#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 1.46 -0.19 -0.52 2.02 -0.23 -4.93 118.70 116.31 1w3t s GLU 3 Ca 0.00 -1.50 -0.06 0.00 0.02 0.00 0.00 54.97 53.43 1w3t s GLU 3 Cb 0.00 -1.71 -0.03 0.00 0.10 0.00 0.00 34.13 32.49 1w3t s GLU 3 CO 0.00 0.36 0.02 0.42 0.02 0.00 0.00 175.26 176.08 1w3t s ILE 4 N -1.78 4.23 -0.14 -1.63 -1.09 -1.26 -1.65 121.20 117.87 1w3t s ILE 4 Ca 0.20 -0.22 0.01 0.00 -2.23 0.00 0.00 60.65 58.40 1w3t s ILE 4 Cb -0.07 -2.91 -0.00 0.00 -1.58 0.00 0.00 42.46 37.89 1w3t s ILE 4 CO 0.09 0.44 -0.16 -0.63 -1.23 0.00 0.00 174.94 173.45 1w3t s ILE 5 N 0.76 2.66 -0.21 2.92 1.01 0.13 -0.97 121.20 127.49 1w3t s ILE 5 Ca 0.01 -0.79 -0.20 0.00 0.00 0.00 0.00 60.65 59.68 1w3t s ILE 5 Cb -0.14 -2.10 -0.03 0.00 0.01 0.00 0.00 42.46 40.20 1w3t s ILE 5 CO 0.02 0.53 0.58 -0.89 0.00 0.00 0.00 174.94 175.18 1w3t s THR 6 N 0.61 5.05 -0.79 2.92 2.01 -0.68 -1.17 115.64 123.59 1w3t s THR 6 Ca -0.09 1.07 -0.26 0.00 0.31 0.00 0.00 61.69 62.72 1w3t s THR 6 Cb -0.16 -3.90 0.03 0.00 0.01 0.00 0.00 72.50 68.49 1w3t s THR 6 CO 0.03 0.12 1.30 -2.16 -0.69 0.00 0.00 174.62 173.22 1w3t s PRO 7 N 1.94 3.26 0.19 4.92 0.04 -1.26 -0.26 135.00 143.83 1w3t s PRO 7 Ca 0.26 -0.40 -0.30 0.00 0.04 0.00 0.00 61.00 60.60 1w3t s PRO 7 Cb -0.16 -4.38 -0.08 0.00 0.04 0.00 0.00 34.50 29.92 1w3t s PRO 7 CO 0.10 -2.15 1.16 -1.50 0.04 0.00 0.00 177.00 174.64 1w3t s ILE 8 N 5.58 3.68 0.39 0.56 2.07 -0.74 -4.45 121.20 128.30 1w3t s ILE 8 Ca 0.37 1.44 -0.28 0.00 -1.41 0.00 0.00 60.65 60.77 1w3t s ILE 8 Cb -0.07 -3.92 -0.11 0.00 0.13 0.00 0.00 42.46 38.50 1w3t s ILE 8 CO 0.11 0.24 1.49 -0.63 -1.91 0.00 0.00 174.94 174.24 1w3t s ILE 9 N -0.17 2.00 -0.40 2.00 1.01 -1.26 -3.43 121.20 120.95 1w3t s ILE 9 Ca 0.51 0.00 -0.17 0.00 0.00 0.00 0.00 60.65 60.99 1w3t s ILE 9 Cb -0.31 -3.00 0.01 0.00 0.01 0.00 0.00 42.46 39.17 1w3t s ILE 9 CO 0.36 0.00 0.45 -0.89 0.00 0.00 0.00 174.94 174.86 1w3t s THR 10 N -1.13 5.07 -0.02 2.92 2.01 -1.26 -4.93 115.64 118.30 1w3t s THR 10 Ca 0.54 -0.16 -0.28 0.00 0.31 0.00 0.00 61.69 62.10 1w3t s THR 10 Cb -0.47 -4.01 -0.03 0.00 0.01 0.00 0.00 72.50 68.00 1w3t s THR 10 CO 0.63 -0.36 0.91 -2.16 -0.69 0.00 0.00 174.62 172.95 1w3t s PRO 11 N 2.21 4.52 0.06 4.92 0.04 -1.26 -4.75 135.00 140.74 1w3t s PRO 11 Ca 0.14 1.27 0.03 0.00 0.04 0.00 0.00 61.00 62.48 1w3t s PRO 11 Cb -0.16 -3.46 -0.04 0.00 0.04 0.00 0.00 34.50 30.88 1w3t s PRO 11 CO 0.14 -0.03 0.06 -0.06 0.04 0.00 0.00 177.00 177.15 1w3t s PHE 12 N 0.99 3.17 1.02 0.56 0.40 -0.16 -0.39 117.98 123.56 1w3t s PHE 12 Ca 0.48 0.08 -0.15 0.00 -0.60 0.00 0.00 56.93 56.75 1w3t s PHE 12 Cb -0.20 -1.63 0.20 0.00 0.51 0.00 0.00 43.02 41.90 1w3t s PHE 12 CO 0.25 0.51 1.14 0.95 0.70 0.00 0.00 175.22 178.78 1w3t s THR 13 N -1.33 1.90 0.51 0.64 -4.23 0.18 -1.79 115.64 111.52 1w3t s THR 13 Ca 0.27 0.00 0.24 0.00 -1.18 0.00 0.00 61.69 61.02 1w3t s THR 13 Cb -0.12 -2.65 0.29 0.00 1.34 0.00 0.00 72.50 71.36 1w3t s THR 13 CO 0.19 0.00 2.14 0.11 -0.54 0.00 0.00 174.62 176.53 1w3t h LYS 14 N -1.90 0.00 -0.97 3.99 1.57 -1.97 -0.73 116.57 116.56 1w3t h LYS 14 Ca -0.49 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 57.80 1w3t h LYS 14 Cb 1.31 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 33.33 1w3t h LYS 14 CO 0.51 0.07 0.61 -0.40 -0.57 0.00 0.00 179.45 179.67 1w3t n ASP 15 N -3.97 3.88 -2.15 0.86 5.75 -1.26 -4.96 116.55 114.70 1w3t n ASP 15 Ca -0.03 -3.57 -0.15 0.00 -0.01 0.00 0.00 54.79 51.04 1w3t n ASP 15 Cb 0.16 -0.83 0.03 0.00 -1.03 0.00 0.00 41.12 39.44 1w3t n ASP 15 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1w3t n ASN 16 N -1.03 -4.67 -4.60 -1.12 5.15 -0.28 -5.02 115.26 103.68 1w3t n ASN 16 Ca 0.58 -0.21 -0.24 0.00 -0.60 0.00 0.00 54.58 54.11 1w3t n ASN 16 Cb 1.65 -3.50 -0.09 0.00 -0.53 0.00 0.00 39.78 37.31 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 -5.38 2.04 0.09 1.20 1.81 -1.26 -4.86 118.95 112.60 1w3t s ARG 17 Ca 0.22 -1.68 -0.31 0.00 -1.72 0.00 0.00 55.73 52.25 1w3t s ARG 17 Cb -0.10 -1.95 -0.09 0.00 -0.45 0.00 0.00 34.95 32.36 1w3t s ARG 17 CO 0.28 0.23 1.78 0.42 -0.68 0.00 0.00 175.30 177.33 1w3t s ILE 18 N -2.47 2.79 -1.01 1.52 1.01 -1.26 0.47 121.20 122.25 1w3t s ILE 18 Ca 0.33 0.21 -0.21 0.00 0.00 0.00 0.00 60.65 60.98 1w3t s ILE 18 Cb -0.02 -3.13 0.09 0.00 0.01 0.00 0.00 42.46 39.40 1w3t s ILE 18 CO 0.19 -0.00 1.34 -0.62 0.00 0.00 0.00 174.94 175.84 1w3t s ASP 19 N 2.85 6.59 0.37 3.58 -1.08 0.48 -4.75 116.67 124.71 1w3t s ASP 19 Ca 0.79 -1.79 0.12 0.00 -0.52 0.00 0.00 52.55 51.15 1w3t s ASP 19 Cb -0.43 -2.50 0.90 0.00 -1.46 0.00 0.00 42.92 39.43 1w3t s ASP 19 CO 0.35 -1.29 1.85 0.11 0.52 0.00 0.00 175.17 176.72 1w3t h LYS 20 N 9.21 0.58 0.00 4.34 1.57 -1.91 -2.14 116.57 128.22 1w3t h LYS 20 Ca 0.20 -0.04 -0.22 0.00 -1.87 0.00 0.00 60.65 58.73 1w3t h LYS 20 Cb 1.00 -0.13 0.02 0.00 0.08 0.00 0.00 32.23 33.20 1w3t h LYS 20 CO 1.30 0.39 -0.85 0.93 -0.57 0.00 0.00 179.45 180.65 1w3t h GLU 21 N 0.60 0.57 -0.30 3.15 4.39 -1.98 -1.24 114.58 119.77 1w3t h GLU 21 Ca 0.47 -0.62 -0.04 0.00 0.34 0.00 0.00 59.36 59.52 1w3t h GLU 21 Cb 0.90 0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 29.71 1w3t h GLU 21 CO -0.22 1.23 0.02 0.87 -1.16 0.00 0.00 179.01 179.76 1w3t h LYS 22 N 0.16 0.45 -0.42 2.33 1.57 -1.87 -1.45 116.57 117.34 1w3t h LYS 22 Ca -0.11 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.51 1w3t h LYS 22 Cb 1.53 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.75 1w3t h LYS 22 CO 0.17 0.46 -0.07 1.25 -0.57 0.00 0.00 179.45 180.69 1w3t h LEU 23 N 0.44 0.78 -0.52 2.94 6.46 -1.21 -1.29 115.31 122.91 1w3t h LEU 23 Ca 0.10 -0.34 -0.07 0.00 -0.12 0.00 0.00 57.88 57.44 1w3t h LEU 23 Cb 0.25 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 39.95 1w3t h LEU 23 CO 0.00 0.94 0.04 0.11 -0.62 0.00 0.00 178.44 178.92 1w3t h LYS 24 N 0.61 0.89 -0.75 1.25 1.57 -0.89 -0.84 116.57 118.42 1w3t h LYS 24 Ca 0.11 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1w3t h LYS 24 Cb 0.58 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.76 1w3t h LYS 24 CO 0.03 0.90 0.47 0.82 -0.57 0.00 0.00 179.45 181.11 1w3t h ILE 25 N 0.77 1.20 0.12 1.86 1.08 -1.10 -2.09 117.51 119.36 1w3t h ILE 25 Ca 0.15 -0.41 -0.01 0.00 -0.39 0.00 0.00 64.86 64.21 1w3t h ILE 25 Cb 0.47 0.13 0.00 0.00 -3.07 0.00 0.00 36.82 34.35 1w3t h ILE 25 CO 0.02 0.20 -0.06 -0.74 -0.69 0.00 0.00 178.15 176.88 1w3t h HIS 26 N 1.02 -0.15 -0.61 1.37 2.76 -0.97 -2.44 115.15 116.13 1w3t h HIS 26 Ca 0.27 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.47 1w3t h HIS 26 Cb -0.08 0.05 -0.03 0.00 1.55 0.00 0.00 27.41 28.90 1w3t h HIS 26 CO -0.02 0.08 0.40 0.00 -1.30 0.00 0.00 177.93 177.09 1w3t h ALA 27 N 0.49 1.67 -0.15 5.26 0.00 -0.99 -1.36 119.26 124.17 1w3t h ALA 27 Ca -0.02 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1w3t h ALA 27 Cb 0.29 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1w3t h ALA 27 CO 0.03 0.27 -0.10 0.93 0.00 0.00 0.00 179.25 180.38 1w3t h GLU 28 N 0.73 0.34 -0.04 0.00 5.08 -1.34 -2.00 114.58 117.34 1w3t h GLU 28 Ca 0.24 -0.16 0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1w3t h GLU 28 Cb 0.06 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 1w3t h GLU 28 CO -0.06 0.68 -0.10 -0.97 -1.00 0.00 0.00 179.01 177.55 1w3t h ASN 29 N -0.01 -0.30 -0.24 1.42 -1.24 -1.08 0.16 115.58 114.28 1w3t h ASN 29 Ca 0.03 0.05 0.05 0.00 0.71 0.00 0.00 56.30 57.14 1w3t h ASN 29 Cb 0.59 0.14 -0.04 0.00 0.73 0.00 0.00 38.32 39.74 1w3t h ASN 29 CO 0.03 -0.14 -0.03 -0.07 -1.29 0.00 0.00 177.43 175.92 1w3t h LEU 30 N -0.16 -0.17 -0.50 0.34 3.38 -1.16 0.30 115.31 117.34 1w3t h LEU 30 Ca 0.05 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.10 1w3t h LEU 30 Cb 0.23 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1w3t h LEU 30 CO -0.13 -0.05 0.32 0.40 0.09 0.00 0.00 178.44 179.06 1w3t h ILE 31 N 0.03 1.09 -0.60 1.22 1.08 -1.19 -2.11 117.51 117.04 1w3t h ILE 31 Ca 0.12 -0.22 0.07 0.00 -0.39 0.00 0.00 64.86 64.44 1w3t h ILE 31 Cb 0.17 0.39 -0.04 0.00 -3.07 0.00 0.00 36.82 34.27 1w3t h ILE 31 CO -0.23 0.12 0.40 -0.09 -0.69 0.00 0.00 178.15 177.66 1w3t h ARG 32 N 0.64 0.51 -0.23 2.37 2.43 -0.23 -1.90 114.38 117.97 1w3t h ARG 32 Ca 0.19 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1w3t h ARG 32 Cb -0.03 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.40 1w3t h ARG 32 CO -0.06 0.34 0.00 1.63 -1.51 0.00 0.00 179.97 180.36 1w3t n LYS 33 N -4.48 1.61 0.00 0.20 5.02 0.05 -4.90 118.16 115.67 1w3t n LYS 33 Ca 0.09 -0.94 0.00 0.00 -2.02 0.00 0.00 58.31 55.44 1w3t n LYS 33 Cb 0.28 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 34.04 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 0.97 0.78 3.75 0.72 0.00 -0.71 -4.70 105.19 105.99 1w3t n GLY 34 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 2.81 -0.05 -0.61 -1.09 -0.90 -4.89 121.20 114.47 1w3t s ILE 35 Ca 0.00 0.73 -0.25 0.00 -2.23 0.00 0.00 60.65 58.90 1w3t s ILE 35 Cb 0.00 -3.47 -0.22 0.00 -1.58 0.00 0.00 42.46 37.19 1w3t s ILE 35 CO 0.00 0.14 1.09 0.44 -1.23 0.00 0.00 174.94 175.38 1w3t h ASP 36 N 4.40 0.15 -5.21 3.58 3.32 -1.40 -3.42 116.42 117.84 1w3t h ASP 36 Ca -0.47 -0.70 -0.07 0.00 0.02 0.00 0.00 57.03 55.80 1w3t h ASP 36 Cb 1.22 -0.05 -0.11 0.00 0.22 0.00 0.00 39.33 40.61 1w3t h ASP 36 CO 0.72 0.83 -0.19 -0.54 -1.72 0.00 0.00 179.24 178.35 1w3t s LYS 37 N -3.41 1.28 -0.07 3.56 1.02 -1.24 -4.90 119.74 115.97 1w3t s LYS 37 Ca -0.16 -1.10 0.04 0.00 0.02 0.00 0.00 55.97 54.77 1w3t s LYS 37 Cb 0.01 0.43 0.00 0.00 -0.52 0.00 0.00 37.83 37.76 1w3t s LYS 37 CO 0.72 -0.50 -0.19 -0.51 -0.92 0.00 0.00 175.35 173.95 1w3t s LEU 38 N -2.95 1.90 -0.32 3.17 1.43 0.30 -1.68 118.68 120.53 1w3t s LEU 38 Ca 0.16 -0.42 -0.09 0.00 -1.03 0.00 0.00 54.13 52.74 1w3t s LEU 38 Cb 0.01 -1.11 0.00 0.00 0.03 0.00 0.00 46.19 45.13 1w3t s LEU 38 CO 0.01 0.12 0.14 0.12 0.23 0.00 0.00 176.35 176.97 1w3t s PHE 39 N 0.36 3.18 -0.09 0.29 5.36 0.64 0.26 117.98 127.99 1w3t s PHE 39 Ca -0.13 -0.76 -0.02 0.00 -0.96 0.00 0.00 56.93 55.05 1w3t s PHE 39 Cb -0.16 -2.34 -0.03 0.00 -0.34 0.00 0.00 43.02 40.15 1w3t s PHE 39 CO 0.05 -0.53 0.01 0.08 -1.46 0.00 0.00 175.22 173.38 1w3t s VAL 40 N 1.57 4.37 -1.23 3.12 1.01 0.23 -1.80 120.40 127.68 1w3t s VAL 40 Ca 0.03 -0.22 -0.04 0.00 0.00 0.00 0.00 61.98 61.75 1w3t s VAL 40 Cb -0.17 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.37 1w3t s VAL 40 CO 0.05 0.61 0.53 0.59 0.00 0.00 0.00 175.10 176.88 1w3t n ASN 41 N 2.13 -5.25 -2.00 3.32 3.02 -1.26 -0.67 115.26 114.56 1w3t n ASN 41 Ca -0.19 -0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.11 1w3t n ASN 41 Cb 0.54 -4.07 0.00 0.00 -0.61 0.00 0.00 39.78 35.64 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 -1.41 0.09 0.17 7.41 0.00 -1.26 -3.95 105.19 106.25 1w3t n GLY 42 Ca -0.08 -1.85 -0.09 0.00 0.00 0.00 0.00 46.02 44.00 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 -0.60 1.15 -0.42 2.61 2.02 -1.95 0.27 112.91 115.99 1w3t h THR 43 Ca 0.00 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 66.77 1w3t h THR 43 Cb 0.00 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 1w3t h THR 43 CO 0.00 0.16 0.27 0.74 0.37 0.00 0.00 175.52 177.06 1w3t h THR 44 N 0.47 1.11 -0.14 3.16 2.02 -1.90 -0.78 112.91 116.84 1w3t h THR 44 Ca 0.13 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 67.08 1w3t h THR 44 Cb 0.08 0.50 0.00 0.00 -1.74 0.00 0.00 68.15 66.99 1w3t h THR 44 CO -0.02 0.11 0.00 0.61 0.37 0.00 0.00 175.52 176.59 1w3t n GLY 45 N -1.44 0.20 3.73 2.16 0.00 -0.99 -4.43 105.19 104.42 1w3t n GLY 45 Ca 0.03 -0.17 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.01 -2.40 -0.24 0.99 4.77 -0.30 -4.24 117.00 115.56 1w3t n LEU 46 Ca 0.05 -0.66 0.01 0.00 -0.03 0.00 0.00 56.01 55.38 1w3t n LEU 46 Cb 0.20 -2.53 0.09 0.00 -2.33 0.00 0.00 43.42 38.85 1w3t n LEU 46 CO 0.04 0.40 0.75 1.23 -1.33 0.00 0.00 177.39 178.48 1w3t h GLY 47 N -1.85 0.56 2.00 -0.72 0.00 -0.61 -0.06 103.07 102.39 1w3t h GLY 47 Ca -0.55 0.20 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 1w3t h GLY 47 CO 0.64 -0.27 -0.00 -2.55 0.00 0.00 0.00 176.54 174.36 1w3t h PRO 48 N 0.02 0.00 -0.01 4.80 0.11 -1.83 -1.80 132.00 133.28 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 0.54 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.65 1w3t h PRO 48 CO -0.70 0.00 -0.14 0.43 -0.21 0.00 0.00 178.00 177.38 1w3t n SER 49 N -3.17 0.93 -4.73 -2.05 7.64 -0.04 -4.85 113.62 107.35 1w3t n SER 49 Ca -0.03 -0.95 -0.35 0.00 1.01 0.00 0.00 58.87 58.55 1w3t n SER 49 Cb 0.08 0.04 -0.08 0.00 -1.01 0.00 0.00 64.21 63.23 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 -2.35 4.16 1.05 -3.43 1.43 -0.68 -5.10 118.68 113.75 1w3t s LEU 50 Ca 0.30 0.23 -0.12 0.00 -1.03 0.00 0.00 54.13 53.51 1w3t s LEU 50 Cb 0.20 -2.06 0.22 0.00 0.03 0.00 0.00 46.19 44.58 1w3t s LEU 50 CO 0.46 0.21 1.07 -0.94 0.23 0.00 0.00 176.35 177.37 1w3t s SER 51 N 0.20 1.92 0.31 2.29 1.04 -1.26 -4.73 113.70 113.48 1w3t s SER 51 Ca 0.08 1.68 -0.00 0.00 0.48 0.00 0.00 55.95 58.18 1w3t s SER 51 Cb -0.11 -2.34 0.51 0.00 0.10 0.00 0.00 66.02 64.18 1w3t s SER 51 CO -0.01 -3.64 1.96 -0.65 0.98 0.00 0.00 173.24 171.88 1w3t h PRO 52 N -2.24 0.95 -0.46 4.02 0.11 -1.96 0.65 132.00 133.06 1w3t h PRO 52 Ca -0.55 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.49 1w3t h PRO 52 Cb 1.31 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 1w3t h PRO 52 CO 0.49 0.66 0.30 0.93 -0.21 0.00 0.00 178.00 180.17 1w3t h GLU 53 N 0.96 0.61 -0.24 1.05 3.07 -1.99 -1.13 114.58 116.91 1w3t h GLU 53 Ca 0.25 -0.04 -0.13 0.00 -0.50 0.00 0.00 59.36 58.95 1w3t h GLU 53 Cb -0.04 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.72 1w3t h GLU 53 CO -0.05 0.41 -0.38 0.93 -1.40 0.00 0.00 179.01 178.52 1w3t h GLU 54 N 0.62 0.54 -0.85 2.33 5.08 -1.71 -1.18 114.58 119.41 1w3t h GLU 54 Ca 0.17 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1w3t h GLU 54 Cb -0.06 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.15 1w3t h GLU 54 CO -0.04 0.84 0.53 0.87 -1.00 0.00 0.00 179.01 180.21 1w3t h LYS 55 N 0.45 1.14 -0.57 2.33 1.57 -0.54 -1.46 116.57 119.49 1w3t h LYS 55 Ca 0.04 -0.09 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 1w3t h LYS 55 Cb 0.87 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.91 1w3t h LYS 55 CO 0.07 0.79 0.25 1.25 -0.57 0.00 0.00 179.45 181.25 1w3t h LEU 56 N 1.16 0.77 -0.76 2.94 5.85 -0.93 -2.55 115.31 121.78 1w3t h LEU 56 Ca 0.31 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.92 1w3t h LEU 56 Cb -0.07 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 40.71 1w3t h LEU 56 CO -0.06 0.70 0.47 -0.33 -0.34 0.00 0.00 178.44 178.89 1w3t h GLU 57 N 0.78 0.89 -0.33 1.25 5.08 -0.92 -0.20 114.58 121.13 1w3t h GLU 57 Ca 0.19 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.51 1w3t h GLU 57 Cb 0.16 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 1w3t h GLU 57 CO -0.02 0.59 0.19 -0.91 -1.00 0.00 0.00 179.01 177.86 1w3t h ASN 58 N 0.91 0.31 -0.24 1.42 2.35 -1.23 -1.12 115.58 117.98 1w3t h ASN 58 Ca 0.31 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 56.10 1w3t h ASN 58 Cb 0.05 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 38.32 1w3t h ASN 58 CO -0.12 0.22 0.03 0.25 -1.65 0.00 0.00 177.43 176.16 1w3t h LEU 59 N 0.39 -0.02 -0.59 1.61 5.85 -0.90 -2.02 115.31 119.63 1w3t h LEU 59 Ca 0.13 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.92 1w3t h LEU 59 Cb 0.00 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 1w3t h LEU 59 CO -0.06 0.02 0.35 0.11 -0.34 0.00 0.00 178.44 178.52 1w3t h LYS 60 N 0.12 0.66 -0.09 1.25 1.57 -0.88 0.07 116.57 119.27 1w3t h LYS 60 Ca 0.11 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1w3t h LYS 60 Cb 0.12 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 1w3t h LYS 60 CO -0.16 0.44 0.00 0.00 -0.57 0.00 0.00 179.45 179.16 1w3t h ALA 61 N 1.27 0.13 -0.55 3.86 0.00 -1.05 -2.61 119.26 120.30 1w3t h ALA 61 Ca 0.24 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1w3t h ALA 61 Cb 0.05 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1w3t h ALA 61 CO -0.12 -0.20 0.01 0.28 0.00 0.00 0.00 179.25 179.23 1w3t h VAL 62 N -0.11 1.25 0.00 0.00 2.07 -1.07 -2.69 116.25 115.71 1w3t h VAL 62 Ca 0.03 -1.07 -0.00 0.00 0.82 0.00 0.00 66.70 66.47 1w3t h VAL 62 Cb 0.34 0.82 -0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1w3t h VAL 62 CO 0.00 0.38 -0.02 0.22 0.02 0.00 0.00 177.57 178.18 1w3t h TYR 63 N 0.86 0.00 -0.72 1.57 3.20 -0.89 0.27 116.97 121.27 1w3t h TYR 63 Ca 0.16 0.00 0.14 0.00 3.14 0.00 0.00 58.73 62.17 1w3t h TYR 63 Cb 0.49 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 38.72 1w3t h TYR 63 CO 0.03 0.02 0.48 -0.44 -1.64 0.00 0.00 178.16 176.61 1w3t h ASP 64 N 0.00 0.36 0.11 -2.11 3.32 -1.11 -3.22 116.42 113.76 1w3t h ASP 64 Ca -0.00 0.02 -0.36 0.00 0.02 0.00 0.00 57.03 56.71 1w3t h ASP 64 Cb 0.05 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.52 1w3t h ASP 64 CO 0.00 0.19 -2.01 0.52 -1.72 0.00 0.00 179.24 176.22 1w3t n VAL 65 N -4.47 1.74 -3.47 -1.35 0.31 0.86 -5.03 118.33 106.93 1w3t n VAL 65 Ca 0.13 -0.62 -0.15 0.00 -0.01 0.00 0.00 64.34 63.70 1w3t n VAL 65 Cb 0.51 -1.72 -0.04 0.00 -0.91 0.00 0.00 33.84 31.68 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 -2.54 0.00 -2.60 2.52 -1.32 -0.57 -5.01 115.64 106.12 1w3t s THR 66 Ca -0.24 0.00 0.25 0.00 -1.21 0.00 0.00 61.69 60.49 1w3t s THR 66 Cb 0.07 -1.00 0.30 0.00 -1.51 0.00 0.00 72.50 70.36 1w3t s THR 66 CO 0.74 0.00 1.44 -0.46 -2.21 0.00 0.00 174.62 174.13 1w3t n ASN 67 N 0.24 2.18 -3.56 8.08 2.04 -1.26 -3.96 115.26 119.01 1w3t n ASN 67 Ca -0.17 -1.67 -0.41 0.00 -0.44 0.00 0.00 54.58 51.89 1w3t n ASN 67 Cb 0.61 0.07 -0.01 0.00 -2.53 0.00 0.00 39.78 37.92 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 0.59 3.45 -5.13 -3.83 4.76 -1.26 -3.58 118.16 113.16 1w3t n LYS 68 Ca 0.15 -2.65 -0.30 0.00 -2.87 0.00 0.00 58.31 52.64 1w3t n LYS 68 Cb 0.48 -2.99 -0.16 0.00 -1.84 0.00 0.00 35.03 30.51 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 1.85 -0.23 -0.18 1.01 -1.26 -0.54 121.20 123.86 1w3t s ILE 69 Ca 0.55 -0.96 -0.07 0.00 0.00 0.00 0.00 60.65 60.18 1w3t s ILE 69 Cb 0.15 -1.56 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 1w3t s ILE 69 CO -0.07 0.52 0.07 -0.63 0.00 0.00 0.00 174.94 174.83 1w3t s ILE 70 N -0.14 4.40 -0.51 2.92 1.01 0.14 -1.45 121.20 127.56 1w3t s ILE 70 Ca -0.02 -0.15 -0.17 0.00 0.00 0.00 0.00 60.65 60.31 1w3t s ILE 70 Cb -0.13 -3.04 0.09 0.00 0.01 0.00 0.00 42.46 39.40 1w3t s ILE 70 CO 0.03 0.37 0.51 0.12 0.00 0.00 0.00 174.94 175.96 1w3t s PHE 71 N 1.33 3.18 -0.04 3.97 5.36 -0.40 -0.60 117.98 130.78 1w3t s PHE 71 Ca 0.05 -0.97 -0.30 0.00 -0.96 0.00 0.00 56.93 54.75 1w3t s PHE 71 Cb -0.15 -3.53 -0.03 0.00 -0.34 0.00 0.00 43.02 38.98 1w3t s PHE 71 CO 0.03 -0.97 1.04 -1.14 -1.46 0.00 0.00 175.22 172.72 1w3t s GLN 72 N 1.94 4.48 0.00 10.12 -0.44 0.16 -1.17 119.66 134.74 1w3t s GLN 72 Ca 0.07 1.47 0.00 0.00 -2.50 0.00 0.00 55.36 54.40 1w3t s GLN 72 Cb -0.25 -3.49 0.00 0.00 -1.64 0.00 0.00 33.01 27.63 1w3t s GLN 72 CO 0.06 -0.20 0.36 1.33 0.50 0.00 0.00 175.29 177.33 1w3t n VAL 73 N 4.20 0.00 -1.35 1.34 0.24 -0.04 -4.68 118.33 118.03 1w3t n VAL 73 Ca 0.08 -0.37 -0.32 0.00 -2.04 0.00 0.00 64.34 61.69 1w3t n VAL 73 Cb 0.49 1.24 0.09 0.00 -1.47 0.00 0.00 33.84 34.20 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 -0.03 1.90 0.00 7.63 0.00 -1.25 -4.32 107.32 111.24 1w3t s GLY 74 Ca 0.00 0.47 0.00 0.00 0.00 0.00 0.00 44.72 45.19 1w3t s GLY 74 CO 0.00 0.84 0.00 0.61 0.00 0.00 0.00 173.10 174.55 1w3t n GLY 75 N -0.61 -0.66 1.18 0.20 0.00 -1.26 -4.96 105.19 99.09 1w3t n GLY 75 Ca 0.10 -0.65 0.12 0.00 0.00 0.00 0.00 46.02 45.59 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 3.51 -3.97 0.99 4.77 -1.26 -4.57 117.00 116.47 1w3t n LEU 76 Ca 0.00 -1.58 -0.31 0.00 -0.03 0.00 0.00 56.01 54.09 1w3t n LEU 76 Cb 0.00 -0.31 -0.15 0.00 -2.33 0.00 0.00 43.42 40.63 1w3t n LEU 76 CO 0.00 0.79 -0.39 0.21 -1.33 0.00 0.00 177.39 176.67 1w3t s ASN 77 N -1.36 4.28 0.34 -1.43 3.84 -1.26 -5.00 114.94 114.36 1w3t s ASN 77 Ca 0.41 -1.57 0.06 0.00 0.21 0.00 0.00 52.86 51.97 1w3t s ASN 77 Cb 0.23 -1.36 0.63 0.00 -0.55 0.00 0.00 41.25 40.20 1w3t s ASN 77 CO 0.32 -0.29 1.85 0.25 -2.79 0.00 0.00 177.10 176.44 1w3t h LEU 78 N 7.83 0.35 -1.06 3.21 5.85 -2.00 -2.21 115.31 127.28 1w3t h LEU 78 Ca -0.14 -0.09 0.08 0.00 0.84 0.00 0.00 57.88 58.58 1w3t h LEU 78 Cb 1.04 -0.09 -0.07 0.00 0.37 0.00 0.00 40.66 41.91 1w3t h LEU 78 CO 0.46 0.52 0.63 0.44 -0.34 0.00 0.00 178.44 180.15 1w3t h ASP 79 N 0.34 0.97 -0.29 1.25 3.32 -1.97 0.85 116.42 120.89 1w3t h ASP 79 Ca 0.07 0.02 -0.17 0.00 0.02 0.00 0.00 57.03 56.97 1w3t h ASP 79 Cb 0.46 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 1w3t h ASP 79 CO 0.03 0.60 -0.47 0.44 -1.72 0.00 0.00 179.24 178.12 1w3t h ASP 80 N 1.09 0.92 -0.31 6.45 3.32 -1.82 -1.82 116.42 124.25 1w3t h ASP 80 Ca 0.43 -0.52 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 1w3t h ASP 80 Cb 0.25 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 1w3t h ASP 80 CO -0.18 1.26 0.19 0.00 -1.72 0.00 0.00 179.24 178.79 1w3t h ALA 81 N 0.68 0.39 -0.53 3.45 0.00 -1.06 -0.98 119.26 121.22 1w3t h ALA 81 Ca 0.02 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1w3t h ALA 81 Cb 1.07 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.68 1w3t h ALA 81 CO 0.11 -0.11 0.23 0.82 0.00 0.00 0.00 179.25 180.29 1w3t h ILE 82 N 0.40 0.87 -0.53 0.00 2.04 -0.85 -0.01 117.51 119.43 1w3t h ILE 82 Ca 0.11 -0.15 -0.05 0.00 1.00 0.00 0.00 64.86 65.77 1w3t h ILE 82 Cb 0.00 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 1w3t h ILE 82 CO -0.02 0.08 0.14 -0.09 0.00 0.00 0.00 178.15 178.26 1w3t h ARG 83 N 0.43 0.85 -0.77 2.37 2.43 -1.12 -0.45 114.38 118.11 1w3t h ARG 83 Ca 0.25 -0.20 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1w3t h ARG 83 Cb 0.23 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.63 1w3t h ARG 83 CO -0.22 0.80 0.43 -0.07 -1.51 0.00 0.00 179.97 179.39 1w3t h LEU 84 N 0.74 0.96 -0.19 3.80 3.38 -0.88 -1.56 115.31 121.58 1w3t h LEU 84 Ca 0.17 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1w3t h LEU 84 Cb 0.32 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1w3t h LEU 84 CO -0.00 0.78 0.12 0.00 0.09 0.00 0.00 178.44 179.43 1w3t h ALA 85 N 1.22 0.24 -0.77 1.53 0.00 -0.33 -2.29 119.26 118.86 1w3t h ALA 85 Ca 0.27 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.22 1w3t h ALA 85 Cb 0.03 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 1w3t h ALA 85 CO -0.04 -0.28 0.46 0.87 0.00 0.00 0.00 179.25 180.26 1w3t h LYS 86 N 0.24 0.82 0.00 0.00 1.57 -0.97 -2.70 116.57 115.53 1w3t h LYS 86 Ca 0.07 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.73 1w3t h LYS 86 Cb -0.01 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 1w3t h LYS 86 CO -0.01 0.54 -0.32 -0.07 -0.57 0.00 0.00 179.45 179.02 1w3t h LEU 87 N 0.84 0.00 -0.38 2.94 3.38 -1.03 -1.29 115.31 119.77 1w3t h LEU 87 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1w3t h LEU 87 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1w3t h LEU 87 CO -0.17 0.32 0.00 -1.54 0.09 0.00 0.00 178.44 177.14 1w3t n SER 88 N -3.70 0.17 0.01 -0.43 3.41 -0.89 -2.93 113.62 109.26 1w3t n SER 88 Ca -0.01 0.57 0.21 0.00 -0.26 0.00 0.00 58.87 59.38 1w3t n SER 88 Cb 0.42 -0.60 0.70 0.00 -0.26 0.00 0.00 64.21 64.48 1w3t n SER 88 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1w3t h LYS 89 N 0.00 0.00 -0.03 4.33 2.10 -1.32 -1.14 116.57 120.50 1w3t h LYS 89 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1w3t h LYS 89 Cb 0.05 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.38 1w3t h LYS 89 CO 0.00 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.20 1w3t n ASP 90 N -4.30 0.86 -4.44 7.07 8.00 -1.15 -4.78 116.55 117.81 1w3t n ASP 90 Ca 0.10 -1.37 -0.33 0.00 0.71 0.00 0.00 54.79 53.90 1w3t n ASP 90 Cb 0.62 -0.02 -0.13 0.00 -0.02 0.00 0.00 41.12 41.56 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 -1.96 2.82 -1.47 1.24 0.40 -0.43 -5.02 117.98 113.55 1w3t s PHE 91 Ca 0.39 -0.38 -0.09 0.00 -0.60 0.00 0.00 56.93 56.25 1w3t s PHE 91 Cb 0.20 -1.78 0.02 0.00 0.51 0.00 0.00 43.02 41.97 1w3t s PHE 91 CO 0.32 -0.01 2.58 -0.25 0.70 0.00 0.00 175.22 178.56 1w3t n ASP 92 N 3.00 7.59 -5.01 1.36 8.00 -1.26 -4.95 116.55 125.28 1w3t n ASP 92 Ca -0.18 -2.84 -0.18 0.00 0.71 0.00 0.00 54.79 52.30 1w3t n ASP 92 Cb 0.53 -1.50 0.03 0.00 -0.02 0.00 0.00 41.12 40.15 1w3t n ASP 92 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1w3t s ILE 93 N 1.03 2.63 0.11 0.53 -4.36 -1.26 -4.76 121.20 115.12 1w3t s ILE 93 Ca 0.59 -1.02 -0.14 0.00 -0.26 0.00 0.00 60.65 59.82 1w3t s ILE 93 Cb 0.17 -2.66 -0.06 0.00 1.25 0.00 0.00 42.46 41.16 1w3t s ILE 93 CO -0.07 0.00 1.46 0.58 0.24 0.00 0.00 174.94 177.15 1w3t h VAL 94 N 0.48 1.29 0.00 8.37 2.07 -1.30 -3.48 116.25 123.68 1w3t h VAL 94 Ca -0.36 -1.37 0.00 0.00 0.82 0.00 0.00 66.70 65.79 1w3t h VAL 94 Cb 1.28 1.44 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 1w3t h VAL 94 CO 0.44 0.45 0.00 0.61 0.02 0.00 0.00 177.57 179.09 1w3t n GLY 95 N 0.04 0.31 3.84 2.17 0.00 -1.18 -4.32 105.19 106.04 1w3t n GLY 95 Ca -0.03 -0.82 -0.22 0.00 0.00 0.00 0.00 46.02 44.95 1w3t n GLY 95 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1w3t s ILE 96 N -2.00 2.62 0.14 -0.61 -4.36 0.86 -1.27 121.20 116.58 1w3t s ILE 96 Ca 0.00 -1.44 -0.07 0.00 -0.26 0.00 0.00 60.65 58.88 1w3t s ILE 96 Cb 0.00 -3.01 -0.01 0.00 1.25 0.00 0.00 42.46 40.69 1w3t s ILE 96 CO 0.00 -0.01 0.21 0.00 0.24 0.00 0.00 174.94 175.37 1w3t s ALA 97 N -2.50 0.14 -0.19 2.27 0.00 -0.32 0.25 121.76 121.42 1w3t s ALA 97 Ca 0.46 -0.96 -0.15 0.00 0.00 0.00 0.00 51.96 51.31 1w3t s ALA 97 Cb -0.01 0.76 0.05 0.00 0.00 0.00 0.00 23.12 23.92 1w3t s ALA 97 CO 0.26 -0.58 0.49 0.45 0.00 0.00 0.00 175.76 176.39 1w3t s SER 98 N -2.96 -0.55 0.93 0.00 0.15 -1.13 -0.86 113.70 109.28 1w3t s SER 98 Ca 0.16 1.02 -0.12 0.00 0.70 0.00 0.00 55.95 57.71 1w3t s SER 98 Cb 0.05 0.99 0.15 0.00 -1.71 0.00 0.00 66.02 65.50 1w3t s SER 98 CO -0.02 -0.18 1.09 -0.72 1.20 0.00 0.00 173.24 174.60 1w3t s TYR 99 N 0.61 2.16 0.61 3.44 -0.85 -1.25 -1.66 117.35 120.40 1w3t s TYR 99 Ca -0.03 1.26 -0.16 0.00 -0.52 0.00 0.00 57.07 57.63 1w3t s TYR 99 Cb -0.05 -3.18 -0.03 0.00 0.38 0.00 0.00 41.96 39.09 1w3t s TYR 99 CO -0.04 -2.60 1.08 0.00 -1.52 0.00 0.00 175.55 172.47 1w3t s ALA 100 N -2.87 2.65 -0.06 9.51 0.00 -1.26 -4.80 121.76 124.93 1w3t s ALA 100 Ca 0.64 0.48 -0.37 0.00 0.00 0.00 0.00 51.96 52.71 1w3t s ALA 100 Cb -0.19 -3.27 -0.15 0.00 0.00 0.00 0.00 23.12 19.51 1w3t s ALA 100 CO 0.58 -0.94 1.61 -2.30 0.00 0.00 0.00 175.76 174.71 1w3t n PRO 101 N -2.07 1.46 -2.35 0.00 -0.02 -1.26 -4.91 135.00 125.85 1w3t n PRO 101 Ca 0.09 0.53 -0.17 0.00 -2.02 0.00 0.00 63.50 61.93 1w3t n PRO 101 Cb 0.52 -2.24 0.08 0.00 -0.02 0.00 0.00 33.50 31.84 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 4.37 -2.78 0.00 6.00 0.18 -1.26 -4.72 117.16 118.94 1w3t n TYR 102 Ca 0.22 -1.54 0.00 0.00 1.88 0.00 0.00 57.90 58.46 1w3t n TYR 102 Cb 0.20 -0.53 0.00 0.00 -0.38 0.00 0.00 39.34 38.63 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 -2.35 0.00 -1.86 -3.48 9.36 -1.24 -4.89 117.16 112.70 1w3t n TYR 103 Ca 0.13 0.00 -0.42 0.00 3.32 0.00 0.00 57.90 60.93 1w3t n TYR 103 Cb 0.48 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.16 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 1.66 0.66 2.98 1.51 -1.26 -4.98 117.35 117.93 1w3t s TYR 104 Ca 0.00 -0.10 -0.10 0.00 -1.01 0.00 0.00 57.07 55.86 1w3t s TYR 104 Cb 0.00 -4.06 0.01 0.00 -0.11 0.00 0.00 41.96 37.79 1w3t s TYR 104 CO 0.00 -4.63 1.03 -2.14 -1.11 0.00 0.00 175.55 168.71 1w3t s PRO 105 N 4.23 2.98 -1.39 -1.71 0.02 -1.26 -4.38 135.00 133.48 1w3t s PRO 105 Ca 0.80 0.38 -0.08 0.00 0.02 0.00 0.00 61.00 62.12 1w3t s PRO 105 Cb -0.37 -2.10 0.03 0.00 0.02 0.00 0.00 34.50 32.08 1w3t s PRO 105 CO 0.35 -0.88 1.03 0.54 -0.33 0.00 0.00 177.00 177.71 1w3t n ARG 106 N -2.86 -6.54 -2.72 5.54 1.74 -1.26 -4.96 116.66 105.60 1w3t n ARG 106 Ca 0.06 0.72 -0.41 0.00 -0.77 0.00 0.00 57.85 57.46 1w3t n ARG 106 Cb 0.57 -5.65 -0.05 0.00 -1.02 0.00 0.00 32.46 26.31 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 -6.25 4.75 0.48 5.56 -1.94 -1.26 -5.03 119.30 115.62 1w3t s MET 107 Ca 0.46 1.49 -0.23 0.00 -1.71 0.00 0.00 55.69 55.70 1w3t s MET 107 Cb -0.21 -3.33 -0.07 0.00 2.01 0.00 0.00 34.83 33.23 1w3t s MET 107 CO 0.78 0.33 1.22 -1.54 -0.01 0.00 0.00 175.02 175.79 1w3t s SER 108 N -0.49 5.92 0.23 3.03 1.04 -1.26 -4.87 113.70 117.30 1w3t s SER 108 Ca 0.45 2.43 -0.15 0.00 0.48 0.00 0.00 55.95 59.16 1w3t s SER 108 Cb -0.25 -2.61 0.27 0.00 0.10 0.00 0.00 66.02 63.53 1w3t s SER 108 CO 0.31 -1.10 1.58 -0.08 0.98 0.00 0.00 173.24 174.93 1w3t h GLU 109 N 1.89 -0.04 -0.78 4.02 4.81 -1.99 -0.67 114.58 121.82 1w3t h GLU 109 Ca -0.50 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 58.84 1w3t h GLU 109 Cb 1.26 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 30.58 1w3t h GLU 109 CO 0.59 -0.03 0.42 0.87 -0.73 0.00 0.00 179.01 180.13 1w3t h LYS 110 N -0.04 0.67 -0.14 1.92 1.57 -1.99 0.63 116.57 119.18 1w3t h LYS 110 Ca 0.34 -0.04 -0.16 0.00 -1.87 0.00 0.00 60.65 58.92 1w3t h LYS 110 Cb 0.60 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 1w3t h LYS 110 CO -0.86 0.44 -0.59 0.45 -0.57 0.00 0.00 179.45 178.33 1w3t h HIS 111 N 0.69 0.58 -0.49 -1.35 3.86 -1.68 -1.20 115.15 115.55 1w3t h HIS 111 Ca 0.38 -0.21 -0.09 0.00 -1.16 0.00 0.00 60.37 59.29 1w3t h HIS 111 Cb 0.40 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 28.75 1w3t h HIS 111 CO -0.09 0.93 -0.05 -0.07 0.86 0.00 0.00 177.93 179.52 1w3t h LEU 112 N 0.34 0.90 -0.46 2.43 3.38 -0.46 -1.12 115.31 120.33 1w3t h LEU 112 Ca -0.00 -0.33 -0.04 0.00 0.09 0.00 0.00 57.88 57.60 1w3t h LEU 112 Cb 1.12 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 1w3t h LEU 112 CO 0.10 1.01 0.12 0.58 0.09 0.00 0.00 178.44 180.34 1w3t h VAL 113 N 0.76 1.23 -0.66 1.22 2.07 -0.85 -2.55 116.25 117.48 1w3t h VAL 113 Ca 0.13 -0.81 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 1w3t h VAL 113 Cb 0.58 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 1w3t h VAL 113 CO 0.03 0.29 0.37 0.50 0.02 0.00 0.00 177.57 178.78 1w3t h LYS 114 N 0.60 0.91 -0.30 1.57 3.64 -0.99 0.51 116.57 122.52 1w3t h LYS 114 Ca 0.14 -0.10 0.06 0.00 -1.27 0.00 0.00 60.65 59.49 1w3t h LYS 114 Cb 0.31 -0.18 -0.06 0.00 -0.41 0.00 0.00 32.23 31.89 1w3t h LYS 114 CO 0.00 0.67 -0.10 -0.92 -2.27 0.00 0.00 179.45 176.83 1w3t h TYR 115 N 0.90 -0.23 -0.11 1.91 3.20 -1.04 -0.31 116.97 121.28 1w3t h TYR 115 Ca 0.23 0.03 -0.20 0.00 3.14 0.00 0.00 58.73 61.93 1w3t h TYR 115 Cb 0.02 0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.44 1w3t h TYR 115 CO -0.01 -0.16 -0.76 0.74 -1.64 0.00 0.00 178.16 176.33 1w3t h PHE 116 N -0.04 0.81 -0.93 -3.82 -1.00 -0.99 -2.78 116.94 108.20 1w3t h PHE 116 Ca 0.15 -0.36 0.02 0.00 2.81 0.00 0.00 57.97 60.59 1w3t h PHE 116 Cb 0.27 -0.12 -0.05 0.00 3.61 0.00 0.00 35.95 39.65 1w3t h PHE 116 CO -0.31 1.15 0.61 0.87 -1.61 0.00 0.00 178.31 179.03 1w3t h LYS 117 N 0.41 1.19 -0.44 1.51 1.57 -0.79 -1.20 116.57 118.82 1w3t h LYS 117 Ca -0.04 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1w3t h LYS 117 Cb 1.36 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 33.38 1w3t h LYS 117 CO 0.14 0.79 0.28 1.15 -0.57 0.00 0.00 179.45 181.24 1w3t h THR 118 N 1.23 1.13 -0.39 -0.16 2.02 -0.95 0.93 112.91 116.72 1w3t h THR 118 Ca 0.35 -0.26 -0.06 0.00 0.77 0.00 0.00 66.41 67.21 1w3t h THR 118 Cb -0.10 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 66.80 1w3t h THR 118 CO -0.09 0.12 0.00 -0.07 0.37 0.00 0.00 175.52 175.86 1w3t h LEU 119 N 0.60 0.67 -0.91 2.58 3.38 -1.20 -2.93 115.31 117.50 1w3t h LEU 119 Ca 0.16 -0.30 0.08 0.00 0.09 0.00 0.00 57.88 57.90 1w3t h LEU 119 Cb -0.04 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.46 1w3t h LEU 119 CO -0.03 0.81 0.57 0.00 0.09 0.00 0.00 178.44 179.88 1w3t h GLU 121 N 1.00 1.05 -0.01 0.00 5.08 -0.66 -2.93 114.58 118.12 1w3t h GLU 121 Ca 0.41 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1w3t h GLU 121 Cb 0.26 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1w3t h GLU 121 CO -0.20 0.75 -0.43 1.33 -1.00 0.00 0.00 179.01 179.46 1w3t n VAL 122 N -4.37 0.00 -2.69 3.13 0.24 -1.03 -4.97 118.33 108.63 1w3t n VAL 122 Ca 0.08 -0.15 -0.41 0.00 -2.04 0.00 0.00 64.34 61.82 1w3t n VAL 122 Cb 0.07 0.74 -0.04 0.00 -1.47 0.00 0.00 33.84 33.14 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 -2.59 7.44 0.00 -1.34 0.15 -0.48 -4.51 113.70 112.36 1w3t s SER 123 Ca 0.19 1.82 0.23 0.00 0.70 0.00 0.00 55.95 58.90 1w3t s SER 123 Cb 0.18 -2.59 1.00 0.00 -1.71 0.00 0.00 66.02 62.90 1w3t s SER 123 CO 0.59 -0.13 1.69 -0.81 1.20 0.00 0.00 173.24 175.78 1w3t n PRO 124 N 2.94 1.52 -4.17 5.44 -0.04 -1.26 -4.89 135.00 134.54 1w3t n PRO 124 Ca 0.03 -0.77 -0.10 0.00 -0.04 0.00 0.00 63.50 62.62 1w3t n PRO 124 Cb 0.49 -1.41 -0.10 0.00 -0.04 0.00 0.00 33.50 32.44 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 -1.90 0.87 0.51 0.54 3.76 -1.26 -4.98 115.29 112.84 1w3t s HIS 125 Ca 0.34 -0.97 -0.22 0.00 -0.15 0.00 0.00 55.06 54.07 1w3t s HIS 125 Cb 0.18 -0.52 -0.07 0.00 1.11 0.00 0.00 32.58 33.28 1w3t s HIS 125 CO 0.28 -0.21 1.05 -2.30 -0.85 0.00 0.00 174.74 172.70 1w3t n PRO 126 N -0.05 1.25 -4.32 8.40 -0.02 -1.26 -4.64 135.00 134.36 1w3t n PRO 126 Ca -0.11 0.46 -0.34 0.00 -2.02 0.00 0.00 63.50 61.49 1w3t n PRO 126 Cb 0.61 -2.18 -0.13 0.00 -0.02 0.00 0.00 33.50 31.78 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 -1.38 3.45 -0.13 -1.45 1.01 -1.26 -0.10 120.40 120.54 1w3t s VAL 127 Ca 0.69 -0.50 -0.04 0.00 0.00 0.00 0.00 61.98 62.13 1w3t s VAL 127 Cb -0.47 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.36 1w3t s VAL 127 CO 0.52 0.47 0.03 -0.31 0.00 0.00 0.00 175.10 175.81 1w3t s TYR 128 N 0.79 3.22 -0.04 5.22 1.51 0.14 -0.61 117.35 127.59 1w3t s TYR 128 Ca -0.02 0.13 -0.29 0.00 -1.01 0.00 0.00 57.07 55.88 1w3t s TYR 128 Cb -0.15 -1.91 -0.03 0.00 -0.11 0.00 0.00 41.96 39.77 1w3t s TYR 128 CO 0.02 0.34 0.95 -1.17 -1.11 0.00 0.00 175.55 174.58 1w3t s LEU 129 N -0.38 4.33 -0.46 -1.29 2.96 0.20 -2.84 118.68 121.20 1w3t s LEU 129 Ca 0.08 1.56 -0.12 0.00 -0.22 0.00 0.00 54.13 55.44 1w3t s LEU 129 Cb -0.12 -3.50 0.10 0.00 0.50 0.00 0.00 46.19 43.16 1w3t s LEU 129 CO 0.02 -0.29 0.35 -0.47 -1.32 0.00 0.00 176.35 174.64 1w3t s TYR 130 N 1.25 3.32 -0.33 5.38 5.04 -0.67 -0.19 117.35 131.17 1w3t s TYR 130 Ca 0.49 -1.42 -0.14 0.00 -2.44 0.00 0.00 57.07 53.56 1w3t s TYR 130 Cb -0.20 -3.28 -0.02 0.00 0.35 0.00 0.00 41.96 38.82 1w3t s TYR 130 CO 0.24 -0.90 0.33 1.21 -1.34 0.00 0.00 175.55 175.09 1w3t s ASN 131 N 2.61 6.15 -0.41 4.32 2.47 0.58 -3.95 114.94 126.71 1w3t s ASN 131 Ca 0.04 -0.17 0.04 0.00 0.42 0.00 0.00 52.86 53.19 1w3t s ASN 131 Cb -0.25 -2.18 0.17 0.00 -1.45 0.00 0.00 41.25 37.54 1w3t s ASN 131 CO 0.03 -0.27 0.36 -0.47 -3.72 0.00 0.00 177.10 173.03 1w3t s TYR 132 N 1.95 0.77 0.35 0.43 6.04 -1.26 -0.59 117.35 125.04 1w3t s TYR 132 Ca 0.11 -2.07 0.02 0.00 0.04 0.00 0.00 57.07 55.17 1w3t s TYR 132 Cb -0.17 -0.79 0.63 0.00 -1.04 0.00 0.00 41.96 40.60 1w3t s TYR 132 CO 0.11 -0.87 1.99 -1.35 -1.54 0.00 0.00 175.55 173.89 1w3t h PRO 133 N 5.74 0.81 -0.55 4.97 0.11 -1.72 -1.51 132.00 139.85 1w3t h PRO 133 Ca 0.23 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.24 1w3t h PRO 133 Cb 0.94 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 31.85 1w3t h PRO 133 CO 0.32 0.56 0.21 1.15 -0.21 0.00 0.00 178.00 180.03 1w3t h THR 134 N 0.82 1.22 0.06 -1.15 2.02 -1.86 0.98 112.91 115.01 1w3t h THR 134 Ca 0.22 -0.72 -0.26 0.00 0.77 0.00 0.00 66.41 66.42 1w3t h THR 134 Cb -0.05 0.67 0.02 0.00 -1.74 0.00 0.00 68.15 67.05 1w3t h THR 134 CO -0.04 0.27 -1.07 0.00 0.37 0.00 0.00 175.52 175.05 1w3t h ALA 135 N 1.06 0.04 0.00 6.16 0.00 -1.88 -3.36 119.26 121.29 1w3t h ALA 135 Ca 0.18 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1w3t h ALA 135 Cb 0.22 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1w3t h ALA 135 CO -0.01 0.63 -1.55 0.25 0.00 0.00 0.00 179.25 178.56 1w3t n THR 136 N -3.89 0.22 -0.20 0.00 -2.24 -0.60 -4.66 114.28 102.92 1w3t n THR 136 Ca -0.12 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 1w3t n THR 136 Cb 0.90 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 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 1.25 0.70 3.26 3.38 0.00 0.33 -3.65 105.19 110.46 1w3t n GLY 137 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 1w3t n GLY 137 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1w3t s LYS 138 N -0.72 1.03 -0.11 1.61 0.00 -1.23 -4.86 119.74 115.46 1w3t s LYS 138 Ca 0.00 -1.23 0.03 0.00 0.00 0.00 0.00 55.97 54.78 1w3t s LYS 138 Cb 0.00 0.33 0.01 0.00 0.00 0.00 0.00 37.83 38.16 1w3t s LYS 138 CO 0.00 -0.34 -0.21 0.34 0.00 0.00 0.00 175.35 175.13 1w3t s ASP 139 N -2.98 2.91 -0.69 0.03 2.15 -1.26 -3.69 116.67 113.15 1w3t s ASP 139 Ca 0.17 -0.54 -0.05 0.00 0.43 0.00 0.00 52.55 52.57 1w3t s ASP 139 Cb 0.05 -1.33 0.18 0.00 -0.30 0.00 0.00 42.92 41.51 1w3t s ASP 139 CO -0.01 0.11 0.53 -0.63 -0.17 0.00 0.00 175.17 174.99 1w3t s ILE 140 N 0.59 4.09 0.54 4.11 -1.09 -1.26 -5.03 121.20 123.15 1w3t s ILE 140 Ca -0.14 -2.99 -0.05 0.00 -2.23 0.00 0.00 60.65 55.25 1w3t s ILE 140 Cb -0.17 -3.62 0.12 0.00 -1.58 0.00 0.00 42.46 37.21 1w3t s ILE 140 CO 0.04 -0.93 0.73 -0.90 -1.23 0.00 0.00 174.94 172.66 1w3t n ASP 141 N 3.43 0.47 -0.11 3.58 5.68 -1.26 -4.61 116.55 123.72 1w3t n ASP 141 Ca 0.10 -1.52 0.04 0.00 -0.50 0.00 0.00 54.79 52.92 1w3t n ASP 141 Cb 0.39 -0.52 0.36 0.00 -1.14 0.00 0.00 41.12 40.21 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 -1.20 1.67 -0.02 2.12 0.00 -1.88 0.34 119.26 120.30 1w3t h ALA 142 Ca -0.24 -0.03 -0.26 0.00 0.00 0.00 0.00 54.91 54.38 1w3t h ALA 142 Cb 0.76 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 18.37 1w3t h ALA 142 CO 0.21 0.27 -1.00 -0.22 0.00 0.00 0.00 179.25 178.51 1w3t h LYS 143 N 0.72 0.71 -0.62 0.00 3.64 -1.92 -0.23 116.57 118.86 1w3t h LYS 143 Ca 0.24 -0.74 -0.07 0.00 -1.27 0.00 0.00 60.65 58.81 1w3t h LYS 143 Cb 0.06 0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 32.05 1w3t h LYS 143 CO -0.06 1.31 0.12 0.28 -2.27 0.00 0.00 179.45 178.84 1w3t h VAL 144 N 0.39 1.26 -0.42 2.00 2.07 -1.65 -0.50 116.25 119.40 1w3t h VAL 144 Ca -0.12 -0.97 -0.00 0.00 0.82 0.00 0.00 66.70 66.43 1w3t h VAL 144 Cb 1.65 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.09 1w3t h VAL 144 CO 0.20 0.36 0.26 0.00 0.02 0.00 0.00 177.57 178.41 1w3t h ALA 145 N 1.04 0.54 -0.39 1.67 0.00 -0.30 -0.63 119.26 121.18 1w3t h ALA 145 Ca 0.19 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.11 1w3t h ALA 145 Cb 0.40 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1w3t h ALA 145 CO 0.01 0.02 0.08 -0.22 0.00 0.00 0.00 179.25 179.14 1w3t h LYS 146 N 0.56 0.20 -0.65 0.00 3.64 -0.86 -1.50 116.57 117.97 1w3t h LYS 146 Ca 0.15 -0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.62 1w3t h LYS 146 Cb -0.01 -0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 31.69 1w3t h LYS 146 CO -0.03 0.13 0.26 1.49 -2.27 0.00 0.00 179.45 179.03 1w3t h GLU 147 N 0.21 0.44 -0.66 1.90 4.81 -0.47 -1.79 114.58 119.02 1w3t h GLU 147 Ca 0.19 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.33 1w3t h GLU 147 Cb 0.22 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 1w3t h GLU 147 CO -0.24 0.29 0.19 0.82 -0.73 0.00 0.00 179.01 179.33 1w3t h ILE 148 N 0.45 1.25 0.00 2.32 2.04 -0.87 -3.46 117.51 119.23 1w3t h ILE 148 Ca 0.33 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 65.31 1w3t h ILE 148 Cb 0.40 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.02 1w3t h ILE 148 CO -0.31 0.34 0.00 0.61 0.00 0.00 0.00 178.15 178.79 1w3t n GLY 149 N -0.80 0.72 0.05 5.37 0.00 -0.59 -4.83 105.19 105.11 1w3t n GLY 149 Ca 0.05 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.14 3.75 0.07 0.00 2.99 -1.26 -4.53 117.98 117.85 1w3t s PHE 151 Ca 0.07 1.40 0.03 0.00 0.00 0.00 0.00 56.93 58.43 1w3t s PHE 151 Cb 0.06 -2.72 -0.24 0.00 0.00 0.00 0.00 43.02 40.11 1w3t s PHE 151 CO 0.01 0.36 1.08 1.15 -0.00 0.00 0.00 175.22 177.82 1w3t h THR 152 N 3.95 1.44 -3.30 0.64 2.02 -1.23 -3.47 112.91 112.96 1w3t h THR 152 Ca -0.45 -3.13 -0.12 0.00 0.77 0.00 0.00 66.41 63.48 1w3t h THR 152 Cb 1.20 2.80 -0.02 0.00 -1.74 0.00 0.00 68.15 70.39 1w3t h THR 152 CO 0.69 0.86 0.11 0.61 0.37 0.00 0.00 175.52 178.16 1w3t n GLY 153 N 1.48 1.46 3.02 2.16 0.00 -1.24 -0.99 105.19 111.08 1w3t n GLY 153 Ca -0.07 -1.38 -0.13 0.00 0.00 0.00 0.00 46.02 44.44 1w3t n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1w3t s VAL 154 N -2.40 -0.01 -0.27 1.61 0.11 -0.24 -0.63 120.40 118.58 1w3t s VAL 154 Ca 0.20 0.04 -0.09 0.00 -2.93 0.00 0.00 61.98 59.20 1w3t s VAL 154 Cb -0.03 -0.25 -0.03 0.00 -1.53 0.00 0.00 36.38 34.54 1w3t s VAL 154 CO 0.14 0.02 0.12 -0.75 -3.33 0.00 0.00 175.10 171.30 1w3t s LYS 155 N 0.38 3.71 -0.43 1.54 2.20 0.74 -0.72 119.74 127.15 1w3t s LYS 155 Ca -0.02 -0.46 -0.09 0.00 -0.36 0.00 0.00 55.97 55.04 1w3t s LYS 155 Cb -0.04 -3.47 0.09 0.00 -1.51 0.00 0.00 37.83 32.90 1w3t s LYS 155 CO -0.02 -0.22 0.27 0.34 -0.36 0.00 0.00 175.35 175.36 1w3t s ASP 156 N 1.66 5.61 -0.54 1.43 3.68 -0.12 -0.31 116.67 128.09 1w3t s ASP 156 Ca 0.06 -1.63 -0.16 0.00 2.13 0.00 0.00 52.55 52.95 1w3t s ASP 156 Cb -0.16 -1.98 0.12 0.00 -1.45 0.00 0.00 42.92 39.46 1w3t s ASP 156 CO 0.06 -0.57 0.50 -0.89 0.13 0.00 0.00 175.17 174.40 1w3t s THR 157 N 1.39 5.20 0.10 1.71 2.01 0.25 -1.19 115.64 125.10 1w3t s THR 157 Ca 0.04 -1.45 -0.25 0.00 0.31 0.00 0.00 61.69 60.33 1w3t s THR 157 Cb -0.24 -4.33 0.07 0.00 0.01 0.00 0.00 72.50 68.02 1w3t s THR 157 CO 0.01 -0.85 0.64 -0.51 -0.69 0.00 0.00 174.62 173.22 1w3t s ILE 158 N 1.63 0.00 -1.10 1.82 2.07 -1.26 -4.13 121.20 120.23 1w3t s ILE 158 Ca 0.03 0.00 -0.07 0.00 -1.41 0.00 0.00 60.65 59.20 1w3t s ILE 158 Cb -0.29 -1.00 0.29 0.00 0.13 0.00 0.00 42.46 41.58 1w3t s ILE 158 CO 0.03 0.00 1.23 -0.62 -1.91 0.00 0.00 174.94 173.67 1w3t n GLU 159 N -0.06 3.83 0.00 3.50 1.02 -1.26 -4.72 120.64 122.95 1w3t n GLU 159 Ca -0.17 -4.50 0.00 0.00 -0.02 0.00 0.00 57.16 52.48 1w3t n GLU 159 Cb 0.63 -2.53 0.00 0.00 -0.02 0.00 0.00 31.44 29.52 1w3t n GLU 159 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1w3t n ASN 160 N 2.18 0.00 0.27 1.62 2.85 -1.26 -5.04 115.26 115.89 1w3t n ASN 160 Ca 0.25 0.00 0.18 0.00 -0.11 0.00 0.00 54.58 54.90 1w3t n ASN 160 Cb 0.37 0.00 0.82 0.00 1.24 0.00 0.00 39.78 42.21 1w3t n ASN 160 CO 0.00 0.00 0.00 -0.29 -2.11 0.00 0.00 177.26 174.86 1w3t h ILE 161 N 0.00 0.00 -0.55 -1.44 2.10 -2.01 -2.27 117.51 113.34 1w3t h ILE 161 Ca 0.00 -0.29 0.01 0.00 1.08 0.00 0.00 64.86 65.66 1w3t h ILE 161 Cb 0.00 1.22 -0.03 0.00 -1.09 0.00 0.00 36.82 36.92 1w3t h ILE 161 CO 0.00 0.00 0.37 0.40 -1.08 0.00 0.00 178.15 177.84 1w3t h ILE 162 N 0.00 1.14 -0.80 2.19 2.04 -1.99 -0.68 117.51 119.40 1w3t h ILE 162 Ca 0.00 -0.26 0.05 0.00 1.00 0.00 0.00 64.86 65.66 1w3t h ILE 162 Cb 0.31 0.33 -0.06 0.00 -0.74 0.00 0.00 36.82 36.65 1w3t h ILE 162 CO 0.00 0.14 0.50 -0.74 0.00 0.00 0.00 178.15 178.04 1w3t h HIS 163 N 0.75 0.92 -0.27 1.37 2.76 -1.83 -1.39 115.15 117.45 1w3t h HIS 163 Ca 0.20 0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.32 1w3t h HIS 163 Cb -0.08 -0.30 -0.01 0.00 1.55 0.00 0.00 27.41 28.57 1w3t h HIS 163 CO -0.04 0.48 -0.13 1.15 -1.30 0.00 0.00 177.93 178.09 1w3t h THR 164 N 0.92 1.30 -0.53 6.26 2.02 -1.33 -2.59 112.91 118.96 1w3t h THR 164 Ca 0.34 -1.22 0.07 0.00 0.77 0.00 0.00 66.41 66.37 1w3t h THR 164 Cb 0.13 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.02 1w3t h THR 164 CO -0.16 0.38 0.36 -0.07 0.37 0.00 0.00 175.52 176.40 1w3t h LEU 165 N 0.31 0.39 -1.38 2.58 3.38 -0.96 -2.11 115.31 117.52 1w3t h LEU 165 Ca 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1w3t h LEU 165 Cb 0.64 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 1w3t h LEU 165 CO 0.04 0.25 0.29 0.44 0.09 0.00 0.00 178.44 179.56 1w3t h ASP 166 N 0.45 0.63 -0.48 -0.43 3.32 -0.84 -1.16 116.42 117.91 1w3t h ASP 166 Ca 0.23 -0.04 0.09 0.00 0.02 0.00 0.00 57.03 57.33 1w3t h ASP 166 Cb 0.35 -0.16 -0.07 0.00 0.22 0.00 0.00 39.33 39.67 1w3t h ASP 166 CO -0.06 0.50 0.06 1.88 -1.72 0.00 0.00 179.24 179.90 1w3t h TYR 167 N 0.72 0.08 -0.56 4.55 -1.99 -1.37 0.22 116.97 118.62 1w3t h TYR 167 Ca 0.19 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.94 1w3t h TYR 167 Cb 0.01 0.04 -0.03 0.00 2.00 0.00 0.00 36.73 38.75 1w3t h TYR 167 CO 0.00 -0.05 0.32 -0.22 -0.00 0.00 0.00 178.16 178.22 1w3t h LYS 168 N 0.18 0.77 -0.12 4.88 1.63 -1.42 0.25 116.57 122.74 1w3t h LYS 168 Ca 0.24 -0.08 -0.00 0.00 -0.85 0.00 0.00 60.65 59.96 1w3t h LYS 168 Cb 0.34 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 31.80 1w3t h LYS 168 CO -0.35 0.57 0.07 -0.09 -3.45 0.00 0.00 179.45 176.21 1w3t h ARG 169 N 0.76 0.16 0.00 1.90 2.43 -0.88 -2.78 114.38 115.96 1w3t h ARG 169 Ca 0.20 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.35 1w3t h ARG 169 Cb 0.01 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.53 1w3t h ARG 169 CO -0.04 0.15 -0.50 1.28 -1.51 0.00 0.00 179.97 179.35 1w3t n LEU 170 N -4.98 0.68 -3.34 3.80 4.77 0.03 -4.49 117.00 113.47 1w3t n LEU 170 Ca -0.05 0.27 -0.26 0.00 -0.03 0.00 0.00 56.01 55.94 1w3t n LEU 170 Cb 0.05 -0.22 -0.09 0.00 -2.33 0.00 0.00 43.42 40.84 1w3t n LEU 170 CO 0.34 -0.06 -0.28 0.59 -1.33 0.00 0.00 177.39 176.65 1w3t n ASN 171 N -2.06 0.09 0.23 -1.43 3.02 0.87 -4.94 115.26 111.04 1w3t n ASN 171 Ca 0.04 -2.58 0.18 0.00 -0.03 0.00 0.00 54.58 52.19 1w3t n ASN 171 Cb 0.43 -0.60 0.87 0.00 -0.61 0.00 0.00 39.78 39.86 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 4.92 0.00 -0.17 3.52 0.11 -1.71 -1.48 132.00 137.19 1w3t h PRO 172 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1w3t h PRO 172 Cb 0.88 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.99 1w3t h PRO 172 CO 0.44 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.32 1w3t n ASN 173 N -3.60 2.96 -4.76 -2.05 3.02 -1.26 -4.94 115.26 104.62 1w3t n ASN 173 Ca 0.01 -1.94 -0.40 0.00 -0.03 0.00 0.00 54.58 52.22 1w3t n ASN 173 Cb 0.32 -0.10 -0.04 0.00 -0.61 0.00 0.00 39.78 39.35 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 -1.81 4.66 0.02 3.52 1.75 -0.56 -4.99 119.30 121.90 1w3t s MET 174 Ca 0.33 1.77 -0.30 0.00 -1.25 0.00 0.00 55.69 56.24 1w3t s MET 174 Cb 0.21 -3.20 -0.05 0.00 2.84 0.00 0.00 34.83 34.63 1w3t s MET 174 CO 0.31 0.24 1.18 -0.51 -0.65 0.00 0.00 175.02 175.59 1w3t s LEU 175 N -1.40 4.34 -0.19 4.11 1.43 -0.16 -4.90 118.68 121.90 1w3t s LEU 175 Ca 0.44 1.93 0.01 0.00 -1.03 0.00 0.00 54.13 55.48 1w3t s LEU 175 Cb -0.31 -3.57 0.04 0.00 0.03 0.00 0.00 46.19 42.37 1w3t s LEU 175 CO 0.40 -0.48 -0.11 -0.69 0.23 0.00 0.00 176.35 175.69 1w3t s VAL 176 N 1.39 1.65 0.07 -1.59 1.01 -1.26 -1.08 120.40 120.58 1w3t s VAL 176 Ca 0.57 -0.94 0.07 0.00 0.00 0.00 0.00 61.98 61.68 1w3t s VAL 176 Cb -0.27 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1w3t s VAL 176 CO 0.27 0.23 -0.14 -0.31 0.00 0.00 0.00 175.10 175.16 1w3t s TYR 177 N 1.41 2.66 -0.01 5.22 1.51 0.10 -1.21 117.35 127.03 1w3t s TYR 177 Ca 0.00 -0.19 -0.17 0.00 -1.01 0.00 0.00 57.07 55.70 1w3t s TYR 177 Cb -0.15 -1.46 -0.06 0.00 -0.11 0.00 0.00 41.96 40.18 1w3t s TYR 177 CO -0.09 0.35 0.48 0.45 -1.11 0.00 0.00 175.55 175.64 1w3t s SER 178 N -1.80 6.86 0.00 2.29 0.15 -0.29 -0.95 113.70 119.97 1w3t s SER 178 Ca 0.18 1.03 0.00 0.00 0.70 0.00 0.00 55.95 57.85 1w3t s SER 178 Cb -0.11 -2.30 0.00 0.00 -1.71 0.00 0.00 66.02 61.90 1w3t s SER 178 CO 0.09 0.21 0.85 0.61 1.20 0.00 0.00 173.24 176.21 1w3t n GLY 179 N 2.20 -0.43 3.73 9.45 0.00 -0.34 -0.54 105.19 119.26 1w3t n GLY 179 Ca -0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.83 5.61 0.45 1.61 0.15 -1.26 -4.73 113.70 114.70 1w3t s SER 180 Ca 0.00 0.23 0.23 0.00 0.70 0.00 0.00 55.95 57.11 1w3t s SER 180 Cb 0.00 -1.71 1.03 0.00 -1.71 0.00 0.00 66.02 63.63 1w3t s SER 180 CO 0.00 0.36 1.89 0.44 1.20 0.00 0.00 173.24 177.13 1w3t h ASP 181 N 5.31 0.00 0.97 5.45 3.32 -1.90 -3.25 116.42 126.32 1w3t h ASP 181 Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 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 0.57 0.24 -0.17 0.23 -1.72 0.00 0.00 179.24 178.39 1w3t n MET 182 N -3.59 0.08 -0.51 3.56 2.81 -1.26 -3.70 117.12 114.50 1w3t n MET 182 Ca -0.01 0.05 0.08 0.00 -1.81 0.00 0.00 57.70 56.01 1w3t n MET 182 Cb 0.38 -1.58 0.29 0.00 -0.71 0.00 0.00 33.22 31.60 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 -1.70 4.21 -0.04 4.03 4.77 -1.23 -4.65 117.00 122.39 1w3t n LEU 183 Ca 0.06 -2.76 -0.11 0.00 -0.03 0.00 0.00 56.01 53.17 1w3t n LEU 183 Cb 0.37 -0.53 -0.05 0.00 -2.33 0.00 0.00 43.42 40.88 1w3t n LEU 183 CO 0.30 0.70 0.84 0.40 -1.33 0.00 0.00 177.39 178.30 1w3t h ILE 184 N 2.58 1.16 -0.56 -0.08 2.04 -1.73 0.17 117.51 121.09 1w3t h ILE 184 Ca 0.00 -0.49 -0.04 0.00 1.00 0.00 0.00 64.86 65.33 1w3t h ILE 184 Cb 1.43 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 38.68 1w3t h ILE 184 CO 0.24 0.15 0.20 0.00 0.00 0.00 0.00 178.15 178.74 1w3t h ALA 185 N 0.90 0.73 0.02 1.87 0.00 -1.85 -2.35 119.26 118.58 1w3t h ALA 185 Ca 0.05 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1w3t h ALA 185 Cb 0.18 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1w3t h ALA 185 CO -0.00 0.37 -0.01 1.15 0.00 0.00 0.00 179.25 180.76 1w3t h THR 186 N 0.78 1.19 -0.48 0.00 2.02 -1.83 -1.59 112.91 113.00 1w3t h THR 186 Ca 0.18 -0.66 0.08 0.00 0.77 0.00 0.00 66.41 66.79 1w3t h THR 186 Cb 0.25 1.63 -0.07 0.00 -1.74 0.00 0.00 68.15 68.22 1w3t h THR 186 CO -0.01 0.17 0.11 0.58 0.37 0.00 0.00 175.52 176.73 1w3t h VAL 187 N -0.31 0.75 -0.06 3.16 2.07 -0.62 -0.00 116.25 121.23 1w3t h VAL 187 Ca -0.00 -0.08 -0.07 0.00 0.82 0.00 0.00 66.70 67.36 1w3t h VAL 187 Cb 0.30 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 1w3t h VAL 187 CO 0.01 0.05 -0.29 0.00 0.02 0.00 0.00 177.57 177.35 1w3t h ALA 188 N 1.37 1.40 0.00 1.67 0.00 -1.33 -2.67 119.26 119.69 1w3t h ALA 188 Ca 0.24 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1w3t h ALA 188 Cb 0.31 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1w3t h ALA 188 CO -0.30 0.43 -0.45 0.77 0.00 0.00 0.00 179.25 179.69 1w3t h SER 189 N 0.11 0.00 -0.70 0.00 0.02 -0.41 -3.36 113.55 109.21 1w3t h SER 189 Ca 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 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 0.45 0.00 1.07 -1.14 0.00 0.00 176.83 177.26 1w3t n THR 190 N -3.29 1.07 -0.93 -2.27 5.66 -0.10 -4.95 114.28 109.48 1w3t n THR 190 Ca 0.01 -1.02 0.00 0.00 -3.05 0.00 0.00 64.05 60.00 1w3t n THR 190 Cb 0.67 0.47 0.00 0.00 -1.55 0.00 0.00 70.33 69.92 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 1.53 0.44 3.97 1.09 0.00 -1.17 -5.05 105.19 105.98 1w3t n GLY 191 Ca 0.24 -1.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.03 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 3.05 0.00 0.99 1.43 -1.04 -5.02 118.68 118.09 1w3t s LEU 192 Ca 0.00 -0.01 0.26 0.00 -1.03 0.00 0.00 54.13 53.35 1w3t s LEU 192 Cb 0.00 -2.62 0.63 0.00 0.03 0.00 0.00 46.19 44.24 1w3t s LEU 192 CO 0.00 -1.54 1.49 0.47 0.23 0.00 0.00 176.35 177.00 1w3t n ASP 193 N -2.69 0.91 0.00 2.29 8.00 -0.35 -4.66 116.55 120.06 1w3t n ASP 193 Ca 0.10 -0.74 0.00 0.00 0.71 0.00 0.00 54.79 54.87 1w3t n ASP 193 Cb 0.60 0.20 0.00 0.00 -0.02 0.00 0.00 41.12 41.90 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 1.39 0.98 2.96 0.44 0.00 -1.24 -1.06 105.19 108.65 1w3t n GLY 194 Ca 0.10 -1.88 -0.16 0.00 0.00 0.00 0.00 46.02 44.08 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 0.70 -0.49 1.61 0.01 -0.66 -1.13 114.94 110.98 1w3t s ASN 195 Ca 0.00 -0.11 -0.14 0.00 -0.71 0.00 0.00 52.86 51.90 1w3t s ASN 195 Cb 0.00 -0.09 0.10 0.00 0.41 0.00 0.00 41.25 41.67 1w3t s ASN 195 CO 0.00 0.07 0.41 -0.69 -1.51 0.00 0.00 177.10 175.38 1w3t s VAL 196 N -0.08 4.97 -0.24 1.60 1.01 0.30 -0.70 120.40 127.26 1w3t s VAL 196 Ca 0.02 -1.36 -0.00 0.00 0.00 0.00 0.00 61.98 60.64 1w3t s VAL 196 Cb -0.03 -4.09 0.03 0.00 0.00 0.00 0.00 36.38 32.29 1w3t s VAL 196 CO -0.00 -0.70 -0.09 0.00 0.00 0.00 0.00 175.10 174.30 1w3t s ALA 197 N 1.56 2.61 0.35 5.51 0.00 -0.31 -4.21 121.76 127.26 1w3t s ALA 197 Ca 0.04 -1.51 0.05 0.00 0.00 0.00 0.00 51.96 50.53 1w3t s ALA 197 Cb -0.26 -1.59 0.70 0.00 0.00 0.00 0.00 23.12 21.96 1w3t s ALA 197 CO 0.04 -0.85 1.94 0.00 0.00 0.00 0.00 175.76 176.89 1w3t h ALA 198 N 7.94 1.67 0.00 0.00 0.00 -1.86 -0.66 119.26 126.34 1w3t h ALA 198 Ca -0.31 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1w3t h ALA 198 Cb 1.09 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1w3t h ALA 198 CO 0.56 0.21 0.00 0.41 0.00 0.00 0.00 179.25 180.42 1w3t n GLY 199 N -1.44 -1.26 0.03 0.00 0.00 -1.26 -1.37 105.19 99.89 1w3t n GLY 199 Ca 0.12 0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.26 1w3t n GLY 199 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1w3t n SER 200 N -1.93 0.17 -0.25 1.61 3.41 -0.25 -1.22 113.62 115.16 1w3t n SER 200 Ca 0.03 0.53 -0.04 0.00 -0.26 0.00 0.00 58.87 59.13 1w3t n SER 200 Cb 0.25 -0.57 0.07 0.00 -0.26 0.00 0.00 64.21 63.70 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 0.74 0.00 4.04 2.35 -1.37 -2.72 115.58 118.62 1w3t h ASN 201 Ca 0.00 -0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 55.63 1w3t h ASN 201 Cb 0.43 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.61 1w3t h ASN 201 CO 0.00 0.52 -1.85 0.00 -1.65 0.00 0.00 177.43 174.45 1w3t n TYR 202 N -4.65 0.00 -3.03 1.19 0.18 -1.02 -4.61 117.16 105.23 1w3t n TYR 202 Ca 0.07 0.00 -0.24 0.00 1.88 0.00 0.00 57.90 59.61 1w3t n TYR 202 Cb 0.06 -0.52 -0.04 0.00 -0.38 0.00 0.00 39.34 38.46 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 -2.27 3.28 -0.02 -3.48 4.77 -0.36 -4.42 117.00 114.51 1w3t n LEU 203 Ca -0.12 -5.46 0.10 0.00 -0.03 0.00 0.00 56.01 50.49 1w3t n LEU 203 Cb 0.66 -0.14 0.50 0.00 -2.33 0.00 0.00 43.42 42.11 1w3t n LEU 203 CO 0.33 2.33 1.17 1.55 -1.33 0.00 0.00 177.39 181.44 1w3t h PRO 204 N 3.00 0.38 -0.43 3.23 0.13 -1.69 -2.18 132.00 134.44 1w3t h PRO 204 Ca 0.12 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 65.14 1w3t h PRO 204 Cb 0.66 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.69 1w3t h PRO 204 CO 0.71 0.25 -0.07 0.93 -0.23 0.00 0.00 178.00 179.60 1w3t h GLU 205 N 0.39 0.80 -0.15 0.86 3.07 -1.88 -1.53 114.58 116.14 1w3t h GLU 205 Ca 0.21 -0.29 -0.00 0.00 -0.50 0.00 0.00 59.36 58.78 1w3t h GLU 205 Cb 0.33 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 1w3t h GLU 205 CO -0.05 0.91 0.09 0.28 -1.40 0.00 0.00 179.01 178.83 1w3t h VAL 206 N 0.63 1.08 -0.60 3.13 2.07 -1.74 -2.19 116.25 118.63 1w3t h VAL 206 Ca 0.11 -0.21 -0.07 0.00 0.82 0.00 0.00 66.70 67.35 1w3t h VAL 206 Cb 0.59 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 1w3t h VAL 206 CO 0.04 0.07 0.09 0.71 0.02 0.00 0.00 177.57 178.50 1w3t h THR 207 N 0.16 1.25 -0.38 2.57 1.35 -1.03 -0.98 112.91 115.85 1w3t h THR 207 Ca 0.05 -0.98 -0.12 0.00 -0.55 0.00 0.00 66.41 64.81 1w3t h THR 207 Cb 0.05 0.70 -0.01 0.00 -1.73 0.00 0.00 68.15 67.15 1w3t h THR 207 CO -0.01 0.36 -0.25 0.58 -0.25 0.00 0.00 175.52 175.95 1w3t h VAL 208 N 0.91 1.27 -0.23 6.82 2.07 -1.32 -2.64 116.25 123.14 1w3t h VAL 208 Ca 0.18 -1.37 -0.12 0.00 0.82 0.00 0.00 66.70 66.21 1w3t h VAL 208 Cb 0.41 1.25 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1w3t h VAL 208 CO 0.01 0.46 -0.33 0.74 0.02 0.00 0.00 177.57 178.47 1w3t h THR 209 N 0.66 1.32 -0.36 2.57 2.02 -0.86 -0.78 112.91 117.49 1w3t h THR 209 Ca 0.09 -1.53 0.07 0.00 0.77 0.00 0.00 66.41 65.81 1w3t h THR 209 Cb 0.77 1.76 -0.06 0.00 -1.74 0.00 0.00 68.15 68.87 1w3t h THR 209 CO 0.06 0.48 -0.03 0.40 0.37 0.00 0.00 175.52 176.80 1w3t h ILE 210 N 0.32 0.70 -0.24 3.11 2.04 -1.18 0.97 117.51 123.23 1w3t h ILE 210 Ca 0.02 -0.02 0.02 0.00 1.00 0.00 0.00 64.86 65.89 1w3t h ILE 210 Cb 0.91 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.59 1w3t h ILE 210 CO 0.08 0.01 0.08 0.50 0.00 0.00 0.00 178.15 178.82 1w3t h LYS 211 N 0.06 0.18 0.08 2.37 3.64 -1.28 -0.38 116.57 121.24 1w3t h LYS 211 Ca 0.18 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1w3t h LYS 211 Cb 0.26 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1w3t h LYS 211 CO -0.32 0.12 -0.04 -0.22 -2.27 0.00 0.00 179.45 176.72 1w3t h LYS 212 N 0.19 -0.10 -0.78 1.90 3.64 -0.61 -0.30 116.57 120.51 1w3t h LYS 212 Ca 0.10 0.01 0.12 0.00 -1.27 0.00 0.00 60.65 59.61 1w3t h LYS 212 Cb 0.07 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 31.83 1w3t h LYS 212 CO -0.11 0.01 0.39 -0.07 -2.27 0.00 0.00 179.45 177.40 1w3t h LEU 213 N -0.19 0.48 -0.30 5.20 3.38 -0.67 -1.08 115.31 122.14 1w3t h LEU 213 Ca -0.01 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1w3t h LEU 213 Cb 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1w3t h LEU 213 CO 0.02 0.24 0.08 0.00 0.09 0.00 0.00 178.44 178.86 1w3t h ALA 214 N 1.50 0.39 0.00 1.53 0.00 -0.82 -1.28 119.26 120.58 1w3t h ALA 214 Ca 0.41 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1w3t h ALA 214 Cb 0.52 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1w3t h ALA 214 CO -0.32 0.05 -0.10 0.52 0.00 0.00 0.00 179.25 179.39 1w3t h MET 215 N 0.32 0.00 -0.00 0.00 2.86 -0.57 0.11 114.93 117.65 1w3t h MET 215 Ca 0.09 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 1w3t h MET 215 Cb 0.28 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.94 1w3t h MET 215 CO 0.00 0.10 0.00 0.39 1.06 0.00 0.00 176.91 178.46 1w3t n GLU 216 N -4.08 1.02 -2.22 1.72 1.02 -0.45 -4.92 120.64 112.72 1w3t n GLU 216 Ca -0.02 -0.03 -0.15 0.00 -0.02 0.00 0.00 57.16 56.94 1w3t n GLU 216 Cb 0.19 -1.42 -0.01 0.00 -0.02 0.00 0.00 31.44 30.18 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 -0.89 -1.19 -2.99 3.49 5.12 0.39 -4.92 116.66 115.67 1w3t n ARG 217 Ca 0.20 0.76 -0.42 0.00 -1.93 0.00 0.00 57.85 56.45 1w3t n ARG 217 Cb 0.10 -5.08 0.01 0.00 -1.16 0.00 0.00 32.46 26.32 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 -2.46 4.49 0.03 5.56 5.02 -0.51 -4.86 118.16 125.44 1w3t n LYS 218 Ca -0.18 -4.57 -0.09 0.00 -2.02 0.00 0.00 58.31 51.46 1w3t n LYS 218 Cb 0.63 -2.50 0.06 0.00 -0.02 0.00 0.00 35.03 33.20 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 3.35 1.34 -0.67 -0.18 6.09 -1.88 0.21 117.51 125.78 1w3t h ILE 219 Ca 0.22 -1.91 -0.04 0.00 -1.37 0.00 0.00 64.86 61.76 1w3t h ILE 219 Cb 0.60 1.89 -0.03 0.00 0.47 0.00 0.00 36.82 39.75 1w3t h ILE 219 CO 1.32 0.58 0.25 0.44 -3.07 0.00 0.00 178.15 177.67 1w3t h ASP 220 N 0.34 0.91 -0.17 2.19 3.32 -1.96 0.51 116.42 121.56 1w3t h ASP 220 Ca -0.00 -0.14 -0.14 0.00 0.02 0.00 0.00 57.03 56.77 1w3t h ASP 220 Cb 1.14 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.46 1w3t h ASP 220 CO 0.11 0.82 -0.43 -0.33 -1.72 0.00 0.00 179.24 177.69 1w3t h GLU 221 N 0.96 0.59 -0.91 3.56 5.08 -1.79 -2.03 114.58 120.04 1w3t h GLU 221 Ca 0.22 -0.41 0.07 0.00 -1.00 0.00 0.00 59.36 58.24 1w3t h GLU 221 Cb 0.21 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.46 1w3t h GLU 221 CO -0.02 1.03 0.57 0.00 -1.00 0.00 0.00 179.01 179.59 1w3t h ALA 222 N 0.56 1.26 -0.09 3.43 0.00 -0.38 -2.34 119.26 121.71 1w3t h ALA 222 Ca -0.01 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.69 1w3t h ALA 222 Cb 1.04 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 18.60 1w3t h ALA 222 CO 0.09 0.32 -0.76 -0.07 0.00 0.00 0.00 179.25 178.83 1w3t h LEU 223 N 1.03 0.82 -0.62 0.00 3.38 -0.84 0.30 115.31 119.37 1w3t h LEU 223 Ca 0.40 -0.67 0.11 0.00 0.09 0.00 0.00 57.88 57.81 1w3t h LEU 223 Cb 0.20 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.62 1w3t h LEU 223 CO -0.18 1.37 0.16 0.50 0.09 0.00 0.00 178.44 180.38 1w3t h LYS 224 N 0.33 0.29 -0.17 1.13 3.64 -1.25 0.21 116.57 120.76 1w3t h LYS 224 Ca -0.07 -0.02 -0.19 0.00 -1.27 0.00 0.00 60.65 59.10 1w3t h LYS 224 Cb 1.41 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 33.17 1w3t h LYS 224 CO 0.15 0.19 -0.64 1.25 -2.27 0.00 0.00 179.45 178.14 1w3t h LEU 225 N 0.30 0.86 -0.65 5.20 5.85 -1.12 -2.49 115.31 123.26 1w3t h LEU 225 Ca 0.32 -0.61 0.13 0.00 0.84 0.00 0.00 57.88 58.57 1w3t h LEU 225 Cb 0.47 -0.25 -0.10 0.00 0.37 0.00 0.00 40.66 41.15 1w3t h LEU 225 CO -0.39 1.32 0.11 -0.61 -0.34 0.00 0.00 178.44 178.53 1w3t h GLN 226 N 0.44 0.22 -0.55 1.25 5.75 -0.09 -1.05 115.11 121.07 1w3t h GLN 226 Ca -0.03 -0.01 -0.09 0.00 -0.15 0.00 0.00 58.65 58.36 1w3t h GLN 226 Cb 1.27 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.75 1w3t h GLN 226 CO 0.13 0.14 -0.03 0.74 -2.65 0.00 0.00 178.83 177.17 1w3t h PHE 227 N 0.22 1.06 0.17 3.99 0.05 -0.50 0.89 116.94 122.82 1w3t h PHE 227 Ca 0.35 -0.18 0.00 0.00 3.82 0.00 0.00 57.97 61.96 1w3t h PHE 227 Cb 0.55 -0.28 -0.02 0.00 2.00 0.00 0.00 35.95 38.21 1w3t h PHE 227 CO -0.29 0.96 -0.18 -0.07 -0.18 0.00 0.00 178.31 178.56 1w3t h LEU 228 N 0.89 -0.48 -0.84 1.54 3.38 -1.15 -2.69 115.31 115.97 1w3t h LEU 228 Ca 0.16 0.05 0.12 0.00 0.09 0.00 0.00 57.88 58.29 1w3t h LEU 228 Cb 0.56 0.17 -0.08 0.00 0.09 0.00 0.00 40.66 41.40 1w3t h LEU 228 CO 0.03 -0.27 0.46 -0.74 0.09 0.00 0.00 178.44 178.01 1w3t h HIS 229 N -0.39 0.82 -1.01 1.13 2.76 -0.81 -2.33 115.15 115.33 1w3t h HIS 229 Ca 0.00 0.03 0.20 0.00 -2.20 0.00 0.00 60.37 58.40 1w3t h HIS 229 Cb 0.37 -0.24 -0.11 0.00 1.55 0.00 0.00 27.41 28.98 1w3t h HIS 229 CO -0.15 0.28 0.61 -0.44 -1.30 0.00 0.00 177.93 176.94 1w3t h ASP 230 N 0.73 0.78 -0.17 3.26 3.32 -0.58 -0.83 116.42 122.93 1w3t h ASP 230 Ca 0.42 0.10 -0.09 0.00 0.02 0.00 0.00 57.03 57.49 1w3t h ASP 230 Cb 0.48 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 1w3t h ASP 230 CO -0.29 0.26 -0.17 -0.33 -1.72 0.00 0.00 179.24 176.99 1w3t h GLU 231 N 0.75 0.57 -0.32 3.56 5.08 -1.10 0.10 114.58 123.22 1w3t h GLU 231 Ca 0.59 -0.19 -0.05 0.00 -1.00 0.00 0.00 59.36 58.70 1w3t h GLU 231 Cb 0.94 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 1w3t h GLU 231 CO -0.39 0.72 -0.00 0.28 -1.00 0.00 0.00 179.01 178.62 1w3t h VAL 232 N 0.52 1.26 -0.50 3.13 2.07 -1.13 -0.65 116.25 120.95 1w3t h VAL 232 Ca 0.09 -0.96 0.06 0.00 0.82 0.00 0.00 66.70 66.71 1w3t h VAL 232 Cb 0.59 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.55 1w3t h VAL 232 CO 0.04 0.31 0.22 0.40 0.02 0.00 0.00 177.57 178.56 1w3t h ILE 233 N 0.37 0.89 -0.51 4.57 1.08 -0.71 -0.93 117.51 122.28 1w3t h ILE 233 Ca 0.09 -0.14 -0.02 0.00 -0.39 0.00 0.00 64.86 64.40 1w3t h ILE 233 Cb 0.45 0.44 -0.02 0.00 -3.07 0.00 0.00 36.82 34.61 1w3t h ILE 233 CO 0.02 0.08 0.25 -0.33 -0.69 0.00 0.00 178.15 177.47 1w3t h GLU 234 N 0.42 0.74 -0.95 2.37 5.08 -0.71 -2.08 114.58 119.45 1w3t h GLU 234 Ca 0.23 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.52 1w3t h GLU 234 Cb 0.19 -0.13 -0.06 0.00 0.50 0.00 0.00 28.75 29.25 1w3t h GLU 234 CO -0.20 0.62 0.62 0.00 -1.00 0.00 0.00 179.01 179.04 1w3t h ALA 235 N 1.09 1.27 0.00 3.43 0.00 -0.47 -2.11 119.26 122.46 1w3t h ALA 235 Ca 0.18 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1w3t h ALA 235 Cb 0.12 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1w3t h ALA 235 CO -0.02 0.48 -0.07 0.66 0.00 0.00 0.00 179.25 180.29 1w3t h SER 236 N 1.18 0.00 1.49 0.00 4.64 -0.50 -1.93 113.55 118.43 1w3t h SER 236 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1w3t h SER 236 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1w3t h SER 236 CO -0.13 0.07 -0.19 0.03 -0.87 0.00 0.00 176.83 175.74 1w3t h ARG 237 N 0.00 0.00 -0.36 4.77 3.08 -1.03 -2.65 114.38 118.18 1w3t h ARG 237 Ca -0.00 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.12 1w3t h ARG 237 Cb 0.20 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.19 1w3t h ARG 237 CO 0.01 0.00 -0.04 0.82 -1.07 0.00 0.00 179.97 179.69 1w3t h ILE 238 N 0.00 0.69 -0.30 2.04 2.04 -1.34 -2.85 117.51 117.79 1w3t h ILE 238 Ca 0.00 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1w3t h ILE 238 Cb 0.84 0.63 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1w3t h ILE 238 CO 0.00 0.01 0.00 0.49 0.00 0.00 0.00 178.15 178.65 1w3t n PHE 239 N -5.23 0.39 0.00 1.37 3.01 -1.26 -5.02 117.46 110.73 1w3t n PHE 239 Ca 0.02 -0.33 0.00 0.00 1.01 0.00 0.00 57.45 58.14 1w3t n PHE 239 Cb 0.20 -0.01 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 0.80 2.59 0.30 1.37 0.00 -1.08 -4.84 105.19 104.33 1w3t n GLY 240 Ca 0.13 -1.09 -0.07 0.00 0.00 0.00 0.00 46.02 44.99 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 0.97 -0.55 1.61 4.64 -1.71 0.22 113.55 118.73 1w3t h SER 241 Ca 0.00 -0.20 -0.04 0.00 -0.47 0.00 0.00 61.79 61.08 1w3t h SER 241 Cb 0.00 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 61.81 1w3t h SER 241 CO 0.00 0.90 0.19 -0.07 -0.87 0.00 0.00 176.83 176.99 1w3t h LEU 242 N 0.98 0.82 0.00 5.97 3.38 -1.94 0.15 115.31 124.67 1w3t h LEU 242 Ca 0.22 -0.13 -0.16 0.00 0.09 0.00 0.00 57.88 57.91 1w3t h LEU 242 Cb 0.27 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 40.82 1w3t h LEU 242 CO -0.01 0.77 -0.61 0.28 0.09 0.00 0.00 178.44 178.95 1w3t h SER 243 N 0.86 0.53 0.46 -0.43 0.02 -1.77 -3.34 113.55 109.89 1w3t h SER 243 Ca 0.20 -0.77 -0.04 0.00 -0.84 0.00 0.00 61.79 60.34 1w3t h SER 243 Cb 0.24 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 1w3t h SER 243 CO -0.01 1.23 -0.19 0.28 -1.14 0.00 0.00 176.83 177.00 1w3t h SER 244 N -0.11 0.00 -0.58 3.07 0.02 -0.20 -2.81 113.55 112.95 1w3t h SER 244 Ca -0.08 0.00 0.11 0.00 -0.84 0.00 0.00 61.79 60.98 1w3t h SER 244 Cb 1.33 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.83 1w3t h SER 244 CO 0.12 0.19 0.39 0.78 -1.14 0.00 0.00 176.83 177.17 1w3t h ASN 245 N 0.00 0.30 0.37 3.07 2.35 -0.84 -0.73 115.58 120.10 1w3t h ASN 245 Ca -0.00 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 1w3t h ASN 245 Cb 0.47 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.79 1w3t h ASN 245 CO 0.02 0.18 -0.18 1.88 -1.65 0.00 0.00 177.43 177.68 1w3t h TYR 246 N 0.33 -0.46 -0.59 1.19 -1.99 -1.70 -1.71 116.97 112.04 1w3t h TYR 246 Ca 0.27 -0.01 0.02 0.00 2.00 0.00 0.00 58.73 61.01 1w3t h TYR 246 Cb 0.62 0.15 -0.04 0.00 2.00 0.00 0.00 36.73 39.46 1w3t h TYR 246 CO -0.00 -0.17 0.36 0.28 -0.00 0.00 0.00 178.16 178.63 1w3t h VAL 247 N -0.73 1.08 -0.39 -2.88 2.07 -1.52 -2.28 116.25 111.60 1w3t h VAL 247 Ca -0.05 -0.25 -0.07 0.00 0.82 0.00 0.00 66.70 67.15 1w3t h VAL 247 Cb 0.50 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 1w3t h VAL 247 CO 0.08 0.13 -0.04 -0.07 0.02 0.00 0.00 177.57 177.70 1w3t h LEU 248 N 0.72 0.62 -0.27 2.57 3.38 -1.18 -1.10 115.31 120.06 1w3t h LEU 248 Ca 0.23 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 1w3t h LEU 248 Cb 0.01 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1w3t h LEU 248 CO -0.09 0.72 -0.03 0.74 0.09 0.00 0.00 178.44 179.87 1w3t h THR 249 N 0.61 1.27 -0.35 0.22 2.02 -0.90 -0.41 112.91 115.37 1w3t h THR 249 Ca 0.12 -0.99 0.03 0.00 0.77 0.00 0.00 66.41 66.34 1w3t h THR 249 Cb 0.44 1.38 -0.03 0.00 -1.74 0.00 0.00 68.15 68.20 1w3t h THR 249 CO 0.02 0.31 0.15 0.50 0.37 0.00 0.00 175.52 176.87 1w3t h LYS 250 N 0.26 0.30 -0.46 6.66 3.64 -1.29 0.23 116.57 125.91 1w3t h LYS 250 Ca 0.07 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.36 1w3t h LYS 250 Cb 0.47 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 1w3t h LYS 250 CO 0.02 0.20 -0.03 -0.92 -2.27 0.00 0.00 179.45 176.45 1w3t h TYR 251 N 0.31 0.82 0.02 1.91 3.20 -0.94 -0.37 116.97 121.93 1w3t h TYR 251 Ca 0.15 -0.12 -0.37 0.00 3.14 0.00 0.00 58.73 61.52 1w3t h TYR 251 Cb 0.09 -0.22 -0.06 0.00 1.54 0.00 0.00 36.73 38.08 1w3t h TYR 251 CO -0.12 0.78 -2.32 1.19 -1.64 0.00 0.00 178.16 176.06 1w3t n PHE 252 N -4.20 0.30 0.49 -3.82 3.01 -0.18 -4.45 117.46 108.60 1w3t n PHE 252 Ca 0.02 0.07 0.11 0.00 1.01 0.00 0.00 57.45 58.67 1w3t n PHE 252 Cb 0.31 -1.04 -0.03 0.00 -0.01 0.00 0.00 39.48 38.71 1w3t n PHE 252 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1w3t n GLN 253 N -3.17 0.34 -0.71 -1.08 1.13 0.80 -5.01 117.38 109.68 1w3t n GLN 253 Ca -0.38 -0.03 0.00 0.00 -1.94 0.00 0.00 57.00 54.64 1w3t n GLN 253 Cb 1.04 -1.58 0.00 0.00 0.11 0.00 0.00 30.24 29.81 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 1.35 0.77 3.39 1.08 0.00 -0.15 -5.00 105.19 106.63 1w3t n GLY 254 Ca 0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.85 1.87 0.15 1.61 -0.85 -1.25 -5.03 117.35 111.00 1w3t s TYR 255 Ca 0.00 -0.58 -0.17 0.00 -0.52 0.00 0.00 57.07 55.80 1w3t s TYR 255 Cb 0.00 -0.93 -0.07 0.00 0.38 0.00 0.00 41.96 41.34 1w3t s TYR 255 CO 0.00 0.39 0.60 0.34 -1.52 0.00 0.00 175.55 175.35 1w3t s ASP 256 N -3.39 6.95 -0.14 -0.18 -1.08 -1.26 -3.49 116.67 114.08 1w3t s ASP 256 Ca 0.26 1.21 0.15 0.00 -0.52 0.00 0.00 52.55 53.65 1w3t s ASP 256 Cb 0.00 -2.34 0.32 0.00 -1.46 0.00 0.00 42.92 39.44 1w3t s ASP 256 CO 0.10 0.13 1.16 0.18 0.52 0.00 0.00 175.17 177.26 1w3t n LEU 257 N 1.01 2.15 0.00 -1.34 4.77 -1.26 -4.91 117.00 117.42 1w3t n LEU 257 Ca -0.06 -3.10 0.00 0.00 -0.03 0.00 0.00 56.01 52.82 1w3t n LEU 257 Cb 0.51 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1w3t n LEU 257 CO 0.42 0.90 0.00 0.61 -1.33 0.00 0.00 177.39 177.99 1w3t n GLY 258 N -1.04 2.56 3.32 -0.72 0.00 -1.26 -3.95 105.19 104.09 1w3t n GLY 258 Ca 0.15 -0.31 -0.21 0.00 0.00 0.00 0.00 46.02 45.65 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 1.74 0.99 1.61 1.51 -0.74 -4.87 117.35 117.59 1w3t s TYR 259 Ca 0.00 -0.49 -0.16 0.00 -1.01 0.00 0.00 57.07 55.41 1w3t s TYR 259 Cb 0.00 -0.87 0.20 0.00 -0.11 0.00 0.00 41.96 41.17 1w3t s TYR 259 CO 0.00 0.30 1.24 -1.25 -1.11 0.00 0.00 175.55 174.73 1w3t s PRO 260 N -2.83 0.48 -0.26 -1.71 0.04 -1.26 -0.99 135.00 128.47 1w3t s PRO 260 Ca 0.15 -0.18 -0.09 0.00 0.04 0.00 0.00 61.00 60.91 1w3t s PRO 260 Cb -0.05 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.64 1w3t s PRO 260 CO 0.06 -2.56 0.13 0.50 0.04 0.00 0.00 177.00 175.17 1w3t s ARG 261 N -5.67 3.84 0.27 4.56 3.52 -1.24 -4.81 118.95 119.41 1w3t s ARG 261 Ca 0.71 -0.38 -0.30 0.00 -0.13 0.00 0.00 55.73 55.62 1w3t s ARG 261 Cb -0.07 -3.48 -0.13 0.00 -1.56 0.00 0.00 34.95 29.71 1w3t s ARG 261 CO 0.53 -0.13 1.36 -2.30 -0.81 0.00 0.00 175.30 173.95 1w3t n PRO 262 N 4.83 2.04 -0.10 5.12 -0.02 -1.26 -1.06 135.00 144.56 1w3t n PRO 262 Ca -0.15 0.72 0.01 0.00 -2.02 0.00 0.00 63.50 62.07 1w3t n PRO 262 Cb 0.52 -2.35 0.06 0.00 -0.02 0.00 0.00 33.50 31.70 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 1.58 1.45 -2.86 0.52 -0.04 -1.26 -4.99 135.00 129.40 1w3t n PRO 263 Ca 0.10 -0.46 -0.43 0.00 -0.04 0.00 0.00 63.50 62.66 1w3t n PRO 263 Cb 0.33 -1.36 -0.03 0.00 -0.04 0.00 0.00 33.50 32.40 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 -1.56 4.52 0.30 0.52 -1.09 -0.22 -5.01 121.20 118.66 1w3t s ILE 264 Ca 0.08 -1.17 -0.24 0.00 -2.23 0.00 0.00 60.65 57.09 1w3t s ILE 264 Cb 0.05 -4.79 -0.09 0.00 -1.58 0.00 0.00 42.46 36.05 1w3t s ILE 264 CO 0.04 -1.55 0.89 -0.36 -1.23 0.00 0.00 174.94 172.73 1w3t s PHE 265 N 3.32 3.68 0.62 3.97 0.40 -1.26 -3.69 117.98 125.01 1w3t s PHE 265 Ca 0.32 1.68 -0.19 0.00 -0.60 0.00 0.00 56.93 58.14 1w3t s PHE 265 Cb -0.07 -2.84 -0.02 0.00 0.51 0.00 0.00 43.02 40.59 1w3t s PHE 265 CO -0.05 0.24 1.29 -2.30 0.70 0.00 0.00 175.22 175.10 1w3t n PRO 266 N 0.59 1.26 -1.96 0.24 -0.02 -1.26 -4.73 135.00 129.12 1w3t n PRO 266 Ca 0.01 0.48 -0.39 0.00 -2.02 0.00 0.00 63.50 61.58 1w3t n PRO 266 Cb 0.50 -2.52 0.01 0.00 -0.02 0.00 0.00 33.50 31.47 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 -3.94 4.05 0.90 2.45 1.43 -1.26 -5.04 118.68 117.27 1w3t s LEU 267 Ca 0.79 2.67 -0.13 0.00 -1.03 0.00 0.00 54.13 56.43 1w3t s LEU 267 Cb -0.39 -4.08 0.17 0.00 0.03 0.00 0.00 46.19 41.91 1w3t s LEU 267 CO 0.43 -1.14 1.25 1.51 0.23 0.00 0.00 176.35 178.63 1w3t s ASP 268 N -0.88 3.53 0.20 2.29 1.47 -1.26 -4.84 116.67 117.17 1w3t s ASP 268 Ca 0.63 0.28 -0.12 0.00 1.18 0.00 0.00 52.55 54.52 1w3t s ASP 268 Cb -0.38 -0.45 0.13 0.00 -0.34 0.00 0.00 42.92 41.87 1w3t s ASP 268 CO 0.47 -2.47 1.86 0.44 0.68 0.00 0.00 175.17 176.15 1w3t h ASP 269 N -1.39 0.74 -0.16 2.11 3.32 -1.98 -0.67 116.42 118.39 1w3t h ASP 269 Ca -0.44 -0.02 -0.15 0.00 0.02 0.00 0.00 57.03 56.44 1w3t h ASP 269 Cb 1.26 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 1w3t h ASP 269 CO 0.43 0.53 -0.44 -0.08 -1.72 0.00 0.00 179.24 177.97 1w3t h GLU 270 N 0.88 0.71 -0.41 3.56 4.57 -1.98 -0.12 114.58 121.79 1w3t h GLU 270 Ca 0.24 -0.39 -0.04 0.00 -1.18 0.00 0.00 59.36 57.99 1w3t h GLU 270 Cb -0.08 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.51 1w3t h GLU 270 CO -0.06 1.01 0.09 0.93 -1.18 0.00 0.00 179.01 179.79 1w3t h GLU 271 N 0.57 0.66 -0.56 1.92 5.08 -1.88 0.40 114.58 120.78 1w3t h GLU 271 Ca 0.04 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 1w3t h GLU 271 Cb 0.99 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.13 1w3t h GLU 271 CO 0.09 0.69 0.31 1.49 -1.00 0.00 0.00 179.01 180.60 1w3t h GLU 272 N 0.52 0.77 -0.40 2.33 4.81 -0.99 0.11 114.58 121.74 1w3t h GLU 272 Ca 0.13 -0.09 -0.04 0.00 -0.13 0.00 0.00 59.36 59.23 1w3t h GLU 272 Cb 0.34 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1w3t h GLU 272 CO 0.00 0.59 0.08 -0.09 -0.73 0.00 0.00 179.01 178.86 1w3t h ARG 273 N 0.75 0.64 -0.25 1.92 2.43 -0.84 -1.55 114.38 117.48 1w3t h ARG 273 Ca 0.20 -0.16 -0.06 0.00 -0.81 0.00 0.00 59.98 59.15 1w3t h ARG 273 Cb 0.03 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1w3t h ARG 273 CO -0.03 0.68 -0.11 1.96 -1.51 0.00 0.00 179.97 180.96 1w3t h GLN 274 N 0.50 0.40 -0.06 0.20 4.20 -0.50 -1.45 115.11 118.41 1w3t h GLN 274 Ca 0.12 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 1w3t h GLN 274 Cb 0.33 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.06 1w3t h GLN 274 CO 0.00 0.52 0.01 1.25 -0.67 0.00 0.00 178.83 179.94 1w3t h LEU 275 N 0.38 0.10 -0.98 1.46 5.85 -0.45 -2.06 115.31 119.60 1w3t h LEU 275 Ca 0.08 -0.28 -0.07 0.00 0.84 0.00 0.00 57.88 58.45 1w3t h LEU 275 Cb 0.42 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 1w3t h LEU 275 CO 0.02 0.35 -0.03 0.40 -0.34 0.00 0.00 178.44 178.85 1w3t h ILE 276 N -0.15 1.24 -0.64 4.05 2.04 -1.10 0.66 117.51 123.61 1w3t h ILE 276 Ca 0.02 -0.98 0.08 0.00 1.00 0.00 0.00 64.86 64.97 1w3t h ILE 276 Cb 0.30 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 1w3t h ILE 276 CO 0.00 0.34 0.42 0.50 0.00 0.00 0.00 178.15 179.42 1w3t h LYS 277 N 0.66 0.55 0.00 2.37 3.64 -1.01 0.10 116.57 122.87 1w3t h LYS 277 Ca 0.13 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.40 1w3t h LYS 277 Cb 0.45 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1w3t h LYS 277 CO 0.02 0.36 -0.38 0.87 -2.27 0.00 0.00 179.45 178.05 1w3t h LYS 278 N 0.56 0.00 -0.00 1.90 1.79 -0.15 -3.33 116.57 117.34 1w3t h LYS 278 Ca 0.28 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.75 1w3t h LYS 278 Cb 0.38 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.03 1w3t h LYS 278 CO -0.09 0.38 -0.00 1.33 -1.08 0.00 0.00 179.45 179.99 1w3t n VAL 279 N -3.56 0.00 -0.23 0.50 0.24 -0.61 -4.70 118.33 109.97 1w3t n VAL 279 Ca -0.00 -0.50 -0.05 0.00 -2.04 0.00 0.00 64.34 61.75 1w3t n VAL 279 Cb 0.50 1.06 0.11 0.00 -1.47 0.00 0.00 33.84 34.04 1w3t n VAL 279 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 1w3t h GLU 280 N 0.57 1.06 -0.05 7.34 4.11 -0.95 -0.99 114.58 125.67 1w3t h GLU 280 Ca 0.00 -0.22 -0.09 0.00 0.07 0.00 0.00 59.36 59.12 1w3t h GLU 280 Cb 0.12 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1w3t h GLU 280 CO 0.00 0.90 -0.40 0.78 0.07 0.00 0.00 179.01 180.36 1w3t h GLY 281 N 1.08 0.12 0.96 1.06 0.00 -1.84 -2.19 103.07 102.26 1w3t h GLY 281 Ca 0.23 -0.10 -0.10 0.00 0.00 0.00 0.00 47.33 47.35 1w3t h GLY 281 CO -0.01 0.10 -0.21 -2.22 0.00 0.00 0.00 176.54 174.20 1w3t h ILE 282 N 0.09 1.29 -0.35 2.60 2.04 -1.69 -1.87 117.51 119.62 1w3t h ILE 282 Ca 0.01 -1.34 0.05 0.00 1.00 0.00 0.00 64.86 64.58 1w3t h ILE 282 Cb 0.75 1.46 -0.05 0.00 -0.74 0.00 0.00 36.82 38.24 1w3t h ILE 282 CO 0.06 0.43 0.08 -0.09 0.00 0.00 0.00 178.15 178.63 1w3t h ARG 283 N 0.47 0.20 -0.46 2.37 2.43 -1.02 -0.33 114.38 118.05 1w3t h ARG 283 Ca 0.07 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.29 1w3t h ARG 283 Cb 0.75 -0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 30.20 1w3t h ARG 283 CO 0.06 0.13 0.12 0.00 -1.51 0.00 0.00 179.97 178.77 1w3t h ALA 284 N 1.26 0.52 0.10 2.80 0.00 -1.33 0.75 119.26 123.37 1w3t h ALA 284 Ca 0.17 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.17 1w3t h ALA 284 Cb 0.18 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1w3t h ALA 284 CO -0.21 -0.28 -0.26 -0.22 0.00 0.00 0.00 179.25 178.29 1w3t h LYS 285 N 0.27 -0.44 -0.61 0.00 3.64 -0.75 0.36 116.57 119.04 1w3t h LYS 285 Ca 0.22 0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.69 1w3t h LYS 285 Cb 0.26 0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 32.14 1w3t h LYS 285 CO -0.26 -0.29 0.40 -0.07 -2.27 0.00 0.00 179.45 176.96 1w3t h LEU 286 N -0.46 0.53 0.35 5.20 3.38 -0.27 0.35 115.31 124.39 1w3t h LEU 286 Ca 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1w3t h LEU 286 Cb 0.49 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1w3t h LEU 286 CO -0.16 0.35 -0.17 0.58 0.09 0.00 0.00 178.44 179.14 1w3t h VAL 287 N 0.61 0.46 -1.05 1.22 2.07 -0.42 -1.29 116.25 117.86 1w3t h VAL 287 Ca 0.26 -0.71 0.34 0.00 0.82 0.00 0.00 66.70 67.41 1w3t h VAL 287 Cb 0.24 0.72 -0.14 0.00 -1.52 0.00 0.00 31.29 30.59 1w3t h VAL 287 CO -0.08 0.10 0.62 -0.08 0.02 0.00 0.00 177.57 178.15 1w3t h GLU 288 N -0.96 0.26 0.00 1.57 4.81 -0.50 0.16 114.58 119.93 1w3t h GLU 288 Ca -0.05 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1w3t h GLU 288 Cb 0.52 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1w3t h GLU 288 CO 0.08 0.17 0.00 1.28 -0.73 0.00 0.00 179.01 179.81 1w3t n LEU 289 N -4.98 0.00 0.00 1.64 4.77 0.12 -4.88 117.00 113.66 1w3t n LEU 289 Ca 0.33 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 1w3t n LEU 289 Cb 1.06 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 42.01 1w3t n LEU 289 CO 0.12 -0.01 0.00 0.29 -1.33 0.00 0.00 177.39 176.46 1w3t n LYS 290 N -1.15 -1.07 -0.06 3.23 5.02 0.57 -4.88 118.16 119.82 1w3t n LYS 290 Ca 0.18 0.27 -0.13 0.00 -2.02 0.00 0.00 58.31 56.60 1w3t n LYS 290 Cb 0.17 -4.12 -0.07 0.00 -0.02 0.00 0.00 35.03 30.99 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 -2.91 -0.18 2.04 -1.47 -3.44 117.51 112.89 1w3t h ILE 291 Ca 0.00 -1.40 -0.63 0.00 1.00 0.00 0.00 64.86 63.83 1w3t h ILE 291 Cb 0.54 1.87 -0.05 0.00 -0.74 0.00 0.00 36.82 38.43 1w3t h ILE 291 CO 0.00 0.42 -0.51 -0.76 0.00 0.00 0.00 178.15 177.30 1w3t s LEU 292 N -9.01 4.28 -0.10 1.44 1.43 -0.86 -4.84 118.68 111.01 1w3t s LEU 292 Ca -0.14 0.26 -0.26 0.00 -1.03 0.00 0.00 54.13 52.97 1w3t s LEU 292 Cb 0.06 -2.75 -0.22 0.00 0.03 0.00 0.00 46.19 43.31 1w3t s LEU 292 CO 0.78 0.21 0.83 0.11 0.23 0.00 0.00 176.35 178.51 1w3t h LYS 293 N 3.43 -0.02 0.00 1.70 1.79 -1.89 -3.38 116.57 118.20 1w3t h LYS 293 Ca -0.47 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 1w3t h LYS 293 Cb 1.17 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.83 1w3t h LYS 293 CO 0.72 0.74 0.00 -1.91 -1.08 0.00 0.00 179.45 177.92