3t h LEU 225 N 0.73 0.53 -0.69 5.20 5.85 -1.31 -2.57 115.31 123.04 1w3t h LEU 225 Ca 0.24 -0.45 0.13 0.00 0.84 0.00 0.00 57.88 58.65 1w3t h LEU 225 Cb 0.02 -0.15 -0.09 0.00 0.37 0.00 0.00 40.66 40.81 1w3t h LEU 225 CO -0.10 0.87 0.21 -0.61 -0.34 0.00 0.00 178.44 178.46 1w3t h GLN 226 N 0.19 0.33 -0.17 1.25 5.75 -0.11 -0.89 115.11 121.47 1w3t h GLN 226 Ca 0.04 -0.02 -0.08 0.00 -0.15 0.00 0.00 58.65 58.44 1w3t h GLN 226 Cb 0.70 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 29.16 1w3t h GLN 226 CO 0.04 0.22 -0.23 0.74 -2.65 0.00 0.00 178.83 176.95 1w3t h PHE 227 N 0.34 0.32 -0.36 3.99 0.05 0.27 0.22 116.94 121.76 1w3t h PHE 227 Ca 0.38 -0.06 -0.16 0.00 3.82 0.00 0.00 57.97 61.95 1w3t h PHE 227 Cb 0.59 -0.08 -0.01 0.00 2.00 0.00 0.00 35.95 38.45 1w3t h PHE 227 CO -0.22 0.52 -0.41 -0.07 -0.18 0.00 0.00 178.31 177.95 1w3t h LEU 228 N 0.27 0.97 -0.86 1.54 3.38 -0.94 -2.69 115.31 116.98 1w3t h LEU 228 Ca 0.04 -0.46 -0.06 0.00 0.09 0.00 0.00 57.88 57.50 1w3t h LEU 228 Cb 0.57 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1w3t h LEU 228 CO 0.04 1.25 0.20 -0.74 0.09 0.00 0.00 178.44 179.28 1w3t h HIS 229 N 0.73 1.08 -1.01 1.13 2.76 -0.62 -2.19 115.15 117.04 1w3t h HIS 229 Ca 0.05 -0.11 0.12 0.00 -2.20 0.00 0.00 60.37 58.24 1w3t h HIS 229 Cb 1.00 -0.31 -0.09 0.00 1.55 0.00 0.00 27.41 29.56 1w3t h HIS 229 CO 0.06 0.86 0.63 -0.44 -1.30 0.00 0.00 177.93 177.75 1w3t h ASP 230 N 1.00 0.93 -0.74 3.26 3.32 -0.76 -1.75 116.42 121.68 1w3t h ASP 230 Ca 0.22 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.29 1w3t h ASP 230 Cb 0.30 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 1w3t h ASP 230 CO -0.01 0.49 0.35 -0.33 -1.72 0.00 0.00 179.24 178.03 1w3t h GLU 231 N 1.00 1.06 -0.57 3.56 5.08 -1.07 -1.08 114.58 122.57 1w3t h GLU 231 Ca 0.50 -0.16 -0.04 0.00 -1.00 0.00 0.00 59.36 58.66 1w3t h GLU 231 Cb 0.49 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 1w3t h GLU 231 CO -0.27 0.83 0.19 0.28 -1.00 0.00 0.00 179.01 179.05 1w3t h VAL 232 N 1.04 1.23 -0.10 3.13 2.07 -1.15 0.14 116.25 122.61 1w3t h VAL 232 Ca 0.25 -0.77 0.03 0.00 0.82 0.00 0.00 66.70 67.03 1w3t h VAL 232 Cb 0.12 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 1w3t h VAL 232 CO -0.03 0.29 -0.07 0.40 0.02 0.00 0.00 177.57 178.18 1w3t h ILE 233 N 0.79 0.78 -0.52 4.57 1.08 -1.20 0.18 117.51 123.18 1w3t h ILE 233 Ca 0.18 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.70 1w3t h ILE 233 Cb 0.26 0.78 -0.04 0.00 -3.07 0.00 0.00 36.82 34.74 1w3t h ILE 233 CO -0.01 0.00 0.27 -0.33 -0.69 0.00 0.00 178.15 177.39 1w3t h GLU 234 N -0.08 0.51 -0.76 2.37 5.08 -1.06 -1.64 114.58 119.00 1w3t h GLU 234 Ca 0.07 -0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.46 1w3t h GLU 234 Cb 0.18 -0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.25 1w3t h GLU 234 CO -0.15 0.34 0.45 0.00 -1.00 0.00 0.00 179.01 178.65 1w3t h ALA 235 N 1.28 1.04 0.00 3.43 0.00 -0.55 -2.17 119.26 122.29 1w3t h ALA 235 Ca 0.23 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1w3t h ALA 235 Cb 0.13 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1w3t h ALA 235 CO -0.15 0.16 -0.10 0.66 0.00 0.00 0.00 179.25 179.81 1w3t h SER 236 N 0.82 0.00 1.55 0.00 4.64 0.28 -2.39 113.55 118.45 1w3t h SER 236 Ca 0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 1w3t h SER 236 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1w3t h SER 236 CO -0.18 0.10 0.00 0.03 -0.87 0.00 0.00 176.83 175.92 1w3t h ARG 237 N 0.00 0.00 -0.37 4.77 3.08 -0.80 -2.81 114.38 118.25 1w3t h ARG 237 Ca -0.00 0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.11 1w3t h ARG 237 Cb 0.22 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.21 1w3t h ARG 237 CO 0.01 0.00 0.03 0.82 -1.07 0.00 0.00 179.97 179.77 1w3t h ILE 238 N 0.00 0.76 -0.01 2.04 2.04 -1.39 -3.04 117.51 117.90 1w3t h ILE 238 Ca 0.00 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.81 1w3t h ILE 238 Cb 0.77 0.60 0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1w3t h ILE 238 CO 0.00 0.03 -0.19 0.49 0.00 0.00 0.00 178.15 178.47 1w3t n PHE 239 N -5.15 0.00 0.00 1.37 3.01 -1.26 -5.04 117.46 110.40 1w3t n PHE 239 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.48 1w3t n PHE 239 Cb 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.65 1w3t n PHE 239 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1w3t n GLY 240 N 1.03 3.54 0.23 1.37 0.00 -1.15 -4.85 105.19 105.35 1w3t n GLY 240 Ca 0.07 -1.10 -0.12 0.00 0.00 0.00 0.00 46.02 44.88 1w3t n GLY 240 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1w3t h SER 241 N 0.00 0.79 -0.75 1.61 4.64 -1.75 0.15 113.55 118.25 1w3t h SER 241 Ca 0.00 -0.41 -0.04 0.00 -0.47 0.00 0.00 61.79 60.87 1w3t h SER 241 Cb 0.00 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 61.83 1w3t h SER 241 CO 0.00 1.16 0.32 -0.07 -0.87 0.00 0.00 176.83 177.37 1w3t h LEU 242 N 0.56 1.03 -0.07 5.97 3.38 -1.95 0.15 115.31 124.38 1w3t h LEU 242 Ca 0.02 -0.15 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 1w3t h LEU 242 Cb 1.08 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 41.57 1w3t h LEU 242 CO 0.11 0.91 -0.37 0.28 0.09 0.00 0.00 178.44 179.45 1w3t h SER 243 N 1.10 0.46 -0.11 -0.43 0.02 -1.83 -3.30 113.55 109.47 1w3t h SER 243 Ca 0.26 -0.65 -0.00 0.00 -0.84 0.00 0.00 61.79 60.55 1w3t h SER 243 Cb 0.19 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.59 1w3t h SER 243 CO -0.02 1.04 0.07 0.28 -1.14 0.00 0.00 176.83 177.05 1w3t h SER 244 N -0.09 0.13 -0.50 3.07 0.02 -0.54 -2.67 113.55 112.97 1w3t h SER 244 Ca -0.03 -0.00 0.14 0.00 -0.84 0.00 0.00 61.79 61.06 1w3t h SER 244 Cb 1.03 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.51 1w3t h SER 244 CO 0.08 0.10 0.35 0.78 -1.14 0.00 0.00 176.83 177.00 1w3t h ASN 245 N 0.15 0.04 -0.02 3.07 2.35 -0.80 -0.62 115.58 119.75 1w3t h ASN 245 Ca 0.04 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 1w3t h ASN 245 Cb -0.01 -0.01 -0.00 0.00 0.05 0.00 0.00 38.32 38.36 1w3t h ASN 245 CO -0.01 0.02 -0.01 1.88 -1.65 0.00 0.00 177.43 177.66 1w3t h TYR 246 N 0.04 0.05 -0.49 1.19 -1.99 -1.66 -2.00 116.97 112.11 1w3t h TYR 246 Ca 0.24 -0.01 -0.02 0.00 2.00 0.00 0.00 58.73 60.93 1w3t h TYR 246 Cb 0.89 -0.01 -0.02 0.00 2.00 0.00 0.00 36.73 39.58 1w3t h TYR 246 CO -0.00 0.46 0.22 0.28 -0.00 0.00 0.00 178.16 179.13 1w3t h VAL 247 N -0.38 1.20 -0.42 -2.88 2.07 -1.41 -2.51 116.25 111.92 1w3t h VAL 247 Ca 0.00 -0.58 -0.05 0.00 0.82 0.00 0.00 66.70 66.89 1w3t h VAL 247 Cb 0.45 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1w3t h VAL 247 CO 0.00 0.22 0.04 -0.07 0.02 0.00 0.00 177.57 177.79 1w3t h LEU 248 N 0.65 0.61 -0.16 2.57 3.38 -1.15 -0.59 115.31 120.63 1w3t h LEU 248 Ca 0.17 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1w3t h LEU 248 Cb 0.14 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 1w3t h LEU 248 CO -0.02 0.66 -0.03 0.74 0.09 0.00 0.00 178.44 179.88 1w3t h THR 249 N 0.63 1.28 -0.68 0.22 2.02 -1.14 0.22 112.91 115.45 1w3t h THR 249 Ca 0.13 -0.96 0.02 0.00 0.77 0.00 0.00 66.41 66.38 1w3t h THR 249 Cb 0.34 1.60 -0.04 0.00 -1.74 0.00 0.00 68.15 68.31 1w3t h THR 249 CO 0.01 0.28 0.43 0.50 0.37 0.00 0.00 175.52 177.11 1w3t h LYS 250 N 0.00 0.83 0.38 6.66 3.64 -1.33 0.74 116.57 127.49 1w3t h LYS 250 Ca 0.04 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1w3t h LYS 250 Cb 0.45 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 1w3t h LYS 250 CO 0.01 0.55 -0.18 -0.92 -2.27 0.00 0.00 179.45 176.64 1w3t h TYR 251 N 0.85 -0.47 0.05 1.91 3.20 -0.96 -1.07 116.97 120.48 1w3t h TYR 251 Ca 0.27 -0.01 -0.23 0.00 3.14 0.00 0.00 58.73 61.90 1w3t h TYR 251 Cb -0.01 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 1w3t h TYR 251 CO -0.04 -0.18 -1.06 0.74 -1.64 0.00 0.00 178.16 175.98 1w3t h PHE 252 N -0.72 0.29 0.00 -3.82 -1.00 -0.45 -3.37 116.94 107.87 1w3t h PHE 252 Ca -0.05 -0.20 0.00 0.00 2.81 0.00 0.00 57.97 60.53 1w3t h PHE 252 Cb 0.50 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 40.04 1w3t h PHE 252 CO -0.00 1.11 -1.57 1.04 -1.61 0.00 0.00 178.31 177.27 1w3t n GLN 253 N -3.52 0.71 -0.64 1.51 1.13 0.26 -5.00 117.38 111.82 1w3t n GLN 253 Ca -0.05 -0.12 0.00 0.00 -1.94 0.00 0.00 57.00 54.89 1w3t n GLN 253 Cb 0.93 -1.40 0.00 0.00 0.11 0.00 0.00 30.24 29.88 1w3t n GLN 253 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1w3t n GLY 254 N 1.46 0.71 3.31 1.08 0.00 -0.40 -5.00 105.19 106.34 1w3t n GLY 254 Ca -0.02 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.84 1w3t n GLY 254 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1w3t s TYR 255 N -2.29 1.50 0.31 1.61 -0.85 -1.25 -5.04 117.35 111.33 1w3t s TYR 255 Ca 0.00 -0.73 0.08 0.00 -0.52 0.00 0.00 57.07 55.89 1w3t s TYR 255 Cb 0.00 -0.77 -0.03 0.00 0.38 0.00 0.00 41.96 41.54 1w3t s TYR 255 CO 0.00 0.15 0.24 0.16 -1.52 0.00 0.00 175.55 174.58 1w3t s ASP 256 N -3.26 5.24 -0.17 -0.18 -4.77 -1.26 -3.36 116.67 108.91 1w3t s ASP 256 Ca 0.21 -0.48 0.16 0.00 -3.30 0.00 0.00 52.55 49.15 1w3t s ASP 256 Cb 0.02 -1.04 0.40 0.00 -1.09 0.00 0.00 42.92 41.21 1w3t s ASP 256 CO 0.05 -0.26 1.27 0.18 0.70 0.00 0.00 175.17 177.11 1w3t n LEU 257 N -1.28 3.04 0.00 2.11 4.77 -1.26 -4.95 117.00 119.43 1w3t n LEU 257 Ca -0.04 -3.27 0.00 0.00 -0.03 0.00 0.00 56.01 52.67 1w3t n LEU 257 Cb 0.59 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1w3t n LEU 257 CO 0.43 0.87 0.00 0.61 -1.33 0.00 0.00 177.39 177.96 1w3t n GLY 258 N -1.10 2.31 3.31 -0.72 0.00 -1.26 -3.86 105.19 103.87 1w3t n GLY 258 Ca 0.20 -0.34 -0.25 0.00 0.00 0.00 0.00 46.02 45.62 1w3t n GLY 258 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1w3t s TYR 259 N 0.00 1.93 1.06 1.61 1.51 -0.36 -4.88 117.35 118.23 1w3t s TYR 259 Ca 0.00 -0.41 -0.18 0.00 -1.01 0.00 0.00 57.07 55.48 1w3t s TYR 259 Cb 0.00 -1.06 0.25 0.00 -0.11 0.00 0.00 41.96 41.04 1w3t s TYR 259 CO 0.00 0.23 1.30 -1.25 -1.11 0.00 0.00 175.55 174.72 1w3t s PRO 260 N -1.89 -0.13 -0.33 -1.71 0.04 -1.26 -1.25 135.00 128.47 1w3t s PRO 260 Ca 0.08 -0.46 -0.09 0.00 0.04 0.00 0.00 61.00 60.57 1w3t s PRO 260 Cb -0.10 -1.76 0.01 0.00 0.04 0.00 0.00 34.50 32.69 1w3t s PRO 260 CO 0.04 -2.93 0.15 0.50 0.04 0.00 0.00 177.00 174.81 1w3t s ARG 261 N -5.86 3.09 0.25 4.56 3.52 -1.24 -4.83 118.95 118.43 1w3t s ARG 261 Ca 0.76 -0.88 -0.31 0.00 -0.13 0.00 0.00 55.73 55.17 1w3t s ARG 261 Cb -0.03 -3.56 -0.14 0.00 -1.56 0.00 0.00 34.95 29.66 1w3t s ARG 261 CO 0.54 -0.52 1.31 -2.30 -0.81 0.00 0.00 175.30 173.52 1w3t n PRO 262 N 4.95 1.82 0.00 5.12 -0.02 -1.26 -1.72 135.00 143.89 1w3t n PRO 262 Ca -0.13 0.65 0.08 0.00 -2.02 0.00 0.00 63.50 62.07 1w3t n PRO 262 Cb 0.48 -2.24 0.45 0.00 -0.02 0.00 0.00 33.50 32.17 1w3t n PRO 262 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1w3t n PRO 263 N 1.65 0.86 -2.31 0.52 -0.04 -1.26 -4.98 135.00 129.44 1w3t n PRO 263 Ca 0.11 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.22 1w3t n PRO 263 Cb 0.31 -1.28 -0.04 0.00 -0.04 0.00 0.00 33.50 32.45 1w3t n PRO 263 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1w3t s ILE 264 N -2.00 3.68 0.23 0.52 -1.09 -0.70 -5.01 121.20 116.84 1w3t s ILE 264 Ca 0.23 -0.49 -0.22 0.00 -2.23 0.00 0.00 60.65 57.94 1w3t s ILE 264 Cb 0.10 -4.55 -0.09 0.00 -1.58 0.00 0.00 42.46 36.35 1w3t s ILE 264 CO 0.18 -1.46 0.77 -0.36 -1.23 0.00 0.00 174.94 172.84 1w3t s PHE 265 N 7.41 3.69 0.55 3.97 0.40 -1.26 -3.74 117.98 129.00 1w3t s PHE 265 Ca 0.57 1.50 -0.21 0.00 -0.60 0.00 0.00 56.93 58.18 1w3t s PHE 265 Cb -0.04 -2.70 -0.05 0.00 0.51 0.00 0.00 43.02 40.75 1w3t s PHE 265 CO -0.03 0.33 1.28 -2.30 0.70 0.00 0.00 175.22 175.20 1w3t n PRO 266 N 0.80 1.53 -1.87 0.24 -0.02 -1.26 -4.75 135.00 129.67 1w3t n PRO 266 Ca -0.02 0.56 -0.39 0.00 -2.02 0.00 0.00 63.50 61.64 1w3t n PRO 266 Cb 0.51 -2.49 0.02 0.00 -0.02 0.00 0.00 33.50 31.52 1w3t n PRO 266 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1w3t s LEU 267 N -3.14 4.04 0.94 2.45 1.43 -1.26 -5.03 118.68 118.12 1w3t s LEU 267 Ca 0.72 2.78 -0.15 0.00 -1.03 0.00 0.00 54.13 56.45 1w3t s LEU 267 Cb -0.42 -4.06 0.18 0.00 0.03 0.00 0.00 46.19 41.91 1w3t s LEU 267 CO 0.49 -1.23 1.28 1.51 0.23 0.00 0.00 176.35 178.62 1w3t s ASP 268 N -0.76 3.29 0.18 2.29 1.47 -1.26 -4.83 116.67 117.06 1w3t s ASP 268 Ca 0.64 0.41 -0.13 0.00 1.18 0.00 0.00 52.55 54.66 1w3t s ASP 268 Cb -0.40 -0.58 0.18 0.00 -0.34 0.00 0.00 42.92 41.78 1w3t s ASP 268 CO 0.51 -2.64 1.74 0.44 0.68 0.00 0.00 175.17 175.89 1w3t h ASP 269 N -1.57 0.12 -0.55 2.11 5.19 -2.00 -1.26 116.42 118.46 1w3t h ASP 269 Ca -0.45 0.07 -0.11 0.00 -0.62 0.00 0.00 57.03 55.92 1w3t h ASP 269 Cb 1.26 0.07 -0.02 0.00 0.18 0.00 0.00 39.33 40.82 1w3t h ASP 269 CO 0.44 0.09 -0.09 -0.08 -3.12 0.00 0.00 179.24 176.49 1w3t h GLU 270 N 0.31 1.03 -0.45 3.56 4.57 -1.99 -2.01 114.58 119.60 1w3t h GLU 270 Ca 0.24 -0.37 -0.04 0.00 -1.18 0.00 0.00 59.36 58.00 1w3t h GLU 270 Cb 0.28 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.78 1w3t h GLU 270 CO -0.27 1.06 0.11 0.93 -1.18 0.00 0.00 179.01 179.67 1w3t h GLU 271 N 0.91 0.72 -0.93 1.92 5.08 -1.88 0.29 114.58 120.69 1w3t h GLU 271 Ca 0.14 -0.17 0.06 0.00 -1.00 0.00 0.00 59.36 58.40 1w3t h GLU 271 Cb 0.66 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.75 1w3t h GLU 271 CO 0.05 0.72 0.59 1.49 -1.00 0.00 0.00 179.01 180.85 1w3t h GLU 272 N 0.60 1.04 -0.20 2.33 4.81 -1.04 0.13 114.58 122.25 1w3t h GLU 272 Ca 0.14 -0.06 -0.11 0.00 -0.13 0.00 0.00 59.36 59.20 1w3t h GLU 272 Cb 0.32 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.46 1w3t h GLU 272 CO 0.00 0.69 -0.30 0.00 -0.73 0.00 0.00 179.01 178.67 1w3t h ARG 273 N 1.08 0.56 -0.72 1.92 3.08 -0.79 -0.13 114.38 119.38 1w3t h ARG 273 Ca 0.40 -0.33 0.02 0.00 0.07 0.00 0.00 59.98 60.14 1w3t h ARG 273 Cb 0.17 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.21 1w3t h ARG 273 CO -0.17 0.93 0.47 1.96 -1.07 0.00 0.00 179.97 182.09 1w3t h GLN 274 N 0.23 0.90 -0.20 0.04 4.20 -0.48 -1.82 115.11 117.99 1w3t h GLN 274 Ca 0.02 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1w3t h GLN 274 Cb 0.88 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 28.44 1w3t h GLN 274 CO 0.07 0.60 0.08 1.25 -0.67 0.00 0.00 178.83 180.15 1w3t h LEU 275 N 0.93 0.28 -0.72 1.46 5.85 -0.58 -2.12 115.31 120.41 1w3t h LEU 275 Ca 0.28 -0.17 0.08 0.00 0.84 0.00 0.00 57.88 58.91 1w3t h LEU 275 Cb -0.04 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 40.85 1w3t h LEU 275 CO -0.09 0.37 0.38 0.40 -0.34 0.00 0.00 178.44 179.17 1w3t h ILE 276 N 0.17 0.90 0.00 4.05 2.04 -0.89 -1.24 117.51 122.53 1w3t h ILE 276 Ca 0.07 -0.23 -0.05 0.00 1.00 0.00 0.00 64.86 65.65 1w3t h ILE 276 Cb 0.18 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.43 1w3t h ILE 276 CO -0.00 0.12 -0.22 0.11 0.00 0.00 0.00 178.15 178.16 1w3t h LYS 277 N 0.67 0.00 0.00 2.37 1.79 -1.14 -0.18 116.57 120.07 1w3t h LYS 277 Ca 0.34 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.74 1w3t h LYS 277 Cb 0.31 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.95 1w3t h LYS 277 CO -0.24 0.22 -0.33 0.87 -1.08 0.00 0.00 179.45 178.88 1w3t h LYS 278 N 0.00 0.00 -0.01 3.15 1.79 -0.55 -3.34 116.57 117.61 1w3t h LYS 278 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1w3t h LYS 278 Cb 0.43 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 1w3t h LYS 278 CO 0.03 0.33 -0.19 1.33 -1.08 0.00 0.00 179.45 179.87 1w3t n VAL 279 N -3.31 0.00 -0.18 0.50 0.24 -0.65 -4.61 118.33 110.33 1w3t n VAL 279 Ca 0.01 -0.40 -0.02 0.00 -2.04 0.00 0.00 64.34 61.89 1w3t n VAL 279 Cb 0.57 1.09 0.08 0.00 -1.47 0.00 0.00 33.84 34.12 1w3t n VAL 279 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 1w3t h GLU 280 N 0.86 0.34 -0.05 7.34 4.81 -1.20 0.12 114.58 126.80 1w3t h GLU 280 Ca 0.00 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.05 1w3t h GLU 280 Cb 0.28 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1w3t h GLU 280 CO 0.00 0.22 -0.68 0.78 -0.73 0.00 0.00 179.01 178.61 1w3t h GLY 281 N 0.35 0.25 1.12 1.92 0.00 -1.81 -2.16 103.07 102.74 1w3t h GLY 281 Ca 0.27 -0.35 -0.06 0.00 0.00 0.00 0.00 47.33 47.19 1w3t h GLY 281 CO -0.29 0.31 0.19 -2.22 0.00 0.00 0.00 176.54 174.53 1w3t h ILE 282 N 0.16 1.26 -0.84 2.60 2.04 -1.59 -2.08 117.51 119.05 1w3t h ILE 282 Ca -0.02 -0.93 0.01 0.00 1.00 0.00 0.00 64.86 64.93 1w3t h ILE 282 Cb 1.22 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 37.77 1w3t h ILE 282 CO 0.10 0.36 0.56 -0.09 0.00 0.00 0.00 178.15 179.08 1w3t h ARG 283 N 1.05 1.09 -0.43 2.37 2.43 -0.50 -0.26 114.38 120.14 1w3t h ARG 283 Ca 0.22 -0.07 -0.14 0.00 -0.81 0.00 0.00 59.98 59.18 1w3t h ARG 283 Cb 0.34 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1w3t h ARG 283 CO -0.00 0.72 -0.29 0.00 -1.51 0.00 0.00 179.97 178.89 1w3t h ALA 284 N 1.48 0.61 -0.76 2.80 0.00 -1.17 -1.57 119.26 120.66 1w3t h ALA 284 Ca 0.31 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 1w3t h ALA 284 Cb -0.10 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1w3t h ALA 284 CO -0.07 0.65 0.34 0.87 0.00 0.00 0.00 179.25 181.04 1w3t h LYS 285 N 0.79 1.09 -0.18 0.00 1.57 -0.59 -1.03 116.57 118.22 1w3t h LYS 285 Ca 0.08 -0.17 -0.12 0.00 -1.87 0.00 0.00 60.65 58.58 1w3t h LYS 285 Cb 0.88 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 1w3t h LYS 285 CO 0.08 0.86 -0.40 -0.07 -0.57 0.00 0.00 179.45 179.35 1w3t h LEU 286 N 1.08 0.43 -0.25 2.94 3.38 -0.94 0.60 115.31 122.55 1w3t h LEU 286 Ca 0.26 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1w3t h LEU 286 Cb 0.14 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1w3t h LEU 286 CO -0.03 0.79 0.09 0.58 0.09 0.00 0.00 178.44 179.96 1w3t h VAL 287 N 0.34 1.18 -0.61 1.22 2.07 -0.92 -0.18 116.25 119.35 1w3t h VAL 287 Ca 0.03 -0.56 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 1w3t h VAL 287 Cb 0.85 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 31.68 1w3t h VAL 287 CO 0.07 0.18 0.33 -0.08 0.02 0.00 0.00 177.57 178.09 1w3t h GLU 288 N 0.25 0.85 0.00 1.57 4.81 -0.96 0.11 114.58 121.20 1w3t h GLU 288 Ca 0.08 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1w3t h GLU 288 Cb 0.20 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.41 1w3t h GLU 288 CO -0.01 0.63 0.00 1.28 -0.73 0.00 0.00 179.01 180.19 1w3t n LEU 289 N -4.38 0.00 -1.30 1.64 4.77 0.18 -4.89 117.00 113.02 1w3t n LEU 289 Ca 0.06 0.08 -0.17 0.00 -0.03 0.00 0.00 56.01 55.95 1w3t n LEU 289 Cb 0.11 -0.08 -0.07 0.00 -2.33 0.00 0.00 43.42 41.05 1w3t n LEU 289 CO 0.37 -0.02 -0.16 0.29 -1.33 0.00 0.00 177.39 176.54 1w3t n LYS 290 N -1.08 -1.17 0.06 3.23 5.02 0.38 -4.90 118.16 119.70 1w3t n LYS 290 Ca 0.16 1.08 -0.17 0.00 -2.02 0.00 0.00 58.31 57.36 1w3t n LYS 290 Cb 0.11 -5.29 -0.08 0.00 -0.02 0.00 0.00 35.03 29.75 1w3t n LYS 290 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1w3t h ILE 291 N 0.00 1.34 -3.64 -0.18 2.04 -1.26 -3.46 117.51 112.35 1w3t h ILE 291 Ca -0.34 -2.38 -0.67 0.00 1.00 0.00 0.00 64.86 62.46 1w3t h ILE 291 Cb 1.10 2.45 -0.20 0.00 -0.74 0.00 0.00 36.82 39.42 1w3t h ILE 291 CO 0.50 0.72 -0.83 -0.76 0.00 0.00 0.00 178.15 177.78 1w3t s LEU 292 N -7.89 2.49 0.41 1.44 1.43 -1.10 -4.93 118.68 110.53 1w3t s LEU 292 Ca -0.08 -0.72 -0.10 0.00 -1.03 0.00 0.00 54.13 52.20 1w3t s LEU 292 Cb 0.08 -1.32 -0.06 0.00 0.03 0.00 0.00 46.19 44.91 1w3t s LEU 292 CO 0.90 0.16 0.77 -0.54 0.23 0.00 0.00 176.35 177.87 1w3t s LYS 293 N -2.27 3.76 0.00 1.70 -0.14 -1.26 -4.19 119.74 117.34 1w3t s LYS 293 Ca 0.17 0.45 0.00 0.00 -1.36 0.00 0.00 55.97 55.24 1w3t s LYS 293 Cb -0.10 -2.39 0.00 0.00 -1.68 0.00 0.00 37.83 33.67 1w3t s LYS 293 CO 0.09 -0.05 0.00 -1.91 -0.76 0.00 0.00 175.35 172.71