#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wr0 s GLN 6 N 0.00 0.97 -0.02 -1.24 -2.07 -0.19 -1.66 119.66 115.46 2wr0 s GLN 6 Ca 0.00 -0.82 0.02 0.00 -1.82 0.00 0.00 55.36 52.74 2wr0 s GLN 6 Cb 0.00 0.41 0.00 0.00 -1.09 0.00 0.00 33.01 32.33 2wr0 s GLN 6 CO 0.00 -0.35 -0.07 -1.50 -1.32 0.00 0.00 175.29 172.05 2wr0 s ILE 7 N -3.83 0.57 -0.03 3.63 2.07 -0.80 0.20 121.20 123.01 2wr0 s ILE 7 Ca 0.04 -0.26 0.05 0.00 -1.41 0.00 0.00 60.65 59.07 2wr0 s ILE 7 Cb 0.03 -0.51 -0.01 0.00 0.13 0.00 0.00 42.46 42.10 2wr0 s ILE 7 CO -0.11 0.18 -0.19 0.00 -1.91 0.00 0.00 174.94 172.90 2wr0 s ILE 9 N -0.20 4.64 0.36 0.00 -1.09 0.09 0.34 121.20 125.34 2wr0 s ILE 9 Ca 0.01 1.20 -0.15 0.00 -2.23 0.00 0.00 60.65 59.49 2wr0 s ILE 9 Cb -0.10 -3.86 0.04 0.00 -1.58 0.00 0.00 42.46 36.96 2wr0 s ILE 9 CO 0.01 0.29 0.74 -0.83 -1.23 0.00 0.00 174.94 173.91 2wr0 s GLY 10 N -1.55 0.44 0.01 6.18 0.00 0.16 -4.73 107.32 107.81 2wr0 s GLY 10 Ca 0.39 -0.78 -0.06 0.00 0.00 0.00 0.00 44.72 44.27 2wr0 s GLY 10 CO 0.21 -0.37 0.12 -2.52 0.00 0.00 0.00 173.10 170.54 2wr0 s TYR 11 N -2.66 0.07 0.37 1.90 -0.85 -1.26 -1.37 117.35 113.55 2wr0 s TYR 11 Ca 0.17 -0.19 -0.27 0.00 -0.52 0.00 0.00 57.07 56.26 2wr0 s TYR 11 Cb -0.05 -0.07 -0.11 0.00 0.38 0.00 0.00 41.96 42.11 2wr0 s TYR 11 CO 0.12 -0.28 1.32 1.58 -1.52 0.00 0.00 175.55 176.77 2wr0 n HIS 12 N 1.46 2.36 -4.28 -3.49 -0.00 0.27 -0.11 115.22 111.44 2wr0 n HIS 12 Ca -0.23 0.52 -0.15 0.00 -0.00 0.00 0.00 57.72 57.86 2wr0 n HIS 12 Cb 0.55 -2.42 -0.10 0.00 -0.00 0.00 0.00 29.99 28.02 2wr0 n HIS 12 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2wr0 s ALA 13 N -1.13 1.54 0.00 1.57 0.00 -0.84 -4.51 121.76 118.39 2wr0 s ALA 13 Ca 0.57 -1.68 0.00 0.00 0.00 0.00 0.00 51.96 50.85 2wr0 s ALA 13 Cb -0.53 0.58 0.00 0.00 0.00 0.00 0.00 23.12 23.17 2wr0 s ALA 13 CO 0.61 -0.31 0.00 0.27 0.00 0.00 0.00 175.76 176.33 2wr0 n ASN 14 N -0.32 0.00 0.00 0.00 0.23 -1.26 -4.33 115.26 109.58 2wr0 n ASN 14 Ca -0.05 0.00 0.13 0.00 -0.53 0.00 0.00 54.58 54.12 2wr0 n ASN 14 Cb 0.64 0.00 0.36 0.00 -2.08 0.00 0.00 39.78 38.70 2wr0 n ASN 14 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2wr0 n ASN 15 N 0.00 0.36 -4.74 0.53 3.02 -1.26 -4.76 115.26 108.41 2wr0 n ASN 15 Ca 0.00 -0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.13 2wr0 n ASN 15 Cb 0.00 0.01 -0.00 0.00 -0.61 0.00 0.00 39.78 39.18 2wr0 n ASN 15 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2wr0 n SER 16 N -1.53 3.32 -0.22 6.41 2.88 -1.26 -4.90 113.62 118.31 2wr0 n SER 16 Ca 0.06 1.21 0.02 0.00 -1.33 0.00 0.00 58.87 58.83 2wr0 n SER 16 Cb 0.34 -1.55 0.05 0.00 -0.75 0.00 0.00 64.21 62.30 2wr0 n SER 16 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2wr0 n THR 17 N 0.52 0.77 -1.66 2.46 -2.24 -1.26 -4.81 114.28 108.06 2wr0 n THR 17 Ca 0.03 -0.88 -0.47 0.00 -2.27 0.00 0.00 64.05 60.46 2wr0 n THR 17 Cb 0.37 0.64 -0.04 0.00 -2.10 0.00 0.00 70.33 69.19 2wr0 n THR 17 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2wr0 n GLU 18 N -0.04 2.05 -4.68 -0.78 4.07 -1.26 -4.87 120.64 115.13 2wr0 n GLU 18 Ca 0.04 0.74 -0.32 0.00 -0.06 0.00 0.00 57.16 57.56 2wr0 n GLU 18 Cb 0.27 -2.51 -0.12 0.00 -0.06 0.00 0.00 31.44 29.02 2wr0 n GLU 18 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2wr0 s LYS 19 N 1.29 2.39 0.25 5.31 1.02 -1.26 -1.55 119.74 127.19 2wr0 s LYS 19 Ca 0.81 -0.79 0.05 0.00 0.02 0.00 0.00 55.97 56.06 2wr0 s LYS 19 Cb -0.71 -2.36 -0.05 0.00 -0.52 0.00 0.00 37.83 34.19 2wr0 s LYS 19 CO 0.41 0.59 -0.03 0.14 -0.92 0.00 0.00 175.35 175.53 2wr0 s VAL 20 N -0.87 1.34 0.04 3.17 -7.23 -0.07 -4.91 120.40 111.86 2wr0 s VAL 20 Ca 0.14 -2.08 0.04 0.00 -1.81 0.00 0.00 61.98 58.27 2wr0 s VAL 20 Cb -0.11 -2.37 -0.04 0.00 0.56 0.00 0.00 36.38 34.42 2wr0 s VAL 20 CO 0.04 -0.33 -0.06 -1.81 -0.31 0.00 0.00 175.10 172.63 2wr0 s ASP 21 N -3.37 4.69 0.42 4.85 1.01 -1.26 -0.22 116.67 122.78 2wr0 s ASP 21 Ca 0.28 -0.19 0.04 0.00 0.71 0.00 0.00 52.55 53.39 2wr0 s ASP 21 Cb 0.05 -1.07 -0.04 0.00 1.01 0.00 0.00 42.92 42.86 2wr0 s ASP 21 CO 0.10 0.24 0.04 0.42 0.21 0.00 0.00 175.17 176.18 2wr0 s THR 22 N -1.11 1.27 0.41 -1.27 -4.23 0.81 -4.47 115.64 107.05 2wr0 s THR 22 Ca 0.20 -2.00 0.08 0.00 -1.18 0.00 0.00 61.69 58.79 2wr0 s THR 22 Cb -0.11 -2.56 0.29 0.00 1.34 0.00 0.00 72.50 71.46 2wr0 s THR 22 CO 0.11 0.00 2.02 0.40 -0.54 0.00 0.00 174.62 176.61 2wr0 h ILE 23 N 1.72 1.04 0.00 2.99 1.08 -1.76 -3.02 117.51 119.57 2wr0 h ILE 23 Ca -0.41 -0.19 0.00 0.00 -0.39 0.00 0.00 64.86 63.86 2wr0 h ILE 23 Cb 1.27 0.43 0.00 0.00 -3.07 0.00 0.00 36.82 35.45 2wr0 h ILE 23 CO 0.71 0.10 -1.57 0.18 -0.69 0.00 0.00 178.15 176.89 2wr0 n LEU 24 N -4.47 0.35 -3.92 1.44 4.77 -1.26 -5.00 117.00 108.90 2wr0 n LEU 24 Ca 0.06 0.07 -0.10 0.00 -0.03 0.00 0.00 56.01 56.01 2wr0 n LEU 24 Cb 0.16 -0.03 -0.10 0.00 -2.33 0.00 0.00 43.42 41.12 2wr0 n LEU 24 CO 0.35 -0.04 -0.27 -1.61 -1.33 0.00 0.00 177.39 174.49 2wr0 s GLU 25 N -3.42 0.39 0.05 3.23 2.02 -1.14 -5.16 118.70 114.67 2wr0 s GLU 25 Ca -0.04 -0.49 0.04 0.00 0.02 0.00 0.00 54.97 54.50 2wr0 s GLU 25 Cb 0.13 0.15 -0.04 0.00 0.10 0.00 0.00 34.13 34.47 2wr0 s GLU 25 CO 0.86 -0.08 -0.04 1.03 0.02 0.00 0.00 175.26 177.05 2wr0 s ARG 26 N -1.39 2.49 -1.33 1.61 1.81 -1.26 -0.13 118.95 120.75 2wr0 s ARG 26 Ca -0.15 -0.81 -0.02 0.00 -1.72 0.00 0.00 55.73 53.03 2wr0 s ARG 26 Cb -0.09 -2.50 0.01 0.00 -0.45 0.00 0.00 34.95 31.93 2wr0 s ARG 26 CO 0.00 0.56 0.76 0.09 -0.68 0.00 0.00 175.30 176.03 2wr0 n ASN 27 N 1.02 -1.77 -4.70 0.23 5.03 -0.86 -4.94 115.26 109.27 2wr0 n ASN 27 Ca -0.13 -0.80 -0.42 0.00 0.87 0.00 0.00 54.58 54.09 2wr0 n ASN 27 Cb 0.52 -4.09 -0.03 0.00 -1.02 0.00 0.00 39.78 35.16 2wr0 n ASN 27 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2wr0 s VAL 28 N -3.60 4.60 -0.07 2.41 1.01 0.69 -4.78 120.40 120.65 2wr0 s VAL 28 Ca 0.10 1.87 -0.29 0.00 0.00 0.00 0.00 61.98 63.66 2wr0 s VAL 28 Cb -0.05 -4.20 -0.02 0.00 0.00 0.00 0.00 36.38 32.11 2wr0 s VAL 28 CO 0.81 0.10 0.98 -0.89 0.00 0.00 0.00 175.10 176.11 2wr0 s THR 29 N 1.33 4.83 0.16 3.92 2.01 -1.26 -0.89 115.64 125.73 2wr0 s THR 29 Ca 0.53 2.02 0.09 0.00 0.31 0.00 0.00 61.69 64.64 2wr0 s THR 29 Cb -0.23 -4.30 -0.04 0.00 0.01 0.00 0.00 72.50 67.94 2wr0 s THR 29 CO 0.26 0.07 -0.20 0.68 -0.69 0.00 0.00 174.62 174.74 2wr0 s VAL 30 N 1.60 1.92 0.33 3.82 -7.23 -0.60 -0.73 120.40 119.51 2wr0 s VAL 30 Ca 0.49 -1.88 0.08 0.00 -1.81 0.00 0.00 61.98 58.85 2wr0 s VAL 30 Cb -0.19 -1.86 0.09 0.00 0.56 0.00 0.00 36.38 34.98 2wr0 s VAL 30 CO 0.22 -0.23 1.79 0.71 -0.31 0.00 0.00 175.10 177.27 2wr0 h THR 31 N 3.37 1.26 -3.41 5.32 1.35 -1.35 -3.38 112.91 116.07 2wr0 h THR 31 Ca -0.44 -1.22 -0.08 0.00 -0.55 0.00 0.00 66.41 64.12 2wr0 h THR 31 Cb 1.20 1.48 -0.15 0.00 -1.73 0.00 0.00 68.15 68.95 2wr0 h THR 31 CO 0.48 0.37 -0.23 -1.00 -0.25 0.00 0.00 175.52 174.89 2wr0 s HIS 32 N -4.39 -0.08 0.08 4.73 3.76 -1.26 -4.67 115.29 113.46 2wr0 s HIS 32 Ca -0.05 -0.15 -0.26 0.00 -0.15 0.00 0.00 55.06 54.45 2wr0 s HIS 32 Cb 0.14 0.10 0.08 0.00 1.11 0.00 0.00 32.58 34.02 2wr0 s HIS 32 CO 0.76 -0.56 0.70 0.00 -0.85 0.00 0.00 174.74 174.79 2wr0 s ALA 33 N -3.08 -1.69 -0.07 -1.40 0.00 -1.26 -1.66 121.76 112.60 2wr0 s ALA 33 Ca -0.01 0.78 -0.00 0.00 0.00 0.00 0.00 51.96 52.73 2wr0 s ALA 33 Cb 0.01 0.57 0.03 0.00 0.00 0.00 0.00 23.12 23.73 2wr0 s ALA 33 CO -0.07 -0.67 -0.02 0.21 0.00 0.00 0.00 175.76 175.21 2wr0 s LYS 34 N -3.10 0.80 -0.02 0.00 2.20 0.28 -4.86 119.74 115.04 2wr0 s LYS 34 Ca -0.00 -0.01 -0.30 0.00 -0.36 0.00 0.00 55.97 55.30 2wr0 s LYS 34 Cb -0.01 -1.01 -0.04 0.00 -1.51 0.00 0.00 37.83 35.27 2wr0 s LYS 34 CO -0.08 -0.22 1.13 0.34 -0.36 0.00 0.00 175.35 176.16 2wr0 s ASP 35 N 1.58 7.15 -0.05 1.43 2.15 -1.26 -0.77 116.67 126.89 2wr0 s ASP 35 Ca -0.00 1.81 0.14 0.00 0.43 0.00 0.00 52.55 54.92 2wr0 s ASP 35 Cb -0.13 -2.57 0.43 0.00 -0.30 0.00 0.00 42.92 40.35 2wr0 s ASP 35 CO -0.04 -0.47 1.35 2.30 -0.17 0.00 0.00 175.17 178.15 2wr0 n ILE 36 N 4.27 1.38 -3.72 4.11 -5.35 0.54 -4.91 119.36 115.68 2wr0 n ILE 36 Ca 0.09 -1.22 -0.37 0.00 -0.27 0.00 0.00 62.75 60.98 2wr0 n ILE 36 Cb 0.47 0.29 -0.12 0.00 -1.74 0.00 0.00 39.64 38.54 2wr0 n ILE 36 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 2wr0 s LEU 37 N -1.50 3.68 -0.15 7.28 2.96 -1.25 -3.56 118.68 126.14 2wr0 s LEU 37 Ca 0.32 -0.30 -0.29 0.00 -0.22 0.00 0.00 54.13 53.64 2wr0 s LEU 37 Cb 0.20 -1.96 -0.01 0.00 0.50 0.00 0.00 46.19 44.92 2wr0 s LEU 37 CO 0.16 -0.08 1.12 -0.70 -1.32 0.00 0.00 176.35 175.54 2wr0 s GLU 38 N 1.62 4.31 0.00 1.98 2.56 0.15 -4.89 118.70 124.43 2wr0 s GLU 38 Ca 0.06 1.51 0.00 0.00 0.00 0.00 0.00 54.97 56.54 2wr0 s GLU 38 Cb -0.16 -3.63 0.00 0.00 2.00 0.00 0.00 34.13 32.34 2wr0 s GLU 38 CO 0.05 -0.53 0.34 1.63 -0.56 0.00 0.00 175.26 176.19 2wr0 n LYS 39 N 5.83 1.15 -4.32 4.30 5.02 -1.26 -2.71 118.16 126.18 2wr0 n LYS 39 Ca 0.11 -0.34 -0.24 0.00 -2.02 0.00 0.00 58.31 55.82 2wr0 n LYS 39 Cb 0.46 -0.84 -0.12 0.00 -0.02 0.00 0.00 35.03 34.51 2wr0 n LYS 39 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2wr0 s THR 40 N -0.26 1.83 0.24 -0.18 -4.23 -1.26 -4.89 115.64 106.88 2wr0 s THR 40 Ca 0.00 -1.70 0.01 0.00 -1.18 0.00 0.00 61.69 58.82 2wr0 s THR 40 Cb 0.00 -1.71 -0.04 0.00 1.34 0.00 0.00 72.50 72.09 2wr0 s THR 40 CO 0.00 -0.13 0.15 -1.38 -0.54 0.00 0.00 174.62 172.72 2wr0 s HIS 41 N -1.45 1.36 -2.56 3.99 -3.43 -1.26 -4.61 115.29 107.33 2wr0 s HIS 41 Ca 0.11 -1.40 0.23 0.00 -0.80 0.00 0.00 55.06 53.20 2wr0 s HIS 41 Cb -0.09 -0.66 0.47 0.00 -1.43 0.00 0.00 32.58 30.87 2wr0 s HIS 41 CO 0.05 -0.63 1.42 0.27 -2.00 0.00 0.00 174.74 173.85 2wr0 n ASN 42 N -0.58 2.96 -0.26 7.38 0.23 -0.57 -4.91 115.26 119.50 2wr0 n ASN 42 Ca 0.03 -1.92 -0.03 0.00 -0.53 0.00 0.00 54.58 52.12 2wr0 n ASN 42 Cb 0.65 -0.16 -0.01 0.00 -2.08 0.00 0.00 39.78 38.18 2wr0 n ASN 42 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2wr0 n GLY 43 N 1.39 0.48 3.54 4.83 0.00 -1.26 -4.85 105.19 109.33 2wr0 n GLY 43 Ca 0.18 -0.09 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 2wr0 n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wr0 s LYS 44 N -1.78 1.96 -0.01 1.61 1.02 -1.26 -4.73 119.74 116.56 2wr0 s LYS 44 Ca 0.00 -1.22 -0.23 0.00 0.02 0.00 0.00 55.97 54.54 2wr0 s LYS 44 Cb 0.00 -2.15 -0.05 0.00 -0.52 0.00 0.00 37.83 35.11 2wr0 s LYS 44 CO 0.00 0.46 0.69 -1.17 -0.92 0.00 0.00 175.35 174.41 2wr0 s LEU 45 N -2.53 4.40 0.31 3.17 1.98 -1.26 -2.47 118.68 122.27 2wr0 s LEU 45 Ca 0.22 1.28 0.04 0.00 -2.89 0.00 0.00 54.13 52.78 2wr0 s LEU 45 Cb -0.10 -3.09 -0.06 0.00 0.66 0.00 0.00 46.19 43.60 2wr0 s LEU 45 CO 0.13 -0.00 0.04 0.00 -1.89 0.00 0.00 176.35 174.63 2wr0 s ARG 47 N -3.87 4.40 -0.45 0.00 0.52 0.77 -4.61 118.95 115.71 2wr0 s ARG 47 Ca 0.35 1.60 -0.14 0.00 -0.52 0.00 0.00 55.73 57.02 2wr0 s ARG 47 Cb 0.08 -2.83 0.07 0.00 0.52 0.00 0.00 34.95 32.79 2wr0 s ARG 47 CO 0.14 0.05 0.35 -1.17 0.02 0.00 0.00 175.30 174.70 2wr0 s LEU 48 N -2.09 5.45 -1.23 2.53 2.96 0.80 -1.64 118.68 125.47 2wr0 s LEU 48 Ca 0.51 -1.33 -0.10 0.00 -0.22 0.00 0.00 54.13 53.00 2wr0 s LEU 48 Cb -0.25 -2.13 -0.01 0.00 0.50 0.00 0.00 46.19 44.30 2wr0 s LEU 48 CO 0.32 -0.60 0.69 -1.20 -1.32 0.00 0.00 176.35 174.25 2wr0 n SER 49 N 5.13 -3.21 0.00 3.68 7.64 -0.74 -2.18 113.62 123.93 2wr0 n SER 49 Ca -0.12 -0.94 0.00 0.00 1.01 0.00 0.00 58.87 58.82 2wr0 n SER 49 Cb 0.44 -3.61 0.00 0.00 -1.01 0.00 0.00 64.21 60.03 2wr0 n SER 49 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wr0 n GLY 50 N -1.69 2.83 3.65 0.23 0.00 -1.26 -5.00 105.19 103.95 2wr0 n GLY 50 Ca -0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 2wr0 n GLY 50 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wr0 s ILE 51 N -1.54 5.00 0.77 -0.61 -1.09 -0.93 -5.01 121.20 117.78 2wr0 s ILE 51 Ca 0.00 0.04 -0.11 0.00 -2.23 0.00 0.00 60.65 58.35 2wr0 s ILE 51 Cb 0.00 -3.27 0.05 0.00 -1.58 0.00 0.00 42.46 37.66 2wr0 s ILE 51 CO 0.00 0.43 1.08 -2.16 -1.23 0.00 0.00 174.94 173.07 2wr0 s PRO 52 N 0.51 2.34 0.49 2.79 0.05 -1.26 -0.14 135.00 139.78 2wr0 s PRO 52 Ca 0.05 0.91 -0.13 0.00 0.05 0.00 0.00 61.00 61.89 2wr0 s PRO 52 Cb -0.12 -1.93 -0.06 0.00 0.05 0.00 0.00 34.50 32.44 2wr0 s PRO 52 CO 0.00 -1.51 0.90 -1.25 0.05 0.00 0.00 177.00 175.19 2wr0 s PRO 53 N -5.02 3.81 0.02 0.56 0.05 -1.26 -1.68 135.00 131.48 2wr0 s PRO 53 Ca 0.60 0.69 -0.30 0.00 0.05 0.00 0.00 61.00 62.03 2wr0 s PRO 53 Cb -0.15 -2.24 -0.05 0.00 0.05 0.00 0.00 34.50 32.11 2wr0 s PRO 53 CO 0.55 -0.22 1.19 -1.17 0.05 0.00 0.00 177.00 177.41 2wr0 s LEU 54 N -4.19 4.34 -0.20 -3.56 2.96 0.58 -4.89 118.68 113.72 2wr0 s LEU 54 Ca 0.55 1.94 -0.07 0.00 -0.22 0.00 0.00 54.13 56.33 2wr0 s LEU 54 Cb -0.10 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 2wr0 s LEU 54 CO 0.35 -0.49 0.06 -1.61 -1.32 0.00 0.00 176.35 173.34 2wr0 s GLU 55 N 1.40 3.89 -0.00 1.98 2.02 -1.26 -0.68 118.70 126.05 2wr0 s GLU 55 Ca 0.58 -0.38 0.03 0.00 0.02 0.00 0.00 54.97 55.22 2wr0 s GLU 55 Cb -0.28 -3.23 -0.04 0.00 0.10 0.00 0.00 34.13 30.68 2wr0 s GLU 55 CO 0.27 0.17 0.09 1.28 0.02 0.00 0.00 175.26 177.09 2wr0 n LEU 56 N 3.85 0.06 0.00 1.80 4.77 -0.59 -4.78 117.00 122.11 2wr0 n LEU 56 Ca -0.16 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 2wr0 n LEU 56 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 2wr0 n LEU 56 CO 0.34 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 2wr0 n GLY 57 N 1.78 3.92 0.21 -0.72 0.00 -1.26 -1.45 105.19 107.66 2wr0 n GLY 57 Ca -0.00 0.18 0.14 0.00 0.00 0.00 0.00 46.02 46.34 2wr0 n GLY 57 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wr0 n ASP 58 N 7.39 0.65 -4.80 1.61 8.00 -1.26 -2.53 116.55 125.61 2wr0 n ASP 58 Ca 0.00 -1.27 -0.36 0.00 0.71 0.00 0.00 54.79 53.87 2wr0 n ASP 58 Cb 0.00 -0.01 -0.07 0.00 -0.02 0.00 0.00 41.12 41.02 2wr0 n ASP 58 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wr0 s SER 60 N -0.81 5.59 0.26 0.00 1.04 -0.28 -4.80 113.70 114.70 2wr0 s SER 60 Ca 0.13 1.10 -0.02 0.00 0.48 0.00 0.00 55.95 57.63 2wr0 s SER 60 Cb -0.12 -1.97 0.44 0.00 0.10 0.00 0.00 66.02 64.47 2wr0 s SER 60 CO 0.03 -1.22 1.83 0.40 0.98 0.00 0.00 173.24 175.26 2wr0 h ILE 61 N -0.52 0.95 0.02 -1.02 2.04 -1.98 -0.26 117.51 116.75 2wr0 h ILE 61 Ca -0.45 -0.32 -0.00 0.00 1.00 0.00 0.00 64.86 65.09 2wr0 h ILE 61 Cb 1.24 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2wr0 h ILE 61 CO 0.63 0.17 -0.01 0.00 0.00 0.00 0.00 178.15 178.94 2wr0 h ALA 62 N 1.47 -0.03 -0.73 1.87 0.00 -1.93 0.12 119.26 120.04 2wr0 h ALA 62 Ca 0.43 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.39 2wr0 h ALA 62 Cb 0.35 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 2wr0 h ALA 62 CO -0.24 -0.50 0.41 0.78 0.00 0.00 0.00 179.25 179.71 2wr0 h GLY 63 N -0.05 1.09 0.64 0.00 0.00 -1.54 0.68 103.07 103.88 2wr0 h GLY 63 Ca -0.00 -0.29 -0.00 0.00 0.00 0.00 0.00 47.33 47.04 2wr0 h GLY 63 CO 0.00 0.16 -0.00 -0.25 0.00 0.00 0.00 176.54 176.45 2wr0 h TRP 64 N 0.74 0.03 -0.49 5.60 7.01 -0.81 0.15 115.95 128.19 2wr0 h TRP 64 Ca 0.33 -0.01 -0.09 0.00 2.11 0.00 0.00 58.89 61.24 2wr0 h TRP 64 Cb 0.23 -0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 27.26 2wr0 h TRP 64 CO -0.07 0.39 -0.05 -0.07 -2.79 0.00 0.00 178.44 175.85 2wr0 h LEU 65 N -0.34 0.83 -0.40 0.65 3.38 -0.79 -2.77 115.31 115.88 2wr0 h LEU 65 Ca 0.00 -0.23 -0.11 0.00 0.09 0.00 0.00 57.88 57.63 2wr0 h LEU 65 Cb 0.38 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2wr0 h LEU 65 CO 0.00 0.93 -0.52 -0.07 0.09 0.00 0.00 178.44 178.87 2wr0 h LEU 66 N 0.78 0.00 -0.90 1.67 3.38 -0.86 -3.45 115.31 115.92 2wr0 h LEU 66 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2wr0 h LEU 66 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2wr0 h LEU 66 CO 0.03 0.52 0.00 0.61 0.09 0.00 0.00 178.44 179.69 2wr0 n GLY 67 N 0.82 0.90 3.64 0.83 0.00 0.30 -2.21 105.19 109.47 2wr0 n GLY 67 Ca 0.01 -0.52 -0.55 0.00 0.00 0.00 0.00 46.02 44.96 2wr0 n GLY 67 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wr0 n ASN 68 N 0.94 1.85 -0.35 1.61 2.85 0.13 -0.15 115.26 122.13 2wr0 n ASN 68 Ca 0.00 1.10 0.35 0.00 -0.11 0.00 0.00 54.58 55.93 2wr0 n ASN 68 Cb 0.40 -1.15 0.73 0.00 1.24 0.00 0.00 39.78 41.00 2wr0 n ASN 68 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2wr0 h PRO 69 N 5.57 0.04 0.00 1.20 0.11 -1.90 0.75 132.00 137.78 2wr0 h PRO 69 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2wr0 h PRO 69 Cb 1.33 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2wr0 h PRO 69 CO 0.85 0.03 0.00 0.39 -0.21 0.00 0.00 178.00 179.06 2wr0 n GLU 70 N -4.23 0.13 0.00 1.05 -0.58 -1.26 -2.90 120.64 112.86 2wr0 n GLU 70 Ca 0.27 0.17 0.02 0.00 -0.42 0.00 0.00 57.16 57.20 2wr0 n GLU 70 Cb 1.27 -1.50 -0.00 0.00 -0.57 0.00 0.00 31.44 30.64 2wr0 n GLU 70 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wr0 n ASP 72 N -0.52 0.00 -3.29 0.00 5.75 -1.12 -3.07 116.55 114.31 2wr0 n ASP 72 Ca 0.01 -0.68 -0.30 0.00 -0.01 0.00 0.00 54.79 53.81 2wr0 n ASP 72 Cb 0.07 -0.06 -0.04 0.00 -1.03 0.00 0.00 41.12 40.06 2wr0 n ASP 72 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2wr0 n ARG 73 N -1.06 3.33 -4.74 0.11 1.74 -1.26 -5.06 116.66 109.72 2wr0 n ARG 73 Ca 0.19 -4.75 -0.30 0.00 -0.77 0.00 0.00 57.85 52.22 2wr0 n ARG 73 Cb 0.12 -2.30 -0.14 0.00 -1.02 0.00 0.00 32.46 29.12 2wr0 n ARG 73 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2wr0 s LEU 74 N -3.14 2.27 0.00 0.55 2.96 -1.17 -5.10 118.68 115.05 2wr0 s LEU 74 Ca 0.43 -0.61 0.00 0.00 -0.22 0.00 0.00 54.13 53.73 2wr0 s LEU 74 Cb 0.20 -1.31 0.00 0.00 0.50 0.00 0.00 46.19 45.58 2wr0 s LEU 74 CO -0.07 0.24 0.11 0.18 -1.32 0.00 0.00 176.35 175.49 2wr0 n LEU 75 N 1.51 0.00 -1.70 -0.68 4.32 -1.26 -5.03 117.00 114.16 2wr0 n LEU 75 Ca -0.17 0.11 -0.01 0.00 -0.02 0.00 0.00 56.01 55.92 2wr0 n LEU 75 Cb 0.52 0.00 -0.00 0.00 -1.62 0.00 0.00 43.42 42.32 2wr0 n LEU 75 CO 0.24 0.00 -0.10 -0.24 -1.22 0.00 0.00 177.39 176.06 2wr0 n SER 76 N -0.16 -2.30 -4.85 -1.43 2.88 -1.26 -5.07 113.62 101.43 2wr0 n SER 76 Ca 0.00 0.24 -0.29 0.00 -1.33 0.00 0.00 58.87 57.49 2wr0 n SER 76 Cb 0.00 -1.75 0.10 0.00 -0.75 0.00 0.00 64.21 61.81 2wr0 n SER 76 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 2wr0 s VAL 77 N -0.19 2.36 -0.63 2.46 -7.23 -1.26 -4.95 120.40 110.96 2wr0 s VAL 77 Ca -0.03 0.12 0.24 0.00 -1.81 0.00 0.00 61.98 60.50 2wr0 s VAL 77 Cb 0.00 -3.00 0.25 0.00 0.56 0.00 0.00 36.38 34.19 2wr0 s VAL 77 CO 0.14 -0.15 1.72 -2.65 -0.31 0.00 0.00 175.10 173.85 2wr0 n PRO 78 N -3.43 0.19 -3.64 4.82 -0.02 -1.26 -4.79 135.00 126.87 2wr0 n PRO 78 Ca 0.07 0.32 -0.08 0.00 -2.02 0.00 0.00 63.50 61.80 2wr0 n PRO 78 Cb 0.59 -1.80 -0.07 0.00 -0.02 0.00 0.00 33.50 32.20 2wr0 n PRO 78 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2wr0 s GLU 79 N -3.21 0.53 0.12 -0.52 2.12 -1.26 0.58 118.70 117.05 2wr0 s GLU 79 Ca 0.07 0.71 -0.06 0.00 0.36 0.00 0.00 54.97 56.05 2wr0 s GLU 79 Cb 0.11 0.21 -0.02 0.00 0.26 0.00 0.00 34.13 34.69 2wr0 s GLU 79 CO 0.45 -0.08 0.17 1.67 -0.54 0.00 0.00 175.26 176.93 2wr0 s TRP 80 N 0.64 0.43 -0.14 5.30 -2.14 -1.23 -4.54 118.94 117.27 2wr0 s TRP 80 Ca -0.01 -0.85 0.09 0.00 2.66 0.00 0.00 56.10 57.99 2wr0 s TRP 80 Cb -0.05 -0.19 -0.13 0.00 -3.10 0.00 0.00 33.47 30.01 2wr0 s TRP 80 CO -0.09 -0.58 0.26 -1.13 -2.66 0.00 0.00 176.95 172.75 2wr0 n SER 81 N -0.10 2.10 -3.36 -2.66 3.41 -0.68 -2.33 113.62 110.01 2wr0 n SER 81 Ca -0.10 -0.23 -0.05 0.00 -0.26 0.00 0.00 58.87 58.22 2wr0 n SER 81 Cb 0.63 1.28 0.01 0.00 -0.26 0.00 0.00 64.21 65.86 2wr0 n SER 81 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2wr0 s TYR 82 N -2.37 0.01 -0.09 7.33 -0.85 -1.24 -4.68 117.35 115.47 2wr0 s TYR 82 Ca -0.01 -0.49 0.04 0.00 -0.52 0.00 0.00 57.07 56.09 2wr0 s TYR 82 Cb 0.06 0.73 -0.01 0.00 0.38 0.00 0.00 41.96 43.13 2wr0 s TYR 82 CO 0.37 -1.15 -0.22 0.42 -1.52 0.00 0.00 175.55 173.45 2wr0 s ILE 83 N -2.66 2.29 -0.18 -3.49 1.01 -1.02 -0.31 121.20 116.85 2wr0 s ILE 83 Ca 0.16 -0.95 -0.05 0.00 0.00 0.00 0.00 60.65 59.81 2wr0 s ILE 83 Cb -0.04 -1.88 -0.03 0.00 0.01 0.00 0.00 42.46 40.52 2wr0 s ILE 83 CO 0.07 0.56 0.01 -0.69 0.00 0.00 0.00 174.94 174.89 2wr0 s VAL 84 N 0.14 4.26 0.14 2.92 1.01 0.15 -0.30 120.40 128.71 2wr0 s VAL 84 Ca -0.12 -0.22 0.03 0.00 0.00 0.00 0.00 61.98 61.67 2wr0 s VAL 84 Cb -0.16 -2.90 -0.04 0.00 0.00 0.00 0.00 36.38 33.27 2wr0 s VAL 84 CO 0.06 0.46 -0.07 -1.61 0.00 0.00 0.00 175.10 173.94 2wr0 s GLU 85 N 0.52 1.00 0.62 2.72 2.02 -0.69 -1.55 118.70 123.34 2wr0 s GLU 85 Ca -0.00 -1.43 -0.12 0.00 0.02 0.00 0.00 54.97 53.44 2wr0 s GLU 85 Cb -0.14 -0.44 -0.04 0.00 0.10 0.00 0.00 34.13 33.62 2wr0 s GLU 85 CO 0.02 0.01 1.03 0.15 0.02 0.00 0.00 175.26 176.49 2wr0 s LYS 86 N -3.80 3.51 0.15 1.61 1.02 -1.05 -0.56 119.74 120.62 2wr0 s LYS 86 Ca 0.16 0.83 -0.25 0.00 0.02 0.00 0.00 55.97 56.74 2wr0 s LYS 86 Cb 0.04 -2.07 0.01 0.00 -0.52 0.00 0.00 37.83 35.29 2wr0 s LYS 86 CO -0.01 -0.64 1.60 1.49 -0.92 0.00 0.00 175.35 176.88 2wr0 h GLU 87 N -0.20 -0.33 -3.20 1.68 4.22 -1.85 -3.32 114.58 111.59 2wr0 h GLU 87 Ca -0.44 0.02 -0.62 0.00 0.08 0.00 0.00 59.36 58.39 2wr0 h GLU 87 Cb 1.19 0.07 -0.40 0.00 0.50 0.00 0.00 28.75 30.11 2wr0 h GLU 87 CO 0.61 -0.22 -0.69 -0.80 -2.18 0.00 0.00 179.01 175.73 2wr0 s ASN 88 N -4.99 3.97 0.21 1.04 0.02 -1.26 -5.05 114.94 108.88 2wr0 s ASN 88 Ca -0.15 -2.77 -0.32 0.00 -1.02 0.00 0.00 52.86 48.59 2wr0 s ASN 88 Cb 0.12 -1.31 -0.14 0.00 0.02 0.00 0.00 41.25 39.94 2wr0 s ASN 88 CO 0.66 -0.26 1.45 -2.65 0.02 0.00 0.00 177.10 176.33 2wr0 n PRO 89 N 3.38 2.02 -0.13 -0.60 -0.02 -1.25 -4.89 135.00 133.52 2wr0 n PRO 89 Ca 0.07 0.72 -0.12 0.00 -2.02 0.00 0.00 63.50 62.15 2wr0 n PRO 89 Cb 0.34 -2.41 -0.02 0.00 -0.02 0.00 0.00 33.50 31.38 2wr0 n PRO 89 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2wr0 h VAL 90 N 3.22 1.28 -3.65 -1.45 2.07 -1.29 -3.44 116.25 112.99 2wr0 h VAL 90 Ca -0.45 -1.30 -0.66 0.00 0.82 0.00 0.00 66.70 65.11 2wr0 h VAL 90 Cb 1.27 1.33 -0.23 0.00 -1.52 0.00 0.00 31.29 32.14 2wr0 h VAL 90 CO 0.79 0.43 -0.59 0.20 0.02 0.00 0.00 177.57 178.42 2wr0 s ASN 91 N -6.48 5.32 0.00 0.57 -0.87 0.18 -4.97 114.94 108.69 2wr0 s ASN 91 Ca -0.12 -0.39 0.00 0.00 -1.57 0.00 0.00 52.86 50.78 2wr0 s ASN 91 Cb 0.10 -1.95 0.00 0.00 -0.02 0.00 0.00 41.25 39.37 2wr0 s ASN 91 CO 0.83 -0.12 0.00 0.61 -2.57 0.00 0.00 177.10 175.85 2wr0 n GLY 92 N 4.94 3.89 3.56 0.66 0.00 -1.26 -1.12 105.19 115.86 2wr0 n GLY 92 Ca -0.15 -0.51 -0.37 0.00 0.00 0.00 0.00 46.02 44.99 2wr0 n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wr0 s LEU 93 N 0.00 3.43 0.14 0.99 1.02 -1.26 -4.25 118.68 118.74 2wr0 s LEU 93 Ca 0.00 -1.39 -0.16 0.00 0.02 0.00 0.00 54.13 52.59 2wr0 s LEU 93 Cb 0.00 -2.57 -0.01 0.00 0.02 0.00 0.00 46.19 43.63 2wr0 s LEU 93 CO 0.00 -1.88 1.72 0.00 0.02 0.00 0.00 176.35 176.21 2wr0 s TYR 95 N -5.75 3.50 0.62 0.00 5.04 -1.26 -4.64 117.35 114.85 2wr0 s TYR 95 Ca -0.13 1.56 -0.19 0.00 -2.44 0.00 0.00 57.07 55.87 2wr0 s TYR 95 Cb 0.10 -3.18 -0.03 0.00 0.35 0.00 0.00 41.96 39.20 2wr0 s TYR 95 CO 0.74 -0.24 1.24 -2.30 -1.34 0.00 0.00 175.55 173.64 2wr0 n PRO 96 N 5.10 1.19 -0.15 4.97 -0.02 -1.25 -4.71 135.00 140.14 2wr0 n PRO 96 Ca 0.09 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2wr0 n PRO 96 Cb 0.49 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 2wr0 n PRO 96 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wr0 n GLY 97 N 0.97 -0.63 3.39 -1.23 0.00 -1.26 -1.06 105.19 105.37 2wr0 n GLY 97 Ca 0.14 -0.56 -0.16 0.00 0.00 0.00 0.00 46.02 45.44 2wr0 n GLY 97 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wr0 s SER 98 N -4.00 1.10 -0.17 1.61 1.04 -0.49 -4.91 113.70 107.88 2wr0 s SER 98 Ca 0.00 -1.56 -0.04 0.00 0.48 0.00 0.00 55.95 54.83 2wr0 s SER 98 Cb 0.00 0.60 0.08 0.00 0.10 0.00 0.00 66.02 66.80 2wr0 s SER 98 CO 0.00 -1.17 0.20 0.12 0.98 0.00 0.00 173.24 173.37 2wr0 s PHE 99 N -3.32 -0.21 0.18 5.02 5.36 -1.26 -0.93 117.98 122.82 2wr0 s PHE 99 Ca 0.35 0.26 -0.30 0.00 -0.96 0.00 0.00 56.93 56.28 2wr0 s PHE 99 Cb 0.01 -0.37 -0.08 0.00 -0.34 0.00 0.00 43.02 42.24 2wr0 s PHE 99 CO 0.22 -0.52 1.19 -0.80 -1.46 0.00 0.00 175.22 173.85 2wr0 s ASN 100 N 2.30 7.10 -1.45 6.13 0.01 0.42 -3.34 114.94 126.11 2wr0 s ASN 100 Ca 0.05 2.22 -0.09 0.00 -0.71 0.00 0.00 52.86 54.33 2wr0 s ASN 100 Cb -0.15 -2.61 0.05 0.00 0.41 0.00 0.00 41.25 38.96 2wr0 s ASN 100 CO -0.10 -0.36 0.88 0.47 -1.51 0.00 0.00 177.10 176.47 2wr0 n ASP 101 N 2.53 -3.51 -0.11 -1.22 8.00 -1.26 -4.62 116.55 116.36 2wr0 n ASP 101 Ca 0.04 -0.79 -0.12 0.00 0.71 0.00 0.00 54.79 54.63 2wr0 n ASP 101 Cb 0.45 -3.96 -0.03 0.00 -0.02 0.00 0.00 41.12 37.56 2wr0 n ASP 101 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2wr0 h TYR 102 N -2.03 0.71 -0.92 1.24 3.20 -1.96 -2.00 116.97 115.22 2wr0 h TYR 102 Ca -0.59 -0.17 0.02 0.00 3.14 0.00 0.00 58.73 61.13 2wr0 h TYR 102 Cb 1.37 -0.17 -0.05 0.00 1.54 0.00 0.00 36.73 39.42 2wr0 h TYR 102 CO 0.53 0.83 0.60 0.93 -1.64 0.00 0.00 178.16 179.42 2wr0 h GLU 103 N 0.39 1.16 -0.44 1.82 3.07 -1.90 0.12 114.58 118.80 2wr0 h GLU 103 Ca 0.07 -0.07 -0.03 0.00 -0.50 0.00 0.00 59.36 58.83 2wr0 h GLU 103 Cb 0.63 -0.26 -0.02 0.00 -0.84 0.00 0.00 28.75 28.26 2wr0 h GLU 103 CO 0.04 0.77 0.14 0.93 -1.40 0.00 0.00 179.01 179.49 2wr0 h GLU 104 N 1.20 0.69 -0.27 2.33 4.39 -1.90 0.16 114.58 121.17 2wr0 h GLU 104 Ca 0.35 -0.14 0.03 0.00 0.34 0.00 0.00 59.36 59.94 2wr0 h GLU 104 Cb -0.06 -0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.46 2wr0 h GLU 104 CO -0.10 0.66 0.07 1.25 -1.16 0.00 0.00 179.01 179.73 2wr0 h LEU 105 N 0.58 0.06 -0.46 1.33 5.85 -0.82 0.40 115.31 122.24 2wr0 h LEU 105 Ca 0.14 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.94 2wr0 h LEU 105 Cb 0.26 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 2wr0 h LEU 105 CO -0.01 0.07 0.23 0.11 -0.34 0.00 0.00 178.44 178.51 2wr0 h LYS 106 N 0.18 0.45 -0.44 1.25 1.57 -0.41 -1.67 116.57 117.51 2wr0 h LYS 106 Ca 0.12 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.84 2wr0 h LYS 106 Cb 0.10 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 2wr0 h LYS 106 CO -0.14 0.30 0.12 1.25 -0.57 0.00 0.00 179.45 180.41 2wr0 h HIS 107 N 0.47 0.65 -0.76 -1.35 2.76 -0.29 -2.93 115.15 113.69 2wr0 h HIS 107 Ca 0.20 -0.04 -0.03 0.00 -2.20 0.00 0.00 60.37 58.30 2wr0 h HIS 107 Cb 0.10 -0.20 -0.03 0.00 1.55 0.00 0.00 27.41 28.83 2wr0 h HIS 107 CO -0.10 0.55 0.37 1.25 -1.30 0.00 0.00 177.93 178.69 2wr0 h LEU 108 N 0.63 0.99 -3.59 0.26 5.85 0.01 -2.99 115.31 116.47 2wr0 h LEU 108 Ca 0.15 -0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.67 2wr0 h LEU 108 Cb 0.22 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 2wr0 h LEU 108 CO -0.01 0.85 0.08 2.30 -0.34 0.00 0.00 178.44 181.32 2wr0 n ILE 109 N -4.39 2.78 0.25 4.05 -5.35 -0.99 -4.41 119.36 111.31 2wr0 n ILE 109 Ca 0.07 -1.54 0.12 0.00 -0.27 0.00 0.00 62.75 61.12 2wr0 n ILE 109 Cb 0.13 -0.30 0.63 0.00 -1.74 0.00 0.00 39.64 38.36 2wr0 n ILE 109 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wr0 h THR 110 N 3.39 0.56 -2.18 7.28 1.03 -1.39 -3.42 112.91 118.16 2wr0 h THR 110 Ca 0.08 -0.76 0.02 0.00 -0.01 0.00 0.00 66.41 65.73 2wr0 h THR 110 Cb 2.04 1.51 -0.23 0.00 -1.07 0.00 0.00 68.15 70.40 2wr0 h THR 110 CO 0.54 0.16 -0.21 -0.55 -0.01 0.00 0.00 175.52 175.46 2wr0 s SER 111 N -6.15 -0.83 0.35 0.00 0.15 -1.26 -3.72 113.70 102.23 2wr0 s SER 111 Ca -0.02 1.37 0.03 0.00 0.70 0.00 0.00 55.95 58.04 2wr0 s SER 111 Cb 0.12 1.93 -0.04 0.00 -1.71 0.00 0.00 66.02 66.32 2wr0 s SER 111 CO 0.60 -0.22 0.12 0.68 1.20 0.00 0.00 173.24 175.62 2wr0 s VAL 112 N 2.73 0.65 -0.01 4.45 -7.23 -0.98 -4.28 120.40 115.72 2wr0 s VAL 112 Ca -0.05 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.07 2wr0 s VAL 112 Cb -0.12 -2.52 -0.03 0.00 0.56 0.00 0.00 36.38 34.28 2wr0 s VAL 112 CO -0.17 0.00 0.55 0.74 -0.31 0.00 0.00 175.10 175.91 2wr0 h THR 113 N 2.03 0.00 -1.82 5.32 2.02 0.25 -3.25 112.91 117.45 2wr0 h THR 113 Ca -0.36 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 66.67 2wr0 h THR 113 Cb 1.26 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 2wr0 h THR 113 CO 0.58 0.00 0.00 1.57 0.37 0.00 0.00 175.52 178.04 2wr0 n HIS 114 N -2.89 0.00 -3.16 3.16 -0.00 0.20 -4.48 115.22 108.04 2wr0 n HIS 114 Ca -0.02 0.00 0.03 0.00 -0.00 0.00 0.00 57.72 57.73 2wr0 n HIS 114 Cb 0.07 -1.15 -0.01 0.00 -0.00 0.00 0.00 29.99 28.90 2wr0 n HIS 114 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.34 176.46 2wr0 s PHE 115 N 0.00 -1.67 -0.10 1.57 5.36 -1.07 -2.61 117.98 119.45 2wr0 s PHE 115 Ca 0.00 1.45 0.02 0.00 -0.96 0.00 0.00 56.93 57.44 2wr0 s PHE 115 Cb 0.00 0.46 0.01 0.00 -0.34 0.00 0.00 43.02 43.15 2wr0 s PHE 115 CO 0.00 -0.95 -0.15 -2.00 -1.46 0.00 0.00 175.22 170.66 2wr0 s GLU 116 N 2.84 2.18 0.21 10.12 2.12 -0.16 -4.82 118.70 131.19 2wr0 s GLU 116 Ca 0.17 -0.55 -0.30 0.00 0.36 0.00 0.00 54.97 54.65 2wr0 s GLU 116 Cb -0.13 -1.84 -0.08 0.00 0.26 0.00 0.00 34.13 32.34 2wr0 s GLU 116 CO -0.23 -0.04 1.01 0.21 -0.54 0.00 0.00 175.26 175.67 2wr0 s LYS 117 N 0.93 4.73 -0.02 4.30 2.20 -1.26 -0.32 119.74 130.29 2wr0 s LYS 117 Ca -0.08 1.60 0.01 0.00 -0.36 0.00 0.00 55.97 57.14 2wr0 s LYS 117 Cb -0.15 -3.28 0.01 0.00 -1.51 0.00 0.00 37.83 32.90 2wr0 s LYS 117 CO -0.00 0.31 -0.04 0.08 -0.36 0.00 0.00 175.35 175.34 2wr0 s VAL 118 N -0.76 0.36 -1.07 4.02 1.01 0.53 -4.94 120.40 119.55 2wr0 s VAL 118 Ca 0.45 -0.12 -0.18 0.00 0.00 0.00 0.00 61.98 62.12 2wr0 s VAL 118 Cb -0.27 -0.35 0.11 0.00 0.00 0.00 0.00 36.38 35.87 2wr0 s VAL 118 CO 0.34 0.14 1.36 -0.75 0.00 0.00 0.00 175.10 176.19 2wr0 s LYS 119 N 0.33 3.77 0.13 2.72 2.20 -1.26 -0.35 119.74 127.28 2wr0 s LYS 119 Ca -0.03 -1.85 0.06 0.00 -0.36 0.00 0.00 55.97 53.78 2wr0 s LYS 119 Cb -0.07 -5.14 -0.18 0.00 -1.51 0.00 0.00 37.83 30.93 2wr0 s LYS 119 CO -0.00 -1.94 1.29 -0.84 -0.36 0.00 0.00 175.35 173.49 2wr0 h ILE 120 N 5.73 1.67 -2.54 5.43 3.07 -1.77 -3.40 117.51 125.70 2wr0 h ILE 120 Ca 0.25 -3.27 -0.60 0.00 1.55 0.00 0.00 64.86 62.79 2wr0 h ILE 120 Cb 0.96 2.80 -0.40 0.00 -0.27 0.00 0.00 36.82 39.92 2wr0 h ILE 120 CO 1.26 0.94 -0.84 0.18 -1.05 0.00 0.00 178.15 178.64 2wr0 n LEU 121 N -3.41 0.93 -4.65 0.16 4.77 -0.84 -4.92 117.00 109.03 2wr0 n LEU 121 Ca -0.01 -4.73 -0.52 0.00 -0.03 0.00 0.00 56.01 50.72 2wr0 n LEU 121 Cb 0.92 0.08 -0.06 0.00 -2.33 0.00 0.00 43.42 42.03 2wr0 n LEU 121 CO 0.48 1.86 1.15 -2.65 -1.33 0.00 0.00 177.39 176.90 2wr0 n PRO 122 N 2.30 1.47 -0.29 3.23 -0.02 -1.26 -4.41 135.00 136.02 2wr0 n PRO 122 Ca 0.26 0.53 -0.03 0.00 -2.02 0.00 0.00 63.50 62.24 2wr0 n PRO 122 Cb 0.44 -2.24 0.12 0.00 -0.02 0.00 0.00 33.50 31.80 2wr0 n PRO 122 CO 0.00 0.00 0.00 0.07 1.98 0.00 0.00 175.50 177.55 2wr0 h ARG 123 N 6.18 1.16 0.00 -0.52 0.11 -1.94 -2.47 114.38 116.90 2wr0 h ARG 123 Ca -0.47 -0.15 0.00 0.00 0.10 0.00 0.00 59.98 59.46 2wr0 h ARG 123 Cb 1.31 -0.22 0.00 0.00 1.11 0.00 0.00 29.97 32.17 2wr0 h ARG 123 CO 0.87 0.87 0.05 0.38 0.10 0.00 0.00 179.97 182.24 2wr0 h ASP 124 N 1.16 0.00 -0.23 0.08 2.03 -2.00 -0.35 116.42 117.11 2wr0 h ASP 124 Ca 0.29 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.59 2wr0 h ASP 124 Cb 0.07 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.57 2wr0 h ASP 124 CO -0.04 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 178.17 2wr0 n GLN 125 N -2.27 1.77 -2.23 4.15 6.02 -0.93 -4.31 117.38 119.58 2wr0 n GLN 125 Ca -0.01 -1.16 -0.43 0.00 -0.01 0.00 0.00 57.00 55.39 2wr0 n GLN 125 Cb 0.09 -1.36 0.00 0.00 1.02 0.00 0.00 30.24 29.99 2wr0 n GLN 125 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 2wr0 n TRP 126 N 0.40 3.85 0.27 1.08 7.02 -0.14 -4.82 117.44 125.10 2wr0 n TRP 126 Ca 0.15 -2.95 0.15 0.00 -1.02 0.00 0.00 57.50 53.83 2wr0 n TRP 126 Cb 0.32 -2.39 0.48 0.00 -2.42 0.00 0.00 31.31 27.30 2wr0 n TRP 126 CO 0.00 0.00 0.00 1.79 -2.02 0.00 0.00 177.69 177.46 2wr0 h THR 127 N 4.39 0.00 -0.64 -0.99 1.35 -1.86 -2.73 112.91 112.43 2wr0 h THR 127 Ca 0.47 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 65.64 2wr0 h THR 127 Cb 0.72 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 68.82 2wr0 h THR 127 CO 1.64 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 176.91 2wr0 n GLN 128 N -3.04 3.29 -3.97 4.72 6.02 -1.26 -4.94 117.38 118.19 2wr0 n GLN 128 Ca 0.02 -2.63 -0.11 0.00 -0.01 0.00 0.00 57.00 54.27 2wr0 n GLN 128 Cb 0.39 -1.77 -0.12 0.00 1.02 0.00 0.00 30.24 29.76 2wr0 n GLN 128 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 2wr0 s HIS 129 N -1.61 0.24 0.28 1.08 3.76 -1.03 -4.46 115.29 113.57 2wr0 s HIS 129 Ca 0.48 -0.36 -0.29 0.00 -0.15 0.00 0.00 55.06 54.74 2wr0 s HIS 129 Cb 0.29 -0.17 -0.10 0.00 1.11 0.00 0.00 32.58 33.72 2wr0 s HIS 129 CO 0.26 -0.12 1.12 0.99 -0.85 0.00 0.00 174.74 176.14 2wr0 s THR 130 N -0.98 3.40 0.00 1.30 2.01 -0.28 -4.90 115.64 116.20 2wr0 s THR 130 Ca -0.10 1.41 0.00 0.00 0.31 0.00 0.00 61.69 63.32 2wr0 s THR 130 Cb -0.07 -3.90 0.00 0.00 0.01 0.00 0.00 72.50 68.54 2wr0 s THR 130 CO -0.01 0.34 0.07 1.07 -0.69 0.00 0.00 174.62 175.40 2wr0 n THR 131 N 1.16 0.00 -0.97 -0.82 5.66 -1.26 -1.15 114.28 116.89 2wr0 n THR 131 Ca -0.01 -0.19 0.04 0.00 -3.05 0.00 0.00 64.05 60.84 2wr0 n THR 131 Cb 0.44 1.23 0.35 0.00 -1.55 0.00 0.00 70.33 70.80 2wr0 n THR 131 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2wr0 n THR 132 N -0.24 2.71 -1.90 1.09 -2.24 -1.26 -4.46 114.28 107.97 2wr0 n THR 132 Ca 0.00 -1.60 -0.42 0.00 -2.27 0.00 0.00 64.05 59.76 2wr0 n THR 132 Cb 0.06 -0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 67.96 2wr0 n THR 132 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2wr0 s GLY 133 N -1.14 1.53 0.40 3.38 0.00 -1.26 -5.00 107.32 105.23 2wr0 s GLY 133 Ca 0.52 1.29 0.04 0.00 0.00 0.00 0.00 44.72 46.57 2wr0 s GLY 133 CO 0.13 2.84 0.13 -0.32 0.00 0.00 0.00 173.10 175.88 2wr0 s GLY 134 N 2.04 2.58 0.04 0.20 0.00 -1.26 -4.68 107.32 106.24 2wr0 s GLY 134 Ca 0.73 -1.28 -0.08 0.00 0.00 0.00 0.00 44.72 44.09 2wr0 s GLY 134 CO 0.32 -1.83 0.17 -0.45 0.00 0.00 0.00 173.10 171.32 2wr0 s SER 135 N -3.60 0.08 0.35 1.64 0.15 0.32 -4.73 113.70 107.91 2wr0 s SER 135 Ca 0.24 -0.42 0.27 0.00 0.70 0.00 0.00 55.95 56.74 2wr0 s SER 135 Cb 0.03 0.28 0.97 0.00 -1.71 0.00 0.00 66.02 65.58 2wr0 s SER 135 CO 0.15 -0.55 1.79 -0.09 1.20 0.00 0.00 173.24 175.73 2wr0 h ARG 136 N 3.47 0.00 0.00 5.44 2.43 -1.90 -1.51 114.38 122.31 2wr0 h ARG 136 Ca -0.32 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 2wr0 h ARG 136 Cb 1.19 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 2wr0 h ARG 136 CO 0.49 0.00 0.00 0.00 -1.51 0.00 0.00 179.97 178.95 2wr0 n ALA 137 N -1.90 1.67 -2.18 2.80 0.00 -1.26 -2.46 120.51 117.18 2wr0 n ALA 137 Ca 0.03 -0.03 0.01 0.00 0.00 0.00 0.00 53.44 53.45 2wr0 n ALA 137 Cb 0.33 -1.26 0.09 0.00 0.00 0.00 0.00 19.45 18.61 2wr0 n ALA 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wr0 n ALA 139 N -0.33 1.50 -0.43 0.00 0.00 -1.03 -3.50 120.51 116.71 2wr0 n ALA 139 Ca 0.15 0.41 0.00 0.00 0.00 0.00 0.00 53.44 54.00 2wr0 n ALA 139 Cb 0.93 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 18.04 2wr0 n ALA 139 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wr0 n VAL 140 N 2.43 0.00 -2.95 0.00 0.31 -0.02 -4.86 118.33 113.24 2wr0 n VAL 140 Ca 0.13 0.28 -0.14 0.00 -0.01 0.00 0.00 64.34 64.60 2wr0 n VAL 140 Cb 0.32 -1.09 0.03 0.00 -0.91 0.00 0.00 33.84 32.19 2wr0 n VAL 140 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wr0 n LEU 141 N -1.74 -0.98 -2.43 7.52 -0.00 -1.26 -4.71 117.00 113.39 2wr0 n LEU 141 Ca 0.00 -4.25 -0.27 0.00 -0.00 0.00 0.00 56.01 51.49 2wr0 n LEU 141 Cb 0.00 0.82 0.01 0.00 -0.00 0.00 0.00 43.42 44.25 2wr0 n LEU 141 CO 0.00 2.15 0.28 -0.90 -0.00 0.00 0.00 177.39 178.93 2wr0 n ASP 142 N 0.54 4.95 -4.80 1.45 5.75 -1.26 -5.12 116.55 118.06 2wr0 n ASP 142 Ca 0.15 -3.73 -0.31 0.00 -0.01 0.00 0.00 54.79 50.89 2wr0 n ASP 142 Cb 0.66 -0.48 0.07 0.00 -1.03 0.00 0.00 41.12 40.34 2wr0 n ASP 142 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 2wr0 s ASN 143 N -3.38 4.99 0.49 -1.12 0.01 -1.26 -4.86 114.94 109.80 2wr0 s ASN 143 Ca 0.49 1.62 -0.23 0.00 -0.71 0.00 0.00 52.86 54.03 2wr0 s ASN 143 Cb 0.41 -2.43 -0.08 0.00 0.41 0.00 0.00 41.25 39.56 2wr0 s ASN 143 CO -0.17 -1.69 1.11 -2.65 -1.51 0.00 0.00 177.10 172.19 2wr0 n PRO 144 N -3.29 1.43 -2.50 -0.60 -0.02 -1.26 -0.84 135.00 127.92 2wr0 n PRO 144 Ca 0.08 0.52 -0.06 0.00 -2.02 0.00 0.00 63.50 62.02 2wr0 n PRO 144 Cb 0.54 -2.24 -0.01 0.00 -0.02 0.00 0.00 33.50 31.77 2wr0 n PRO 144 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2wr0 n SER 145 N -0.12 -0.71 -3.88 2.55 2.88 -0.59 -4.64 113.62 109.10 2wr0 n SER 145 Ca 0.10 -1.79 -0.08 0.00 -1.33 0.00 0.00 58.87 55.77 2wr0 n SER 145 Cb 0.42 1.27 -0.03 0.00 -0.75 0.00 0.00 64.21 65.12 2wr0 n SER 145 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 2wr0 s PHE 146 N -4.67 -0.03 -0.20 0.66 5.36 -1.26 -0.52 117.98 117.32 2wr0 s PHE 146 Ca 0.11 -0.38 -0.36 0.00 -0.96 0.00 0.00 56.93 55.33 2wr0 s PHE 146 Cb -0.01 0.53 -0.13 0.00 -0.34 0.00 0.00 43.02 43.08 2wr0 s PHE 146 CO 0.08 -1.14 1.89 1.19 -1.46 0.00 0.00 175.22 175.78 2wr0 n PHE 147 N -0.43 2.13 0.30 10.12 3.72 -1.26 -4.49 117.46 127.55 2wr0 n PHE 147 Ca -0.04 0.22 0.17 0.00 -0.05 0.00 0.00 57.45 57.74 2wr0 n PHE 147 Cb 0.60 -2.58 0.69 0.00 -0.94 0.00 0.00 39.48 37.25 2wr0 n PHE 147 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2wr0 h ARG 148 N 9.08 0.00 -0.01 -1.08 3.08 -0.57 -2.11 114.38 122.77 2wr0 h ARG 148 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.60 2wr0 h ARG 148 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 2wr0 h ARG 148 CO 0.96 0.00 -0.37 0.09 -1.07 0.00 0.00 179.97 179.58 2wr0 n ASN 149 N -2.97 1.07 -4.66 7.04 3.02 -0.94 -4.95 115.26 112.87 2wr0 n ASN 149 Ca 0.01 -0.86 -0.24 0.00 -0.03 0.00 0.00 54.58 53.45 2wr0 n ASN 149 Cb 0.28 0.25 -0.08 0.00 -0.61 0.00 0.00 39.78 39.62 2wr0 n ASN 149 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2wr0 s MET 150 N -2.62 2.16 -0.13 3.52 -1.94 -0.80 -0.60 119.30 118.89 2wr0 s MET 150 Ca 0.20 -1.71 -0.00 0.00 -1.71 0.00 0.00 55.69 52.47 2wr0 s MET 150 Cb 0.19 -1.99 0.03 0.00 2.01 0.00 0.00 34.83 35.07 2wr0 s MET 150 CO 0.58 0.11 -0.08 0.08 -0.01 0.00 0.00 175.02 175.70 2wr0 s VAL 151 N -2.50 1.15 -0.90 -6.03 1.01 0.16 -4.81 120.40 108.47 2wr0 s VAL 151 Ca 0.36 -0.42 -0.21 0.00 0.00 0.00 0.00 61.98 61.71 2wr0 s VAL 151 Cb -0.00 -1.18 0.09 0.00 0.00 0.00 0.00 36.38 35.30 2wr0 s VAL 151 CO 0.20 0.34 1.20 0.86 0.00 0.00 0.00 175.10 177.70 2wr0 s TRP 152 N 1.65 2.85 0.03 5.22 -0.11 -1.26 -1.50 118.94 125.82 2wr0 s TRP 152 Ca 0.04 -1.04 -0.30 0.00 1.22 0.00 0.00 56.10 56.01 2wr0 s TRP 152 Cb -0.13 -4.42 -0.07 0.00 -1.50 0.00 0.00 33.47 27.36 2wr0 s TRP 152 CO -0.09 -1.67 1.48 -0.51 -4.62 0.00 0.00 176.95 171.55 2wr0 s LEU 153 N 3.69 4.34 0.20 5.86 1.43 -1.25 -4.26 118.68 128.69 2wr0 s LEU 153 Ca 0.35 2.25 0.00 0.00 -1.03 0.00 0.00 54.13 55.70 2wr0 s LEU 153 Cb -0.05 -3.56 -0.04 0.00 0.03 0.00 0.00 46.19 42.56 2wr0 s LEU 153 CO -0.05 -0.77 0.08 0.42 0.23 0.00 0.00 176.35 176.26 2wr0 s THR 154 N 2.34 0.34 0.63 5.49 -4.23 -0.30 -4.68 115.64 115.24 2wr0 s THR 154 Ca 0.67 -1.98 -0.18 0.00 -1.18 0.00 0.00 61.69 59.02 2wr0 s THR 154 Cb -0.35 -2.38 -0.02 0.00 1.34 0.00 0.00 72.50 71.10 2wr0 s THR 154 CO 0.29 -0.19 1.26 2.29 -0.54 0.00 0.00 174.62 177.73 2wr0 n LYS 155 N -0.29 1.16 -3.79 3.99 2.85 0.18 -1.12 118.16 121.13 2wr0 n LYS 155 Ca -0.02 0.45 -0.37 0.00 -1.05 0.00 0.00 58.31 57.32 2wr0 n LYS 155 Cb 0.65 -2.49 -0.13 0.00 -0.65 0.00 0.00 35.03 32.41 2wr0 n LYS 155 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 2wr0 s LYS 156 N -3.24 3.09 7.08 -1.58 2.20 0.22 -3.98 119.74 123.53 2wr0 s LYS 156 Ca 0.81 -0.85 0.00 0.00 -0.36 0.00 0.00 55.97 55.57 2wr0 s LYS 156 Cb -0.39 -3.32 0.00 0.00 -1.51 0.00 0.00 37.83 32.62 2wr0 s LYS 156 CO 0.42 -0.42 0.00 0.41 -0.36 0.00 0.00 175.35 175.40 2wr0 n GLY 157 N 4.84 2.46 0.46 5.54 0.00 -1.26 -1.64 105.19 115.59 2wr0 n GLY 157 Ca -0.15 -0.06 0.05 0.00 0.00 0.00 0.00 46.02 45.86 2wr0 n GLY 157 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wr0 n SER 158 N 9.91 2.80 -4.28 1.61 3.41 -1.26 -5.02 113.62 120.79 2wr0 n SER 158 Ca 0.00 -2.31 -0.30 0.00 -0.26 0.00 0.00 58.87 56.00 2wr0 n SER 158 Cb 0.00 -0.25 -0.16 0.00 -0.26 0.00 0.00 64.21 63.54 2wr0 n SER 158 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2wr0 s ASN 159 N -1.37 2.87 -0.48 4.04 3.04 -0.65 -4.90 114.94 117.49 2wr0 s ASN 159 Ca 0.22 -0.44 0.03 0.00 0.04 0.00 0.00 52.86 52.70 2wr0 s ASN 159 Cb 0.15 -0.32 0.14 0.00 -1.54 0.00 0.00 41.25 39.68 2wr0 s ASN 159 CO 0.09 0.30 0.29 -0.47 -3.04 0.00 0.00 177.10 174.26 2wr0 s TYR 160 N -0.58 2.14 0.90 0.43 5.04 -1.26 0.70 117.35 124.72 2wr0 s TYR 160 Ca 0.09 -2.57 -0.11 0.00 -2.44 0.00 0.00 57.07 52.05 2wr0 s TYR 160 Cb -0.09 -1.92 0.13 0.00 0.35 0.00 0.00 41.96 40.43 2wr0 s TYR 160 CO -0.01 -0.75 1.09 -2.14 -1.34 0.00 0.00 175.55 172.40 2wr0 s PRO 161 N 0.05 1.18 0.29 4.97 0.02 -1.26 -4.90 135.00 135.34 2wr0 s PRO 161 Ca 0.20 0.98 -0.30 0.00 0.02 0.00 0.00 61.00 61.90 2wr0 s PRO 161 Cb -0.18 -1.79 -0.12 0.00 0.02 0.00 0.00 34.50 32.43 2wr0 s PRO 161 CO -0.04 -2.34 1.62 1.51 -0.33 0.00 0.00 177.00 177.41 2wr0 n ILE 162 N -3.97 0.92 -3.58 2.83 3.06 -1.26 -4.86 119.36 112.49 2wr0 n ILE 162 Ca 0.08 -0.23 -0.40 0.00 -2.50 0.00 0.00 62.75 59.69 2wr0 n ILE 162 Cb 0.54 -1.98 -0.11 0.00 0.54 0.00 0.00 39.64 38.63 2wr0 n ILE 162 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2wr0 s ALA 163 N 0.12 3.33 -0.20 1.51 0.00 0.41 -4.95 121.76 121.99 2wr0 s ALA 163 Ca 0.65 -1.60 -0.00 0.00 0.00 0.00 0.00 51.96 51.00 2wr0 s ALA 163 Cb -0.49 -2.60 0.05 0.00 0.00 0.00 0.00 23.12 20.08 2wr0 s ALA 163 CO 0.47 -1.23 -0.04 0.15 0.00 0.00 0.00 175.76 175.10 2wr0 s LYS 164 N 1.61 1.40 0.03 0.00 1.02 -1.26 -0.97 119.74 121.57 2wr0 s LYS 164 Ca 0.04 -0.68 -0.00 0.00 0.02 0.00 0.00 55.97 55.35 2wr0 s LYS 164 Cb -0.18 -2.24 -0.03 0.00 -0.52 0.00 0.00 37.83 34.86 2wr0 s LYS 164 CO 0.08 -0.52 -0.03 1.03 -0.92 0.00 0.00 175.35 174.98 2wr0 s ARG 165 N 1.58 0.43 0.12 1.68 0.52 -1.01 -5.02 118.95 117.23 2wr0 s ARG 165 Ca -0.02 -0.82 -0.02 0.00 -0.52 0.00 0.00 55.73 54.35 2wr0 s ARG 165 Cb -0.17 0.10 -0.04 0.00 0.52 0.00 0.00 34.95 35.37 2wr0 s ARG 165 CO -0.07 -0.06 0.06 -1.54 0.02 0.00 0.00 175.30 173.71 2wr0 s SER 166 N -1.94 0.32 -0.03 0.23 1.04 -1.26 -1.11 113.70 110.95 2wr0 s SER 166 Ca -0.08 -1.13 -0.02 0.00 0.48 0.00 0.00 55.95 55.20 2wr0 s SER 166 Cb -0.04 0.29 0.02 0.00 0.10 0.00 0.00 66.02 66.38 2wr0 s SER 166 CO -0.04 -0.72 0.08 -0.47 0.98 0.00 0.00 173.24 173.07 2wr0 s TYR 167 N -4.01 -0.07 -0.27 5.02 5.04 -0.34 -4.97 117.35 117.75 2wr0 s TYR 167 Ca 0.20 0.24 -0.11 0.00 -2.44 0.00 0.00 57.07 54.95 2wr0 s TYR 167 Cb 0.07 -0.05 -0.05 0.00 0.35 0.00 0.00 41.96 42.28 2wr0 s TYR 167 CO -0.01 -0.08 0.18 1.21 -1.34 0.00 0.00 175.55 175.52 2wr0 s ASN 168 N 0.50 6.02 -1.10 4.32 3.84 -1.26 -0.90 114.94 126.35 2wr0 s ASN 168 Ca -0.04 0.01 -0.22 0.00 0.21 0.00 0.00 52.86 52.82 2wr0 s ASN 168 Cb -0.05 -2.11 -0.02 0.00 -0.55 0.00 0.00 41.25 38.51 2wr0 s ASN 168 CO -0.02 -0.03 1.82 0.21 -2.79 0.00 0.00 177.10 176.30 2wr0 s ASN 169 N 1.62 5.64 -0.14 -4.21 2.47 0.58 -4.69 114.94 116.21 2wr0 s ASN 169 Ca 0.07 -1.51 0.14 0.00 0.42 0.00 0.00 52.86 51.98 2wr0 s ASN 169 Cb -0.15 -2.58 0.65 0.00 -1.45 0.00 0.00 41.25 37.72 2wr0 s ASN 169 CO 0.10 -2.37 1.52 0.35 -3.72 0.00 0.00 177.10 172.98 2wr0 n THR 170 N 7.41 1.88 0.35 -5.21 -2.24 -1.26 0.13 114.28 115.33 2wr0 n THR 170 Ca 0.42 -1.07 0.13 0.00 -2.27 0.00 0.00 64.05 61.26 2wr0 n THR 170 Cb 0.47 -0.11 0.54 0.00 -2.10 0.00 0.00 70.33 69.14 2wr0 n THR 170 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2wr0 h SER 171 N 3.42 0.00 0.00 3.42 4.64 -1.97 -3.46 113.55 119.60 2wr0 h SER 171 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wr0 h SER 171 Cb 1.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.57 2wr0 h SER 171 CO 0.29 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.86 2wr0 n GLY 172 N -0.22 0.59 3.31 -0.77 0.00 -1.26 -5.03 105.19 101.82 2wr0 n GLY 172 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 2wr0 n GLY 172 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wr0 s GLU 173 N -0.13 0.94 0.23 1.61 2.02 -1.26 -5.01 118.70 117.10 2wr0 s GLU 173 Ca 0.00 -0.49 -0.29 0.00 0.02 0.00 0.00 54.97 54.21 2wr0 s GLU 173 Cb 0.00 0.41 -0.16 0.00 0.10 0.00 0.00 34.13 34.49 2wr0 s GLU 173 CO 0.00 -0.33 0.80 1.04 0.02 0.00 0.00 175.26 176.79 2wr0 n GLN 174 N 0.31 0.66 -4.26 1.61 6.02 -1.26 -4.42 117.38 116.03 2wr0 n GLN 174 Ca -0.18 0.23 -0.27 0.00 -0.01 0.00 0.00 57.00 56.78 2wr0 n GLN 174 Cb 0.61 -1.45 -0.17 0.00 1.02 0.00 0.00 30.24 30.25 2wr0 n GLN 174 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 2wr0 s MET 175 N -1.13 1.83 -0.05 -1.09 1.75 -0.11 -1.24 119.30 119.26 2wr0 s MET 175 Ca 0.64 -0.41 -0.30 0.00 -1.25 0.00 0.00 55.69 54.37 2wr0 s MET 175 Cb -0.84 -1.66 -0.04 0.00 2.84 0.00 0.00 34.83 35.13 2wr0 s MET 175 CO 0.57 -0.12 1.24 -1.17 -0.65 0.00 0.00 175.02 174.89 2wr0 s LEU 176 N 1.18 4.28 -0.03 4.11 2.96 0.22 0.38 118.68 131.78 2wr0 s LEU 176 Ca -0.04 1.87 0.01 0.00 -0.22 0.00 0.00 54.13 55.75 2wr0 s LEU 176 Cb -0.14 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 43.01 2wr0 s LEU 176 CO -0.03 -0.61 -0.04 -0.63 -1.32 0.00 0.00 176.35 173.72 2wr0 s ILE 177 N 2.26 0.45 0.06 6.68 1.01 -0.48 -0.83 121.20 130.34 2wr0 s ILE 177 Ca 0.57 -0.12 0.08 0.00 0.00 0.00 0.00 60.65 61.19 2wr0 s ILE 177 Cb -0.26 -0.46 -0.03 0.00 0.01 0.00 0.00 42.46 41.72 2wr0 s ILE 177 CO 0.23 0.18 -0.22 -0.63 0.00 0.00 0.00 174.94 174.50 2wr0 s ILE 178 N 0.63 2.50 0.19 2.92 1.01 -1.26 -1.37 121.20 125.81 2wr0 s ILE 178 Ca -0.08 -1.34 -0.07 0.00 0.00 0.00 0.00 60.65 59.16 2wr0 s ILE 178 Cb -0.11 -2.04 -0.02 0.00 0.01 0.00 0.00 42.46 40.31 2wr0 s ILE 178 CO -0.00 0.31 0.27 -1.66 0.00 0.00 0.00 174.94 173.86 2wr0 s TRP 179 N -0.91 0.59 0.16 3.97 -2.14 -0.54 -3.89 118.94 116.18 2wr0 s TRP 179 Ca 0.14 -0.92 0.01 0.00 2.66 0.00 0.00 56.10 57.98 2wr0 s TRP 179 Cb -0.10 -0.15 -0.04 0.00 -3.10 0.00 0.00 33.47 30.08 2wr0 s TRP 179 CO 0.04 -0.74 0.02 0.20 -2.66 0.00 0.00 176.95 173.81 2wr0 s GLY 180 N -3.02 1.15 -0.02 3.67 0.00 0.32 -0.78 107.32 108.63 2wr0 s GLY 180 Ca 0.23 -1.55 0.04 0.00 0.00 0.00 0.00 44.72 43.44 2wr0 s GLY 180 CO 0.04 -1.47 -0.15 -1.50 0.00 0.00 0.00 173.10 170.02 2wr0 s ILE 181 N -3.79 1.21 -0.28 0.90 2.07 -0.62 -0.45 121.20 120.24 2wr0 s ILE 181 Ca 0.24 -0.63 -0.17 0.00 -1.41 0.00 0.00 60.65 58.69 2wr0 s ILE 181 Cb 0.07 -1.02 -0.03 0.00 0.13 0.00 0.00 42.46 41.61 2wr0 s ILE 181 CO 0.03 0.35 0.45 -2.28 -1.91 0.00 0.00 174.94 171.58 2wr0 s HIS 182 N -0.15 3.24 -0.64 3.50 5.65 0.35 -1.63 115.29 125.61 2wr0 s HIS 182 Ca 0.02 0.45 -0.17 0.00 0.25 0.00 0.00 55.06 55.61 2wr0 s HIS 182 Cb -0.08 -2.69 0.14 0.00 -1.18 0.00 0.00 32.58 28.77 2wr0 s HIS 182 CO 0.00 -0.31 0.66 -1.01 -0.65 0.00 0.00 174.74 173.43 2wr0 s HIS 183 N 2.22 3.26 0.82 3.88 0.09 0.79 -4.68 115.29 121.68 2wr0 s HIS 183 Ca 0.18 -1.33 -0.11 0.00 -0.00 0.00 0.00 55.06 53.80 2wr0 s HIS 183 Cb -0.16 -3.90 0.09 0.00 -0.00 0.00 0.00 32.58 28.61 2wr0 s HIS 183 CO 0.10 -1.13 1.12 -2.14 -0.00 0.00 0.00 174.74 172.69 2wr0 s PRO 184 N 1.73 1.76 0.25 8.40 0.02 -1.26 -1.76 135.00 144.13 2wr0 s PRO 184 Ca 0.10 1.39 0.05 0.00 0.02 0.00 0.00 61.00 62.56 2wr0 s PRO 184 Cb -0.23 -1.82 0.28 0.00 0.02 0.00 0.00 34.50 32.75 2wr0 s PRO 184 CO 0.01 -2.05 1.58 -0.97 -0.33 0.00 0.00 177.00 175.24 2wr0 h ASN 185 N -1.31 0.25 -5.08 2.53 -1.24 -1.78 -2.72 115.58 106.22 2wr0 h ASN 185 Ca -0.44 -0.14 0.00 0.00 0.71 0.00 0.00 56.30 56.43 2wr0 h ASN 185 Cb 1.25 -0.07 -0.05 0.00 0.73 0.00 0.00 38.32 40.18 2wr0 h ASN 185 CO 0.47 0.78 0.14 1.51 -1.29 0.00 0.00 177.43 179.04 2wr0 s ASP 186 N -6.89 -0.09 0.25 1.15 1.47 -1.26 -2.62 116.67 108.68 2wr0 s ASP 186 Ca -0.04 -0.86 0.01 0.00 1.18 0.00 0.00 52.55 52.84 2wr0 s ASP 186 Cb 0.12 0.72 0.30 0.00 -0.34 0.00 0.00 42.92 43.73 2wr0 s ASP 186 CO 0.79 -1.38 1.64 0.44 0.68 0.00 0.00 175.17 177.34 2wr0 h ASP 187 N 2.06 0.51 -0.58 2.11 3.45 -1.95 -2.00 116.42 120.03 2wr0 h ASP 187 Ca -0.24 -0.21 0.01 0.00 0.43 0.00 0.00 57.03 57.01 2wr0 h ASP 187 Cb 1.25 -0.14 -0.03 0.00 -0.56 0.00 0.00 39.33 39.85 2wr0 h ASP 187 CO 0.31 0.83 0.38 0.00 -1.57 0.00 0.00 179.24 179.19 2wr0 h ALA 188 N 1.20 1.58 -0.02 3.45 0.00 -1.98 0.10 119.26 123.59 2wr0 h ALA 188 Ca 0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2wr0 h ALA 188 Cb 0.82 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2wr0 h ALA 188 CO 0.07 0.39 -0.04 1.49 0.00 0.00 0.00 179.25 181.16 2wr0 h GLU 189 N 0.79 0.06 -0.96 0.00 4.81 -1.88 -0.50 114.58 116.90 2wr0 h GLU 189 Ca 0.21 -0.04 0.19 0.00 -0.13 0.00 0.00 59.36 59.59 2wr0 h GLU 189 Cb -0.09 0.01 -0.11 0.00 0.63 0.00 0.00 28.75 29.19 2wr0 h GLU 189 CO -0.05 0.62 0.55 0.37 -0.73 0.00 0.00 179.01 179.78 2wr0 h GLN 190 N -0.50 0.67 -0.06 1.92 5.75 -1.07 -1.07 115.11 120.75 2wr0 h GLN 190 Ca 0.00 -0.04 -0.14 0.00 -0.15 0.00 0.00 58.65 58.32 2wr0 h GLN 190 Cb 0.62 -0.15 0.01 0.00 1.07 0.00 0.00 27.48 29.03 2wr0 h GLN 190 CO 0.01 0.45 -0.52 -0.09 -2.65 0.00 0.00 178.83 176.02 2wr0 h ARG 191 N 0.69 0.47 -0.05 1.69 2.43 -0.68 -0.55 114.38 118.38 2wr0 h ARG 191 Ca 0.55 -0.42 -0.00 0.00 -0.81 0.00 0.00 59.98 59.31 2wr0 h ARG 191 Cb 0.87 0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.52 2wr0 h ARG 191 CO -0.39 1.06 0.03 1.15 -1.51 0.00 0.00 179.97 180.30 2wr0 h THR 192 N 0.02 1.06 -0.10 0.20 2.02 -0.65 -0.40 112.91 115.06 2wr0 h THR 192 Ca -0.05 -0.17 -0.19 0.00 0.77 0.00 0.00 66.41 66.77 2wr0 h THR 192 Cb 1.19 1.09 0.01 0.00 -1.74 0.00 0.00 68.15 68.70 2wr0 h THR 192 CO 0.11 0.05 -0.67 -0.07 0.37 0.00 0.00 175.52 175.31 2wr0 h LEU 193 N 0.01 0.76 -1.11 2.58 3.38 -1.24 -3.40 115.31 116.29 2wr0 h LEU 193 Ca 0.02 -0.66 0.00 0.00 0.09 0.00 0.00 57.88 57.33 2wr0 h LEU 193 Cb 0.06 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.58 2wr0 h LEU 193 CO -0.00 1.30 0.00 -1.22 0.09 0.00 0.00 178.44 178.61 2wr0 n TYR 194 N -4.09 0.00 0.00 1.13 4.01 -0.22 -0.65 117.16 117.34 2wr0 n TYR 194 Ca -0.08 -0.07 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 2wr0 n TYR 194 Cb 0.69 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.71 2wr0 n TYR 194 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 2wr0 n GLN 195 N -0.07 0.00 -2.54 -0.72 -0.06 -0.16 -4.53 117.38 109.29 2wr0 n GLN 195 Ca 0.00 0.00 -0.40 0.00 -2.00 0.00 0.00 57.00 54.60 2wr0 n GLN 195 Cb 0.11 0.00 -0.05 0.00 -4.06 0.00 0.00 30.24 26.24 2wr0 n GLN 195 CO 0.00 0.00 0.00 -0.80 -0.20 0.00 0.00 177.06 176.06 2wr0 s ASN 196 N 0.00 7.36 -0.09 1.69 0.01 -1.26 -4.69 114.94 117.95 2wr0 s ASN 196 Ca 0.00 2.17 -0.02 0.00 -0.71 0.00 0.00 52.86 54.30 2wr0 s ASN 196 Cb 0.00 -2.62 -0.03 0.00 0.41 0.00 0.00 41.25 39.01 2wr0 s ASN 196 CO 0.00 -0.08 -0.01 0.54 -1.51 0.00 0.00 177.10 176.04 2wr0 s VAL 197 N -1.04 4.18 0.00 1.60 0.11 -1.26 -4.74 120.40 119.25 2wr0 s VAL 197 Ca 0.44 -0.29 0.00 0.00 -2.93 0.00 0.00 61.98 59.20 2wr0 s VAL 197 Cb -0.30 -2.76 0.00 0.00 -1.53 0.00 0.00 36.38 31.79 2wr0 s VAL 197 CO 0.38 0.59 0.00 0.61 -3.33 0.00 0.00 175.10 173.35 2wr0 n GLY 198 N 2.36 0.51 3.49 6.54 0.00 -1.26 -5.13 105.19 111.70 2wr0 n GLY 198 Ca -0.18 -0.54 -0.31 0.00 0.00 0.00 0.00 46.02 44.98 2wr0 n GLY 198 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wr0 n THR 199 N -0.47 0.00 -3.54 2.61 -2.24 -1.26 -5.05 114.28 104.33 2wr0 n THR 199 Ca 0.00 -2.30 -0.15 0.00 -2.27 0.00 0.00 64.05 59.32 2wr0 n THR 199 Cb 0.21 0.47 -0.05 0.00 -2.10 0.00 0.00 70.33 68.85 2wr0 n THR 199 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2wr0 s TYR 200 N -2.77 -0.52 -0.05 4.78 -0.85 -1.26 -4.31 117.35 112.38 2wr0 s TYR 200 Ca 0.00 0.70 0.05 0.00 -0.52 0.00 0.00 57.07 57.30 2wr0 s TYR 200 Cb 0.00 0.39 -0.02 0.00 0.38 0.00 0.00 41.96 42.71 2wr0 s TYR 200 CO 0.00 -0.65 -0.22 0.08 -1.52 0.00 0.00 175.55 173.25 2wr0 s VAL 201 N -2.09 2.38 -0.03 -3.49 1.01 0.04 -2.58 120.40 115.65 2wr0 s VAL 201 Ca -0.07 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 60.95 2wr0 s VAL 201 Cb -0.01 -1.89 0.03 0.00 0.00 0.00 0.00 36.38 34.51 2wr0 s VAL 201 CO 0.02 0.57 0.01 -0.55 0.00 0.00 0.00 175.10 175.15 2wr0 s SER 202 N -0.34 0.29 -0.02 3.32 0.15 0.10 -0.77 113.70 116.44 2wr0 s SER 202 Ca 0.02 -0.00 0.02 0.00 0.70 0.00 0.00 55.95 56.69 2wr0 s SER 202 Cb -0.12 -0.17 0.00 0.00 -1.71 0.00 0.00 66.02 64.02 2wr0 s SER 202 CO 0.02 -0.11 -0.07 -0.69 1.20 0.00 0.00 173.24 173.59 2wr0 s VAL 203 N 1.02 0.62 -0.13 4.45 1.01 -0.07 -1.35 120.40 125.95 2wr0 s VAL 203 Ca -0.10 -0.28 -0.07 0.00 0.00 0.00 0.00 61.98 61.54 2wr0 s VAL 203 Cb -0.13 -0.56 0.05 0.00 0.00 0.00 0.00 36.38 35.74 2wr0 s VAL 203 CO -0.02 0.20 0.31 -0.83 0.00 0.00 0.00 175.10 174.76 2wr0 s GLY 204 N 0.20 -0.21 0.00 4.51 0.00 -0.68 -1.51 107.32 109.63 2wr0 s GLY 204 Ca -0.03 1.20 0.00 0.00 0.00 0.00 0.00 44.72 45.89 2wr0 s GLY 204 CO 0.00 1.47 0.00 -1.30 0.00 0.00 0.00 173.10 173.28 2wr0 n THR 205 N 4.33 0.00 0.00 0.90 -2.24 0.26 -0.45 114.28 117.09 2wr0 n THR 205 Ca -0.23 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.51 2wr0 n THR 205 Cb 0.53 0.00 0.18 0.00 -2.10 0.00 0.00 70.33 68.95 2wr0 n THR 205 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2wr0 h SER 206 N 0.00 0.52 0.00 3.42 0.02 -1.99 -3.36 113.55 112.17 2wr0 h SER 206 Ca 0.00 -0.18 -0.09 0.00 -0.84 0.00 0.00 61.79 60.68 2wr0 h SER 206 Cb 0.00 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.38 2wr0 h SER 206 CO 0.00 0.77 -1.44 0.35 -1.14 0.00 0.00 176.83 175.37 2wr0 n THR 207 N -4.11 0.35 -3.65 -2.27 -2.24 -1.26 -4.99 114.28 96.10 2wr0 n THR 207 Ca -0.00 -0.26 -0.37 0.00 -2.27 0.00 0.00 64.05 61.14 2wr0 n THR 207 Cb 0.41 -0.50 -0.06 0.00 -2.10 0.00 0.00 70.33 68.08 2wr0 n THR 207 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2wr0 s LEU 208 N -4.24 4.42 -0.22 3.22 2.96 -1.26 -5.07 118.68 118.49 2wr0 s LEU 208 Ca -0.03 0.73 -0.04 0.00 -0.22 0.00 0.00 54.13 54.57 2wr0 s LEU 208 Cb 0.03 -2.37 0.11 0.00 0.50 0.00 0.00 46.19 44.46 2wr0 s LEU 208 CO 0.29 0.34 0.31 0.21 -1.32 0.00 0.00 176.35 176.18 2wr0 s ASN 209 N -0.90 0.63 -0.12 3.68 2.47 -1.26 -0.57 114.94 118.87 2wr0 s ASN 209 Ca 0.20 0.13 -0.06 0.00 0.42 0.00 0.00 52.86 53.55 2wr0 s ASN 209 Cb -0.15 0.83 0.05 0.00 -1.45 0.00 0.00 41.25 40.54 2wr0 s ASN 209 CO 0.09 -0.30 0.27 -0.75 -3.72 0.00 0.00 177.10 172.69 2wr0 s LYS 210 N 2.46 0.23 -0.07 0.43 2.20 -0.57 -5.03 119.74 119.39 2wr0 s LYS 210 Ca 0.09 0.58 -0.00 0.00 -0.36 0.00 0.00 55.97 56.27 2wr0 s LYS 210 Cb -0.15 -0.10 0.02 0.00 -1.51 0.00 0.00 37.83 36.09 2wr0 s LYS 210 CO -0.14 -0.17 -0.04 0.50 -0.36 0.00 0.00 175.35 175.14 2wr0 s ARG 211 N 1.33 0.99 0.14 4.03 3.52 -1.26 -0.89 118.95 126.81 2wr0 s ARG 211 Ca -0.09 -0.09 0.08 0.00 -0.13 0.00 0.00 55.73 55.50 2wr0 s ARG 211 Cb -0.10 -1.12 -0.04 0.00 -1.56 0.00 0.00 34.95 32.13 2wr0 s ARG 211 CO -0.09 -0.20 -0.18 -1.12 -0.81 0.00 0.00 175.30 172.89 2wr0 s SER 212 N 1.49 2.50 -0.09 -2.12 0.01 0.06 -4.98 113.70 110.57 2wr0 s SER 212 Ca -0.01 -0.80 0.03 0.00 1.31 0.00 0.00 55.95 56.47 2wr0 s SER 212 Cb -0.13 -0.13 -0.02 0.00 0.21 0.00 0.00 66.02 65.95 2wr0 s SER 212 CO -0.04 -0.03 -0.16 -0.63 0.41 0.00 0.00 173.24 172.79 2wr0 s ILE 213 N -1.80 2.84 0.40 1.44 1.01 -1.26 -0.78 121.20 123.05 2wr0 s ILE 213 Ca 0.11 -0.77 -0.27 0.00 0.00 0.00 0.00 60.65 59.73 2wr0 s ILE 213 Cb -0.07 -2.13 -0.09 0.00 0.01 0.00 0.00 42.46 40.17 2wr0 s ILE 213 CO 0.05 0.56 1.38 -2.84 0.00 0.00 0.00 174.94 174.09 2wr0 s PRO 214 N -0.14 4.00 -0.50 2.79 0.02 -1.26 -4.97 135.00 134.95 2wr0 s PRO 214 Ca -0.02 2.34 -0.13 0.00 0.02 0.00 0.00 61.00 63.22 2wr0 s PRO 214 Cb -0.14 -2.84 0.12 0.00 0.02 0.00 0.00 34.50 31.66 2wr0 s PRO 214 CO 0.04 -0.53 0.41 -1.21 -0.33 0.00 0.00 177.00 175.37 2wr0 s GLU 215 N -2.17 2.76 -0.36 5.54 2.02 -1.26 -5.00 118.70 120.23 2wr0 s GLU 215 Ca 0.55 -1.67 -0.25 0.00 0.02 0.00 0.00 54.97 53.62 2wr0 s GLU 215 Cb -0.42 -4.09 0.01 0.00 0.10 0.00 0.00 34.13 29.73 2wr0 s GLU 215 CO 0.55 -1.21 0.88 0.42 0.02 0.00 0.00 175.26 175.92 2wr0 s ILE 216 N 1.50 4.64 -0.23 -1.63 1.01 -1.26 -4.05 121.20 121.18 2wr0 s ILE 216 Ca 0.04 1.14 -0.26 0.00 0.00 0.00 0.00 60.65 61.57 2wr0 s ILE 216 Cb -0.27 -4.29 0.09 0.00 0.01 0.00 0.00 42.46 38.00 2wr0 s ILE 216 CO 0.02 -0.48 0.84 0.00 0.00 0.00 0.00 174.94 175.32 2wr0 s ALA 217 N 3.33 -1.85 0.26 9.38 0.00 -1.03 -4.92 121.76 126.94 2wr0 s ALA 217 Ca 0.36 1.84 -0.30 0.00 0.00 0.00 0.00 51.96 53.86 2wr0 s ALA 217 Cb -0.12 -1.05 -0.10 0.00 0.00 0.00 0.00 23.12 21.84 2wr0 s ALA 217 CO 0.17 -0.31 1.50 0.99 0.00 0.00 0.00 175.76 178.11 2wr0 s THR 218 N -0.03 2.46 0.07 0.00 2.01 -1.08 -4.37 115.64 114.70 2wr0 s THR 218 Ca -0.01 0.38 -0.05 0.00 0.31 0.00 0.00 61.69 62.33 2wr0 s THR 218 Cb -0.04 -3.25 -0.02 0.00 0.01 0.00 0.00 72.50 69.21 2wr0 s THR 218 CO 0.00 0.06 0.09 -0.13 -0.69 0.00 0.00 174.62 173.95 2wr0 s ARG 219 N -0.30 0.73 0.44 4.92 0.52 -1.26 -5.11 118.95 118.89 2wr0 s ARG 219 Ca 0.61 -1.08 -0.25 0.00 -0.52 0.00 0.00 55.73 54.49 2wr0 s ARG 219 Cb -0.44 0.28 -0.08 0.00 0.52 0.00 0.00 34.95 35.23 2wr0 s ARG 219 CO 0.44 -0.19 1.36 -2.14 0.02 0.00 0.00 175.30 174.79 2wr0 s PRO 220 N -3.88 3.79 0.10 3.54 0.02 -1.26 -4.57 135.00 132.74 2wr0 s PRO 220 Ca 0.06 2.28 -0.31 0.00 0.02 0.00 0.00 61.00 63.05 2wr0 s PRO 220 Cb 0.06 -2.68 -0.07 0.00 0.02 0.00 0.00 34.50 31.83 2wr0 s PRO 220 CO -0.11 -0.69 1.38 0.15 -0.33 0.00 0.00 177.00 177.40 2wr0 s LYS 221 N -2.39 4.33 -0.14 5.54 1.02 -1.26 -4.49 119.74 122.35 2wr0 s LYS 221 Ca 0.60 2.04 0.02 0.00 0.02 0.00 0.00 55.97 58.65 2wr0 s LYS 221 Cb -0.41 -3.29 0.01 0.00 -0.52 0.00 0.00 37.83 33.62 2wr0 s LYS 221 CO 0.52 -0.44 -0.22 0.08 -0.92 0.00 0.00 175.35 174.38 2wr0 s VAL 222 N 1.25 2.06 -1.49 3.17 1.01 0.27 -4.58 120.40 122.09 2wr0 s VAL 222 Ca 0.64 -0.98 -0.13 0.00 0.00 0.00 0.00 61.98 61.52 2wr0 s VAL 222 Cb -0.36 -1.82 0.09 0.00 0.00 0.00 0.00 36.38 34.30 2wr0 s VAL 222 CO 0.30 0.55 0.77 0.59 0.00 0.00 0.00 175.10 177.30 2wr0 n ASN 223 N 4.09 -4.28 -0.19 3.32 3.02 -1.26 -1.42 115.26 118.53 2wr0 n ASN 223 Ca -0.20 -0.67 -0.03 0.00 -0.03 0.00 0.00 54.58 53.66 2wr0 n ASN 223 Cb 0.51 -3.47 -0.01 0.00 -0.61 0.00 0.00 39.78 36.21 2wr0 n ASN 223 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wr0 n GLY 224 N -1.46 0.57 3.14 7.41 0.00 -1.26 -4.31 105.19 109.28 2wr0 n GLY 224 Ca 0.02 -0.41 -0.28 0.00 0.00 0.00 0.00 46.02 45.35 2wr0 n GLY 224 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wr0 s GLN 225 N -1.45 2.26 0.31 1.61 -1.52 -0.51 -4.98 119.66 115.39 2wr0 s GLN 225 Ca 0.00 -0.67 0.18 0.00 -1.95 0.00 0.00 55.36 52.93 2wr0 s GLN 225 Cb 0.00 -1.82 0.14 0.00 -0.22 0.00 0.00 33.01 31.11 2wr0 s GLN 225 CO 0.00 0.17 1.42 0.78 -0.25 0.00 0.00 175.29 177.41 2wr0 h GLY 226 N 6.62 0.00 -0.70 3.09 0.00 -1.80 0.80 103.07 111.07 2wr0 h GLY 226 Ca -0.27 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.59 2wr0 h GLY 226 CO 0.47 0.00 0.35 -0.32 0.00 0.00 0.00 176.54 177.04 2wr0 s GLY 227 N -4.39 1.58 -0.00 4.60 0.00 -1.26 -4.31 107.32 103.54 2wr0 s GLY 227 Ca 0.04 -0.57 -0.03 0.00 0.00 0.00 0.00 44.72 44.16 2wr0 s GLY 227 CO 0.73 -0.04 0.05 0.50 0.00 0.00 0.00 173.10 174.34 2wr0 s ARG 228 N -5.40 0.28 -0.19 2.90 1.81 -0.72 -4.65 118.95 112.98 2wr0 s ARG 228 Ca 0.63 -0.31 -0.03 0.00 -1.72 0.00 0.00 55.73 54.30 2wr0 s ARG 228 Cb -0.13 0.11 -0.01 0.00 -0.45 0.00 0.00 34.95 34.47 2wr0 s ARG 228 CO 0.52 -0.06 -0.06 -1.64 -0.68 0.00 0.00 175.30 173.38 2wr0 s MET 229 N -0.94 3.43 -0.29 3.54 -1.94 -0.23 -0.15 119.30 122.72 2wr0 s MET 229 Ca -0.10 -0.62 -0.09 0.00 -1.71 0.00 0.00 55.69 53.17 2wr0 s MET 229 Cb -0.06 -2.93 -0.02 0.00 2.01 0.00 0.00 34.83 33.84 2wr0 s MET 229 CO 0.00 -0.05 0.13 -2.00 -0.01 0.00 0.00 175.02 173.09 2wr0 s GLU 230 N 1.09 3.46 0.01 2.03 2.12 -0.64 -1.40 118.70 125.38 2wr0 s GLU 230 Ca 0.01 -0.63 -0.01 0.00 0.36 0.00 0.00 54.97 54.70 2wr0 s GLU 230 Cb -0.15 -3.50 -0.04 0.00 0.26 0.00 0.00 34.13 30.71 2wr0 s GLU 230 CO -0.01 -0.34 0.16 -0.06 -0.54 0.00 0.00 175.26 174.48 2wr0 s PHE 231 N 1.62 3.47 0.33 5.30 0.08 -0.10 -1.60 117.98 127.08 2wr0 s PHE 231 Ca 0.05 0.29 0.03 0.00 0.12 0.00 0.00 56.93 57.42 2wr0 s PHE 231 Cb -0.16 -1.78 -0.05 0.00 -0.57 0.00 0.00 43.02 40.45 2wr0 s PHE 231 CO 0.06 0.61 0.09 -1.12 -0.10 0.00 0.00 175.22 174.76 2wr0 s SER 232 N -2.07 2.16 0.05 1.36 0.01 0.04 -0.44 113.70 114.81 2wr0 s SER 232 Ca 0.28 -1.46 -0.14 0.00 1.31 0.00 0.00 55.95 55.94 2wr0 s SER 232 Cb -0.13 0.14 0.02 0.00 0.21 0.00 0.00 66.02 66.26 2wr0 s SER 232 CO 0.20 -0.73 0.31 -1.66 0.41 0.00 0.00 173.24 171.78 2wr0 s TRP 233 N -3.40 -0.11 0.14 2.43 1.48 -1.26 -1.47 118.94 116.75 2wr0 s TRP 233 Ca 0.34 -0.04 -0.07 0.00 -1.06 0.00 0.00 56.10 55.27 2wr0 s TRP 233 Cb 0.07 0.11 -0.02 0.00 -1.16 0.00 0.00 33.47 32.47 2wr0 s TRP 233 CO 0.15 -0.52 0.21 -0.08 -4.06 0.00 0.00 176.95 172.64 2wr0 s THR 234 N -2.69 0.09 -0.27 0.66 -1.32 -0.47 -5.00 115.64 106.64 2wr0 s THR 234 Ca -0.04 -1.48 -0.10 0.00 -1.21 0.00 0.00 61.69 58.86 2wr0 s THR 234 Cb -0.00 -1.79 -0.05 0.00 -1.51 0.00 0.00 72.50 69.15 2wr0 s THR 234 CO -0.04 -0.42 0.16 -0.76 -2.21 0.00 0.00 174.62 171.35 2wr0 s LEU 235 N -2.97 3.90 -0.25 9.08 1.43 -1.26 -1.39 118.68 127.22 2wr0 s LEU 235 Ca 0.16 -0.04 -0.23 0.00 -1.03 0.00 0.00 54.13 52.98 2wr0 s LEU 235 Cb 0.05 -2.07 -0.01 0.00 0.03 0.00 0.00 46.19 44.18 2wr0 s LEU 235 CO -0.02 -0.04 0.78 -0.22 0.23 0.00 0.00 176.35 177.09 2wr0 s LEU 236 N 1.66 4.08 0.77 1.79 2.96 0.16 -4.86 118.68 125.23 2wr0 s LEU 236 Ca 0.07 0.93 -0.11 0.00 -0.22 0.00 0.00 54.13 54.80 2wr0 s LEU 236 Cb -0.16 -3.10 0.06 0.00 0.50 0.00 0.00 46.19 43.49 2wr0 s LEU 236 CO 0.09 -0.49 1.09 -1.61 -1.32 0.00 0.00 176.35 174.11 2wr0 s GLU 237 N 2.78 2.23 0.13 1.98 0.41 -1.26 -0.94 118.70 124.03 2wr0 s GLU 237 Ca 0.33 1.19 -0.34 0.00 -0.41 0.00 0.00 54.97 55.73 2wr0 s GLU 237 Cb -0.15 -1.89 -0.14 0.00 -1.78 0.00 0.00 34.13 30.17 2wr0 s GLU 237 CO 0.08 -1.66 1.58 0.25 -0.49 0.00 0.00 175.26 175.02 2wr0 n THR 238 N -3.51 0.06 -1.10 3.63 -2.24 -1.26 -1.72 114.28 108.14 2wr0 n THR 238 Ca 0.09 -0.01 -0.03 0.00 -2.27 0.00 0.00 64.05 61.83 2wr0 n THR 238 Cb 0.53 -1.49 -0.01 0.00 -2.10 0.00 0.00 70.33 67.26 2wr0 n THR 238 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 2wr0 n TRP 239 N 3.63 0.00 -3.42 4.78 7.02 0.34 -4.99 117.44 124.81 2wr0 n TRP 239 Ca 0.18 0.00 -0.19 0.00 -1.02 0.00 0.00 57.50 56.47 2wr0 n TRP 239 Cb 0.28 -1.31 -0.00 0.00 -2.42 0.00 0.00 31.31 27.85 2wr0 n TRP 239 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 2wr0 s ASP 240 N -2.29 5.94 -0.02 -0.99 2.15 -0.70 -4.76 116.67 116.00 2wr0 s ASP 240 Ca 0.00 -0.21 0.07 0.00 0.43 0.00 0.00 52.55 52.84 2wr0 s ASP 240 Cb 0.00 -1.17 -0.02 0.00 -0.30 0.00 0.00 42.92 41.43 2wr0 s ASP 240 CO 0.00 -0.47 -0.23 -0.69 -0.17 0.00 0.00 175.17 173.62 2wr0 s VAL 241 N -2.19 2.35 -0.16 1.11 1.01 -1.26 -0.31 120.40 120.95 2wr0 s VAL 241 Ca 0.46 -1.04 -0.02 0.00 0.00 0.00 0.00 61.98 61.38 2wr0 s VAL 241 Cb -0.10 -1.86 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 2wr0 s VAL 241 CO 0.31 0.55 -0.08 -0.51 0.00 0.00 0.00 175.10 175.37 2wr0 s ILE 242 N -0.68 3.35 -0.24 2.22 2.07 -0.08 -4.25 121.20 123.60 2wr0 s ILE 242 Ca 0.11 -0.54 -0.07 0.00 -1.41 0.00 0.00 60.65 58.74 2wr0 s ILE 242 Cb -0.10 -2.46 -0.03 0.00 0.13 0.00 0.00 42.46 40.00 2wr0 s ILE 242 CO 0.00 0.49 0.07 0.20 -1.91 0.00 0.00 174.94 173.79 2wr0 s ASN 243 N 0.68 5.23 -0.12 4.50 -0.87 0.41 -1.20 114.94 123.57 2wr0 s ASN 243 Ca -0.04 -0.16 -0.04 0.00 -1.57 0.00 0.00 52.86 51.05 2wr0 s ASN 243 Cb -0.15 -1.93 -0.04 0.00 -0.02 0.00 0.00 41.25 39.11 2wr0 s ASN 243 CO 0.02 0.00 0.05 -0.36 -2.57 0.00 0.00 177.10 174.25 2wr0 s PHE 244 N 1.41 3.30 -0.12 2.20 0.08 -0.26 -1.68 117.98 122.91 2wr0 s PHE 244 Ca 0.05 0.26 -0.08 0.00 0.12 0.00 0.00 56.93 57.28 2wr0 s PHE 244 Cb -0.15 -1.89 0.04 0.00 -0.57 0.00 0.00 43.02 40.45 2wr0 s PHE 244 CO 0.04 0.47 0.29 -2.00 -0.10 0.00 0.00 175.22 173.92 2wr0 s GLU 245 N -0.65 0.30 -0.23 0.44 2.12 -0.46 -2.41 118.70 117.81 2wr0 s GLU 245 Ca 0.11 0.51 -0.19 0.00 0.36 0.00 0.00 54.97 55.77 2wr0 s GLU 245 Cb -0.12 0.03 0.06 0.00 0.26 0.00 0.00 34.13 34.36 2wr0 s GLU 245 CO 0.02 -0.10 0.60 0.45 -0.54 0.00 0.00 175.26 175.69 2wr0 s SER 246 N 0.76 -0.67 0.00 -1.70 0.15 -0.14 -0.72 113.70 111.38 2wr0 s SER 246 Ca -0.05 1.24 0.18 0.00 0.70 0.00 0.00 55.95 58.02 2wr0 s SER 246 Cb -0.06 1.22 0.56 0.00 -1.71 0.00 0.00 66.02 66.03 2wr0 s SER 246 CO -0.05 -0.21 1.44 0.35 1.20 0.00 0.00 173.24 175.96 2wr0 n THR 247 N 3.15 0.39 0.00 6.45 -2.24 -1.07 -0.44 114.28 120.52 2wr0 n THR 247 Ca -0.16 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 2wr0 n THR 247 Cb 0.56 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 69.21 2wr0 n THR 247 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wr0 n GLY 248 N 1.20 3.92 2.59 3.38 0.00 -1.26 -4.77 105.19 110.25 2wr0 n GLY 248 Ca 0.16 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.19 2wr0 n GLY 248 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wr0 n ASN 249 N 0.00 0.00 -4.71 1.61 3.02 -1.26 -4.08 115.26 109.84 2wr0 n ASN 249 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.13 2wr0 n ASN 249 Cb 0.00 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.14 2wr0 n ASN 249 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2wr0 s LEU 250 N 0.00 4.36 -0.49 3.41 2.96 -1.26 -0.50 118.68 127.16 2wr0 s LEU 250 Ca 0.00 2.37 -0.11 0.00 -0.22 0.00 0.00 54.13 56.17 2wr0 s LEU 250 Cb 0.00 -3.58 0.12 0.00 0.50 0.00 0.00 46.19 43.23 2wr0 s LEU 250 CO 0.00 -0.73 0.39 -0.63 -1.32 0.00 0.00 176.35 174.06 2wr0 s ILE 251 N 1.52 4.55 0.32 6.68 -1.09 0.41 -3.74 121.20 129.85 2wr0 s ILE 251 Ca 0.67 -1.66 -0.14 0.00 -2.23 0.00 0.00 60.65 57.29 2wr0 s ILE 251 Cb -0.38 -3.95 -0.09 0.00 -1.58 0.00 0.00 42.46 36.47 2wr0 s ILE 251 CO 0.30 -0.79 0.72 0.00 -1.23 0.00 0.00 174.94 173.94 2wr0 s ALA 252 N 1.45 3.35 0.43 9.38 0.00 -0.56 -0.52 121.76 135.29 2wr0 s ALA 252 Ca 0.05 -0.02 -0.21 0.00 0.00 0.00 0.00 51.96 51.78 2wr0 s ALA 252 Cb -0.27 -2.72 -0.11 0.00 0.00 0.00 0.00 23.12 20.02 2wr0 s ALA 252 CO 0.01 0.32 0.96 -1.25 0.00 0.00 0.00 175.76 175.80 2wr0 s PRO 253 N -3.04 4.20 -0.05 0.00 0.04 -1.25 0.37 135.00 135.26 2wr0 s PRO 253 Ca 0.53 1.13 0.19 0.00 0.04 0.00 0.00 61.00 62.90 2wr0 s PRO 253 Cb -0.10 -2.17 -0.30 0.00 0.04 0.00 0.00 34.50 31.97 2wr0 s PRO 253 CO 0.19 -0.06 0.38 -1.91 0.04 0.00 0.00 177.00 175.64 2wr0 n GLU 254 N -0.67 0.66 -4.31 4.56 2.13 0.23 -4.62 120.64 118.61 2wr0 n GLU 254 Ca 0.07 -0.16 -0.19 0.00 0.66 0.00 0.00 57.16 57.55 2wr0 n GLU 254 Cb 0.54 -1.47 -0.11 0.00 0.27 0.00 0.00 31.44 30.67 2wr0 n GLU 254 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 2wr0 s TYR 255 N -3.24 1.61 0.28 4.31 2.02 -1.24 -1.99 117.35 119.10 2wr0 s TYR 255 Ca -0.08 -0.56 0.06 0.00 -0.37 0.00 0.00 57.07 56.12 2wr0 s TYR 255 Cb 0.12 -0.79 -0.06 0.00 -0.40 0.00 0.00 41.96 40.83 2wr0 s TYR 255 CO 0.81 0.27 -0.05 0.20 -1.57 0.00 0.00 175.55 175.22 2wr0 s GLY 256 N -2.93 1.82 -0.25 0.71 0.00 0.52 -4.69 107.32 102.50 2wr0 s GLY 256 Ca 0.17 -1.90 0.02 0.00 0.00 0.00 0.00 44.72 43.01 2wr0 s GLY 256 CO 0.05 -1.83 -0.07 -1.36 0.00 0.00 0.00 173.10 169.90 2wr0 s PHE 257 N -3.05 2.75 0.06 1.90 0.08 -0.01 -0.34 117.98 119.36 2wr0 s PHE 257 Ca 0.30 -2.00 -0.30 0.00 0.12 0.00 0.00 56.93 55.04 2wr0 s PHE 257 Cb 0.04 -1.75 -0.09 0.00 -0.57 0.00 0.00 43.02 40.66 2wr0 s PHE 257 CO 0.12 -0.82 1.80 0.15 -0.10 0.00 0.00 175.22 176.36 2wr0 s LYS 258 N 1.28 4.16 -0.06 0.44 1.02 0.56 -0.61 119.74 126.53 2wr0 s LYS 258 Ca -0.06 2.47 0.03 0.00 0.02 0.00 0.00 55.97 58.43 2wr0 s LYS 258 Cb -0.19 -3.82 0.01 0.00 -0.52 0.00 0.00 37.83 33.31 2wr0 s LYS 258 CO -0.06 -0.85 -0.14 -1.50 -0.92 0.00 0.00 175.35 171.88 2wr0 s ILE 259 N 3.40 1.22 -0.06 2.17 2.07 -0.37 -0.98 121.20 128.65 2wr0 s ILE 259 Ca 0.80 -0.56 0.03 0.00 -1.41 0.00 0.00 60.65 59.51 2wr0 s ILE 259 Cb -0.41 -1.09 0.01 0.00 0.13 0.00 0.00 42.46 41.09 2wr0 s ILE 259 CO 0.36 0.37 -0.14 -0.44 -1.91 0.00 0.00 174.94 173.18 2wr0 s SER 260 N 0.43 1.88 0.06 4.50 0.01 -1.07 -4.30 113.70 115.21 2wr0 s SER 260 Ca -0.11 -0.32 0.04 0.00 1.31 0.00 0.00 55.95 56.88 2wr0 s SER 260 Cb -0.14 -0.78 -0.04 0.00 0.21 0.00 0.00 66.02 65.27 2wr0 s SER 260 CO 0.03 0.07 -0.02 -0.54 0.41 0.00 0.00 173.24 173.19 2wr0 s LYS 261 N 0.49 2.54 -0.23 12.44 1.02 -1.26 0.22 119.74 134.96 2wr0 s LYS 261 Ca -0.12 -0.80 0.15 0.00 0.02 0.00 0.00 55.97 55.22 2wr0 s LYS 261 Cb -0.15 -2.53 0.47 0.00 -0.52 0.00 0.00 37.83 35.10 2wr0 s LYS 261 CO 0.04 0.56 1.16 -2.13 -0.92 0.00 0.00 175.35 174.06 2wr0 n ARG 262 N 0.90 2.25 0.00 1.68 0.63 -1.26 -4.87 116.66 115.99 2wr0 n ARG 262 Ca -0.13 -3.56 0.00 0.00 -0.92 0.00 0.00 57.85 53.24 2wr0 n ARG 262 Cb 0.52 -1.68 0.00 0.00 0.45 0.00 0.00 32.46 31.75 2wr0 n ARG 262 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2wr0 n GLY 263 N -0.58 -1.31 3.63 5.14 0.00 -1.26 -5.07 105.19 105.74 2wr0 n GLY 263 Ca 0.23 -2.24 -0.26 0.00 0.00 0.00 0.00 46.02 43.75 2wr0 n GLY 263 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wr0 s SER 264 N -0.09 4.07 0.00 1.61 0.01 -1.26 -4.59 113.70 113.46 2wr0 s SER 264 Ca 0.00 -1.14 0.00 0.00 1.31 0.00 0.00 55.95 56.12 2wr0 s SER 264 Cb 0.00 -0.46 0.00 0.00 0.21 0.00 0.00 66.02 65.77 2wr0 s SER 264 CO 0.00 -0.34 0.00 -0.24 0.41 0.00 0.00 173.24 173.07 2wr0 n SER 265 N -0.98 0.79 -1.61 2.44 2.88 -1.26 -4.93 113.62 110.94 2wr0 n SER 265 Ca -0.04 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.46 2wr0 n SER 265 Cb 0.64 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.10 2wr0 n SER 265 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2wr0 n GLY 266 N 0.00 2.21 3.54 0.46 0.00 -1.26 -4.82 105.19 105.31 2wr0 n GLY 266 Ca 0.00 -1.27 -0.34 0.00 0.00 0.00 0.00 46.02 44.42 2wr0 n GLY 266 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wr0 s ILE 267 N -2.64 3.68 -0.23 -0.61 1.01 -1.26 -2.44 121.20 118.72 2wr0 s ILE 267 Ca 0.07 -0.47 -0.05 0.00 0.00 0.00 0.00 60.65 60.21 2wr0 s ILE 267 Cb -0.01 -2.54 -0.02 0.00 0.01 0.00 0.00 42.46 39.91 2wr0 s ILE 267 CO 0.05 0.56 -0.01 -0.32 0.00 0.00 0.00 174.94 175.23 2wr0 s MET 268 N -0.37 3.48 -0.50 2.79 -2.45 0.59 -4.80 119.30 118.04 2wr0 s MET 268 Ca 0.05 -0.57 -0.21 0.00 -1.25 0.00 0.00 55.69 53.71 2wr0 s MET 268 Cb -0.12 -3.10 0.04 0.00 1.25 0.00 0.00 34.83 32.90 2wr0 s MET 268 CO 0.02 -0.18 0.71 0.15 1.05 0.00 0.00 175.02 176.78 2wr0 s LYS 269 N 1.47 3.22 0.20 4.11 1.02 -1.26 -1.71 119.74 126.79 2wr0 s LYS 269 Ca 0.05 -0.58 -0.17 0.00 0.02 0.00 0.00 55.97 55.30 2wr0 s LYS 269 Cb -0.14 -4.04 0.02 0.00 -0.52 0.00 0.00 37.83 33.14 2wr0 s LYS 269 CO -0.01 -1.23 0.50 -0.08 -0.92 0.00 0.00 175.35 173.62 2wr0 s THR 270 N 3.02 0.03 -1.09 2.17 -1.32 0.28 -4.72 115.64 114.01 2wr0 s THR 270 Ca 0.21 -0.86 0.23 0.00 -1.21 0.00 0.00 61.69 60.06 2wr0 s THR 270 Cb -0.16 -1.63 -0.08 0.00 -1.51 0.00 0.00 72.50 69.12 2wr0 s THR 270 CO 0.16 -0.13 1.18 -0.62 -2.21 0.00 0.00 174.62 173.00 2wr0 n GLU 271 N -0.33 0.10 -1.59 7.08 -0.58 -1.26 -3.87 120.64 120.19 2wr0 n GLU 271 Ca -0.09 -0.07 -0.33 0.00 -0.42 0.00 0.00 57.16 56.24 2wr0 n GLU 271 Cb 0.62 -1.50 0.07 0.00 -0.57 0.00 0.00 31.44 30.06 2wr0 n GLU 271 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2wr0 s LYS 272 N -2.95 2.52 0.18 3.49 1.02 -1.26 -5.06 119.74 117.68 2wr0 s LYS 272 Ca 0.11 1.45 0.10 0.00 0.02 0.00 0.00 55.97 57.65 2wr0 s LYS 272 Cb 0.17 -1.91 -0.04 0.00 -0.52 0.00 0.00 37.83 35.53 2wr0 s LYS 272 CO 0.76 -1.48 -0.22 0.95 -0.92 0.00 0.00 175.35 174.44 2wr0 s THR 273 N -2.34 2.11 0.29 2.17 -4.23 -1.26 -4.99 115.64 107.39 2wr0 s THR 273 Ca 0.68 -1.95 -0.29 0.00 -1.18 0.00 0.00 61.69 58.94 2wr0 s THR 273 Cb -0.22 -1.98 -0.13 0.00 1.34 0.00 0.00 72.50 71.51 2wr0 s THR 273 CO 0.44 -0.18 1.27 -0.11 -0.54 0.00 0.00 174.62 175.51 2wr0 n LEU 274 N 0.35 2.95 -4.55 4.79 7.94 -1.26 -4.21 117.00 123.00 2wr0 n LEU 274 Ca -0.13 1.18 -0.26 0.00 -1.11 0.00 0.00 56.01 55.69 2wr0 n LEU 274 Cb 0.56 -1.41 -0.11 0.00 0.53 0.00 0.00 43.42 42.99 2wr0 n LEU 274 CO 0.29 -0.70 -0.28 -1.61 -1.11 0.00 0.00 177.39 173.97 2wr0 s GLU 275 N -1.20 1.84 -1.19 1.96 2.02 -0.73 -4.97 118.70 116.43 2wr0 s GLU 275 Ca 0.62 -2.03 -0.19 0.00 0.02 0.00 0.00 54.97 53.38 2wr0 s GLU 275 Cb -0.64 -1.35 -0.03 0.00 0.10 0.00 0.00 34.13 32.21 2wr0 s GLU 275 CO 0.57 -0.10 1.93 -1.71 0.02 0.00 0.00 175.26 175.97 2wr0 n ASN 276 N -0.86 3.70 -3.93 -0.19 5.15 -1.26 -4.54 115.26 113.32 2wr0 n ASN 276 Ca -0.04 -2.79 -0.11 0.00 -0.60 0.00 0.00 54.58 51.03 2wr0 n ASN 276 Cb 0.67 -1.59 -0.13 0.00 -0.53 0.00 0.00 39.78 38.20 2wr0 n ASN 276 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2wr0 s GLU 278 N -0.67 3.08 0.13 0.00 2.56 -1.26 -0.16 118.70 122.38 2wr0 s GLU 278 Ca -0.06 -0.86 -0.08 0.00 0.00 0.00 0.00 54.97 53.96 2wr0 s GLU 278 Cb -0.05 -2.34 -0.01 0.00 2.00 0.00 0.00 34.13 33.74 2wr0 s GLU 278 CO -0.00 0.18 0.23 -0.08 -0.56 0.00 0.00 175.26 175.03 2wr0 s THR 279 N 0.35 0.10 -0.72 -1.70 -1.32 -0.65 -4.92 115.64 106.78 2wr0 s THR 279 Ca -0.18 -1.32 0.12 0.00 -1.21 0.00 0.00 61.69 59.09 2wr0 s THR 279 Cb -0.18 -1.63 -0.09 0.00 -1.51 0.00 0.00 72.50 69.09 2wr0 s THR 279 CO 0.08 -0.47 0.56 0.29 -2.21 0.00 0.00 174.62 172.88 2wr0 n LYS 280 N -0.14 2.79 -3.48 7.08 5.02 -1.26 -1.79 118.16 126.38 2wr0 n LYS 280 Ca -0.11 -0.19 -0.18 0.00 -2.02 0.00 0.00 58.31 55.81 2wr0 n LYS 280 Cb 0.63 -1.08 -0.12 0.00 -0.02 0.00 0.00 35.03 34.43 2wr0 n LYS 280 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wr0 s GLN 282 N 2.33 3.54 0.31 0.00 2.00 0.11 -1.21 119.66 126.74 2wr0 s GLN 282 Ca 0.07 -0.19 0.07 0.00 -2.00 0.00 0.00 55.36 53.32 2wr0 s GLN 282 Cb -0.16 -3.18 -0.06 0.00 0.80 0.00 0.00 33.01 30.41 2wr0 s GLN 282 CO -0.15 0.66 -0.06 0.95 -0.50 0.00 0.00 175.29 176.19 2wr0 s THR 283 N -0.70 1.84 0.39 -0.34 -4.23 -0.80 -0.90 115.64 110.90 2wr0 s THR 283 Ca 0.13 -2.14 0.36 0.00 -1.18 0.00 0.00 61.69 58.86 2wr0 s THR 283 Cb -0.12 -2.55 0.39 0.00 1.34 0.00 0.00 72.50 71.56 2wr0 s THR 283 CO 0.03 -0.24 2.15 -0.65 -0.54 0.00 0.00 174.62 175.37 2wr0 h PRO 284 N 2.16 0.00 0.00 3.99 0.11 -1.93 -2.25 132.00 134.08 2wr0 h PRO 284 Ca -0.41 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.68 2wr0 h PRO 284 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2wr0 h PRO 284 CO 0.69 0.03 -1.09 1.28 -0.21 0.00 0.00 178.00 178.70 2wr0 n LEU 285 N -3.23 0.82 0.00 2.35 4.77 -1.26 -4.81 117.00 115.65 2wr0 n LEU 285 Ca -0.01 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 2wr0 n LEU 285 Cb 0.20 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 2wr0 n LEU 285 CO 0.25 -0.14 0.00 0.61 -1.33 0.00 0.00 177.39 176.78 2wr0 n GLY 286 N 1.21 1.82 3.84 -0.72 0.00 -0.85 -4.02 105.19 106.47 2wr0 n GLY 286 Ca -0.01 -1.40 -0.33 0.00 0.00 0.00 0.00 46.02 44.27 2wr0 n GLY 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wr0 s ALA 287 N -1.90 3.31 -0.18 4.61 0.00 -1.03 -1.91 121.76 124.66 2wr0 s ALA 287 Ca 0.00 0.10 -0.07 0.00 0.00 0.00 0.00 51.96 51.99 2wr0 s ALA 287 Cb 0.00 -2.81 -0.04 0.00 0.00 0.00 0.00 23.12 20.27 2wr0 s ALA 287 CO 0.00 0.31 0.05 0.42 0.00 0.00 0.00 175.76 176.54 2wr0 s ILE 288 N -1.92 4.65 -0.34 0.00 1.01 -0.35 -1.52 121.20 122.73 2wr0 s ILE 288 Ca 0.53 -0.08 0.04 0.00 0.00 0.00 0.00 60.65 61.13 2wr0 s ILE 288 Cb -0.11 -3.09 0.10 0.00 0.01 0.00 0.00 42.46 39.37 2wr0 s ILE 288 CO 0.18 0.46 0.06 0.21 0.00 0.00 0.00 174.94 175.84 2wr0 s ASN 289 N 0.45 4.79 -0.06 3.58 2.47 -1.26 -4.19 114.94 120.72 2wr0 s ASN 289 Ca 0.02 -2.16 -0.30 0.00 0.42 0.00 0.00 52.86 50.85 2wr0 s ASN 289 Cb -0.13 -1.64 0.09 0.00 -1.45 0.00 0.00 41.25 38.12 2wr0 s ASN 289 CO 0.01 -0.39 0.78 0.28 -3.72 0.00 0.00 177.10 174.06 2wr0 s THR 290 N 0.91 0.00 -0.90 -5.21 -1.32 -1.26 -4.99 115.64 102.87 2wr0 s THR 290 Ca 0.11 0.00 0.21 0.00 -1.21 0.00 0.00 61.69 60.80 2wr0 s THR 290 Cb -0.19 -1.00 -0.23 0.00 -1.51 0.00 0.00 72.50 69.57 2wr0 s THR 290 CO -0.08 0.00 0.89 0.35 -2.21 0.00 0.00 174.62 173.57 2wr0 n THR 291 N 0.66 0.00 -1.62 5.08 -2.24 -1.26 -4.98 114.28 109.93 2wr0 n THR 291 Ca -0.16 -0.05 -0.38 0.00 -2.27 0.00 0.00 64.05 61.19 2wr0 n THR 291 Cb 0.58 0.85 0.05 0.00 -2.10 0.00 0.00 70.33 69.71 2wr0 n THR 291 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2wr0 n LEU 292 N -1.58 3.62 0.14 3.22 4.77 -1.26 -4.92 117.00 120.99 2wr0 n LEU 292 Ca 0.03 0.84 0.12 0.00 -0.03 0.00 0.00 56.01 56.98 2wr0 n LEU 292 Cb 0.36 -1.39 0.25 0.00 -2.33 0.00 0.00 43.42 40.30 2wr0 n LEU 292 CO 0.43 -1.75 0.70 1.55 -1.33 0.00 0.00 177.39 177.00 2wr0 h PRO 293 N 0.68 0.00 -4.70 3.23 0.14 -1.86 -3.42 132.00 126.07 2wr0 h PRO 293 Ca -0.48 0.00 -0.29 0.00 0.14 0.00 0.00 66.00 65.37 2wr0 h PRO 293 Cb 1.36 0.00 -0.21 0.00 0.14 0.00 0.00 31.00 32.29 2wr0 h PRO 293 CO 0.52 0.00 -0.74 -0.06 0.14 0.00 0.00 178.00 177.86 2wr0 s PHE 294 N -3.18 0.77 0.09 1.56 0.08 -1.23 -0.65 117.98 115.43 2wr0 s PHE 294 Ca 0.08 -0.52 -0.09 0.00 0.12 0.00 0.00 56.93 56.52 2wr0 s PHE 294 Cb 0.09 -0.45 -0.00 0.00 -0.57 0.00 0.00 43.02 42.09 2wr0 s PHE 294 CO 0.66 -0.06 0.20 -3.38 -0.10 0.00 0.00 175.22 172.53 2wr0 s HIS 295 N -1.52 0.16 -0.09 0.36 -3.43 -0.44 0.33 115.29 110.66 2wr0 s HIS 295 Ca -0.07 -0.59 0.16 0.00 -0.80 0.00 0.00 55.06 53.77 2wr0 s HIS 295 Cb -0.09 -0.05 0.35 0.00 -1.43 0.00 0.00 32.58 31.36 2wr0 s HIS 295 CO 0.00 -0.56 1.16 0.27 -2.00 0.00 0.00 174.74 173.62 2wr0 n ASN 296 N -0.07 1.27 -0.03 7.38 6.94 -1.10 -1.75 115.26 127.89 2wr0 n ASN 296 Ca -0.15 -2.79 -0.16 0.00 -0.02 0.00 0.00 54.58 51.47 2wr0 n ASN 296 Cb 0.62 -0.38 -0.13 0.00 -2.36 0.00 0.00 39.78 37.53 2wr0 n ASN 296 CO 0.00 0.00 0.00 0.40 -1.03 0.00 0.00 177.26 176.63 2wr0 h ILE 297 N 4.08 1.70 -1.60 1.53 2.04 -1.90 -3.48 117.51 119.88 2wr0 h ILE 297 Ca -0.09 -2.39 0.06 0.00 1.00 0.00 0.00 64.86 63.44 2wr0 h ILE 297 Cb 1.41 3.32 -0.26 0.00 -0.74 0.00 0.00 36.82 40.55 2wr0 h ILE 297 CO 0.04 0.64 0.45 -2.28 0.00 0.00 0.00 178.15 177.00 2wr0 s HIS 298 N -2.32 -0.47 0.31 1.37 5.04 -1.26 -5.04 115.29 112.92 2wr0 s HIS 298 Ca -0.17 1.14 0.05 0.00 -1.54 0.00 0.00 55.06 54.54 2wr0 s HIS 298 Cb -0.02 0.37 0.52 0.00 0.04 0.00 0.00 32.58 33.48 2wr0 s HIS 298 CO 0.73 -0.24 1.77 -1.35 -2.34 0.00 0.00 174.74 173.32 2wr0 h PRO 299 N 4.13 0.36 -4.13 2.88 0.11 -1.98 -3.39 132.00 129.98 2wr0 h PRO 299 Ca -0.28 -0.13 -0.77 0.00 0.11 0.00 0.00 66.00 64.94 2wr0 h PRO 299 Cb 1.18 -0.03 -0.23 0.00 0.11 0.00 0.00 31.00 32.03 2wr0 h PRO 299 CO 0.12 0.59 0.67 -0.51 -0.21 0.00 0.00 178.00 178.66 2wr0 s LEU 300 N -8.59 5.92 0.28 2.35 1.43 -1.26 -4.83 118.68 113.98 2wr0 s LEU 300 Ca -0.06 -3.05 0.08 0.00 -1.03 0.00 0.00 54.13 50.07 2wr0 s LEU 300 Cb 0.14 -2.29 -0.04 0.00 0.03 0.00 0.00 46.19 44.04 2wr0 s LEU 300 CO 0.77 -0.57 0.10 0.42 0.23 0.00 0.00 176.35 177.31 2wr0 s THR 301 N 0.29 3.72 -0.02 5.49 -4.23 -1.26 -4.11 115.64 115.53 2wr0 s THR 301 Ca 0.32 -1.68 0.01 0.00 -1.18 0.00 0.00 61.69 59.16 2wr0 s THR 301 Cb -0.07 -3.07 0.01 0.00 1.34 0.00 0.00 72.50 70.70 2wr0 s THR 301 CO -0.06 -0.33 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.01 2wr0 s ILE 302 N -2.28 0.45 -1.16 2.99 1.01 -0.08 -1.63 121.20 120.50 2wr0 s ILE 302 Ca 0.33 -0.18 0.00 0.00 0.00 0.00 0.00 60.65 60.81 2wr0 s ILE 302 Cb -0.06 -0.42 0.00 0.00 0.01 0.00 0.00 42.46 41.98 2wr0 s ILE 302 CO 0.22 0.16 0.00 0.61 0.00 0.00 0.00 174.94 175.93 2wr0 n GLY 303 N 3.37 0.61 3.36 6.18 0.00 -0.74 0.08 105.19 118.04 2wr0 n GLY 303 Ca -0.18 -2.16 -0.43 0.00 0.00 0.00 0.00 46.02 43.25 2wr0 n GLY 303 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wr0 s GLU 304 N -0.46 2.88 0.22 1.61 2.02 0.39 -0.63 118.70 124.72 2wr0 s GLU 304 Ca 0.00 -1.38 0.12 0.00 0.02 0.00 0.00 54.97 53.72 2wr0 s GLU 304 Cb 0.00 -4.04 -0.05 0.00 0.10 0.00 0.00 34.13 30.15 2wr0 s GLU 304 CO 0.00 -1.01 -0.22 0.00 0.02 0.00 0.00 175.26 174.05 2wr0 s PRO 306 N -2.93 0.92 0.13 0.00 0.02 -1.26 -4.83 135.00 127.05 2wr0 s PRO 306 Ca 0.24 1.29 -0.31 0.00 0.02 0.00 0.00 61.00 62.24 2wr0 s PRO 306 Cb -0.07 -1.73 -0.08 0.00 0.02 0.00 0.00 34.50 32.63 2wr0 s PRO 306 CO 0.11 -2.62 1.38 0.15 -0.33 0.00 0.00 177.00 175.70 2wr0 s LYS 307 N -4.69 4.33 0.17 5.54 -0.14 0.17 -4.66 119.74 120.46 2wr0 s LYS 307 Ca 0.66 2.09 -0.30 0.00 -1.36 0.00 0.00 55.97 57.05 2wr0 s LYS 307 Cb -0.22 -3.23 -0.07 0.00 -1.68 0.00 0.00 37.83 32.63 2wr0 s LYS 307 CO 0.59 -0.41 1.08 -0.47 -0.76 0.00 0.00 175.35 175.38 2wr0 s TYR 308 N 0.90 3.62 0.06 3.18 5.04 -1.26 -1.32 117.35 127.57 2wr0 s TYR 308 Ca 0.63 1.62 -0.01 0.00 -2.44 0.00 0.00 57.07 56.87 2wr0 s TYR 308 Cb -0.37 -3.25 -0.04 0.00 0.35 0.00 0.00 41.96 38.65 2wr0 s TYR 308 CO 0.32 -0.51 -0.03 0.14 -1.34 0.00 0.00 175.55 174.12 2wr0 s VAL 309 N -0.18 0.28 -0.99 3.14 -7.23 -0.72 -4.75 120.40 109.95 2wr0 s VAL 309 Ca 0.49 -1.83 -0.02 0.00 -1.81 0.00 0.00 61.98 58.82 2wr0 s VAL 309 Cb -0.29 -1.56 0.31 0.00 0.56 0.00 0.00 36.38 35.41 2wr0 s VAL 309 CO 0.34 -0.97 1.92 0.29 -0.31 0.00 0.00 175.10 176.38 2wr0 n LYS 310 N 0.08 4.67 -4.18 4.82 5.02 -1.26 -4.54 118.16 122.77 2wr0 n LYS 310 Ca -0.14 -4.28 -0.14 0.00 -2.02 0.00 0.00 58.31 51.74 2wr0 n LYS 310 Cb 0.61 -2.42 -0.11 0.00 -0.02 0.00 0.00 35.03 33.09 2wr0 n LYS 310 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2wr0 s SER 311 N -1.16 1.45 0.04 4.39 1.04 -1.26 -5.04 113.70 113.16 2wr0 s SER 311 Ca 0.43 -0.86 0.24 0.00 0.48 0.00 0.00 55.95 56.24 2wr0 s SER 311 Cb 0.26 0.02 0.29 0.00 0.10 0.00 0.00 66.02 66.68 2wr0 s SER 311 CO -0.20 -0.30 1.25 0.47 0.98 0.00 0.00 173.24 175.44 2wr0 n ASP 312 N 0.38 0.61 -3.56 7.02 10.43 -1.26 -4.79 116.55 125.38 2wr0 n ASP 312 Ca -0.15 -0.22 -0.00 0.00 2.57 0.00 0.00 54.79 56.99 2wr0 n ASP 312 Cb 0.58 0.44 -0.04 0.00 1.84 0.00 0.00 41.12 43.94 2wr0 n ASP 312 CO 0.00 0.00 0.00 -0.60 -1.07 0.00 0.00 177.20 175.53 2wr0 s ARG 313 N -3.09 0.47 -0.39 -1.24 3.52 -1.26 -5.08 118.95 111.88 2wr0 s ARG 313 Ca 0.08 1.15 0.01 0.00 -0.13 0.00 0.00 55.73 56.84 2wr0 s ARG 313 Cb 0.16 0.66 0.14 0.00 -1.56 0.00 0.00 34.95 34.35 2wr0 s ARG 313 CO 0.75 -0.16 0.22 -0.51 -0.81 0.00 0.00 175.30 174.79 2wr0 s LEU 314 N 2.64 1.68 -0.23 -0.88 1.43 -1.26 -5.03 118.68 117.03 2wr0 s LEU 314 Ca -0.05 -2.36 -0.06 0.00 -1.03 0.00 0.00 54.13 50.63 2wr0 s LEU 314 Cb -0.09 -0.66 -0.02 0.00 0.03 0.00 0.00 46.19 45.45 2wr0 s LEU 314 CO -0.18 -0.29 0.01 -0.69 0.23 0.00 0.00 176.35 175.43 2wr0 s VAL 315 N 0.78 3.85 -0.13 -1.59 1.01 -1.26 -0.34 120.40 122.72 2wr0 s VAL 315 Ca 0.18 -0.33 -0.20 0.00 0.00 0.00 0.00 61.98 61.63 2wr0 s VAL 315 Cb -0.24 -2.78 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 2wr0 s VAL 315 CO 0.01 0.38 0.57 -0.76 0.00 0.00 0.00 175.10 175.30 2wr0 s LEU 316 N 1.52 4.25 0.31 3.92 1.43 0.05 -4.71 118.68 125.45 2wr0 s LEU 316 Ca 0.06 0.90 -0.29 0.00 -1.03 0.00 0.00 54.13 53.77 2wr0 s LEU 316 Cb -0.15 -2.84 -0.11 0.00 0.03 0.00 0.00 46.19 43.13 2wr0 s LEU 316 CO 0.00 -0.10 1.52 0.00 0.23 0.00 0.00 176.35 178.00 2wr0 s ALA 317 N 1.02 3.66 0.02 4.21 0.00 -1.26 -0.56 121.76 128.86 2wr0 s ALA 317 Ca 0.29 1.52 -0.01 0.00 0.00 0.00 0.00 51.96 53.76 2wr0 s ALA 317 Cb -0.16 -3.61 -0.01 0.00 0.00 0.00 0.00 23.12 19.34 2wr0 s ALA 317 CO 0.12 -0.95 -0.03 0.25 0.00 0.00 0.00 175.76 175.16 2wr0 n THR 318 N 1.62 0.58 -0.18 0.00 -2.24 -0.94 -4.83 114.28 108.29 2wr0 n THR 318 Ca 0.05 0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.97 2wr0 n THR 318 Cb 0.39 -1.58 0.00 0.00 -2.10 0.00 0.00 70.33 67.04 2wr0 n THR 318 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wr0 n GLY 319 N 3.06 -2.77 3.86 3.38 0.00 -0.67 -4.94 105.19 107.11 2wr0 n GLY 319 Ca -0.03 -1.35 -0.23 0.00 0.00 0.00 0.00 46.02 44.41 2wr0 n GLY 319 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2wr0 s LEU 320 N 0.00 3.12 -0.15 0.99 2.34 -1.26 -4.76 118.68 118.96 2wr0 s LEU 320 Ca 0.00 -0.97 -0.36 0.00 0.06 0.00 0.00 54.13 52.86 2wr0 s LEU 320 Cb 0.00 -1.65 -0.13 0.00 -0.56 0.00 0.00 46.19 43.85 2wr0 s LEU 320 CO 0.00 -0.78 1.83 -1.14 -1.06 0.00 0.00 176.35 175.20 2wr0 n ARG 321 N -1.55 1.84 -2.60 1.48 0.63 -1.26 -0.96 116.66 114.22 2wr0 n ARG 321 Ca 0.01 0.67 -0.43 0.00 -0.92 0.00 0.00 57.85 57.18 2wr0 n ARG 321 Cb 0.63 -2.46 -0.02 0.00 0.45 0.00 0.00 32.46 31.06 2wr0 n ARG 321 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 2wr0 s ASN 322 N 3.82 6.85 -0.50 6.15 2.47 0.09 -4.78 114.94 129.05 2wr0 s ASN 322 Ca 0.94 0.98 0.08 0.00 0.42 0.00 0.00 52.86 55.28 2wr0 s ASN 322 Cb -0.82 -2.54 0.27 0.00 -1.45 0.00 0.00 41.25 36.71 2wr0 s ASN 322 CO 0.56 -0.97 0.68 0.52 -3.72 0.00 0.00 177.10 174.17 2wr0 n VAL 323 N 6.07 0.89 -1.78 -5.21 0.31 -1.26 -4.84 118.33 112.52 2wr0 n VAL 323 Ca 0.12 -4.70 -0.34 0.00 -0.01 0.00 0.00 64.34 59.41 2wr0 n VAL 323 Cb 0.47 -1.71 0.05 0.00 -0.91 0.00 0.00 33.84 31.75 2wr0 n VAL 323 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 2wr0 s PRO 324 N -2.08 2.70 0.36 5.55 0.02 -1.26 -0.72 135.00 139.58 2wr0 s PRO 324 Ca 0.39 1.62 0.08 0.00 0.02 0.00 0.00 61.00 63.12 2wr0 s PRO 324 Cb 0.20 -1.92 -0.07 0.00 0.02 0.00 0.00 34.50 32.73 2wr0 s PRO 324 CO -0.08 -1.37 -0.05 -0.65 -0.33 0.00 0.00 177.00 174.52 2wr0 s GLN 325 N -3.77 1.84 0.00 5.54 -0.21 -1.26 -4.82 119.66 116.97 2wr0 s GLN 325 Ca 0.72 -1.98 0.00 0.00 0.02 0.00 0.00 55.36 54.12 2wr0 s GLN 325 Cb -0.26 -1.62 0.00 0.00 1.00 0.00 0.00 33.01 32.14 2wr0 s GLN 325 CO 0.39 0.06 0.58 0.44 -2.12 0.00 0.00 175.29 174.65 2wr0 n ILE 326 N -0.83 0.60 0.00 1.08 -5.35 -1.26 -4.97 119.36 108.63 2wr0 n ILE 326 Ca -0.05 0.19 0.00 0.00 -0.27 0.00 0.00 62.75 62.62 2wr0 n ILE 326 Cb 0.65 -1.19 0.00 0.00 -1.74 0.00 0.00 39.64 37.36 2wr0 n ILE 326 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wr0 n GLY 330 N -1.08 4.12 0.32 3.28 0.00 -1.26 -5.16 105.19 105.41 2wr0 n GLY 330 Ca 0.00 -1.59 -0.03 0.00 0.00 0.00 0.00 46.02 44.40 2wr0 n GLY 330 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2wr0 h LEU 331 N 0.00 0.88 -0.51 0.99 5.85 -1.94 -2.43 115.31 118.15 2wr0 h LEU 331 Ca 0.00 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2wr0 h LEU 331 Cb 0.00 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.80 2wr0 h LEU 331 CO 0.00 0.78 -0.56 0.49 -0.34 0.00 0.00 178.44 178.81 2wr0 n PHE 332 N -4.31 0.00 -1.01 1.25 3.72 -1.26 -4.98 117.46 110.87 2wr0 n PHE 332 Ca 0.06 0.00 -0.00 0.00 -0.05 0.00 0.00 57.45 57.46 2wr0 n PHE 332 Cb 0.16 -0.06 -0.00 0.00 -0.94 0.00 0.00 39.48 38.64 2wr0 n PHE 332 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wr0 n GLY 333 N 1.43 0.40 0.03 1.37 0.00 -0.92 -4.91 105.19 102.60 2wr0 n GLY 333 Ca 0.08 -0.05 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 2wr0 n GLY 333 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wr0 h ALA 334 N 0.00 0.00 -2.73 4.61 0.00 -1.86 -0.54 119.26 118.75 2wr0 h ALA 334 Ca -0.01 -0.31 -0.53 0.00 0.00 0.00 0.00 54.91 54.07 2wr0 h ALA 334 Cb 0.26 0.19 0.06 0.00 0.00 0.00 0.00 17.79 18.31 2wr0 h ALA 334 CO 0.01 0.19 0.86 0.42 0.00 0.00 0.00 179.25 180.74 2wr0 s ILE 335 N -1.51 2.35 -1.06 0.00 1.01 -1.26 -0.09 121.20 120.64 2wr0 s ILE 335 Ca -0.06 0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.87 2wr0 s ILE 335 Cb 0.01 -3.18 0.00 0.00 0.01 0.00 0.00 42.46 39.30 2wr0 s ILE 335 CO 0.08 0.04 0.00 0.00 0.00 0.00 0.00 174.94 175.06 2wr0 n ALA 336 N 2.83 -0.51 -2.66 9.38 0.00 -1.22 -4.48 120.51 123.84 2wr0 n ALA 336 Ca 0.10 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2wr0 n ALA 336 Cb 0.38 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.51 2wr0 n ALA 336 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wr0 n GLY 337 N -0.52 2.80 0.11 0.00 0.00 0.88 -4.87 105.19 103.58 2wr0 n GLY 337 Ca -0.12 -0.22 0.11 0.00 0.00 0.00 0.00 46.02 45.79 2wr0 n GLY 337 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2wr0 n PHE 338 N 0.00 0.68 -3.59 1.61 1.16 -0.21 -3.22 117.46 113.90 2wr0 n PHE 338 Ca 0.00 0.26 -0.40 0.00 -1.87 0.00 0.00 57.45 55.44 2wr0 n PHE 338 Cb 0.00 -0.92 -0.07 0.00 -1.61 0.00 0.00 39.48 36.88 2wr0 n PHE 338 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 2wr0 s ILE 339 N -3.24 4.29 0.46 1.97 1.01 -0.95 -3.07 121.20 121.67 2wr0 s ILE 339 Ca 0.05 -2.56 0.17 0.00 0.00 0.00 0.00 60.65 58.31 2wr0 s ILE 339 Cb 0.10 -3.76 0.35 0.00 0.01 0.00 0.00 42.46 39.16 2wr0 s ILE 339 CO 0.39 -0.89 1.97 1.05 0.00 0.00 0.00 174.94 177.46 2wr0 h GLU 340 N 7.55 0.29 -3.77 2.79 4.11 -1.80 -3.24 114.58 120.50 2wr0 h GLU 340 Ca -0.03 -0.02 -0.10 0.00 0.07 0.00 0.00 59.36 59.28 2wr0 h GLU 340 Cb 1.00 -0.06 -0.09 0.00 0.50 0.00 0.00 28.75 30.10 2wr0 h GLU 340 CO 0.75 0.19 -0.15 0.20 0.07 0.00 0.00 179.01 180.07 2wr0 s GLY 341 N -3.86 0.75 0.70 1.06 0.00 -1.26 -4.23 107.32 100.47 2wr0 s GLY 341 Ca -0.07 -1.04 0.03 0.00 0.00 0.00 0.00 44.72 43.65 2wr0 s GLY 341 CO 0.75 -0.73 0.96 -0.32 0.00 0.00 0.00 173.10 173.75 2wr0 s GLY 342 N -3.06 1.72 -0.22 0.20 0.00 0.10 -4.74 107.32 101.32 2wr0 s GLY 342 Ca 0.25 -2.01 -0.00 0.00 0.00 0.00 0.00 44.72 42.95 2wr0 s GLY 342 CO 0.11 -1.42 -0.11 -0.98 0.00 0.00 0.00 173.10 170.70 2wr0 s TRP 343 N -3.03 2.97 0.35 1.90 0.51 0.85 -4.28 118.94 118.21 2wr0 s TRP 343 Ca 0.66 -1.60 0.05 0.00 -2.12 0.00 0.00 56.10 53.09 2wr0 s TRP 343 Cb -0.04 -2.00 0.65 0.00 -0.81 0.00 0.00 33.47 31.27 2wr0 s TRP 343 CO 0.43 -0.75 1.91 0.37 -0.51 0.00 0.00 176.95 178.40 2wr0 h GLN 344 N 7.97 0.54 -0.00 4.98 5.75 -1.88 -2.22 115.11 130.25 2wr0 h GLN 344 Ca -0.37 -0.10 0.00 0.00 -0.15 0.00 0.00 58.65 58.03 2wr0 h GLN 344 Cb 1.12 -0.09 0.00 0.00 1.07 0.00 0.00 27.48 29.58 2wr0 h GLN 344 CO 0.59 0.52 -0.01 0.41 -2.65 0.00 0.00 178.83 177.69 2wr0 n GLY 345 N -1.00 -1.44 3.38 2.39 0.00 -1.26 -4.55 105.19 102.70 2wr0 n GLY 345 Ca 0.02 -0.12 -0.45 0.00 0.00 0.00 0.00 46.02 45.47 2wr0 n GLY 345 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2wr0 s MET 346 N -2.89 3.31 0.05 1.61 -2.45 -1.19 -4.83 119.30 112.90 2wr0 s MET 346 Ca 0.18 -1.70 0.22 0.00 -1.25 0.00 0.00 55.69 53.14 2wr0 s MET 346 Cb 0.19 -4.46 -0.10 0.00 1.25 0.00 0.00 34.83 31.71 2wr0 s MET 346 CO 0.52 -1.54 0.85 1.33 1.05 0.00 0.00 175.02 177.23 2wr0 n VAL 347 N 5.15 0.19 1.02 10.11 0.24 -1.26 -4.43 118.33 129.35 2wr0 n VAL 347 Ca 0.04 -0.36 0.10 0.00 -2.04 0.00 0.00 64.34 62.08 2wr0 n VAL 347 Cb 0.45 0.10 0.32 0.00 -1.47 0.00 0.00 33.84 33.24 2wr0 n VAL 347 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2wr0 n ASP 348 N -2.15 2.01 -3.66 -1.34 5.75 -1.26 -4.94 116.55 110.95 2wr0 n ASP 348 Ca -0.00 -1.80 0.02 0.00 -0.01 0.00 0.00 54.79 53.00 2wr0 n ASP 348 Cb 0.49 -0.15 0.00 0.00 -1.03 0.00 0.00 41.12 40.43 2wr0 n ASP 348 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2wr0 s GLY 349 N -1.47 -0.35 0.05 6.12 0.00 -1.26 -4.78 107.32 105.62 2wr0 s GLY 349 Ca 0.32 0.55 0.00 0.00 0.00 0.00 0.00 44.72 45.60 2wr0 s GLY 349 CO 0.26 1.46 1.03 1.49 0.00 0.00 0.00 173.10 177.33 2wr0 h TRP 350 N 2.00 0.33 -3.90 1.90 6.55 -1.90 -3.41 115.95 117.52 2wr0 h TRP 350 Ca -0.29 -0.24 -0.24 0.00 0.95 0.00 0.00 58.89 59.07 2wr0 h TRP 350 Cb 1.20 -0.01 -0.18 0.00 -0.86 0.00 0.00 29.16 29.31 2wr0 h TRP 350 CO 0.59 1.23 -0.71 0.71 -1.05 0.00 0.00 178.44 179.21 2wr0 s TYR 351 N -2.65 0.77 0.00 0.49 2.02 -1.26 -0.56 117.35 116.16 2wr0 s TYR 351 Ca -0.05 -0.72 0.00 0.00 -0.37 0.00 0.00 57.07 55.93 2wr0 s TYR 351 Cb 0.08 -0.46 0.00 0.00 -0.40 0.00 0.00 41.96 41.18 2wr0 s TYR 351 CO 0.85 -0.13 0.00 0.41 -1.57 0.00 0.00 175.55 175.12 2wr0 n GLY 352 N 0.68 0.92 3.27 0.71 0.00 -0.47 -0.48 105.19 109.81 2wr0 n GLY 352 Ca -0.17 -0.64 -0.22 0.00 0.00 0.00 0.00 46.02 44.99 2wr0 n GLY 352 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wr0 s TYR 353 N -2.20 1.67 -0.08 1.61 2.02 0.95 -0.67 117.35 120.65 2wr0 s TYR 353 Ca 0.00 -0.44 0.05 0.00 -0.37 0.00 0.00 57.07 56.31 2wr0 s TYR 353 Cb 0.00 -0.91 -0.00 0.00 -0.40 0.00 0.00 41.96 40.65 2wr0 s TYR 353 CO 0.00 0.19 -0.24 -1.58 -1.57 0.00 0.00 175.55 172.36 2wr0 s HIS 354 N -1.35 2.44 0.01 2.71 5.65 0.15 -0.68 115.29 124.22 2wr0 s HIS 354 Ca 0.06 -0.91 0.06 0.00 0.25 0.00 0.00 55.06 54.53 2wr0 s HIS 354 Cb -0.09 -1.63 -0.02 0.00 -1.18 0.00 0.00 32.58 29.66 2wr0 s HIS 354 CO 0.04 -0.34 -0.20 -3.38 -0.65 0.00 0.00 174.74 170.21 2wr0 s HIS 355 N 0.18 1.74 -0.08 3.88 -0.00 0.28 0.19 115.29 121.49 2wr0 s HIS 355 Ca -0.13 -0.35 0.03 0.00 -0.00 0.00 0.00 55.06 54.61 2wr0 s HIS 355 Cb -0.16 -1.09 0.01 0.00 -0.00 0.00 0.00 32.58 31.34 2wr0 s HIS 355 CO 0.07 0.02 -0.16 -1.12 -0.00 0.00 0.00 174.74 173.55 2wr0 s SER 356 N -0.74 2.20 0.19 7.38 0.01 0.13 -4.06 113.70 118.82 2wr0 s SER 356 Ca 0.07 -0.38 -0.05 0.00 1.31 0.00 0.00 55.95 56.90 2wr0 s SER 356 Cb -0.08 -1.01 0.02 0.00 0.21 0.00 0.00 66.02 65.16 2wr0 s SER 356 CO 0.00 0.07 0.34 -0.46 0.41 0.00 0.00 173.24 173.60 2wr0 n ASN 357 N 3.77 -0.99 0.12 2.44 0.23 -0.98 -1.02 115.26 118.83 2wr0 n ASN 357 Ca -0.21 -1.83 0.17 0.00 -0.53 0.00 0.00 54.58 52.18 2wr0 n ASN 357 Cb 0.52 1.69 0.74 0.00 -2.08 0.00 0.00 39.78 40.64 2wr0 n ASN 357 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2wr0 h ASP 358 N 0.97 0.00 0.18 0.53 3.32 -2.00 -2.75 116.42 116.67 2wr0 h ASP 358 Ca -0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.89 2wr0 h ASP 358 Cb 0.60 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.15 2wr0 h ASP 358 CO 0.20 0.00 -0.38 0.00 -1.72 0.00 0.00 179.24 177.34 2wr0 n GLN 359 N -4.15 0.81 -0.74 3.56 6.02 -1.26 -5.06 117.38 116.56 2wr0 n GLN 359 Ca 0.05 -0.55 0.00 0.00 -0.01 0.00 0.00 57.00 56.49 2wr0 n GLN 359 Cb 0.42 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.20 2wr0 n GLN 359 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wr0 n GLY 360 N 1.39 0.70 0.00 1.08 0.00 -1.04 -5.10 105.19 102.22 2wr0 n GLY 360 Ca 0.10 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.38 2wr0 n GLY 360 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wr0 n SER 361 N 0.16 0.00 0.00 1.61 3.41 -1.26 -2.33 113.62 115.22 2wr0 n SER 361 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2wr0 n SER 361 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2wr0 n SER 361 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wr0 n GLY 362 N 0.00 0.00 3.76 5.00 0.00 -1.26 -5.01 105.19 107.68 2wr0 n GLY 362 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2wr0 n GLY 362 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wr0 s TYR 363 N 0.00 3.58 -0.13 1.61 2.02 -1.26 -0.56 117.35 122.61 2wr0 s TYR 363 Ca 0.00 0.90 -0.05 0.00 -0.37 0.00 0.00 57.07 57.55 2wr0 s TYR 363 Cb 0.00 -2.45 0.06 0.00 -0.40 0.00 0.00 41.96 39.17 2wr0 s TYR 363 CO 0.00 0.33 0.28 0.00 -1.57 0.00 0.00 175.55 174.60 2wr0 s ALA 364 N 0.04 -0.65 0.18 3.71 0.00 0.15 -4.99 121.76 120.20 2wr0 s ALA 364 Ca 0.24 1.05 -0.30 0.00 0.00 0.00 0.00 51.96 52.95 2wr0 s ALA 364 Cb -0.15 -0.92 -0.09 0.00 0.00 0.00 0.00 23.12 21.95 2wr0 s ALA 364 CO 0.11 -0.49 1.33 0.00 0.00 0.00 0.00 175.76 176.71 2wr0 s ALA 365 N 2.01 3.55 -0.39 0.00 0.00 -1.26 -0.04 121.76 125.62 2wr0 s ALA 365 Ca -0.03 1.12 -0.29 0.00 0.00 0.00 0.00 51.96 52.77 2wr0 s ALA 365 Cb -0.11 -3.50 0.01 0.00 0.00 0.00 0.00 23.12 19.52 2wr0 s ALA 365 CO -0.09 -0.57 1.36 0.34 0.00 0.00 0.00 175.76 176.80 2wr0 s ASP 366 N 0.51 6.44 0.22 0.00 2.15 0.36 -4.87 116.67 121.49 2wr0 s ASP 366 Ca 0.59 0.87 -0.03 0.00 0.43 0.00 0.00 52.55 54.41 2wr0 s ASP 366 Cb -0.37 -2.54 0.21 0.00 -0.30 0.00 0.00 42.92 39.92 2wr0 s ASP 366 CO 0.37 -1.34 1.62 0.11 -0.17 0.00 0.00 175.17 175.76 2wr0 h LYS 367 N 10.23 0.68 0.18 4.34 6.56 -1.92 -2.69 116.57 133.95 2wr0 h LYS 367 Ca -0.27 -0.30 -0.01 0.00 -1.06 0.00 0.00 60.65 59.02 2wr0 h LYS 367 Cb 1.10 -0.02 0.00 0.00 -0.57 0.00 0.00 32.23 32.74 2wr0 h LYS 367 CO 1.08 0.89 -0.09 1.49 -2.06 0.00 0.00 179.45 180.76 2wr0 h GLU 368 N 0.58 -0.24 0.00 3.15 4.81 -1.95 -2.20 114.58 118.74 2wr0 h GLU 368 Ca 0.07 0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.23 2wr0 h GLU 368 Cb 0.79 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.21 2wr0 h GLU 368 CO 0.07 0.05 -0.40 0.66 -0.73 0.00 0.00 179.01 178.65 2wr0 h SER 369 N -0.52 0.00 -0.09 1.04 4.64 -1.95 -2.10 113.55 114.57 2wr0 h SER 369 Ca -0.03 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.28 2wr0 h SER 369 Cb 0.40 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2wr0 h SER 369 CO 0.04 0.40 -0.02 0.74 -0.87 0.00 0.00 176.83 177.13 2wr0 h THR 370 N 0.00 1.29 -0.56 2.95 2.02 -1.48 -1.81 112.91 115.32 2wr0 h THR 370 Ca -0.00 -0.92 0.00 0.00 0.77 0.00 0.00 66.41 66.26 2wr0 h THR 370 Cb 1.10 1.72 -0.03 0.00 -1.74 0.00 0.00 68.15 69.21 2wr0 h THR 370 CO 0.05 0.26 0.36 -0.61 0.37 0.00 0.00 175.52 175.95 2wr0 h GLN 371 N -0.15 0.74 -0.22 6.66 5.75 -1.31 0.12 115.11 126.69 2wr0 h GLN 371 Ca 0.02 -0.05 0.06 0.00 -0.15 0.00 0.00 58.65 58.53 2wr0 h GLN 371 Cb 0.41 -0.16 -0.07 0.00 1.07 0.00 0.00 27.48 28.73 2wr0 h GLN 371 CO 0.01 0.50 -0.25 -0.22 -2.65 0.00 0.00 178.83 176.21 2wr0 h LYS 372 N 0.76 -0.26 -0.69 1.69 3.64 -1.36 -0.18 116.57 120.17 2wr0 h LYS 372 Ca 0.20 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.60 2wr0 h LYS 372 Cb -0.07 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 2wr0 h LYS 372 CO -0.04 -0.17 0.43 0.00 -2.27 0.00 0.00 179.45 177.39 2wr0 h ALA 373 N 0.73 0.87 0.16 5.00 0.00 -0.74 0.08 119.26 125.36 2wr0 h ALA 373 Ca 0.13 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 2wr0 h ALA 373 Cb 0.47 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2wr0 h ALA 373 CO -0.38 0.33 -0.08 0.27 0.00 0.00 0.00 179.25 179.40 2wr0 h PHE 374 N 0.93 -0.19 -0.70 0.00 -0.00 -0.33 -1.29 116.94 115.36 2wr0 h PHE 374 Ca 0.25 -0.00 0.05 0.00 -0.00 0.00 0.00 57.97 58.26 2wr0 h PHE 374 Cb -0.05 0.06 -0.05 0.00 -0.00 0.00 0.00 35.95 35.91 2wr0 h PHE 374 CO -0.02 -0.06 0.41 -0.44 -0.00 0.00 0.00 178.31 178.20 2wr0 h ASP 375 N -0.28 0.65 0.51 -0.68 3.32 -0.87 -1.11 116.42 117.96 2wr0 h ASP 375 Ca -0.02 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 2wr0 h ASP 375 Cb 0.22 -0.12 0.01 0.00 0.22 0.00 0.00 39.33 39.66 2wr0 h ASP 375 CO 0.04 0.43 -0.25 1.23 -1.72 0.00 0.00 179.24 178.97 2wr0 h GLY 376 N 0.78 -0.72 1.21 2.75 0.00 -0.78 -1.28 103.07 105.04 2wr0 h GLY 376 Ca 0.30 0.27 -0.01 0.00 0.00 0.00 0.00 47.33 47.88 2wr0 h GLY 376 CO -0.15 -0.26 0.44 -2.22 0.00 0.00 0.00 176.54 174.35 2wr0 h ILE 377 N -0.76 1.22 -0.96 2.60 1.08 -1.18 -0.67 117.51 118.84 2wr0 h ILE 377 Ca -0.07 -0.50 0.00 0.00 -0.39 0.00 0.00 64.86 63.90 2wr0 h ILE 377 Cb 0.56 0.16 -0.05 0.00 -3.07 0.00 0.00 36.82 34.42 2wr0 h ILE 377 CO 0.12 0.23 0.60 0.74 -0.69 0.00 0.00 178.15 179.15 2wr0 h THR 378 N 1.06 1.26 -0.29 -0.27 2.02 -1.09 -1.31 112.91 114.28 2wr0 h THR 378 Ca 0.27 -0.52 -0.15 0.00 0.77 0.00 0.00 66.41 66.78 2wr0 h THR 378 Cb -0.02 -0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 66.27 2wr0 h THR 378 CO -0.05 0.26 -0.41 0.78 0.37 0.00 0.00 175.52 176.47 2wr0 h ASN 379 N 1.31 0.75 0.15 4.18 2.35 -0.41 -1.84 115.58 122.07 2wr0 h ASN 379 Ca 0.35 -0.34 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 2wr0 h ASN 379 Cb -0.09 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.07 2wr0 h ASN 379 CO -0.07 1.07 -0.07 0.50 -1.65 0.00 0.00 177.43 177.21 2wr0 h LYS 380 N 0.57 -0.19 -0.48 0.81 3.64 -0.62 0.44 116.57 120.75 2wr0 h LYS 380 Ca 0.05 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.50 2wr0 h LYS 380 Cb 0.95 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.76 2wr0 h LYS 380 CO 0.09 0.04 0.18 0.28 -2.27 0.00 0.00 179.45 177.76 2wr0 h VAL 381 N -0.40 0.84 -0.52 2.00 2.07 -1.31 -1.89 116.25 117.04 2wr0 h VAL 381 Ca -0.02 -0.12 -0.05 0.00 0.82 0.00 0.00 66.70 67.33 2wr0 h VAL 381 Cb 0.32 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 2wr0 h VAL 381 CO 0.03 0.06 0.11 0.78 0.02 0.00 0.00 177.57 178.57 2wr0 h ASN 382 N 0.35 0.76 0.26 0.57 2.35 -1.07 -1.95 115.58 116.85 2wr0 h ASN 382 Ca 0.23 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2wr0 h ASN 382 Cb 0.23 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 2wr0 h ASN 382 CO -0.23 0.76 -0.31 0.28 -1.65 0.00 0.00 177.43 176.28 2wr0 h SER 383 N 0.78 -0.84 -0.05 5.81 0.02 0.34 0.40 113.55 120.01 2wr0 h SER 383 Ca 0.17 0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 61.20 2wr0 h SER 383 Cb 0.32 0.29 -0.00 0.00 0.14 0.00 0.00 62.40 63.15 2wr0 h SER 383 CO 0.00 -0.43 0.03 0.58 -1.14 0.00 0.00 176.83 175.87 2wr0 h VAL 384 N -0.62 1.03 0.03 2.27 2.07 -1.12 -2.80 116.25 117.11 2wr0 h VAL 384 Ca -0.00 -0.09 -0.33 0.00 0.82 0.00 0.00 66.70 67.09 2wr0 h VAL 384 Cb 0.58 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.26 2wr0 h VAL 384 CO -0.09 0.03 -1.85 -0.38 0.02 0.00 0.00 177.57 175.31 2wr0 n ILE 385 N -4.51 1.58 0.15 4.57 5.41 -0.75 -4.50 119.36 121.31 2wr0 n ILE 385 Ca -0.02 -0.30 0.00 0.00 1.00 0.00 0.00 62.75 63.43 2wr0 n ILE 385 Cb 0.10 -1.87 0.23 0.00 -0.71 0.00 0.00 39.64 37.38 2wr0 n ILE 385 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2wr0 h GLU 386 N -0.66 0.00 0.00 0.38 5.08 -0.23 -3.10 114.58 116.05 2wr0 h GLU 386 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 2wr0 h GLU 386 Cb 1.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.85 2wr0 h GLU 386 CO -0.18 0.54 0.00 1.63 -1.00 0.00 0.00 179.01 180.00 2wr0 n LYS 387 N -3.87 0.15 -2.08 2.33 4.76 -1.06 -4.71 118.16 113.68 2wr0 n LYS 387 Ca -0.01 0.27 -0.43 0.00 -2.87 0.00 0.00 58.31 55.27 2wr0 n LYS 387 Cb 0.55 -1.73 -0.03 0.00 -1.84 0.00 0.00 35.03 31.99 2wr0 n LYS 387 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 2wr0 s MET 388 N -3.15 3.46 -0.09 1.97 1.75 -1.17 -4.97 119.30 117.10 2wr0 s MET 388 Ca 0.08 1.38 -0.30 0.00 -1.25 0.00 0.00 55.69 55.60 2wr0 s MET 388 Cb 0.12 -4.14 -0.02 0.00 2.84 0.00 0.00 34.83 33.63 2wr0 s MET 388 CO 0.45 -1.71 1.14 1.21 -0.65 0.00 0.00 175.02 175.46 2wr0 s ASN 389 N 5.38 7.10 -0.22 1.11 2.47 -1.26 -5.02 114.94 124.50 2wr0 s ASN 389 Ca 0.75 1.69 -0.01 0.00 0.42 0.00 0.00 52.86 55.71 2wr0 s ASN 389 Cb -0.21 -2.55 0.06 0.00 -1.45 0.00 0.00 41.25 37.10 2wr0 s ASN 389 CO 0.33 -0.56 0.01 0.28 -3.72 0.00 0.00 177.10 173.44 2wr0 s THR 390 N 2.33 0.89 0.28 -5.21 -1.32 -1.26 -5.04 115.64 106.31 2wr0 s THR 390 Ca 0.53 -0.85 0.09 0.00 -1.21 0.00 0.00 61.69 60.25 2wr0 s THR 390 Cb -0.22 -1.34 -0.04 0.00 -1.51 0.00 0.00 72.50 69.39 2wr0 s THR 390 CO 0.19 -0.21 0.05 0.00 -2.21 0.00 0.00 174.62 172.44 2wr0 s GLN 391 N 1.68 2.38 0.20 7.08 -2.07 -1.26 -4.86 119.66 122.81 2wr0 s GLN 391 Ca -0.02 -1.41 -0.32 0.00 -1.82 0.00 0.00 55.36 51.79 2wr0 s GLN 391 Cb -0.18 -2.20 -0.12 0.00 -1.09 0.00 0.00 33.01 29.42 2wr0 s GLN 391 CO -0.09 0.31 1.71 0.12 -1.32 0.00 0.00 175.29 176.02 2wr0 s PHE 392 N -2.33 2.88 -0.01 9.60 5.36 -1.26 -4.45 117.98 127.78 2wr0 s PHE 392 Ca 0.33 0.36 -0.07 0.00 -0.96 0.00 0.00 56.93 56.59 2wr0 s PHE 392 Cb -0.06 -4.11 0.00 0.00 -0.34 0.00 0.00 43.02 38.52 2wr0 s PHE 392 CO 0.21 -4.22 0.13 -1.21 -1.46 0.00 0.00 175.22 168.67 2wr0 s GLU 393 N 1.28 0.43 -0.34 10.12 2.02 0.19 -4.97 118.70 127.44 2wr0 s GLU 393 Ca 0.74 -0.31 -0.01 0.00 0.02 0.00 0.00 54.97 55.41 2wr0 s GLU 393 Cb -0.49 0.18 0.08 0.00 0.10 0.00 0.00 34.13 34.01 2wr0 s GLU 393 CO 0.32 -0.10 0.08 0.00 0.02 0.00 0.00 175.26 175.58 2wr0 s ALA 394 N -1.17 2.94 0.03 5.21 0.00 -1.26 -1.79 121.76 125.71 2wr0 s ALA 394 Ca -0.13 -2.20 -0.27 0.00 0.00 0.00 0.00 51.96 49.36 2wr0 s ALA 394 Cb -0.07 -2.09 -0.17 0.00 0.00 0.00 0.00 23.12 20.80 2wr0 s ALA 394 CO 0.01 -1.54 1.32 0.28 0.00 0.00 0.00 175.76 175.83 2wr0 h VAL 395 N 6.48 0.48 -3.13 0.00 2.07 -1.63 -3.44 116.25 117.08 2wr0 h VAL 395 Ca -0.14 -0.37 -0.55 0.00 0.82 0.00 0.00 66.70 66.45 2wr0 h VAL 395 Cb 1.05 0.64 0.09 0.00 -1.52 0.00 0.00 31.29 31.54 2wr0 h VAL 395 CO 0.58 0.06 0.78 0.61 0.02 0.00 0.00 177.57 179.62 2wr0 n GLY 396 N -0.68 1.12 3.25 2.17 0.00 -1.26 -5.01 105.19 104.78 2wr0 n GLY 396 Ca -0.11 0.46 -0.18 0.00 0.00 0.00 0.00 46.02 46.19 2wr0 n GLY 396 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wr0 s LYS 397 N -0.63 1.05 -0.24 1.61 -0.14 -1.26 -4.54 119.74 115.59 2wr0 s LYS 397 Ca 0.64 -1.29 -0.08 0.00 -1.36 0.00 0.00 55.97 53.88 2wr0 s LYS 397 Cb -0.54 -0.89 -0.04 0.00 -1.68 0.00 0.00 37.83 34.68 2wr0 s LYS 397 CO 0.50 0.16 0.09 -1.21 -0.76 0.00 0.00 175.35 174.14 2wr0 s GLU 398 N -2.88 3.80 -0.02 1.68 0.41 -1.26 -5.08 118.70 115.34 2wr0 s GLU 398 Ca 0.11 -0.41 0.04 0.00 -0.41 0.00 0.00 54.97 54.29 2wr0 s GLU 398 Cb -0.04 -3.36 -0.00 0.00 -1.78 0.00 0.00 34.13 28.95 2wr0 s GLU 398 CO 0.03 -0.06 -0.13 -0.06 -0.49 0.00 0.00 175.26 174.55 2wr0 s PHE 399 N 1.31 1.24 1.00 1.61 0.08 -1.26 -4.94 117.98 117.02 2wr0 s PHE 399 Ca 0.05 -0.29 -0.14 0.00 0.12 0.00 0.00 56.93 56.68 2wr0 s PHE 399 Cb -0.15 -0.83 0.19 0.00 -0.57 0.00 0.00 43.02 41.66 2wr0 s PHE 399 CO 0.04 -0.08 1.13 -1.54 -0.10 0.00 0.00 175.22 174.67 2wr0 s SER 400 N -0.07 2.72 0.00 1.36 1.04 -1.26 -4.90 113.70 112.59 2wr0 s SER 400 Ca 0.01 0.93 0.14 0.00 0.48 0.00 0.00 55.95 57.51 2wr0 s SER 400 Cb -0.08 -1.45 0.61 0.00 0.10 0.00 0.00 66.02 65.20 2wr0 s SER 400 CO 0.00 -3.04 1.44 -0.46 0.98 0.00 0.00 173.24 172.16 2wr0 n ASN 401 N -4.08 0.00 -1.19 7.02 2.04 -1.26 -1.70 115.26 116.09 2wr0 n ASN 401 Ca 0.08 0.44 -0.01 0.00 -0.44 0.00 0.00 54.58 54.64 2wr0 n ASN 401 Cb 0.59 -0.47 0.23 0.00 -2.53 0.00 0.00 39.78 37.60 2wr0 n ASN 401 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 2wr0 n LEU 402 N -1.47 4.35 -2.44 -4.53 4.77 -1.26 -4.44 117.00 111.99 2wr0 n LEU 402 Ca 0.04 -3.45 -0.09 0.00 -0.03 0.00 0.00 56.01 52.48 2wr0 n LEU 402 Cb 0.15 -0.62 0.04 0.00 -2.33 0.00 0.00 43.42 40.66 2wr0 n LEU 402 CO 0.13 1.00 0.07 -0.62 -1.33 0.00 0.00 177.39 176.63 2wr0 n GLU 403 N -0.85 2.37 -0.12 3.23 1.02 -0.69 -4.87 120.64 120.74 2wr0 n GLU 403 Ca 0.31 -3.70 -0.09 0.00 -0.02 0.00 0.00 57.16 53.67 2wr0 n GLU 403 Cb 1.05 -1.80 0.06 0.00 -0.02 0.00 0.00 31.44 30.73 2wr0 n GLU 403 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2wr0 h ARG 404 N 2.36 0.86 -0.80 3.49 2.47 -1.78 -1.14 114.38 119.84 2wr0 h ARG 404 Ca 0.05 -0.34 0.00 0.00 -1.26 0.00 0.00 59.98 58.43 2wr0 h ARG 404 Cb 1.39 -0.04 -0.04 0.00 -1.65 0.00 0.00 29.97 29.62 2wr0 h ARG 404 CO 0.39 0.98 0.50 0.00 0.56 0.00 0.00 179.97 182.39 2wr0 h ARG 405 N 0.75 1.07 0.18 0.04 3.08 -1.96 0.13 114.38 117.66 2wr0 h ARG 405 Ca 0.11 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 2wr0 h ARG 405 Cb 0.73 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.55 2wr0 h ARG 405 CO 0.06 0.74 -0.09 1.25 -1.07 0.00 0.00 179.97 180.86 2wr0 h LEU 406 N 1.09 -0.20 -0.78 3.04 5.85 -1.89 0.15 115.31 122.56 2wr0 h LEU 406 Ca 0.29 -0.15 0.16 0.00 0.84 0.00 0.00 57.88 59.01 2wr0 h LEU 406 Cb -0.07 0.05 -0.10 0.00 0.37 0.00 0.00 40.66 40.91 2wr0 h LEU 406 CO -0.06 0.03 0.32 -0.08 -0.34 0.00 0.00 178.44 178.31 2wr0 h GLU 407 N -0.44 0.43 -0.52 1.25 4.81 -1.07 -0.77 114.58 118.27 2wr0 h GLU 407 Ca -0.02 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.08 2wr0 h GLU 407 Cb 0.34 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 2wr0 h GLU 407 CO 0.04 0.28 -0.06 -0.97 -0.73 0.00 0.00 179.01 177.58 2wr0 h ASN 408 N 0.44 0.90 -0.89 1.04 -1.24 -0.30 -0.03 115.58 115.50 2wr0 h ASN 408 Ca 0.44 -0.26 0.01 0.00 0.71 0.00 0.00 56.30 57.20 2wr0 h ASN 408 Cb 0.70 -0.24 -0.05 0.00 0.73 0.00 0.00 38.32 39.46 2wr0 h ASN 408 CO -0.43 0.99 0.59 0.25 -1.29 0.00 0.00 177.43 177.55 2wr0 h LEU 409 N 0.84 1.01 -0.27 0.34 5.85 0.10 0.51 115.31 123.69 2wr0 h LEU 409 Ca 0.15 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 2wr0 h LEU 409 Cb 0.57 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 2wr0 h LEU 409 CO 0.03 0.73 0.03 -1.13 -0.34 0.00 0.00 178.44 177.77 2wr0 h ASN 410 N 1.20 0.44 -0.49 1.25 -1.24 -0.55 -1.75 115.58 114.44 2wr0 h ASN 410 Ca 0.33 -0.27 0.02 0.00 0.71 0.00 0.00 56.30 57.09 2wr0 h ASN 410 Cb -0.12 -0.12 -0.03 0.00 0.73 0.00 0.00 38.32 38.79 2wr0 h ASN 410 CO -0.08 0.60 0.30 0.50 -1.29 0.00 0.00 177.43 177.46 2wr0 h LYS 411 N 0.26 0.58 -0.44 6.67 3.64 -0.76 -1.82 116.57 124.70 2wr0 h LYS 411 Ca 0.08 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.37 2wr0 h LYS 411 Cb 0.36 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 2wr0 h LYS 411 CO 0.01 0.38 0.06 -0.22 -2.27 0.00 0.00 179.45 177.41 2wr0 h LYS 412 N 0.60 0.68 0.01 1.90 3.64 -0.76 -0.20 116.57 122.43 2wr0 h LYS 412 Ca 0.19 -0.14 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2wr0 h LYS 412 Cb -0.00 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 2wr0 h LYS 412 CO -0.08 0.66 -0.01 1.98 -2.27 0.00 0.00 179.45 179.73 2wr0 h MET 413 N 0.65 -0.02 -0.42 1.90 4.05 -1.01 -0.45 114.93 119.63 2wr0 h MET 413 Ca 0.14 0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.53 2wr0 h MET 413 Cb 0.32 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 31.11 2wr0 h MET 413 CO 0.01 0.18 0.14 0.93 0.23 0.00 0.00 176.91 178.39 2wr0 h GLU 414 N -0.21 0.65 -0.96 0.39 4.39 -0.95 -1.49 114.58 116.41 2wr0 h GLU 414 Ca -0.00 -0.14 0.06 0.00 0.34 0.00 0.00 59.36 59.62 2wr0 h GLU 414 Cb 0.20 -0.10 -0.06 0.00 -0.10 0.00 0.00 28.75 28.69 2wr0 h GLU 414 CO 0.00 0.64 0.62 -0.44 -1.16 0.00 0.00 179.01 178.66 2wr0 h ASP 415 N 0.54 0.99 0.03 1.42 3.32 -1.08 0.12 116.42 121.76 2wr0 h ASP 415 Ca 0.14 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.22 2wr0 h ASP 415 Cb 0.25 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.56 2wr0 h ASP 415 CO -0.01 0.64 -0.23 1.23 -1.72 0.00 0.00 179.24 179.15 2wr0 h GLY 416 N 1.13 -0.35 2.00 2.75 0.00 -0.26 -0.83 103.07 107.50 2wr0 h GLY 416 Ca 0.41 0.27 -0.08 0.00 0.00 0.00 0.00 47.33 47.93 2wr0 h GLY 416 CO -0.17 -0.20 -0.39 0.74 0.00 0.00 0.00 176.54 176.53 2wr0 h PHE 417 N -0.37 0.00 0.15 5.60 0.04 -1.04 -2.20 116.94 119.12 2wr0 h PHE 417 Ca 0.05 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.82 2wr0 h PHE 417 Cb 0.44 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.59 2wr0 h PHE 417 CO -0.25 0.39 -0.07 1.25 -0.60 0.00 0.00 178.31 179.02 2wr0 h LEU 418 N 0.00 -0.17 -0.62 1.54 5.85 -0.52 -0.37 115.31 121.02 2wr0 h LEU 418 Ca -0.00 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 2wr0 h LEU 418 Cb 0.80 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.85 2wr0 h LEU 418 CO 0.05 -0.06 0.37 0.44 -0.34 0.00 0.00 178.44 178.90 2wr0 h ASP 419 N -0.27 0.75 0.38 1.25 3.32 -1.01 -0.68 116.42 120.16 2wr0 h ASP 419 Ca -0.02 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 56.94 2wr0 h ASP 419 Cb 0.22 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.58 2wr0 h ASP 419 CO 0.03 0.60 -0.18 0.58 -1.72 0.00 0.00 179.24 178.55 2wr0 h VAL 420 N 0.84 0.63 -0.66 -1.35 2.07 -1.29 -1.65 116.25 114.84 2wr0 h VAL 420 Ca 0.22 -0.17 -0.06 0.00 0.82 0.00 0.00 66.70 67.52 2wr0 h VAL 420 Cb -0.01 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 2wr0 h VAL 420 CO -0.04 0.03 0.19 -0.50 0.02 0.00 0.00 177.57 177.27 2wr0 h TRP 421 N -0.60 1.06 0.20 1.57 4.06 -1.02 -0.48 115.95 120.72 2wr0 h TRP 421 Ca -0.05 -0.10 -0.01 0.00 2.06 0.00 0.00 58.89 60.78 2wr0 h TRP 421 Cb 0.45 -0.31 0.00 0.00 -1.00 0.00 0.00 29.16 28.30 2wr0 h TRP 421 CO -0.03 0.85 -0.09 1.15 -3.56 0.00 0.00 178.44 176.76 2wr0 h THR 422 N 0.98 0.90 -0.18 1.49 2.02 -1.13 -0.58 112.91 116.41 2wr0 h THR 422 Ca 0.21 -0.74 0.04 0.00 0.77 0.00 0.00 66.41 66.70 2wr0 h THR 422 Cb 0.31 1.32 -0.05 0.00 -1.74 0.00 0.00 68.15 67.99 2wr0 h THR 422 CO -0.00 0.16 -0.10 0.22 0.37 0.00 0.00 175.52 176.17 2wr0 h TYR 423 N -0.65 -0.24 -0.56 3.16 3.20 -1.24 -0.91 116.97 119.74 2wr0 h TYR 423 Ca -0.03 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.80 2wr0 h TYR 423 Cb 0.47 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.85 2wr0 h TYR 423 CO 0.04 -0.15 0.08 -0.91 -1.64 0.00 0.00 178.16 175.58 2wr0 h ASN 424 N -0.09 0.86 -0.08 -2.11 4.21 -1.10 -1.16 115.58 116.12 2wr0 h ASN 424 Ca 0.10 -0.19 -0.02 0.00 1.21 0.00 0.00 56.30 57.41 2wr0 h ASN 424 Cb 0.24 -0.23 -0.00 0.00 -1.12 0.00 0.00 38.32 37.21 2wr0 h ASN 424 CO -0.24 0.87 -0.03 0.00 -1.29 0.00 0.00 177.43 176.74 2wr0 h ALA 425 N 1.23 0.11 -0.58 -0.83 0.00 -0.85 0.23 119.26 118.56 2wr0 h ALA 425 Ca 0.17 -0.23 0.09 0.00 0.00 0.00 0.00 54.91 54.94 2wr0 h ALA 425 Cb 0.39 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 2wr0 h ALA 425 CO 0.01 -0.15 0.21 0.93 0.00 0.00 0.00 179.25 180.26 2wr0 h GLU 426 N -0.21 0.38 -0.19 0.00 4.39 -1.06 -2.00 114.58 115.89 2wr0 h GLU 426 Ca 0.02 -0.02 -0.20 0.00 0.34 0.00 0.00 59.36 59.50 2wr0 h GLU 426 Cb 0.47 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 2wr0 h GLU 426 CO 0.01 0.25 -0.67 -0.07 -1.16 0.00 0.00 179.01 177.37 2wr0 h LEU 427 N 0.39 0.84 -0.24 1.33 3.38 -1.15 -2.44 115.31 117.41 2wr0 h LEU 427 Ca 0.29 -0.50 0.05 0.00 0.09 0.00 0.00 57.88 57.81 2wr0 h LEU 427 Cb 0.35 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 2wr0 h LEU 427 CO -0.30 1.28 -0.11 0.25 0.09 0.00 0.00 178.44 179.66 2wr0 h LEU 428 N 0.52 -0.36 -0.01 1.67 5.85 -0.71 -0.36 115.31 121.91 2wr0 h LEU 428 Ca -0.02 0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 2wr0 h LEU 428 Cb 1.27 0.20 -0.00 0.00 0.37 0.00 0.00 40.66 42.51 2wr0 h LEU 428 CO 0.14 -0.14 0.01 0.58 -0.34 0.00 0.00 178.44 178.68 2wr0 h VAL 429 N -0.07 1.06 -1.01 1.05 2.07 -1.35 0.27 116.25 118.28 2wr0 h VAL 429 Ca 0.13 -0.17 0.13 0.00 0.82 0.00 0.00 66.70 67.60 2wr0 h VAL 429 Cb 0.26 1.16 -0.09 0.00 -1.52 0.00 0.00 31.29 31.10 2wr0 h VAL 429 CO -0.29 0.05 0.63 -0.07 0.02 0.00 0.00 177.57 177.91 2wr0 h LEU 430 N -0.06 0.91 0.10 2.57 3.38 -1.21 0.06 115.31 121.06 2wr0 h LEU 430 Ca 0.00 0.06 -0.30 0.00 0.09 0.00 0.00 57.88 57.73 2wr0 h LEU 430 Cb 0.07 -0.12 0.03 0.00 0.09 0.00 0.00 40.66 40.72 2wr0 h LEU 430 CO -0.00 0.46 -1.23 0.24 0.09 0.00 0.00 178.44 178.00 2wr0 h MET 431 N 0.96 0.63 -0.29 1.13 2.86 -0.44 -2.16 114.93 117.62 2wr0 h MET 431 Ca 0.51 -0.82 -0.13 0.00 -2.06 0.00 0.00 59.70 57.20 2wr0 h MET 431 Cb 0.55 0.27 -0.01 0.00 0.06 0.00 0.00 31.60 32.47 2wr0 h MET 431 CO -0.28 1.37 -0.35 0.93 1.06 0.00 0.00 176.91 179.64 2wr0 h GLU 432 N 0.29 0.65 -0.55 1.72 4.39 -0.22 -2.39 114.58 118.47 2wr0 h GLU 432 Ca -0.18 -0.31 -0.11 0.00 0.34 0.00 0.00 59.36 59.11 2wr0 h GLU 432 Cb 1.90 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 30.52 2wr0 h GLU 432 CO 0.23 0.90 -0.07 -0.91 -1.16 0.00 0.00 179.01 178.00 2wr0 h ASN 433 N 0.55 0.99 -0.51 1.42 2.35 -1.04 0.28 115.58 119.62 2wr0 h ASN 433 Ca 0.06 -0.31 0.06 0.00 -0.55 0.00 0.00 56.30 55.56 2wr0 h ASN 433 Cb 0.85 -0.27 -0.05 0.00 0.05 0.00 0.00 38.32 38.90 2wr0 h ASN 433 CO 0.07 1.08 0.21 -0.08 -1.65 0.00 0.00 177.43 177.06 2wr0 h GLU 434 N 0.90 0.39 0.00 0.81 4.57 -1.32 -2.28 114.58 117.65 2wr0 h GLU 434 Ca 0.15 -0.02 -0.13 0.00 -1.18 0.00 0.00 59.36 58.18 2wr0 h GLU 434 Cb 0.62 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.11 2wr0 h GLU 434 CO 0.04 0.26 -0.61 0.00 -1.18 0.00 0.00 179.01 177.52 2wr0 h ARG 435 N 0.40 0.00 -0.18 1.92 3.08 -1.03 -2.88 114.38 115.69 2wr0 h ARG 435 Ca 0.24 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.24 2wr0 h ARG 435 Cb 0.23 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 2wr0 h ARG 435 CO -0.22 0.61 -0.07 1.15 -1.07 0.00 0.00 179.97 180.36 2wr0 h THR 436 N 0.00 1.30 -0.70 2.04 2.02 -0.74 0.01 112.91 116.84 2wr0 h THR 436 Ca -0.01 -1.09 0.07 0.00 0.77 0.00 0.00 66.41 66.15 2wr0 h THR 436 Cb 1.38 1.64 -0.06 0.00 -1.74 0.00 0.00 68.15 69.37 2wr0 h THR 436 CO 0.08 0.33 0.38 -0.07 0.37 0.00 0.00 175.52 176.61 2wr0 h LEU 437 N 0.07 0.55 -0.93 2.58 4.07 -1.44 -1.92 115.31 118.29 2wr0 h LEU 437 Ca 0.04 0.04 -0.11 0.00 0.08 0.00 0.00 57.88 57.93 2wr0 h LEU 437 Cb 0.54 -0.07 -0.02 0.00 1.08 0.00 0.00 40.66 42.19 2wr0 h LEU 437 CO 0.02 0.34 -0.53 0.44 -1.08 0.00 0.00 178.44 177.64 2wr0 h ASP 438 N 0.69 0.00 -0.14 -0.43 3.32 -1.33 -1.24 116.42 117.28 2wr0 h ASP 438 Ca 0.32 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.36 2wr0 h ASP 438 Cb 0.25 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 2wr0 h ASP 438 CO -0.21 0.53 0.03 0.15 -1.72 0.00 0.00 179.24 178.02 2wr0 h PHE 439 N 0.00 0.24 -0.57 4.55 3.57 -0.58 0.78 116.94 124.93 2wr0 h PHE 439 Ca -0.01 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.46 2wr0 h PHE 439 Cb 0.95 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.59 2wr0 h PHE 439 CO 0.00 0.39 0.35 0.45 -2.23 0.00 0.00 178.31 177.27 2wr0 h HIS 440 N 0.02 0.75 -0.17 0.41 3.86 -1.15 0.32 115.15 119.19 2wr0 h HIS 440 Ca 0.04 -0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.28 2wr0 h HIS 440 Cb 0.28 -0.25 -0.03 0.00 1.06 0.00 0.00 27.41 28.47 2wr0 h HIS 440 CO 0.01 0.51 0.00 0.22 0.86 0.00 0.00 177.93 179.53 2wr0 h ASP 441 N 0.77 -0.06 -0.59 2.45 3.58 -1.04 -1.87 116.42 119.66 2wr0 h ASP 441 Ca 0.21 0.04 0.03 0.00 0.42 0.00 0.00 57.03 57.72 2wr0 h ASP 441 Cb -0.02 0.06 -0.04 0.00 1.72 0.00 0.00 39.33 41.05 2wr0 h ASP 441 CO -0.04 -0.01 0.36 -1.28 -2.88 0.00 0.00 179.24 175.40 2wr0 h SER 442 N 0.06 0.59 -0.86 2.28 0.87 -0.50 -0.75 113.55 115.24 2wr0 h SER 442 Ca 0.08 0.00 0.07 0.00 -1.23 0.00 0.00 61.79 60.71 2wr0 h SER 442 Cb 0.09 -0.13 -0.06 0.00 -0.44 0.00 0.00 62.40 61.86 2wr0 h SER 442 CO -0.13 0.42 0.53 0.78 -0.53 0.00 0.00 176.83 177.89 2wr0 h ASN 443 N 0.72 0.82 -0.20 6.23 2.35 -0.35 0.33 115.58 125.47 2wr0 h ASN 443 Ca 0.24 0.02 -0.09 0.00 -0.55 0.00 0.00 56.30 55.92 2wr0 h ASN 443 Cb 0.01 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.23 2wr0 h ASN 443 CO -0.10 0.51 -0.23 0.58 -1.65 0.00 0.00 177.43 176.55 2wr0 h VAL 444 N 0.95 1.33 -0.40 2.81 2.07 -1.00 -1.46 116.25 120.55 2wr0 h VAL 444 Ca 0.38 -1.41 0.03 0.00 0.82 0.00 0.00 66.70 66.52 2wr0 h VAL 444 Cb 0.21 1.78 -0.03 0.00 -1.52 0.00 0.00 31.29 31.73 2wr0 h VAL 444 CO -0.19 0.43 0.21 0.50 0.02 0.00 0.00 177.57 178.54 2wr0 h LYS 445 N 0.18 0.41 -0.76 1.57 1.63 -0.52 -0.87 116.57 118.20 2wr0 h LYS 445 Ca 0.03 -0.02 -0.03 0.00 -0.85 0.00 0.00 60.65 59.77 2wr0 h LYS 445 Cb 0.79 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 32.29 2wr0 h LYS 445 CO 0.06 0.27 0.34 -0.91 -3.45 0.00 0.00 179.45 175.76 2wr0 h ASN 446 N 0.43 1.01 -0.51 4.20 2.35 -0.35 -1.02 115.58 121.70 2wr0 h ASN 446 Ca 0.17 -0.13 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 2wr0 h ASN 446 Cb 0.06 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.15 2wr0 h ASN 446 CO -0.11 0.87 0.27 0.25 -1.65 0.00 0.00 177.43 177.07 2wr0 h LEU 447 N 1.10 0.64 -0.56 1.61 5.85 -0.76 0.16 115.31 123.34 2wr0 h LEU 447 Ca 0.26 -0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.83 2wr0 h LEU 447 Cb 0.15 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 2wr0 h LEU 447 CO -0.03 0.55 0.15 0.22 -0.34 0.00 0.00 178.44 179.00 2wr0 h TYR 448 N 0.68 0.92 -0.19 1.25 3.20 -0.96 -2.57 116.97 119.29 2wr0 h TYR 448 Ca 0.18 -0.10 -0.08 0.00 3.14 0.00 0.00 58.73 61.87 2wr0 h TYR 448 Cb 0.06 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.06 2wr0 h TYR 448 CO -0.01 0.79 -0.22 -0.44 -1.64 0.00 0.00 178.16 176.63 2wr0 h ASP 449 N 0.79 0.34 -0.41 -2.11 3.32 -0.89 -1.29 116.42 116.17 2wr0 h ASP 449 Ca 0.18 -0.10 0.01 0.00 0.02 0.00 0.00 57.03 57.14 2wr0 h ASP 449 Cb 0.31 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 2wr0 h ASP 449 CO -0.00 0.57 0.26 0.50 -1.72 0.00 0.00 179.24 178.85 2wr0 h LYS 450 N 0.31 0.51 -0.01 3.56 3.64 -0.31 0.44 116.57 124.71 2wr0 h LYS 450 Ca 0.05 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2wr0 h LYS 450 Cb 0.57 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.28 2wr0 h LYS 450 CO 0.04 0.33 0.00 0.28 -2.27 0.00 0.00 179.45 177.83 2wr0 h VAL 451 N 0.52 1.24 -0.50 2.00 2.07 -1.31 -2.90 116.25 117.37 2wr0 h VAL 451 Ca 0.16 -0.70 0.08 0.00 0.82 0.00 0.00 66.70 67.06 2wr0 h VAL 451 Cb -0.02 1.69 -0.07 0.00 -1.52 0.00 0.00 31.29 31.37 2wr0 h VAL 451 CO -0.06 0.18 0.12 -0.09 0.02 0.00 0.00 177.57 177.75 2wr0 h ARG 452 N -0.27 0.26 0.00 1.57 2.43 -0.94 0.10 114.38 117.53 2wr0 h ARG 452 Ca 0.00 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.09 2wr0 h ARG 452 Cb 0.30 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 2wr0 h ARG 452 CO 0.00 0.17 -0.31 0.52 -1.51 0.00 0.00 179.97 178.84 2wr0 h MET 453 N 0.27 0.00 0.05 0.20 2.86 -0.95 0.27 114.93 117.63 2wr0 h MET 453 Ca 0.25 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.88 2wr0 h MET 453 Cb 0.31 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.98 2wr0 h MET 453 CO -0.30 0.31 -0.02 1.96 1.06 0.00 0.00 176.91 179.91 2wr0 h GLN 454 N 0.00 -0.06 -0.08 1.72 4.20 -1.13 -3.35 115.11 116.40 2wr0 h GLN 454 Ca -0.00 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.59 2wr0 h GLN 454 Cb 0.69 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.47 2wr0 h GLN 454 CO 0.04 0.52 -0.51 -0.07 -0.67 0.00 0.00 178.83 178.14 2wr0 h LEU 455 N -0.71 0.24 0.00 1.46 3.38 -0.73 -3.44 115.31 115.51 2wr0 h LEU 455 Ca -0.01 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2wr0 h LEU 455 Cb 0.61 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2wr0 h LEU 455 CO 0.01 0.71 0.00 0.54 0.09 0.00 0.00 178.44 179.79 2wr0 n ARG 456 N -3.95 0.00 -0.15 1.13 1.74 0.06 -0.95 116.66 114.55 2wr0 n ARG 456 Ca -0.02 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.16 2wr0 n ARG 456 Cb 0.55 0.00 0.29 0.00 -1.02 0.00 0.00 32.46 32.27 2wr0 n ARG 456 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2wr0 n ASP 457 N 3.11 2.27 0.00 0.55 3.85 -1.26 -3.50 116.55 121.57 2wr0 n ASP 457 Ca 0.00 -1.86 0.10 0.00 -0.71 0.00 0.00 54.79 52.32 2wr0 n ASP 457 Cb 0.00 -0.19 0.53 0.00 -1.35 0.00 0.00 41.12 40.11 2wr0 n ASP 457 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 2wr0 n ASN 458 N 0.72 0.00 -3.92 -1.12 3.02 -0.12 -4.80 115.26 109.04 2wr0 n ASN 458 Ca 0.16 -0.31 -0.09 0.00 -0.03 0.00 0.00 54.58 54.31 2wr0 n ASN 458 Cb 0.40 -0.14 -0.07 0.00 -0.61 0.00 0.00 39.78 39.36 2wr0 n ASN 458 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2wr0 s VAL 459 N -2.28 0.10 -0.11 2.41 -7.23 -1.23 -0.98 120.40 111.09 2wr0 s VAL 459 Ca 0.24 -1.31 -0.01 0.00 -1.81 0.00 0.00 61.98 59.09 2wr0 s VAL 459 Cb 0.13 -1.62 -0.03 0.00 0.56 0.00 0.00 36.38 35.43 2wr0 s VAL 459 CO 0.26 -0.46 -0.06 -0.75 -0.31 0.00 0.00 175.10 173.78 2wr0 s LYS 460 N -3.92 3.19 -0.29 4.82 2.20 0.14 -4.87 119.74 121.01 2wr0 s LYS 460 Ca 0.12 -0.54 -0.29 0.00 -0.36 0.00 0.00 55.97 54.90 2wr0 s LYS 460 Cb 0.04 -2.74 0.01 0.00 -1.51 0.00 0.00 37.83 33.63 2wr0 s LYS 460 CO -0.05 0.46 1.19 -1.21 -0.36 0.00 0.00 175.35 175.38 2wr0 s GLU 461 N -0.25 4.03 0.13 4.03 2.02 -1.26 -1.57 118.70 125.83 2wr0 s GLU 461 Ca 0.04 1.22 0.23 0.00 0.02 0.00 0.00 54.97 56.47 2wr0 s GLU 461 Cb -0.13 -3.80 -0.04 0.00 0.10 0.00 0.00 34.13 30.26 2wr0 s GLU 461 CO 0.02 -0.97 0.94 -0.11 0.02 0.00 0.00 175.26 175.17 2wr0 n LEU 462 N 7.14 0.64 0.00 1.80 7.94 -0.40 -5.00 117.00 129.13 2wr0 n LEU 462 Ca 0.13 0.21 0.00 0.00 -1.11 0.00 0.00 56.01 55.25 2wr0 n LEU 462 Cb 0.47 -0.06 0.00 0.00 0.53 0.00 0.00 43.42 44.36 2wr0 n LEU 462 CO 0.60 -0.11 0.00 0.61 -1.11 0.00 0.00 177.39 177.38 2wr0 n GLY 463 N 1.23 1.23 0.00 -3.96 0.00 -1.26 -4.94 105.19 97.50 2wr0 n GLY 463 Ca -0.00 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 43.87 2wr0 n GLY 463 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2wr0 n ASN 464 N 0.00 0.00 0.00 1.61 2.04 -1.17 -0.78 115.26 116.95 2wr0 n ASN 464 Ca 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.14 2wr0 n ASN 464 Cb 0.00 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.25 2wr0 n ASN 464 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 2wr0 n GLY 465 N 0.00 0.79 3.73 4.83 0.00 -1.25 -4.79 105.19 108.50 2wr0 n GLY 465 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2wr0 n GLY 465 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wr0 s PHE 467 N -1.12 2.46 -0.22 0.00 0.08 0.19 -1.28 117.98 118.09 2wr0 s PHE 467 Ca 0.21 -0.66 -0.05 0.00 0.12 0.00 0.00 56.93 56.54 2wr0 s PHE 467 Cb -0.12 -1.60 -0.02 0.00 -0.57 0.00 0.00 43.02 40.71 2wr0 s PHE 467 CO 0.11 -0.18 -0.00 -2.00 -0.10 0.00 0.00 175.22 173.05 2wr0 s GLU 468 N -0.22 3.54 0.40 0.44 2.12 -0.61 -1.90 118.70 122.48 2wr0 s GLU 468 Ca -0.02 -0.55 -0.24 0.00 0.36 0.00 0.00 54.97 54.52 2wr0 s GLU 468 Cb -0.13 -3.10 -0.09 0.00 0.26 0.00 0.00 34.13 31.07 2wr0 s GLU 468 CO 0.03 -0.10 1.08 -0.06 -0.54 0.00 0.00 175.26 175.68 2wr0 s PHE 469 N 1.28 3.21 -0.94 5.30 0.08 -0.66 -0.68 117.98 125.56 2wr0 s PHE 469 Ca 0.04 1.62 0.11 0.00 0.12 0.00 0.00 56.93 58.82 2wr0 s PHE 469 Cb -0.15 -3.20 0.51 0.00 -0.57 0.00 0.00 43.02 39.62 2wr0 s PHE 469 CO 0.01 -0.83 1.34 0.66 -0.10 0.00 0.00 175.22 176.30 2wr0 n TYR 470 N -0.05 1.17 -3.57 0.36 4.01 -0.15 -4.82 117.16 114.10 2wr0 n TYR 470 Ca 0.05 -0.43 -0.11 0.00 -0.16 0.00 0.00 57.90 57.25 2wr0 n TYR 470 Cb 0.49 -0.27 -0.03 0.00 -0.31 0.00 0.00 39.34 39.22 2wr0 n TYR 470 CO 0.00 0.00 0.00 -3.38 -0.46 0.00 0.00 176.86 173.02 2wr0 s HIS 471 N -1.93 -0.32 0.05 -0.72 -3.43 -1.26 -4.52 115.29 103.16 2wr0 s HIS 471 Ca 0.35 0.04 -0.31 0.00 -0.80 0.00 0.00 55.06 54.34 2wr0 s HIS 471 Cb 0.24 0.42 -0.07 0.00 -1.43 0.00 0.00 32.58 31.74 2wr0 s HIS 471 CO 0.14 -0.82 1.46 0.15 -2.00 0.00 0.00 174.74 173.67 2wr0 s LYS 472 N -3.80 4.27 -0.46 -0.38 -0.14 -1.26 -4.93 119.74 113.04 2wr0 s LYS 472 Ca 0.04 2.08 0.03 0.00 -1.36 0.00 0.00 55.97 56.76 2wr0 s LYS 472 Cb -0.00 -3.48 0.13 0.00 -1.68 0.00 0.00 37.83 32.80 2wr0 s LYS 472 CO -0.10 -0.57 0.24 0.00 -0.76 0.00 0.00 175.35 174.16 2wr0 s ASP 474 N 0.15 1.97 0.46 0.00 1.47 -1.26 -4.53 116.67 114.94 2wr0 s ASP 474 Ca 0.17 0.54 0.22 0.00 1.18 0.00 0.00 52.55 54.66 2wr0 s ASP 474 Cb -0.25 -0.74 1.23 0.00 -0.34 0.00 0.00 42.92 42.82 2wr0 s ASP 474 CO -0.00 -3.46 1.89 0.44 0.68 0.00 0.00 175.17 174.71 2wr0 h ASP 475 N -2.13 0.25 -0.11 2.11 3.32 -1.99 0.19 116.42 118.06 2wr0 h ASP 475 Ca -0.45 0.02 -0.19 0.00 0.02 0.00 0.00 57.03 56.43 2wr0 h ASP 475 Cb 1.28 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.80 2wr0 h ASP 475 CO 0.38 0.10 -0.62 -0.08 -1.72 0.00 0.00 179.24 177.31 2wr0 h GLU 476 N 0.25 0.72 -0.17 3.56 4.57 -1.99 -1.15 114.58 120.37 2wr0 h GLU 476 Ca 0.42 -0.50 -0.01 0.00 -1.18 0.00 0.00 59.36 58.10 2wr0 h GLU 476 Cb 1.27 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.93 2wr0 h GLU 476 CO -0.11 1.12 0.08 0.00 -1.18 0.00 0.00 179.01 178.92 2wr0 h MET 478 N 0.14 0.42 -0.15 0.00 2.86 -1.05 -1.90 114.93 115.25 2wr0 h MET 478 Ca 0.06 -0.03 0.04 0.00 -2.06 0.00 0.00 59.70 57.72 2wr0 h MET 478 Cb 0.13 -0.09 -0.05 0.00 0.06 0.00 0.00 31.60 31.64 2wr0 h MET 478 CO -0.01 0.28 -0.15 -0.91 1.06 0.00 0.00 176.91 177.18 2wr0 h ASN 479 N 0.43 -0.47 -0.14 1.22 2.35 -0.99 0.16 115.58 118.14 2wr0 h ASN 479 Ca 0.31 0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 56.15 2wr0 h ASN 479 Cb 0.38 0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 2wr0 h ASN 479 CO -0.30 -0.19 0.09 0.77 -1.65 0.00 0.00 177.43 176.14 2wr0 h SER 480 N -0.18 0.17 -0.10 5.81 4.64 -0.85 0.28 113.55 123.32 2wr0 h SER 480 Ca 0.10 -0.01 -0.06 0.00 -0.47 0.00 0.00 61.79 61.36 2wr0 h SER 480 Cb 0.32 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2wr0 h SER 480 CO -0.25 0.13 -0.16 0.58 -0.87 0.00 0.00 176.83 176.26 2wr0 h VAL 481 N 0.19 1.38 -0.57 0.95 2.07 -0.60 0.83 116.25 120.50 2wr0 h VAL 481 Ca 0.05 -1.40 0.05 0.00 0.82 0.00 0.00 66.70 66.22 2wr0 h VAL 481 Cb -0.01 2.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.79 2wr0 h VAL 481 CO -0.01 0.40 0.38 0.11 0.02 0.00 0.00 177.57 178.47 2wr0 h LYS 482 N -0.15 0.59 -0.31 1.57 1.57 0.62 -2.62 116.57 117.85 2wr0 h LYS 482 Ca 0.01 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 2wr0 h LYS 482 Cb 0.72 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 2wr0 h LYS 482 CO 0.04 0.39 0.01 0.27 -0.57 0.00 0.00 179.45 179.58 2wr0 n ASN 483 N -4.47 3.87 -1.02 0.86 0.23 -0.04 -4.95 115.26 109.74 2wr0 n ASN 483 Ca 0.07 -3.10 -0.10 0.00 -0.53 0.00 0.00 54.58 50.92 2wr0 n ASN 483 Cb 0.18 -0.57 -0.02 0.00 -2.08 0.00 0.00 39.78 37.29 2wr0 n ASN 483 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2wr0 n GLY 484 N -0.51 0.45 0.78 4.83 0.00 -0.75 -4.91 105.19 105.08 2wr0 n GLY 484 Ca 0.24 -0.50 0.03 0.00 0.00 0.00 0.00 46.02 45.79 2wr0 n GLY 484 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wr0 n THR 485 N -3.47 2.14 -1.56 2.61 -2.24 0.28 -5.01 114.28 107.03 2wr0 n THR 485 Ca -0.11 -3.25 -0.38 0.00 -2.27 0.00 0.00 64.05 58.04 2wr0 n THR 485 Cb 0.49 -0.27 0.05 0.00 -2.10 0.00 0.00 70.33 68.50 2wr0 n THR 485 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wr0 n TYR 486 N -1.01 0.29 -3.84 4.78 9.36 -0.59 -4.79 117.16 121.35 2wr0 n TYR 486 Ca 0.21 0.44 -0.33 0.00 3.32 0.00 0.00 57.90 61.54 2wr0 n TYR 486 Cb 0.74 -2.07 -0.12 0.00 -0.63 0.00 0.00 39.34 37.25 2wr0 n TYR 486 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2wr0 s ASP 487 N -1.22 4.75 0.11 2.98 -1.08 -1.26 -4.99 116.67 115.96 2wr0 s ASP 487 Ca 0.73 -2.99 -0.27 0.00 -0.52 0.00 0.00 52.55 49.51 2wr0 s ASP 487 Cb -0.43 -1.74 -0.09 0.00 -1.46 0.00 0.00 42.92 39.20 2wr0 s ASP 487 CO 0.50 -0.28 1.65 0.22 0.52 0.00 0.00 175.17 177.77 2wr0 h TYR 488 N 6.68 -0.60 -0.73 -5.34 3.20 -1.93 -2.98 116.97 115.27 2wr0 h TYR 488 Ca -0.04 0.01 0.16 0.00 3.14 0.00 0.00 58.73 62.00 2wr0 h TYR 488 Cb 0.91 0.25 -0.04 0.00 1.54 0.00 0.00 36.73 39.38 2wr0 h TYR 488 CO 0.61 -0.32 0.50 -1.35 -1.64 0.00 0.00 178.16 175.95 2wr0 h PRO 489 N -0.43 0.29 -0.03 1.82 0.11 -1.97 -1.93 132.00 129.85 2wr0 h PRO 489 Ca 0.02 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.08 2wr0 h PRO 489 Cb 0.44 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.48 2wr0 h PRO 489 CO -0.11 0.19 -0.16 -0.22 -0.21 0.00 0.00 178.00 177.49 2wr0 h LYS 490 N 0.30 0.05 -1.91 1.05 3.64 -1.96 -3.38 116.57 114.36 2wr0 h LYS 490 Ca 0.36 -0.01 -0.68 0.00 -1.27 0.00 0.00 60.65 59.05 2wr0 h LYS 490 Cb 0.97 -0.01 -0.35 0.00 -0.41 0.00 0.00 32.23 32.43 2wr0 h LYS 490 CO -0.09 0.21 0.13 0.66 -2.27 0.00 0.00 179.45 178.09 2wr0 n TYR 491 N -4.32 3.29 -3.76 1.91 4.02 -0.73 -4.83 117.16 112.74 2wr0 n TYR 491 Ca -0.02 -2.92 -0.28 0.00 -0.01 0.00 0.00 57.90 54.67 2wr0 n TYR 491 Cb 0.24 -0.67 -0.16 0.00 -0.02 0.00 0.00 39.34 38.72 2wr0 n TYR 491 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 2wr0 s GLU 492 N -3.82 0.79 0.00 -0.72 8.01 -1.26 -4.04 118.70 117.66 2wr0 s GLU 492 Ca 0.48 -0.51 0.00 0.00 0.01 0.00 0.00 54.97 54.95 2wr0 s GLU 492 Cb 0.36 -2.18 0.00 0.00 -4.31 0.00 0.00 34.13 28.00 2wr0 s GLU 492 CO -0.25 -0.64 0.00 -0.85 0.01 0.00 0.00 175.26 173.53 2wr0 n GLU 493 N 4.99 -0.29 -0.71 1.61 0.28 -1.26 -4.86 120.64 120.40 2wr0 n GLU 493 Ca -0.09 0.00 -0.14 0.00 -0.16 0.00 0.00 57.16 56.77 2wr0 n GLU 493 Cb 0.47 -0.38 0.07 0.00 1.43 0.00 0.00 31.44 33.03 2wr0 n GLU 493 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2wr0 n GLU 494 N 0.01 1.68 0.15 3.44 4.71 -1.26 -3.15 120.64 126.22 2wr0 n GLU 494 Ca 0.00 -1.48 0.12 0.00 -0.01 0.00 0.00 57.16 55.79 2wr0 n GLU 494 Cb 0.00 -1.58 0.10 0.00 -1.01 0.00 0.00 31.44 28.95 2wr0 n GLU 494 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 2wr0 h SER 495 N 0.89 0.00 -0.35 1.62 4.64 -1.89 -3.25 113.55 115.21 2wr0 h SER 495 Ca 0.30 -0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.49 2wr0 h SER 495 Cb 1.48 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.56 2wr0 h SER 495 CO 0.62 0.01 -0.21 0.11 -0.87 0.00 0.00 176.83 176.48 2wr0 h LYS 496 N 0.00 0.84 -0.15 4.77 6.56 -1.81 -2.02 116.57 124.76 2wr0 h LYS 496 Ca 0.00 -0.34 0.04 0.00 -1.06 0.00 0.00 60.65 59.29 2wr0 h LYS 496 Cb 0.98 -0.04 -0.01 0.00 -0.57 0.00 0.00 32.23 32.59 2wr0 h LYS 496 CO 0.00 0.98 0.45 0.00 -2.06 0.00 0.00 179.45 178.82 2wr0 h ALA 497 N 1.02 1.67 0.00 3.86 0.00 -1.80 -3.52 119.26 120.49 2wr0 h ALA 497 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2wr0 h ALA 497 Cb 0.74 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2wr0 h ALA 497 CO 0.06 -0.53 0.00 0.00 0.00 0.00 0.00 179.25 178.78