#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wr7 s GLY 10 N 0.00 0.20 0.31 7.39 0.00 -0.39 -4.82 107.32 110.00 2wr7 s GLY 10 Ca 0.00 -0.55 0.05 0.00 0.00 0.00 0.00 44.72 44.21 2wr7 s GLY 10 CO 0.00 0.05 0.02 -2.52 0.00 0.00 0.00 173.10 170.65 2wr7 s TYR 11 N -2.74 1.94 0.43 1.90 -0.85 -1.26 -1.42 117.35 115.35 2wr7 s TYR 11 Ca 0.15 -0.87 -0.25 0.00 -0.52 0.00 0.00 57.07 55.58 2wr7 s TYR 11 Cb -0.05 -1.22 -0.08 0.00 0.38 0.00 0.00 41.96 40.99 2wr7 s TYR 11 CO 0.09 0.09 1.26 -1.58 -1.52 0.00 0.00 175.55 173.89 2wr7 s HIS 12 N -3.21 2.81 0.02 -3.49 5.65 0.04 -0.86 115.29 116.25 2wr7 s HIS 12 Ca 0.34 1.46 -0.05 0.00 0.25 0.00 0.00 55.06 57.05 2wr7 s HIS 12 Cb 0.07 -3.57 -0.01 0.00 -1.18 0.00 0.00 32.58 27.89 2wr7 s HIS 12 CO 0.14 -1.93 0.09 0.00 -0.65 0.00 0.00 174.74 172.39 2wr7 s ALA 13 N -1.35 -0.12 0.00 1.58 0.00 -1.21 -4.49 121.76 116.17 2wr7 s ALA 13 Ca 0.60 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.15 2wr7 s ALA 13 Cb -0.35 0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.95 2wr7 s ALA 13 CO 0.44 -0.25 0.00 0.27 0.00 0.00 0.00 175.76 176.22 2wr7 n ASN 14 N 1.15 0.00 -0.70 0.00 6.94 -1.26 -4.02 115.26 117.37 2wr7 n ASN 14 Ca -0.21 -0.72 0.10 0.00 -0.02 0.00 0.00 54.58 53.73 2wr7 n ASN 14 Cb 0.57 0.00 0.31 0.00 -2.36 0.00 0.00 39.78 38.30 2wr7 n ASN 14 CO 0.00 0.00 0.00 -0.46 -1.03 0.00 0.00 177.26 175.77 2wr7 n ASN 15 N -1.63 2.09 -4.62 0.53 0.23 -1.26 -4.85 115.26 105.74 2wr7 n ASN 15 Ca 0.00 -1.81 -0.49 0.00 -0.53 0.00 0.00 54.58 51.75 2wr7 n ASN 15 Cb 0.00 -0.16 -0.05 0.00 -2.08 0.00 0.00 39.78 37.50 2wr7 n ASN 15 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 2wr7 n SER 16 N 0.60 2.23 -0.46 0.53 2.88 -1.26 -4.85 113.62 113.28 2wr7 n SER 16 Ca 0.16 1.11 0.07 0.00 -1.33 0.00 0.00 58.87 58.88 2wr7 n SER 16 Cb 0.38 -1.30 0.04 0.00 -0.75 0.00 0.00 64.21 62.58 2wr7 n SER 16 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2wr7 n THR 17 N 2.61 0.00 -1.53 2.46 -2.24 -1.26 -4.78 114.28 109.55 2wr7 n THR 17 Ca 0.17 -0.45 -0.53 0.00 -2.27 0.00 0.00 64.05 60.96 2wr7 n THR 17 Cb 0.25 1.24 -0.06 0.00 -2.10 0.00 0.00 70.33 69.66 2wr7 n THR 17 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2wr7 n GLU 18 N 0.45 0.56 -4.52 -0.78 4.07 -1.26 -4.89 120.64 114.26 2wr7 n GLU 18 Ca 0.07 0.20 -0.30 0.00 -0.06 0.00 0.00 57.16 57.07 2wr7 n GLU 18 Cb 0.32 -1.66 -0.12 0.00 -0.06 0.00 0.00 31.44 29.92 2wr7 n GLU 18 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 2wr7 s LYS 19 N -0.15 1.99 0.09 5.31 -0.14 -1.26 -1.80 119.74 123.78 2wr7 s LYS 19 Ca 0.81 -1.04 0.01 0.00 -1.36 0.00 0.00 55.97 54.39 2wr7 s LYS 19 Cb -1.04 -2.17 -0.04 0.00 -1.68 0.00 0.00 37.83 32.89 2wr7 s LYS 19 CO 0.53 0.52 -0.06 0.14 -0.76 0.00 0.00 175.35 175.72 2wr7 s VAL 20 N -1.01 0.63 0.16 3.17 -7.23 0.56 -4.91 120.40 111.77 2wr7 s VAL 20 Ca 0.16 -1.88 0.06 0.00 -1.81 0.00 0.00 61.98 58.51 2wr7 s VAL 20 Cb -0.11 -1.61 -0.04 0.00 0.56 0.00 0.00 36.38 35.19 2wr7 s VAL 20 CO 0.07 -0.87 0.07 -1.81 -0.31 0.00 0.00 175.10 172.26 2wr7 s ASP 21 N -2.96 5.22 0.26 4.85 1.01 -1.26 -0.11 116.67 123.68 2wr7 s ASP 21 Ca 0.10 -0.22 0.01 0.00 0.71 0.00 0.00 52.55 53.16 2wr7 s ASP 21 Cb 0.05 -1.28 -0.05 0.00 1.01 0.00 0.00 42.92 42.66 2wr7 s ASP 21 CO -0.05 0.09 0.11 0.42 0.21 0.00 0.00 175.17 175.95 2wr7 s THR 22 N -1.69 0.44 0.52 -1.27 -4.23 0.36 -4.49 115.64 105.28 2wr7 s THR 22 Ca 0.29 -2.00 0.42 0.00 -1.18 0.00 0.00 61.69 59.22 2wr7 s THR 22 Cb -0.10 -2.59 0.43 0.00 1.34 0.00 0.00 72.50 71.58 2wr7 s THR 22 CO 0.21 0.00 2.28 0.40 -0.54 0.00 0.00 174.62 176.97 2wr7 h ILE 23 N 2.37 0.00 0.00 2.99 2.04 -1.85 -3.07 117.51 120.00 2wr7 h ILE 23 Ca -0.37 -0.10 -0.20 0.00 1.00 0.00 0.00 64.86 65.19 2wr7 h ILE 23 Cb 1.25 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 38.37 2wr7 h ILE 23 CO 0.58 0.00 -1.75 0.18 0.00 0.00 0.00 178.15 177.15 2wr7 n LEU 24 N -3.05 0.00 -4.25 1.44 4.77 -1.26 -5.04 117.00 109.61 2wr7 n LEU 24 Ca -0.02 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.77 2wr7 n LEU 24 Cb 0.12 0.27 -0.11 0.00 -2.33 0.00 0.00 43.42 41.36 2wr7 n LEU 24 CO 0.21 0.27 -0.46 -1.61 -1.33 0.00 0.00 177.39 174.47 2wr7 s GLU 25 N -2.27 1.04 0.23 3.23 2.02 -1.16 -5.16 118.70 116.64 2wr7 s GLU 25 Ca -0.05 -1.23 0.11 0.00 0.02 0.00 0.00 54.97 53.81 2wr7 s GLU 25 Cb 0.03 -0.98 -0.05 0.00 0.10 0.00 0.00 34.13 33.24 2wr7 s GLU 25 CO 0.45 0.20 -0.18 -0.98 0.02 0.00 0.00 175.26 174.76 2wr7 s ARG 26 N -2.56 1.72 -1.17 1.61 1.70 -1.26 -0.49 118.95 118.50 2wr7 s ARG 26 Ca 0.09 -1.56 -0.04 0.00 -0.47 0.00 0.00 55.73 53.75 2wr7 s ARG 26 Cb -0.06 -1.90 -0.02 0.00 -0.57 0.00 0.00 34.95 32.40 2wr7 s ARG 26 CO 0.03 0.38 0.88 0.09 -1.08 0.00 0.00 175.30 175.61 2wr7 n ASN 27 N -0.16 -3.73 -4.78 -2.89 3.02 -1.19 -4.98 115.26 100.56 2wr7 n ASN 27 Ca -0.09 -0.74 -0.37 0.00 -0.03 0.00 0.00 54.58 53.35 2wr7 n ASN 27 Cb 0.57 -4.73 -0.07 0.00 -0.61 0.00 0.00 39.78 34.95 2wr7 n ASN 27 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2wr7 s VAL 28 N -3.45 5.27 -0.08 2.41 1.01 0.85 -4.86 120.40 121.55 2wr7 s VAL 28 Ca 0.20 0.57 -0.22 0.00 0.00 0.00 0.00 61.98 62.53 2wr7 s VAL 28 Cb -0.04 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 2wr7 s VAL 28 CO 0.77 0.47 0.65 -0.89 0.00 0.00 0.00 175.10 176.09 2wr7 s THR 29 N -0.11 5.08 -0.08 3.92 2.01 -1.26 -0.32 115.64 124.88 2wr7 s THR 29 Ca 0.18 1.34 0.01 0.00 0.31 0.00 0.00 61.69 63.53 2wr7 s THR 29 Cb -0.14 -3.99 0.02 0.00 0.01 0.00 0.00 72.50 68.40 2wr7 s THR 29 CO 0.06 0.27 -0.10 0.68 -0.69 0.00 0.00 174.62 174.84 2wr7 s VAL 30 N 0.76 1.07 0.40 3.82 -7.23 -0.74 -0.28 120.40 118.20 2wr7 s VAL 30 Ca 0.35 -0.40 0.34 0.00 -1.81 0.00 0.00 61.98 60.46 2wr7 s VAL 30 Cb -0.17 -1.02 0.50 0.00 0.56 0.00 0.00 36.38 36.26 2wr7 s VAL 30 CO 0.16 0.35 1.25 0.35 -0.31 0.00 0.00 175.10 176.91 2wr7 n THR 31 N 4.20 -0.10 -3.72 5.32 -2.24 0.32 -4.48 114.28 113.58 2wr7 n THR 31 Ca -0.20 1.32 -0.13 0.00 -2.27 0.00 0.00 64.05 62.77 2wr7 n THR 31 Cb 0.51 -2.18 -0.07 0.00 -2.10 0.00 0.00 70.33 66.48 2wr7 n THR 31 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2wr7 s HIS 32 N -4.70 -0.21 0.17 4.78 3.76 -1.26 -4.73 115.29 113.10 2wr7 s HIS 32 Ca -0.05 0.23 -0.17 0.00 -0.15 0.00 0.00 55.06 54.92 2wr7 s HIS 32 Cb 0.23 0.15 0.03 0.00 1.11 0.00 0.00 32.58 34.10 2wr7 s HIS 32 CO 0.69 -0.48 0.48 0.00 -0.85 0.00 0.00 174.74 174.58 2wr7 s ALA 33 N -1.96 -0.92 -0.11 -1.40 0.00 -1.26 -2.27 121.76 113.84 2wr7 s ALA 33 Ca -0.09 -0.17 -0.00 0.00 0.00 0.00 0.00 51.96 51.70 2wr7 s ALA 33 Cb -0.02 0.82 0.02 0.00 0.00 0.00 0.00 23.12 23.93 2wr7 s ALA 33 CO 0.01 -0.75 -0.08 0.21 0.00 0.00 0.00 175.76 175.15 2wr7 s LYS 34 N -3.85 1.51 -0.02 0.00 2.36 0.62 -4.86 119.74 115.50 2wr7 s LYS 34 Ca 0.08 -0.26 -0.27 0.00 -2.55 0.00 0.00 55.97 52.96 2wr7 s LYS 34 Cb -0.00 -1.54 -0.03 0.00 -1.05 0.00 0.00 37.83 35.20 2wr7 s LYS 34 CO -0.06 -0.24 0.87 0.34 1.55 0.00 0.00 175.35 177.82 2wr7 s ASP 35 N 1.60 7.23 -0.18 1.43 2.15 -1.26 -1.42 116.67 126.22 2wr7 s ASP 35 Ca 0.03 1.49 0.15 0.00 0.43 0.00 0.00 52.55 54.64 2wr7 s ASP 35 Cb -0.13 -2.51 0.40 0.00 -0.30 0.00 0.00 42.92 40.39 2wr7 s ASP 35 CO -0.07 -0.19 1.27 2.30 -0.17 0.00 0.00 175.17 178.31 2wr7 n ILE 36 N 3.78 2.15 -3.93 4.11 -5.35 -0.91 -4.90 119.36 114.33 2wr7 n ILE 36 Ca 0.03 -2.50 -0.31 0.00 -0.27 0.00 0.00 62.75 59.71 2wr7 n ILE 36 Cb 0.51 -0.26 -0.15 0.00 -1.74 0.00 0.00 39.64 38.00 2wr7 n ILE 36 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 2wr7 s LEU 37 N -3.01 3.50 0.17 7.28 2.96 -1.26 -3.73 118.68 124.59 2wr7 s LEU 37 Ca 0.38 -1.75 -0.31 0.00 -0.22 0.00 0.00 54.13 52.23 2wr7 s LEU 37 Cb 0.33 -1.32 -0.09 0.00 0.50 0.00 0.00 46.19 45.62 2wr7 s LEU 37 CO 0.01 -0.34 1.45 -0.70 -1.32 0.00 0.00 176.35 175.44 2wr7 s GLU 38 N 1.22 4.28 0.00 1.98 2.56 -0.30 -4.88 118.70 123.56 2wr7 s GLU 38 Ca 0.06 2.21 0.00 0.00 0.00 0.00 0.00 54.97 57.23 2wr7 s GLU 38 Cb -0.19 -3.18 0.00 0.00 2.00 0.00 0.00 34.13 32.76 2wr7 s GLU 38 CO -0.12 -0.46 0.67 0.36 -0.56 0.00 0.00 175.26 175.15 2wr7 n LYS 39 N 3.46 0.00 -4.71 4.30 2.85 -1.26 -2.48 118.16 120.32 2wr7 n LYS 39 Ca 0.11 -0.63 -0.31 0.00 -1.05 0.00 0.00 58.31 56.43 2wr7 n LYS 39 Cb 0.41 -0.42 -0.13 0.00 -0.65 0.00 0.00 35.03 34.23 2wr7 n LYS 39 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 2wr7 s THR 40 N 0.00 2.71 0.33 0.58 2.01 -1.26 -4.82 115.64 115.18 2wr7 s THR 40 Ca 0.00 -1.19 0.04 0.00 0.31 0.00 0.00 61.69 60.85 2wr7 s THR 40 Cb 0.00 -2.12 -0.06 0.00 0.01 0.00 0.00 72.50 70.32 2wr7 s THR 40 CO 0.00 0.36 0.04 -1.38 -0.69 0.00 0.00 174.62 172.95 2wr7 s HIS 41 N -0.90 2.00 -2.50 4.92 -3.43 -1.26 -4.70 115.29 109.43 2wr7 s HIS 41 Ca 0.14 -0.91 0.24 0.00 -0.80 0.00 0.00 55.06 53.73 2wr7 s HIS 41 Cb -0.10 -1.30 0.72 0.00 -1.43 0.00 0.00 32.58 30.46 2wr7 s HIS 41 CO 0.04 0.07 1.55 0.27 -2.00 0.00 0.00 174.74 174.67 2wr7 n ASN 42 N -0.70 2.06 0.00 7.38 0.23 -0.56 -4.87 115.26 118.81 2wr7 n ASN 42 Ca -0.03 -1.72 0.00 0.00 -0.53 0.00 0.00 54.58 52.30 2wr7 n ASN 42 Cb 0.66 -0.07 0.00 0.00 -2.08 0.00 0.00 39.78 38.29 2wr7 n ASN 42 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2wr7 n GLY 43 N 1.23 0.39 3.48 4.83 0.00 -1.26 -4.83 105.19 109.03 2wr7 n GLY 43 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 2wr7 n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wr7 s LYS 44 N -0.72 2.18 -0.13 1.61 1.02 -1.26 -4.67 119.74 117.76 2wr7 s LYS 44 Ca 0.00 -0.92 -0.21 0.00 0.02 0.00 0.00 55.97 54.86 2wr7 s LYS 44 Cb 0.00 -2.25 -0.03 0.00 -0.52 0.00 0.00 37.83 35.03 2wr7 s LYS 44 CO 0.00 0.55 0.62 -0.51 -0.92 0.00 0.00 175.35 175.10 2wr7 s LEU 45 N -1.39 4.24 0.38 3.17 1.43 -1.26 -2.24 118.68 123.00 2wr7 s LEU 45 Ca 0.15 0.96 0.04 0.00 -1.03 0.00 0.00 54.13 54.25 2wr7 s LEU 45 Cb -0.11 -2.92 -0.05 0.00 0.03 0.00 0.00 46.19 43.14 2wr7 s LEU 45 CO 0.05 -0.16 0.07 0.00 0.23 0.00 0.00 176.35 176.54 2wr7 s LYS 47 N -3.82 4.18 -0.33 0.00 1.02 -1.24 -4.65 119.74 114.89 2wr7 s LYS 47 Ca 0.29 1.57 -0.08 0.00 0.02 0.00 0.00 55.97 57.77 2wr7 s LYS 47 Cb 0.06 -2.60 0.02 0.00 -0.52 0.00 0.00 37.83 34.80 2wr7 s LYS 47 CO 0.14 -0.14 0.13 -1.17 -0.92 0.00 0.00 175.35 173.39 2wr7 s LEU 48 N -2.55 4.27 -1.51 3.17 2.96 0.75 -2.60 118.68 123.18 2wr7 s LEU 48 Ca 0.57 -0.94 -0.13 0.00 -0.22 0.00 0.00 54.13 53.41 2wr7 s LEU 48 Cb -0.24 -1.92 0.07 0.00 0.50 0.00 0.00 46.19 44.61 2wr7 s LEU 48 CO 0.30 -0.29 1.00 0.59 -1.32 0.00 0.00 176.35 176.62 2wr7 n ASN 49 N 4.89 -5.08 0.00 3.68 5.03 -0.88 -1.59 115.26 121.31 2wr7 n ASN 49 Ca -0.13 -0.73 0.00 0.00 0.87 0.00 0.00 54.58 54.59 2wr7 n ASN 49 Cb 0.46 -4.04 0.00 0.00 -1.02 0.00 0.00 39.78 35.18 2wr7 n ASN 49 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2wr7 n GLY 50 N -1.73 0.88 3.30 7.41 0.00 -1.26 -5.02 105.19 108.78 2wr7 n GLY 50 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 2wr7 n GLY 50 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wr7 s ILE 51 N -3.47 2.57 0.85 -0.61 1.01 -0.62 -5.05 121.20 115.88 2wr7 s ILE 51 Ca 0.00 -0.84 -0.11 0.00 0.00 0.00 0.00 60.65 59.69 2wr7 s ILE 51 Cb 0.00 -2.03 0.10 0.00 0.01 0.00 0.00 42.46 40.54 2wr7 s ILE 51 CO 0.00 0.54 1.10 -2.84 0.00 0.00 0.00 174.94 173.74 2wr7 s PRO 52 N 0.27 1.68 0.26 2.79 0.02 -1.26 -0.18 135.00 138.58 2wr7 s PRO 52 Ca -0.13 0.72 -0.01 0.00 0.02 0.00 0.00 61.00 61.60 2wr7 s PRO 52 Cb -0.16 -1.86 -0.04 0.00 0.02 0.00 0.00 34.50 32.45 2wr7 s PRO 52 CO 0.07 -1.93 0.47 -1.25 -0.33 0.00 0.00 177.00 174.03 2wr7 s PRO 53 N -5.05 3.53 -0.02 5.54 0.05 -1.26 -1.14 135.00 136.64 2wr7 s PRO 53 Ca 0.62 -0.30 -0.30 0.00 0.05 0.00 0.00 61.00 61.07 2wr7 s PRO 53 Cb -0.16 -2.75 -0.05 0.00 0.05 0.00 0.00 34.50 31.58 2wr7 s PRO 53 CO 0.55 0.29 1.45 -1.17 0.05 0.00 0.00 177.00 178.17 2wr7 s LEU 54 N -3.71 4.31 -0.45 -3.56 2.96 -0.77 -4.89 118.68 112.56 2wr7 s LEU 54 Ca 0.40 2.13 -0.13 0.00 -0.22 0.00 0.00 54.13 56.30 2wr7 s LEU 54 Cb -0.10 -3.55 0.08 0.00 0.50 0.00 0.00 46.19 43.11 2wr7 s LEU 54 CO 0.31 -0.77 0.35 -1.61 -1.32 0.00 0.00 176.35 173.32 2wr7 s GLU 55 N 2.75 2.85 0.00 1.98 2.02 -1.26 -0.23 118.70 126.81 2wr7 s GLU 55 Ca 0.65 -1.39 0.27 0.00 0.02 0.00 0.00 54.97 54.52 2wr7 s GLU 55 Cb -0.32 -4.02 0.92 0.00 0.10 0.00 0.00 34.13 30.82 2wr7 s GLU 55 CO 0.26 -1.01 1.67 1.28 0.02 0.00 0.00 175.26 177.48 2wr7 n LEU 56 N 5.11 0.84 0.00 1.80 4.77 -0.96 -4.57 117.00 123.98 2wr7 n LEU 56 Ca -0.12 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 2wr7 n LEU 56 Cb 0.43 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 2wr7 n LEU 56 CO 0.45 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 2wr7 n GLY 57 N 1.32 0.66 0.87 -0.72 0.00 -1.26 0.20 105.19 106.26 2wr7 n GLY 57 Ca 0.13 0.68 0.08 0.00 0.00 0.00 0.00 46.02 46.91 2wr7 n GLY 57 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wr7 n ASP 58 N 6.58 3.22 -4.90 1.61 10.43 -1.26 -4.34 116.55 127.89 2wr7 n ASP 58 Ca 0.00 -1.98 -0.31 0.00 2.57 0.00 0.00 54.79 55.07 2wr7 n ASP 58 Cb 0.00 -0.30 -0.04 0.00 1.84 0.00 0.00 41.12 42.62 2wr7 n ASP 58 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2wr7 s SER 60 N -2.51 5.40 0.30 0.00 1.04 -0.71 -4.71 113.70 112.52 2wr7 s SER 60 Ca 0.34 0.27 0.01 0.00 0.48 0.00 0.00 55.95 57.05 2wr7 s SER 60 Cb -0.13 -1.23 0.49 0.00 0.10 0.00 0.00 66.02 65.25 2wr7 s SER 60 CO 0.27 -1.09 1.84 0.40 0.98 0.00 0.00 173.24 175.64 2wr7 h ILE 61 N 0.00 1.21 0.07 -1.02 2.04 -1.98 -1.56 117.51 116.28 2wr7 h ILE 61 Ca -0.44 -0.82 -0.00 0.00 1.00 0.00 0.00 64.86 64.60 2wr7 h ILE 61 Cb 1.28 0.82 0.00 0.00 -0.74 0.00 0.00 36.82 38.18 2wr7 h ILE 61 CO 0.56 0.29 -0.04 0.00 0.00 0.00 0.00 178.15 178.97 2wr7 h ALA 62 N 1.41 -0.10 -0.63 1.87 0.00 -1.93 -0.98 119.26 118.90 2wr7 h ALA 62 Ca 0.14 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 55.00 2wr7 h ALA 62 Cb 0.32 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 2wr7 h ALA 62 CO 0.01 -0.44 0.31 0.78 0.00 0.00 0.00 179.25 179.90 2wr7 h GLY 63 N -0.33 0.91 0.98 0.00 0.00 -1.64 0.19 103.07 103.18 2wr7 h GLY 63 Ca -0.01 -0.20 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 2wr7 h GLY 63 CO 0.02 0.09 0.23 -0.25 0.00 0.00 0.00 176.54 176.62 2wr7 h TRP 64 N 0.56 0.82 0.06 5.60 7.01 -1.11 0.04 115.95 128.94 2wr7 h TRP 64 Ca 0.29 -0.06 -0.24 0.00 2.11 0.00 0.00 58.89 60.99 2wr7 h TRP 64 Cb 0.26 -0.25 -0.01 0.00 -2.10 0.00 0.00 29.16 27.06 2wr7 h TRP 64 CO -0.11 0.67 -1.12 -0.07 -2.79 0.00 0.00 178.44 175.02 2wr7 h LEU 65 N 0.74 0.21 -0.46 0.65 3.38 -0.80 -3.27 115.31 115.77 2wr7 h LEU 65 Ca 0.18 -0.23 -0.17 0.00 0.09 0.00 0.00 57.88 57.76 2wr7 h LEU 65 Cb 0.18 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2wr7 h LEU 65 CO -0.02 1.18 -0.66 -0.07 0.09 0.00 0.00 178.44 178.96 2wr7 h LEU 66 N 0.04 0.50 0.00 1.67 3.38 -0.56 -3.45 115.31 116.89 2wr7 h LEU 66 Ca -0.07 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2wr7 h LEU 66 Cb 1.87 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.47 2wr7 h LEU 66 CO 0.17 1.03 0.00 0.61 0.09 0.00 0.00 178.44 180.33 2wr7 n GLY 67 N 0.44 1.83 3.66 0.83 0.00 -0.38 -2.02 105.19 109.55 2wr7 n GLY 67 Ca -0.04 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.46 2wr7 n GLY 67 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wr7 n ASN 68 N 0.00 2.51 0.21 1.61 2.85 -0.14 -0.26 115.26 122.04 2wr7 n ASN 68 Ca 0.00 1.07 0.14 0.00 -0.11 0.00 0.00 54.58 55.68 2wr7 n ASN 68 Cb 0.00 -1.25 0.75 0.00 1.24 0.00 0.00 39.78 40.52 2wr7 n ASN 68 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2wr7 h PRO 69 N 6.63 0.00 0.00 1.20 0.11 -1.90 0.17 132.00 138.21 2wr7 h PRO 69 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2wr7 h PRO 69 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2wr7 h PRO 69 CO 0.89 0.00 0.00 -1.91 -0.21 0.00 0.00 178.00 176.77 2wr7 n GLU 70 N -4.18 0.54 0.00 1.05 4.07 -1.26 -2.34 120.64 118.52 2wr7 n GLU 70 Ca 0.00 0.00 0.01 0.00 -0.06 0.00 0.00 57.16 57.11 2wr7 n GLU 70 Cb 0.24 -1.22 0.00 0.00 -0.06 0.00 0.00 31.44 30.40 2wr7 n GLU 70 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2wr7 h ASP 72 N 0.25 0.44 -0.34 0.00 3.45 -1.56 -2.10 116.42 116.56 2wr7 h ASP 72 Ca 0.00 0.18 -0.01 0.00 0.43 0.00 0.00 57.03 57.63 2wr7 h ASP 72 Cb 0.06 0.14 -0.01 0.00 -0.56 0.00 0.00 39.33 38.97 2wr7 h ASP 72 CO 0.00 -0.17 0.02 0.54 -1.57 0.00 0.00 179.24 178.06 2wr7 n ARG 73 N -4.99 3.20 -2.57 3.56 1.74 -1.26 -4.94 116.66 111.40 2wr7 n ARG 73 Ca 0.33 -1.81 -0.35 0.00 -0.77 0.00 0.00 57.85 55.25 2wr7 n ARG 73 Cb 1.09 -1.94 -0.04 0.00 -1.02 0.00 0.00 32.46 30.56 2wr7 n ARG 73 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2wr7 s LEU 74 N -1.60 3.93 -0.01 0.55 1.43 -0.79 -5.00 118.68 117.19 2wr7 s LEU 74 Ca 0.31 1.93 -0.22 0.00 -1.03 0.00 0.00 54.13 55.12 2wr7 s LEU 74 Cb 0.24 -4.46 -0.13 0.00 0.03 0.00 0.00 46.19 41.86 2wr7 s LEU 74 CO 0.09 -0.67 0.97 0.25 0.23 0.00 0.00 176.35 177.23 2wr7 h LEU 75 N 1.83 -0.56 -1.56 1.79 6.46 -1.92 -3.50 115.31 117.86 2wr7 h LEU 75 Ca -0.49 -0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.22 2wr7 h LEU 75 Cb 1.21 0.14 0.00 0.00 -0.73 0.00 0.00 40.66 41.29 2wr7 h LEU 75 CO 0.60 -0.15 -0.71 -1.20 -0.62 0.00 0.00 178.44 176.36 2wr7 n SER 76 N -5.23 -7.30 -4.73 1.25 7.64 -1.26 -5.06 113.62 98.92 2wr7 n SER 76 Ca -0.10 1.16 -0.23 0.00 1.01 0.00 0.00 58.87 60.72 2wr7 n SER 76 Cb 0.30 -4.03 -0.06 0.00 -1.01 0.00 0.00 64.21 59.41 2wr7 n SER 76 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2wr7 s VAL 77 N -0.40 3.55 -2.23 0.44 1.01 -1.26 -5.01 120.40 116.49 2wr7 s VAL 77 Ca 0.00 -1.68 0.20 0.00 0.00 0.00 0.00 61.98 60.50 2wr7 s VAL 77 Cb 0.00 -3.04 0.46 0.00 0.00 0.00 0.00 36.38 33.79 2wr7 s VAL 77 CO 0.00 -0.29 1.56 -0.81 0.00 0.00 0.00 175.10 175.55 2wr7 n PRO 78 N -1.08 1.63 -3.64 2.72 -0.05 -1.26 -4.81 135.00 128.50 2wr7 n PRO 78 Ca -0.05 -0.95 -0.05 0.00 -0.05 0.00 0.00 63.50 62.41 2wr7 n PRO 78 Cb 0.59 -1.37 -0.07 0.00 -0.05 0.00 0.00 33.50 32.60 2wr7 n PRO 78 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 175.50 173.45 2wr7 s GLU 79 N -1.81 0.46 0.08 0.54 2.12 -1.26 -1.67 118.70 117.15 2wr7 s GLU 79 Ca 0.31 0.73 -0.11 0.00 0.36 0.00 0.00 54.97 56.26 2wr7 s GLU 79 Cb 0.16 0.12 0.01 0.00 0.26 0.00 0.00 34.13 34.69 2wr7 s GLU 79 CO 0.25 -0.09 0.25 1.67 -0.54 0.00 0.00 175.26 176.81 2wr7 s TRP 80 N 1.15 0.02 -0.07 5.30 -2.14 -0.94 -4.62 118.94 117.64 2wr7 s TRP 80 Ca -0.07 -0.34 0.11 0.00 2.66 0.00 0.00 56.10 58.47 2wr7 s TRP 80 Cb -0.04 0.03 -0.17 0.00 -3.10 0.00 0.00 33.47 30.19 2wr7 s TRP 80 CO -0.14 -0.55 0.27 -1.13 -2.66 0.00 0.00 176.95 172.75 2wr7 n SER 81 N 0.16 2.24 -2.42 -2.66 3.41 -0.29 -2.04 113.62 112.01 2wr7 n SER 81 Ca -0.17 -0.08 -0.09 0.00 -0.26 0.00 0.00 58.87 58.28 2wr7 n SER 81 Cb 0.61 1.46 0.00 0.00 -0.26 0.00 0.00 64.21 66.03 2wr7 n SER 81 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wr7 n TYR 82 N -1.83 -1.66 -5.22 7.33 0.18 -1.24 -4.68 117.16 110.04 2wr7 n TYR 82 Ca -0.02 -1.57 -0.31 0.00 1.88 0.00 0.00 57.90 57.88 2wr7 n TYR 82 Cb 0.28 0.57 -0.17 0.00 -0.38 0.00 0.00 39.34 39.65 2wr7 n TYR 82 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 2wr7 s ILE 83 N -2.51 2.01 -0.19 -3.48 1.01 -1.14 -1.85 121.20 115.06 2wr7 s ILE 83 Ca 0.16 -1.02 -0.11 0.00 0.00 0.00 0.00 60.65 59.69 2wr7 s ILE 83 Cb -0.02 -1.71 -0.05 0.00 0.01 0.00 0.00 42.46 40.68 2wr7 s ILE 83 CO 0.12 0.56 0.16 -0.04 0.00 0.00 0.00 174.94 175.74 2wr7 s MET 84 N 0.03 4.15 -0.08 2.79 -1.94 0.68 -0.25 119.30 124.68 2wr7 s MET 84 Ca -0.09 -0.15 -0.15 0.00 -1.71 0.00 0.00 55.69 53.59 2wr7 s MET 84 Cb -0.15 -3.40 0.03 0.00 2.01 0.00 0.00 34.83 33.32 2wr7 s MET 84 CO 0.05 0.33 0.37 -2.00 -0.01 0.00 0.00 175.02 173.77 2wr7 s GLU 85 N 0.27 0.60 0.52 2.03 2.12 -0.97 -2.27 118.70 121.00 2wr7 s GLU 85 Ca 0.10 0.18 -0.17 0.00 0.36 0.00 0.00 54.97 55.44 2wr7 s GLU 85 Cb -0.11 0.28 -0.08 0.00 0.26 0.00 0.00 34.13 34.48 2wr7 s GLU 85 CO -0.00 -0.14 0.99 0.15 -0.54 0.00 0.00 175.26 175.72 2wr7 s LYS 86 N -0.62 3.90 -0.02 4.30 1.02 -1.25 -1.86 119.74 125.20 2wr7 s LYS 86 Ca -0.07 1.00 -0.30 0.00 0.02 0.00 0.00 55.97 56.62 2wr7 s LYS 86 Cb -0.04 -2.13 -0.06 0.00 -0.52 0.00 0.00 37.83 35.09 2wr7 s LYS 86 CO 0.03 -0.32 1.52 -2.00 -0.92 0.00 0.00 175.35 173.66 2wr7 s GLU 87 N -4.00 4.23 -0.35 1.68 2.56 -1.26 -3.72 118.70 117.84 2wr7 s GLU 87 Ca 0.60 2.08 -0.19 0.00 0.00 0.00 0.00 54.97 57.46 2wr7 s GLU 87 Cb -0.11 -3.73 0.03 0.00 2.00 0.00 0.00 34.13 32.32 2wr7 s GLU 87 CO 0.31 -0.70 0.42 0.09 -0.56 0.00 0.00 175.26 174.82 2wr7 n ASN 88 N 6.09 -6.93 0.00 -1.70 3.02 -1.26 -4.99 115.26 109.49 2wr7 n ASN 88 Ca 0.15 0.44 0.00 0.00 -0.03 0.00 0.00 54.58 55.14 2wr7 n ASN 88 Cb 0.43 -3.51 0.00 0.00 -0.61 0.00 0.00 39.78 36.09 2wr7 n ASN 88 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 2wr7 n PRO 89 N 0.17 0.00 0.00 3.52 -0.02 -1.24 -5.03 135.00 132.40 2wr7 n PRO 89 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 2wr7 n PRO 89 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.95 2wr7 n PRO 89 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2wr7 n ARG 90 N 0.00 0.00 -3.34 -0.52 0.63 -1.09 -5.00 116.66 107.34 2wr7 n ARG 90 Ca 0.00 0.00 -0.47 0.00 -0.92 0.00 0.00 57.85 56.46 2wr7 n ARG 90 Cb 0.00 0.00 -0.03 0.00 0.45 0.00 0.00 32.46 32.88 2wr7 n ARG 90 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2wr7 s ASP 91 N -1.47 6.67 0.00 6.15 1.01 -0.60 -4.91 116.67 123.52 2wr7 s ASP 91 Ca 0.00 -2.64 0.00 0.00 0.71 0.00 0.00 52.55 50.62 2wr7 s ASP 91 Cb 0.00 -2.20 0.00 0.00 1.01 0.00 0.00 42.92 41.73 2wr7 s ASP 91 CO 0.00 -0.58 0.00 0.61 0.21 0.00 0.00 175.17 175.41 2wr7 n GLY 92 N 4.04 1.49 3.49 0.21 0.00 -1.26 -1.73 105.19 111.43 2wr7 n GLY 92 Ca 0.12 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 2wr7 n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wr7 s LEU 93 N 0.00 4.56 0.20 0.99 1.43 -1.26 -3.95 118.68 120.66 2wr7 s LEU 93 Ca 0.00 -2.10 -0.10 0.00 -1.03 0.00 0.00 54.13 50.89 2wr7 s LEU 93 Cb 0.00 -2.46 0.22 0.00 0.03 0.00 0.00 46.19 43.98 2wr7 s LEU 93 CO 0.00 -1.13 1.78 0.00 0.23 0.00 0.00 176.35 177.24 2wr7 s TYR 95 N -6.10 3.40 0.57 0.00 5.04 -1.26 -4.63 117.35 114.36 2wr7 s TYR 95 Ca -0.13 1.18 -0.20 0.00 -2.44 0.00 0.00 57.07 55.48 2wr7 s TYR 95 Cb 0.16 -2.97 -0.04 0.00 0.35 0.00 0.00 41.96 39.45 2wr7 s TYR 95 CO 0.75 -0.24 1.24 -1.25 -1.34 0.00 0.00 175.55 174.71 2wr7 s PRO 96 N 2.16 3.09 0.00 4.97 0.04 -1.25 -4.70 135.00 139.31 2wr7 s PRO 96 Ca 0.36 1.93 0.00 0.00 0.04 0.00 0.00 61.00 63.33 2wr7 s PRO 96 Cb -0.16 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2wr7 s PRO 96 CO 0.11 -1.14 0.00 0.41 0.04 0.00 0.00 177.00 176.43 2wr7 n GLY 97 N 0.58 -0.61 3.85 0.56 0.00 -1.26 -0.33 105.19 107.98 2wr7 n GLY 97 Ca 0.12 -0.40 -0.07 0.00 0.00 0.00 0.00 46.02 45.67 2wr7 n GLY 97 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wr7 s SER 98 N -4.00 -0.27 -0.31 1.61 1.04 0.11 -4.88 113.70 107.00 2wr7 s SER 98 Ca 0.00 -0.59 -0.02 0.00 0.48 0.00 0.00 55.95 55.82 2wr7 s SER 98 Cb 0.00 0.73 0.10 0.00 0.10 0.00 0.00 66.02 66.95 2wr7 s SER 98 CO 0.00 -1.34 0.11 0.12 0.98 0.00 0.00 173.24 173.11 2wr7 s PHE 99 N -3.92 1.24 0.16 5.02 5.36 -1.26 0.19 117.98 124.78 2wr7 s PHE 99 Ca 0.11 -1.46 -0.34 0.00 -0.96 0.00 0.00 56.93 54.28 2wr7 s PHE 99 Cb -0.06 -1.44 -0.14 0.00 -0.34 0.00 0.00 43.02 41.04 2wr7 s PHE 99 CO 0.06 -0.86 1.48 0.09 -1.46 0.00 0.00 175.22 174.53 2wr7 n ASN 100 N 4.96 2.67 -3.22 6.13 3.02 -0.37 -2.47 115.26 125.98 2wr7 n ASN 100 Ca -0.03 1.10 -0.23 0.00 -0.03 0.00 0.00 54.58 55.39 2wr7 n ASN 100 Cb 0.42 -1.37 0.03 0.00 -0.61 0.00 0.00 39.78 38.25 2wr7 n ASN 100 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2wr7 n ASP 101 N 2.92 -5.52 -0.20 6.41 8.00 -1.26 -4.64 116.55 122.26 2wr7 n ASP 101 Ca 0.16 -0.37 -0.04 0.00 0.71 0.00 0.00 54.79 55.26 2wr7 n ASP 101 Cb 0.27 -4.46 0.06 0.00 -0.02 0.00 0.00 41.12 36.98 2wr7 n ASP 101 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2wr7 h TYR 102 N -1.47 0.61 -0.41 1.24 3.20 -1.89 -1.78 116.97 116.46 2wr7 h TYR 102 Ca -0.52 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.34 2wr7 h TYR 102 Cb 1.35 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 39.41 2wr7 h TYR 102 CO 0.56 0.32 0.08 0.93 -1.64 0.00 0.00 178.16 178.41 2wr7 h GLU 103 N 0.63 0.61 -0.20 1.82 3.07 -1.89 -0.20 114.58 118.41 2wr7 h GLU 103 Ca 0.25 -0.11 -0.12 0.00 -0.50 0.00 0.00 59.36 58.88 2wr7 h GLU 103 Cb 0.10 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 2wr7 h GLU 103 CO -0.14 0.57 -0.39 0.93 -1.40 0.00 0.00 179.01 178.58 2wr7 h GLU 104 N 0.59 0.47 -0.45 2.33 4.39 -1.82 -2.27 114.58 117.81 2wr7 h GLU 104 Ca 0.13 -0.23 -0.10 0.00 0.34 0.00 0.00 59.36 59.51 2wr7 h GLU 104 Cb 0.25 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 2wr7 h GLU 104 CO -0.00 0.79 -0.11 1.25 -1.16 0.00 0.00 179.01 179.77 2wr7 h LEU 105 N 0.39 0.88 -0.35 1.33 5.85 -0.52 -2.51 115.31 120.38 2wr7 h LEU 105 Ca 0.04 -0.36 -0.00 0.00 0.84 0.00 0.00 57.88 58.39 2wr7 h LEU 105 Cb 0.86 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.63 2wr7 h LEU 105 CO 0.07 1.04 0.20 0.11 -0.34 0.00 0.00 178.44 179.52 2wr7 h LYS 106 N 0.71 0.48 -0.83 1.25 1.57 -0.84 -0.44 116.57 118.49 2wr7 h LYS 106 Ca 0.11 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.88 2wr7 h LYS 106 Cb 0.66 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.82 2wr7 h LYS 106 CO 0.05 0.39 0.54 1.25 -0.57 0.00 0.00 179.45 181.11 2wr7 h HIS 107 N 0.45 0.98 -0.36 -1.35 2.76 -1.40 0.13 115.15 116.35 2wr7 h HIS 107 Ca 0.12 0.02 -0.08 0.00 -2.20 0.00 0.00 60.37 58.23 2wr7 h HIS 107 Cb 0.04 -0.33 -0.01 0.00 1.55 0.00 0.00 27.41 28.66 2wr7 h HIS 107 CO -0.03 0.56 -0.11 1.25 -1.30 0.00 0.00 177.93 178.30 2wr7 h LEU 108 N 1.00 0.71 -0.15 0.26 5.85 -0.95 -2.90 115.31 119.13 2wr7 h LEU 108 Ca 0.33 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.68 2wr7 h LEU 108 Cb 0.07 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.91 2wr7 h LEU 108 CO -0.10 0.93 0.00 0.18 -0.34 0.00 0.00 178.44 179.10 2wr7 n LEU 109 N -4.37 0.69 0.11 2.25 4.32 -0.23 -4.17 117.00 115.60 2wr7 n LEU 109 Ca -0.02 0.59 0.20 0.00 -0.02 0.00 0.00 56.01 56.76 2wr7 n LEU 109 Cb 0.36 -0.39 0.75 0.00 -1.62 0.00 0.00 43.42 42.52 2wr7 n LEU 109 CO 0.42 -0.25 1.18 0.77 -1.22 0.00 0.00 177.39 178.29 2wr7 h SER 110 N 0.00 0.00 -2.83 -1.43 4.64 -0.54 -3.39 113.55 110.00 2wr7 h SER 110 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 2wr7 h SER 110 Cb 0.63 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.47 2wr7 h SER 110 CO 0.00 0.00 -0.22 -0.55 -0.87 0.00 0.00 176.83 175.19 2wr7 s SER 111 N -5.31 -0.64 -0.03 4.97 0.15 -1.26 -3.60 113.70 107.99 2wr7 s SER 111 Ca -0.04 1.16 0.01 0.00 0.70 0.00 0.00 55.95 57.77 2wr7 s SER 111 Cb 0.15 1.27 0.02 0.00 -1.71 0.00 0.00 66.02 65.75 2wr7 s SER 111 CO 0.54 -0.22 -0.01 -0.69 1.20 0.00 0.00 173.24 174.06 2wr7 s VAL 112 N 1.97 0.26 0.04 4.45 1.01 -0.87 -4.50 120.40 122.75 2wr7 s VAL 112 Ca -0.07 0.00 -0.18 0.00 0.00 0.00 0.00 61.98 61.73 2wr7 s VAL 112 Cb -0.09 -0.31 -0.18 0.00 0.00 0.00 0.00 36.38 35.80 2wr7 s VAL 112 CO -0.15 0.14 1.23 0.50 0.00 0.00 0.00 175.10 176.83 2wr7 h LYS 113 N 7.00 0.48 -3.27 2.72 3.64 -1.27 -2.51 116.57 123.36 2wr7 h LYS 113 Ca -0.39 -0.38 -0.19 0.00 -1.27 0.00 0.00 60.65 58.42 2wr7 h LYS 113 Cb 1.15 0.07 -0.27 0.00 -0.41 0.00 0.00 32.23 32.77 2wr7 h LYS 113 CO 0.48 1.00 -0.51 -1.58 -2.27 0.00 0.00 179.45 176.57 2wr7 s HIS 114 N -3.73 -0.20 -0.28 1.91 5.04 -0.97 -4.41 115.29 112.65 2wr7 s HIS 114 Ca -0.13 0.50 -0.01 0.00 -1.54 0.00 0.00 55.06 53.88 2wr7 s HIS 114 Cb 0.05 0.05 0.13 0.00 0.04 0.00 0.00 32.58 32.86 2wr7 s HIS 114 CO 0.81 -0.11 0.30 0.12 -2.34 0.00 0.00 174.74 173.52 2wr7 s PHE 115 N 0.28 -0.52 -0.08 3.88 2.19 -0.67 -1.46 117.98 121.61 2wr7 s PHE 115 Ca -0.02 -0.01 0.03 0.00 0.33 0.00 0.00 56.93 57.26 2wr7 s PHE 115 Cb -0.03 -0.39 0.01 0.00 -1.31 0.00 0.00 43.02 41.30 2wr7 s PHE 115 CO -0.01 -0.88 -0.15 -2.00 1.83 0.00 0.00 175.22 174.01 2wr7 s GLU 116 N 2.39 2.05 0.14 10.12 2.12 -0.87 -4.58 118.70 130.07 2wr7 s GLU 116 Ca 0.09 -0.53 -0.30 0.00 0.36 0.00 0.00 54.97 54.59 2wr7 s GLU 116 Cb -0.14 -1.65 -0.07 0.00 0.26 0.00 0.00 34.13 32.54 2wr7 s GLU 116 CO -0.29 0.06 1.05 0.21 -0.54 0.00 0.00 175.26 175.75 2wr7 s LYS 117 N 0.60 4.62 -0.02 4.30 2.20 -1.26 -0.02 119.74 130.16 2wr7 s LYS 117 Ca -0.15 1.61 0.01 0.00 -0.36 0.00 0.00 55.97 57.07 2wr7 s LYS 117 Cb -0.16 -3.33 0.02 0.00 -1.51 0.00 0.00 37.83 32.85 2wr7 s LYS 117 CO 0.05 0.10 -0.01 0.54 -0.36 0.00 0.00 175.35 175.67 2wr7 s VAL 118 N -0.01 0.20 -0.00 4.02 0.11 -0.08 -4.94 120.40 119.70 2wr7 s VAL 118 Ca 0.49 0.02 -0.30 0.00 -2.93 0.00 0.00 61.98 59.26 2wr7 s VAL 118 Cb -0.27 -0.26 -0.07 0.00 -1.53 0.00 0.00 36.38 34.26 2wr7 s VAL 118 CO 0.32 0.12 1.66 -0.75 -3.33 0.00 0.00 175.10 173.13 2wr7 s LYS 119 N 0.70 4.19 -0.01 1.54 2.20 -1.26 -0.23 119.74 126.86 2wr7 s LYS 119 Ca -0.07 2.26 0.02 0.00 -0.36 0.00 0.00 55.97 57.82 2wr7 s LYS 119 Cb -0.10 -3.84 -0.03 0.00 -1.51 0.00 0.00 37.83 32.35 2wr7 s LYS 119 CO -0.01 -0.80 0.03 0.44 -0.36 0.00 0.00 175.35 174.65 2wr7 n ILE 120 N 5.17 0.06 -3.38 5.43 -5.35 0.15 -4.89 119.36 116.55 2wr7 n ILE 120 Ca 0.17 -0.07 -0.26 0.00 -0.27 0.00 0.00 62.75 62.32 2wr7 n ILE 120 Cb 0.42 -0.16 -0.10 0.00 -1.74 0.00 0.00 39.64 38.06 2wr7 n ILE 120 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2wr7 s LEU 121 N -3.59 0.95 -0.01 7.28 1.43 0.06 -4.80 118.68 120.00 2wr7 s LEU 121 Ca -0.01 -2.53 -0.37 0.00 -1.03 0.00 0.00 54.13 50.18 2wr7 s LEU 121 Cb 0.01 -0.21 -0.16 0.00 0.03 0.00 0.00 46.19 45.86 2wr7 s LEU 121 CO 0.09 -0.22 1.46 -2.65 0.23 0.00 0.00 176.35 175.25 2wr7 n PRO 122 N 3.43 1.20 -0.29 1.29 -0.02 -1.26 -4.31 135.00 135.03 2wr7 n PRO 122 Ca 0.21 0.43 0.19 0.00 -2.02 0.00 0.00 63.50 62.32 2wr7 n PRO 122 Cb 0.44 -2.09 0.48 0.00 -0.02 0.00 0.00 33.50 32.30 2wr7 n PRO 122 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2wr7 h LYS 123 N 5.36 0.45 -0.00 -0.52 3.64 -1.95 -1.81 116.57 121.75 2wr7 h LYS 123 Ca -0.47 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 2wr7 h LYS 123 Cb 1.33 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 2wr7 h LYS 123 CO 0.83 0.30 -0.11 -0.25 -2.27 0.00 0.00 179.45 177.95 2wr7 n ASP 124 N -4.59 0.13 0.02 4.20 10.43 -1.26 -2.82 116.55 122.66 2wr7 n ASP 124 Ca 0.22 0.25 0.13 0.00 2.57 0.00 0.00 54.79 57.97 2wr7 n ASP 124 Cb 0.74 -0.31 0.49 0.00 1.84 0.00 0.00 41.12 43.88 2wr7 n ASP 124 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2wr7 n ARG 125 N -1.46 0.06 -1.37 -1.24 1.74 -0.68 -4.11 116.66 109.60 2wr7 n ARG 125 Ca 0.07 0.04 -0.38 0.00 -0.77 0.00 0.00 57.85 56.81 2wr7 n ARG 125 Cb 0.33 -1.57 -0.02 0.00 -1.02 0.00 0.00 32.46 30.18 2wr7 n ARG 125 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 2wr7 n TRP 126 N -1.67 2.63 -1.38 -1.55 7.02 -1.13 -4.91 117.44 116.45 2wr7 n TRP 126 Ca 0.06 -2.73 -0.29 0.00 -1.02 0.00 0.00 57.50 53.52 2wr7 n TRP 126 Cb 0.36 -2.30 0.13 0.00 -2.42 0.00 0.00 31.31 27.08 2wr7 n TRP 126 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2wr7 s THR 127 N 3.10 2.58 0.00 -0.99 -4.23 -1.26 -3.37 115.64 111.47 2wr7 s THR 127 Ca 0.55 0.19 0.00 0.00 -1.18 0.00 0.00 61.69 61.25 2wr7 s THR 127 Cb 0.15 -2.81 0.00 0.00 1.34 0.00 0.00 72.50 71.18 2wr7 s THR 127 CO -0.04 -0.25 0.00 0.00 -0.54 0.00 0.00 174.62 173.79 2wr7 n GLN 128 N -3.76 0.00 -4.27 3.99 6.02 -1.26 -4.98 117.38 113.13 2wr7 n GLN 128 Ca 0.07 0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.84 2wr7 n GLN 128 Cb 0.57 -1.61 -0.12 0.00 1.02 0.00 0.00 30.24 30.09 2wr7 n GLN 128 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 2wr7 s HIS 129 N -1.31 1.53 0.31 1.08 3.76 -1.22 -4.54 115.29 114.90 2wr7 s HIS 129 Ca 0.00 -0.43 -0.27 0.00 -0.15 0.00 0.00 55.06 54.21 2wr7 s HIS 129 Cb 0.00 -0.85 -0.09 0.00 1.11 0.00 0.00 32.58 32.74 2wr7 s HIS 129 CO 0.00 0.13 1.02 0.99 -0.85 0.00 0.00 174.74 176.03 2wr7 s THR 130 N -1.16 3.80 0.00 1.30 2.01 -0.29 -4.91 115.64 116.40 2wr7 s THR 130 Ca 0.03 1.63 0.00 0.00 0.31 0.00 0.00 61.69 63.66 2wr7 s THR 130 Cb -0.10 -3.97 0.00 0.00 0.01 0.00 0.00 72.50 68.44 2wr7 s THR 130 CO 0.03 0.25 0.25 1.07 -0.69 0.00 0.00 174.62 175.53 2wr7 n THR 131 N 0.80 0.00 1.14 -0.82 5.66 -1.26 -1.12 114.28 118.68 2wr7 n THR 131 Ca 0.01 -0.30 0.12 0.00 -3.05 0.00 0.00 64.05 60.83 2wr7 n THR 131 Cb 0.47 1.33 0.24 0.00 -1.55 0.00 0.00 70.33 70.83 2wr7 n THR 131 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2wr7 n THR 132 N -0.10 0.00 -1.54 1.09 -2.24 -1.26 -4.89 114.28 105.34 2wr7 n THR 132 Ca 0.00 -0.14 -0.41 0.00 -2.27 0.00 0.00 64.05 61.23 2wr7 n THR 132 Cb 0.08 0.64 0.01 0.00 -2.10 0.00 0.00 70.33 68.96 2wr7 n THR 132 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wr7 n GLY 133 N 1.39 -0.83 0.23 3.38 0.00 -1.26 -5.00 105.19 103.09 2wr7 n GLY 133 Ca 0.10 0.06 -0.01 0.00 0.00 0.00 0.00 46.02 46.17 2wr7 n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wr7 n GLY 134 N 1.48 2.09 3.38 -0.02 0.00 -1.26 -4.70 105.19 106.15 2wr7 n GLY 134 Ca 0.11 -1.08 -0.15 0.00 0.00 0.00 0.00 46.02 44.91 2wr7 n GLY 134 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wr7 s SER 135 N -1.13 -0.41 0.00 1.61 0.15 0.21 -4.87 113.70 109.27 2wr7 s SER 135 Ca 0.01 0.27 0.27 0.00 0.70 0.00 0.00 55.95 57.20 2wr7 s SER 135 Cb -0.00 0.45 1.40 0.00 -1.71 0.00 0.00 66.02 66.15 2wr7 s SER 135 CO 0.01 -0.61 1.93 0.54 1.20 0.00 0.00 173.24 176.31 2wr7 n ARG 136 N 0.78 0.44 0.20 5.44 1.74 -1.26 -1.87 116.66 122.12 2wr7 n ARG 136 Ca -0.19 0.03 0.07 0.00 -0.77 0.00 0.00 57.85 56.98 2wr7 n ARG 136 Cb 0.58 -1.50 0.36 0.00 -1.02 0.00 0.00 32.46 30.88 2wr7 n ARG 136 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wr7 h ALA 137 N 3.33 0.98 -1.26 7.54 0.00 -1.88 -3.02 119.26 124.95 2wr7 h ALA 137 Ca 0.00 -0.30 -0.65 0.00 0.00 0.00 0.00 54.91 53.97 2wr7 h ALA 137 Cb 0.22 -0.05 -0.37 0.00 0.00 0.00 0.00 17.79 17.59 2wr7 h ALA 137 CO 0.00 0.41 -0.11 0.00 0.00 0.00 0.00 179.25 179.55 2wr7 s ALA 139 N -3.73 3.24 -0.21 0.00 0.00 -1.14 -2.47 121.76 117.46 2wr7 s ALA 139 Ca 0.50 0.62 0.02 0.00 0.00 0.00 0.00 51.96 53.10 2wr7 s ALA 139 Cb 0.42 -3.33 0.04 0.00 0.00 0.00 0.00 23.12 20.25 2wr7 s ALA 139 CO -0.23 -0.17 -0.15 0.54 0.00 0.00 0.00 175.76 175.74 2wr7 s VAL 140 N 0.48 2.02 -1.15 0.00 0.11 -0.93 -4.73 120.40 116.20 2wr7 s VAL 140 Ca 0.51 -1.19 -0.00 0.00 -2.93 0.00 0.00 61.98 58.36 2wr7 s VAL 140 Cb -0.24 -1.98 -0.00 0.00 -1.53 0.00 0.00 36.38 32.63 2wr7 s VAL 140 CO 0.30 0.27 0.96 -1.20 -3.33 0.00 0.00 175.10 172.10 2wr7 n SER 141 N 4.57 -2.19 0.00 3.54 7.64 -1.26 -2.91 113.62 123.00 2wr7 n SER 141 Ca -0.17 -0.60 0.00 0.00 1.01 0.00 0.00 58.87 59.11 2wr7 n SER 141 Cb 0.47 -4.97 0.00 0.00 -1.01 0.00 0.00 64.21 58.70 2wr7 n SER 141 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wr7 n GLY 142 N -1.13 0.36 3.86 0.23 0.00 -1.26 -4.93 105.19 102.32 2wr7 n GLY 142 Ca -0.27 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 2wr7 n GLY 142 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wr7 s ASN 143 N -2.26 6.63 -0.00 1.61 0.01 -1.15 -5.03 114.94 114.76 2wr7 s ASN 143 Ca 0.00 0.76 -0.32 0.00 -0.71 0.00 0.00 52.86 52.59 2wr7 s ASN 143 Cb 0.00 -2.17 -0.10 0.00 0.41 0.00 0.00 41.25 39.39 2wr7 s ASN 143 CO 0.00 0.30 1.94 -2.65 -1.51 0.00 0.00 177.10 175.18 2wr7 n PRO 144 N 1.53 2.64 0.00 -0.60 -0.02 -1.26 -2.19 135.00 135.09 2wr7 n PRO 144 Ca -0.13 0.97 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2wr7 n PRO 144 Cb 0.53 -2.88 0.00 0.00 -0.02 0.00 0.00 33.50 31.12 2wr7 n PRO 144 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2wr7 n SER 145 N 7.17 1.75 -3.48 2.55 2.88 -1.03 -4.60 113.62 118.85 2wr7 n SER 145 Ca 0.21 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.67 2wr7 n SER 145 Cb 0.37 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.83 2wr7 n SER 145 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 2wr7 s PHE 146 N 1.13 -0.06 -0.02 0.66 5.36 -1.25 0.66 117.98 124.44 2wr7 s PHE 146 Ca 0.00 -0.48 -0.34 0.00 -0.96 0.00 0.00 56.93 55.14 2wr7 s PHE 146 Cb 0.00 0.76 -0.13 0.00 -0.34 0.00 0.00 43.02 43.32 2wr7 s PHE 146 CO 0.00 -1.37 1.78 1.19 -1.46 0.00 0.00 175.22 175.35 2wr7 n PHE 147 N -0.49 2.28 0.29 10.12 3.01 -1.26 -4.63 117.46 126.77 2wr7 n PHE 147 Ca -0.06 0.11 0.14 0.00 1.01 0.00 0.00 57.45 58.66 2wr7 n PHE 147 Cb 0.59 -2.61 0.86 0.00 -0.01 0.00 0.00 39.48 38.31 2wr7 n PHE 147 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2wr7 h ARG 148 N 8.07 0.00 0.00 -1.08 2.47 -0.70 -2.29 114.38 120.84 2wr7 h ARG 148 Ca -0.47 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.25 2wr7 h ARG 148 Cb 1.27 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.59 2wr7 h ARG 148 CO 0.93 0.03 -1.18 0.09 0.56 0.00 0.00 179.97 180.40 2wr7 n ASN 149 N -3.86 0.68 -4.78 7.04 3.02 -0.86 -4.96 115.26 111.53 2wr7 n ASN 149 Ca -0.03 -0.57 -0.23 0.00 -0.03 0.00 0.00 54.58 53.73 2wr7 n ASN 149 Cb 0.11 1.11 -0.05 0.00 -0.61 0.00 0.00 39.78 40.34 2wr7 n ASN 149 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2wr7 s MET 150 N -3.15 2.79 0.00 3.52 -1.94 -0.86 -1.16 119.30 118.50 2wr7 s MET 150 Ca 0.04 -1.10 0.00 0.00 -1.71 0.00 0.00 55.69 52.92 2wr7 s MET 150 Cb 0.15 -2.49 0.00 0.00 2.01 0.00 0.00 34.83 34.50 2wr7 s MET 150 CO 0.85 0.40 0.00 0.28 -0.01 0.00 0.00 175.02 176.55 2wr7 n VAL 151 N -1.01 0.00 -3.29 -6.03 0.31 0.17 -4.75 118.33 103.74 2wr7 n VAL 151 Ca -0.08 0.00 0.03 0.00 -0.01 0.00 0.00 64.34 64.28 2wr7 n VAL 151 Cb 0.58 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.49 2wr7 n VAL 151 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2wr7 s LEU 153 N 0.00 -1.07 0.44 7.52 1.02 -1.22 -1.63 118.68 123.74 2wr7 s LEU 153 Ca 0.00 0.91 0.06 0.00 0.02 0.00 0.00 54.13 55.12 2wr7 s LEU 153 Cb 0.00 1.99 -0.05 0.00 0.02 0.00 0.00 46.19 48.16 2wr7 s LEU 153 CO 0.00 -0.20 0.12 0.42 0.02 0.00 0.00 176.35 176.71 2wr7 s THR 154 N 2.83 1.96 0.40 5.49 -4.23 -0.27 -4.62 115.64 117.20 2wr7 s THR 154 Ca 0.08 -1.82 -0.26 0.00 -1.18 0.00 0.00 61.69 58.51 2wr7 s THR 154 Cb -0.12 -2.78 -0.09 0.00 1.34 0.00 0.00 72.50 70.85 2wr7 s THR 154 CO -0.18 0.00 1.28 -1.83 -0.54 0.00 0.00 174.62 173.35 2wr7 s GLU 155 N -3.88 4.02 -0.21 3.99 -1.05 0.42 -1.14 118.70 120.85 2wr7 s GLU 155 Ca 0.33 2.11 0.01 0.00 -0.15 0.00 0.00 54.97 57.27 2wr7 s GLU 155 Cb 0.05 -2.78 0.05 0.00 -0.44 0.00 0.00 34.13 31.01 2wr7 s GLU 155 CO 0.18 -0.43 -0.10 0.21 0.95 0.00 0.00 175.26 176.07 2wr7 s LYS 156 N -2.20 1.98 0.00 -4.83 2.20 -0.64 -4.30 119.74 111.95 2wr7 s LYS 156 Ca 0.56 -0.89 0.00 0.00 -0.36 0.00 0.00 55.97 55.28 2wr7 s LYS 156 Cb -0.37 -2.47 0.00 0.00 -1.51 0.00 0.00 37.83 33.48 2wr7 s LYS 156 CO 0.48 -0.46 0.00 0.41 -0.36 0.00 0.00 175.35 175.42 2wr7 n GLY 157 N 4.67 2.25 0.00 5.54 0.00 -1.26 -3.17 105.19 113.22 2wr7 n GLY 157 Ca -0.14 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.55 2wr7 n GLY 157 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2wr7 n SER 158 N 1.23 0.00 -3.74 1.61 7.64 -1.26 -5.15 113.62 113.94 2wr7 n SER 158 Ca 0.00 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.76 2wr7 n SER 158 Cb 0.00 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.08 2wr7 n SER 158 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 2wr7 s ASN 159 N -0.54 -0.29 -0.55 6.43 3.84 -1.19 -4.95 114.94 117.69 2wr7 s ASN 159 Ca 0.00 0.56 0.04 0.00 0.21 0.00 0.00 52.86 53.67 2wr7 s ASN 159 Cb 0.00 0.48 0.15 0.00 -0.55 0.00 0.00 41.25 41.33 2wr7 s ASN 159 CO 0.00 -0.15 0.35 -0.47 -2.79 0.00 0.00 177.10 174.05 2wr7 s TYR 160 N 0.95 2.69 0.81 0.43 5.04 -1.26 -1.62 117.35 124.40 2wr7 s TYR 160 Ca -0.07 -2.91 -0.11 0.00 -2.44 0.00 0.00 57.07 51.55 2wr7 s TYR 160 Cb -0.08 -2.25 0.08 0.00 0.35 0.00 0.00 41.96 40.07 2wr7 s TYR 160 CO -0.06 -0.69 1.11 -2.14 -1.34 0.00 0.00 175.55 172.42 2wr7 s PRO 161 N -0.50 1.92 -0.03 4.97 0.02 -1.26 -4.84 135.00 135.28 2wr7 s PRO 161 Ca 0.22 1.29 -0.38 0.00 0.02 0.00 0.00 61.00 62.16 2wr7 s PRO 161 Cb -0.13 -1.85 -0.16 0.00 0.02 0.00 0.00 34.50 32.37 2wr7 s PRO 161 CO -0.09 -1.92 1.47 0.28 -0.33 0.00 0.00 177.00 176.41 2wr7 n VAL 162 N -3.68 0.10 -3.64 3.83 0.31 -1.26 -4.87 118.33 109.12 2wr7 n VAL 162 Ca 0.10 -0.02 -0.37 0.00 -0.01 0.00 0.00 64.34 64.04 2wr7 n VAL 162 Cb 0.53 -0.94 -0.10 0.00 -0.91 0.00 0.00 33.84 32.42 2wr7 n VAL 162 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wr7 s ALA 163 N 1.44 3.59 -0.04 3.52 0.00 -0.11 -4.95 121.76 125.21 2wr7 s ALA 163 Ca 0.89 -0.91 0.03 0.00 0.00 0.00 0.00 51.96 51.97 2wr7 s ALA 163 Cb -0.99 -2.37 0.00 0.00 0.00 0.00 0.00 23.12 19.76 2wr7 s ALA 163 CO 0.53 -0.26 -0.14 0.15 0.00 0.00 0.00 175.76 176.04 2wr7 s LYS 164 N 1.19 1.50 0.02 0.00 1.02 -1.26 -0.77 119.74 121.44 2wr7 s LYS 164 Ca 0.08 -0.47 0.01 0.00 0.02 0.00 0.00 55.97 55.60 2wr7 s LYS 164 Cb -0.14 -1.31 -0.02 0.00 -0.52 0.00 0.00 37.83 35.84 2wr7 s LYS 164 CO 0.06 0.16 -0.04 0.20 -0.92 0.00 0.00 175.35 174.81 2wr7 s GLY 165 N 0.20 0.30 0.14 -3.33 0.00 -0.61 -5.00 107.32 99.02 2wr7 s GLY 165 Ca -0.05 -0.61 -0.14 0.00 0.00 0.00 0.00 44.72 43.92 2wr7 s GLY 165 CO 0.02 -0.67 0.37 -1.35 0.00 0.00 0.00 173.10 171.46 2wr7 s SER 166 N -1.43 -0.12 -0.16 1.64 1.04 -1.26 -0.24 113.70 113.18 2wr7 s SER 166 Ca -0.14 -0.53 -0.09 0.00 0.48 0.00 0.00 55.95 55.68 2wr7 s SER 166 Cb -0.10 0.46 0.06 0.00 0.10 0.00 0.00 66.02 66.55 2wr7 s SER 166 CO -0.01 -0.88 0.38 -0.47 0.98 0.00 0.00 173.24 173.24 2wr7 s TYR 167 N -3.86 -0.55 -0.27 5.02 5.04 -0.64 -4.97 117.35 117.12 2wr7 s TYR 167 Ca 0.08 1.19 -0.14 0.00 -2.44 0.00 0.00 57.07 55.76 2wr7 s TYR 167 Cb 0.02 0.22 -0.04 0.00 0.35 0.00 0.00 41.96 42.51 2wr7 s TYR 167 CO -0.07 -0.32 0.31 1.21 -1.34 0.00 0.00 175.55 175.34 2wr7 s ASN 168 N 1.36 6.19 -0.95 4.32 3.84 -1.26 -1.16 114.94 127.28 2wr7 s ASN 168 Ca -0.09 0.21 -0.24 0.00 0.21 0.00 0.00 52.86 52.95 2wr7 s ASN 168 Cb -0.09 -2.18 -0.04 0.00 -0.55 0.00 0.00 41.25 38.40 2wr7 s ASN 168 CO -0.12 -0.13 1.88 0.21 -2.79 0.00 0.00 177.10 176.16 2wr7 s ASN 169 N 1.60 5.33 -0.06 -4.21 3.84 0.48 -4.67 114.94 117.25 2wr7 s ASN 169 Ca 0.13 -0.89 0.18 0.00 0.21 0.00 0.00 52.86 52.49 2wr7 s ASN 169 Cb -0.16 -2.56 0.62 0.00 -0.55 0.00 0.00 41.25 38.60 2wr7 s ASN 169 CO 0.10 -2.59 1.51 0.35 -2.79 0.00 0.00 177.10 173.68 2wr7 n THR 170 N 7.72 1.32 1.08 -5.21 -2.24 -1.26 -0.48 114.28 115.21 2wr7 n THR 170 Ca 0.40 -0.97 0.11 0.00 -2.27 0.00 0.00 64.05 61.32 2wr7 n THR 170 Cb 0.47 0.22 0.57 0.00 -2.10 0.00 0.00 70.33 69.50 2wr7 n THR 170 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2wr7 n SER 171 N 1.16 0.00 0.00 3.42 3.41 -1.26 -4.85 113.62 115.50 2wr7 n SER 171 Ca 0.23 -0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.76 2wr7 n SER 171 Cb 0.70 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 2wr7 n SER 171 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wr7 n GLY 172 N 0.61 0.48 3.44 5.00 0.00 -1.26 -5.00 105.19 108.47 2wr7 n GLY 172 Ca 0.11 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.02 2wr7 n GLY 172 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wr7 s GLU 173 N -0.35 1.51 0.60 1.61 2.02 -1.26 -5.07 118.70 117.76 2wr7 s GLU 173 Ca 0.00 -1.48 -0.19 0.00 0.02 0.00 0.00 54.97 53.33 2wr7 s GLU 173 Cb 0.00 0.40 -0.03 0.00 0.10 0.00 0.00 34.13 34.60 2wr7 s GLU 173 CO 0.00 -0.59 1.20 -0.65 0.02 0.00 0.00 175.26 175.24 2wr7 s GLN 174 N -3.88 2.95 -0.07 1.61 -0.21 -1.25 -4.36 119.66 114.46 2wr7 s GLN 174 Ca 0.29 1.80 -0.00 0.00 0.02 0.00 0.00 55.36 57.47 2wr7 s GLN 174 Cb 0.02 -1.93 0.02 0.00 1.00 0.00 0.00 33.01 32.12 2wr7 s GLN 174 CO 0.12 -1.21 -0.04 1.41 -2.12 0.00 0.00 175.29 173.45 2wr7 s MET 175 N -3.37 0.96 -0.00 2.91 1.75 -0.37 -0.85 119.30 120.33 2wr7 s MET 175 Ca 0.77 -0.08 -0.30 0.00 -1.25 0.00 0.00 55.69 54.83 2wr7 s MET 175 Cb -0.30 -1.10 -0.05 0.00 2.84 0.00 0.00 34.83 36.22 2wr7 s MET 175 CO 0.33 -0.20 1.31 -1.17 -0.65 0.00 0.00 175.02 174.64 2wr7 s LEU 176 N 1.50 4.31 -0.05 4.11 2.96 -0.06 -0.11 118.68 131.34 2wr7 s LEU 176 Ca -0.01 2.02 0.01 0.00 -0.22 0.00 0.00 54.13 55.93 2wr7 s LEU 176 Cb -0.13 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 43.02 2wr7 s LEU 176 CO -0.04 -0.64 -0.06 -0.63 -1.32 0.00 0.00 176.35 173.67 2wr7 s ILE 177 N 2.10 0.63 0.07 6.68 1.01 -0.28 -1.02 121.20 130.38 2wr7 s ILE 177 Ca 0.61 -0.17 0.08 0.00 0.00 0.00 0.00 60.65 61.17 2wr7 s ILE 177 Cb -0.29 -0.64 -0.03 0.00 0.01 0.00 0.00 42.46 41.50 2wr7 s ILE 177 CO 0.26 0.25 -0.21 -0.63 0.00 0.00 0.00 174.94 174.61 2wr7 s ILE 178 N 0.93 2.63 0.14 2.92 1.01 -1.26 -1.39 121.20 126.17 2wr7 s ILE 178 Ca -0.11 -1.35 -0.12 0.00 0.00 0.00 0.00 60.65 59.07 2wr7 s ILE 178 Cb -0.14 -2.12 0.01 0.00 0.01 0.00 0.00 42.46 40.22 2wr7 s ILE 178 CO 0.00 0.27 0.33 -1.66 0.00 0.00 0.00 174.94 173.88 2wr7 s TRP 179 N -0.96 0.11 0.11 3.97 -2.14 -0.24 -4.06 118.94 115.73 2wr7 s TRP 179 Ca 0.15 -0.47 0.04 0.00 2.66 0.00 0.00 56.10 58.47 2wr7 s TRP 179 Cb -0.10 0.10 -0.04 0.00 -3.10 0.00 0.00 33.47 30.33 2wr7 s TRP 179 CO 0.06 -0.71 -0.10 0.20 -2.66 0.00 0.00 176.95 173.73 2wr7 s GLY 180 N -2.89 0.91 -0.07 3.67 0.00 0.54 -0.74 107.32 108.75 2wr7 s GLY 180 Ca 0.10 -1.28 0.05 0.00 0.00 0.00 0.00 44.72 43.59 2wr7 s GLY 180 CO -0.06 -1.36 -0.23 0.14 0.00 0.00 0.00 173.10 171.59 2wr7 s VAL 181 N -2.70 2.18 -0.26 1.40 1.01 -0.20 -0.50 120.40 121.34 2wr7 s VAL 181 Ca 0.09 -1.01 -0.17 0.00 0.00 0.00 0.00 61.98 60.88 2wr7 s VAL 181 Cb -0.01 -1.81 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 2wr7 s VAL 181 CO 0.00 0.57 0.48 -2.28 0.00 0.00 0.00 175.10 173.87 2wr7 s HIS 182 N -0.10 3.27 -0.43 5.22 2.46 -0.11 -0.50 115.29 125.09 2wr7 s HIS 182 Ca -0.05 0.59 -0.14 0.00 0.47 0.00 0.00 55.06 55.93 2wr7 s HIS 182 Cb -0.14 -2.68 0.05 0.00 -0.13 0.00 0.00 32.58 29.68 2wr7 s HIS 182 CO 0.04 -0.26 0.31 -1.01 -2.47 0.00 0.00 174.74 171.36 2wr7 s HIS 183 N 2.21 3.25 0.63 3.88 3.76 0.30 -4.63 115.29 124.69 2wr7 s HIS 183 Ca 0.20 -0.90 -0.15 0.00 -0.15 0.00 0.00 55.06 54.06 2wr7 s HIS 183 Cb -0.16 -2.82 -0.02 0.00 1.11 0.00 0.00 32.58 30.70 2wr7 s HIS 183 CO 0.09 -0.71 1.06 -2.14 -0.85 0.00 0.00 174.74 172.20 2wr7 s PRO 184 N 1.61 3.15 0.33 8.40 0.02 -1.24 -0.99 135.00 146.27 2wr7 s PRO 184 Ca 0.04 1.18 0.12 0.00 0.02 0.00 0.00 61.00 62.36 2wr7 s PRO 184 Cb -0.21 -2.01 0.57 0.00 0.02 0.00 0.00 34.50 32.87 2wr7 s PRO 184 CO 0.07 -0.95 1.74 -0.97 -0.33 0.00 0.00 177.00 176.56 2wr7 h ASN 185 N 0.12 0.00 -5.04 2.53 -1.24 -1.82 -1.74 115.58 108.39 2wr7 h ASN 185 Ca -0.46 0.00 -0.03 0.00 0.71 0.00 0.00 56.30 56.51 2wr7 h ASN 185 Cb 1.22 0.00 -0.12 0.00 0.73 0.00 0.00 38.32 40.15 2wr7 h ASN 185 CO 0.57 0.47 0.07 1.51 -1.29 0.00 0.00 177.43 178.76 2wr7 s ASP 186 N -6.87 -0.39 0.49 1.15 -4.77 -1.26 -2.81 116.67 102.20 2wr7 s ASP 186 Ca -0.02 -0.18 0.14 0.00 -3.30 0.00 0.00 52.55 49.18 2wr7 s ASP 186 Cb 0.14 0.54 1.15 0.00 -1.09 0.00 0.00 42.92 43.66 2wr7 s ASP 186 CO 0.74 -0.92 2.12 -0.08 0.70 0.00 0.00 175.17 177.72 2wr7 h GLU 187 N 2.18 0.14 0.02 2.11 4.81 -1.92 -1.93 114.58 119.99 2wr7 h GLU 187 Ca -0.34 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 58.88 2wr7 h GLU 187 Cb 1.28 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.63 2wr7 h GLU 187 CO 0.42 0.10 -0.01 1.15 -0.73 0.00 0.00 179.01 179.94 2wr7 h THR 188 N 0.14 1.12 -0.87 0.32 2.02 -2.00 -1.07 112.91 112.58 2wr7 h THR 188 Ca 0.04 -0.45 0.17 0.00 0.77 0.00 0.00 66.41 66.94 2wr7 h THR 188 Cb 0.01 1.43 -0.07 0.00 -1.74 0.00 0.00 68.15 67.78 2wr7 h THR 188 CO -0.01 0.12 0.57 -0.08 0.37 0.00 0.00 175.52 176.49 2wr7 h GLU 189 N -0.22 0.50 0.12 6.66 4.81 -1.79 -1.90 114.58 122.76 2wr7 h GLU 189 Ca -0.00 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 2wr7 h GLU 189 Cb 0.21 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.48 2wr7 h GLU 189 CO 0.00 0.33 -0.06 0.37 -0.73 0.00 0.00 179.01 178.93 2wr7 h GLN 190 N 0.52 -0.16 -0.48 1.92 5.75 -0.70 -2.74 115.11 119.22 2wr7 h GLN 190 Ca 0.45 0.01 -0.09 0.00 -0.15 0.00 0.00 58.65 58.87 2wr7 h GLN 190 Cb 0.95 0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.52 2wr7 h GLN 190 CO -0.19 0.25 -0.06 0.00 -2.65 0.00 0.00 178.83 176.18 2wr7 h ARG 191 N -0.61 0.84 0.00 1.69 3.08 -0.83 0.15 114.38 118.69 2wr7 h ARG 191 Ca -0.02 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2wr7 h ARG 191 Cb 0.48 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.45 2wr7 h ARG 191 CO 0.03 0.88 0.00 1.79 -1.07 0.00 0.00 179.97 181.59 2wr7 h THR 192 N 0.77 0.00 0.13 2.04 1.35 -1.47 0.30 112.91 116.02 2wr7 h THR 192 Ca 0.14 -0.83 -0.26 0.00 -0.55 0.00 0.00 66.41 64.91 2wr7 h THR 192 Cb 0.55 1.82 0.00 0.00 -1.73 0.00 0.00 68.15 68.79 2wr7 h THR 192 CO 0.03 0.00 -1.30 -0.07 -0.25 0.00 0.00 175.52 173.94 2wr7 h LEU 193 N 0.00 0.43 -1.08 3.87 3.38 -1.12 -3.44 115.31 117.34 2wr7 h LEU 193 Ca 0.00 -0.88 0.00 0.00 0.09 0.00 0.00 57.88 57.09 2wr7 h LEU 193 Cb 0.85 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.46 2wr7 h LEU 193 CO 0.00 1.58 0.00 -1.22 0.09 0.00 0.00 178.44 178.89 2wr7 n TYR 194 N -3.95 0.00 0.00 1.13 4.02 0.49 -0.44 117.16 118.41 2wr7 n TYR 194 Ca -0.22 -0.10 0.00 0.00 -0.01 0.00 0.00 57.90 57.57 2wr7 n TYR 194 Cb 0.90 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 40.21 2wr7 n TYR 194 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2wr7 n GLN 195 N -0.10 0.00 -1.21 -0.72 1.13 0.10 -4.45 117.38 112.14 2wr7 n GLN 195 Ca 0.00 0.00 -0.30 0.00 -1.94 0.00 0.00 57.00 54.76 2wr7 n GLN 195 Cb 0.20 0.00 0.13 0.00 0.11 0.00 0.00 30.24 30.68 2wr7 n GLN 195 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 2wr7 s ASN 196 N 0.00 3.65 -0.02 1.08 0.02 -1.26 -4.70 114.94 113.70 2wr7 s ASN 196 Ca 0.00 1.55 -0.01 0.00 -1.02 0.00 0.00 52.86 53.38 2wr7 s ASN 196 Cb 0.00 -2.23 -0.01 0.00 0.02 0.00 0.00 41.25 39.03 2wr7 s ASN 196 CO 0.00 -2.54 -0.03 0.52 0.02 0.00 0.00 177.10 175.08 2wr7 n VAL 197 N -3.82 0.14 -1.87 1.60 0.31 -1.26 -4.63 118.33 108.79 2wr7 n VAL 197 Ca 0.07 -0.04 -0.36 0.00 -0.01 0.00 0.00 64.34 64.01 2wr7 n VAL 197 Cb 0.55 -1.28 -0.02 0.00 -0.91 0.00 0.00 33.84 32.18 2wr7 n VAL 197 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wr7 n GLY 198 N 2.99 5.02 3.92 2.92 0.00 -1.26 -4.97 105.19 113.80 2wr7 n GLY 198 Ca -0.05 -2.06 -0.27 0.00 0.00 0.00 0.00 46.02 43.64 2wr7 n GLY 198 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wr7 s THR 199 N -2.01 2.43 0.20 2.61 -4.23 -1.26 -5.04 115.64 108.34 2wr7 s THR 199 Ca 0.54 -0.12 -0.13 0.00 -1.18 0.00 0.00 61.69 60.81 2wr7 s THR 199 Cb 0.27 -3.08 0.01 0.00 1.34 0.00 0.00 72.50 71.03 2wr7 s THR 199 CO -0.16 -0.09 0.42 -0.72 -0.54 0.00 0.00 174.62 173.53 2wr7 s TYR 200 N -3.32 0.20 -0.02 3.99 -0.85 -1.26 -4.37 117.35 111.73 2wr7 s TYR 200 Ca 0.60 -0.56 0.02 0.00 -0.52 0.00 0.00 57.07 56.61 2wr7 s TYR 200 Cb -0.11 0.17 0.00 0.00 0.38 0.00 0.00 41.96 42.41 2wr7 s TYR 200 CO 0.46 -0.86 -0.08 0.08 -1.52 0.00 0.00 175.55 173.63 2wr7 s VAL 201 N -3.95 0.71 -0.19 -3.49 1.01 0.30 -2.40 120.40 112.38 2wr7 s VAL 201 Ca 0.16 -0.33 -0.04 0.00 0.00 0.00 0.00 61.98 61.77 2wr7 s VAL 201 Cb 0.01 -0.63 0.06 0.00 0.00 0.00 0.00 36.38 35.82 2wr7 s VAL 201 CO 0.01 0.22 0.07 -0.55 0.00 0.00 0.00 175.10 174.85 2wr7 s SER 202 N 0.12 2.73 -0.08 3.32 0.15 0.01 -0.08 113.70 119.88 2wr7 s SER 202 Ca -0.02 -0.78 -0.00 0.00 0.70 0.00 0.00 55.95 55.85 2wr7 s SER 202 Cb -0.07 -0.44 -0.03 0.00 -1.71 0.00 0.00 66.02 63.77 2wr7 s SER 202 CO 0.00 -0.34 -0.05 -0.69 1.20 0.00 0.00 173.24 173.37 2wr7 s VAL 203 N 1.98 3.88 -0.15 4.45 1.01 -0.07 -1.76 120.40 129.74 2wr7 s VAL 203 Ca 0.01 -0.41 -0.17 0.00 0.00 0.00 0.00 61.98 61.41 2wr7 s VAL 203 Cb -0.17 -2.60 0.04 0.00 0.00 0.00 0.00 36.38 33.66 2wr7 s VAL 203 CO -0.10 0.60 0.47 -0.83 0.00 0.00 0.00 175.10 175.23 2wr7 s GLY 204 N -0.79 -0.35 0.00 4.51 0.00 -0.89 -1.46 107.32 108.34 2wr7 s GLY 204 Ca 0.12 1.22 0.00 0.00 0.00 0.00 0.00 44.72 46.06 2wr7 s GLY 204 CO 0.02 1.02 0.00 -1.30 0.00 0.00 0.00 173.10 172.84 2wr7 n THR 205 N 2.54 0.00 0.41 0.90 -2.24 -0.35 -0.74 114.28 114.81 2wr7 n THR 205 Ca -0.15 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.77 2wr7 n THR 205 Cb 0.57 0.00 0.49 0.00 -2.10 0.00 0.00 70.33 69.29 2wr7 n THR 205 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2wr7 h SER 206 N 0.00 0.00 0.00 3.42 0.02 -2.00 -3.34 113.55 111.65 2wr7 h SER 206 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2wr7 h SER 206 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2wr7 h SER 206 CO 0.00 0.00 -0.75 0.41 -1.14 0.00 0.00 176.83 175.35 2wr7 n THR 207 N -2.45 0.00 -4.05 -2.27 -1.04 -1.26 -5.02 114.28 98.20 2wr7 n THR 207 Ca 0.03 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.68 2wr7 n THR 207 Cb 0.30 -0.60 -0.08 0.00 -1.82 0.00 0.00 70.33 68.13 2wr7 n THR 207 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 2wr7 s LEU 208 N -3.74 4.02 -0.15 -4.42 2.96 -1.25 -5.08 118.68 111.01 2wr7 s LEU 208 Ca 0.00 0.28 -0.03 0.00 -0.22 0.00 0.00 54.13 54.16 2wr7 s LEU 208 Cb 0.00 -1.97 0.05 0.00 0.50 0.00 0.00 46.19 44.77 2wr7 s LEU 208 CO 0.00 0.34 0.03 0.21 -1.32 0.00 0.00 176.35 175.61 2wr7 s ASN 209 N -0.64 2.44 -0.10 3.68 2.47 -1.26 -1.21 114.94 120.32 2wr7 s ASN 209 Ca 0.12 -0.57 -0.05 0.00 0.42 0.00 0.00 52.86 52.78 2wr7 s ASN 209 Cb -0.12 -0.51 0.05 0.00 -1.45 0.00 0.00 41.25 39.22 2wr7 s ASN 209 CO 0.02 -0.28 0.23 -0.75 -3.72 0.00 0.00 177.10 172.61 2wr7 s LYS 210 N 1.92 0.18 -0.08 0.43 2.20 -0.54 -5.04 119.74 118.82 2wr7 s LYS 210 Ca 0.01 0.53 0.03 0.00 -0.36 0.00 0.00 55.97 56.18 2wr7 s LYS 210 Cb -0.15 -0.13 0.01 0.00 -1.51 0.00 0.00 37.83 36.05 2wr7 s LYS 210 CO -0.07 -0.18 -0.17 0.50 -0.36 0.00 0.00 175.35 175.07 2wr7 s ARG 211 N 1.36 2.26 0.09 4.03 3.52 -1.26 -0.89 118.95 128.06 2wr7 s ARG 211 Ca -0.08 -0.62 0.08 0.00 -0.13 0.00 0.00 55.73 54.98 2wr7 s ARG 211 Cb -0.11 -1.78 -0.03 0.00 -1.56 0.00 0.00 34.95 31.47 2wr7 s ARG 211 CO -0.08 0.10 -0.21 -1.12 -0.81 0.00 0.00 175.30 173.18 2wr7 s SER 212 N 0.49 2.59 -0.06 -2.12 0.01 0.89 -4.97 113.70 110.53 2wr7 s SER 212 Ca -0.16 -0.66 0.05 0.00 1.31 0.00 0.00 55.95 56.50 2wr7 s SER 212 Cb -0.16 -0.16 -0.01 0.00 0.21 0.00 0.00 66.02 65.90 2wr7 s SER 212 CO 0.06 0.09 -0.21 0.42 0.41 0.00 0.00 173.24 174.00 2wr7 s THR 213 N -1.07 1.78 0.60 1.44 -4.23 -1.26 -0.54 115.64 112.35 2wr7 s THR 213 Ca 0.07 -0.90 -0.19 0.00 -1.18 0.00 0.00 61.69 59.49 2wr7 s THR 213 Cb -0.10 -1.52 -0.03 0.00 1.34 0.00 0.00 72.50 72.19 2wr7 s THR 213 CO 0.04 0.50 1.25 -2.84 -0.54 0.00 0.00 174.62 173.03 2wr7 s PRO 214 N -0.01 2.87 -0.39 3.99 0.02 -1.26 -5.00 135.00 135.22 2wr7 s PRO 214 Ca -0.05 1.95 -0.08 0.00 0.02 0.00 0.00 61.00 62.83 2wr7 s PRO 214 Cb -0.13 -1.95 0.06 0.00 0.02 0.00 0.00 34.50 32.50 2wr7 s PRO 214 CO 0.04 -1.31 0.20 -0.51 -0.33 0.00 0.00 177.00 175.08 2wr7 s ASP 215 N -1.45 5.51 -0.32 2.53 1.01 -1.26 -5.01 116.67 117.67 2wr7 s ASP 215 Ca 0.78 -1.39 -0.24 0.00 0.71 0.00 0.00 52.55 52.42 2wr7 s ASP 215 Cb -0.34 -1.94 0.00 0.00 1.01 0.00 0.00 42.92 41.66 2wr7 s ASP 215 CO 0.37 -0.46 0.80 -0.63 0.21 0.00 0.00 175.17 175.46 2wr7 s ILE 216 N 1.41 4.76 -0.21 0.77 1.01 -1.26 -3.73 121.20 123.95 2wr7 s ILE 216 Ca 0.02 1.12 -0.32 0.00 0.00 0.00 0.00 60.65 61.46 2wr7 s ILE 216 Cb -0.22 -4.18 0.15 0.00 0.01 0.00 0.00 42.46 38.23 2wr7 s ILE 216 CO 0.02 -0.31 1.22 0.00 0.00 0.00 0.00 174.94 175.86 2wr7 s ALA 217 N 3.03 -2.06 -0.00 9.38 0.00 -0.65 -4.90 121.76 126.55 2wr7 s ALA 217 Ca 0.33 1.68 -0.30 0.00 0.00 0.00 0.00 51.96 53.67 2wr7 s ALA 217 Cb -0.14 -0.63 -0.03 0.00 0.00 0.00 0.00 23.12 22.32 2wr7 s ALA 217 CO 0.14 -0.44 0.97 0.99 0.00 0.00 0.00 175.76 177.42 2wr7 s THR 218 N -1.78 4.87 0.07 0.00 2.01 -1.13 -4.19 115.64 115.50 2wr7 s THR 218 Ca 0.07 2.05 0.02 0.00 0.31 0.00 0.00 61.69 64.14 2wr7 s THR 218 Cb -0.01 -4.31 -0.03 0.00 0.01 0.00 0.00 72.50 68.16 2wr7 s THR 218 CO -0.05 0.16 -0.08 -0.13 -0.69 0.00 0.00 174.62 173.83 2wr7 s ARG 219 N 1.01 0.67 0.22 4.92 0.52 -1.26 -5.12 118.95 119.91 2wr7 s ARG 219 Ca 0.52 -0.98 -0.29 0.00 -0.52 0.00 0.00 55.73 54.45 2wr7 s ARG 219 Cb -0.21 -0.33 -0.16 0.00 0.52 0.00 0.00 34.95 34.77 2wr7 s ARG 219 CO 0.28 0.04 0.81 -2.30 0.02 0.00 0.00 175.30 174.15 2wr7 n PRO 220 N 0.91 0.64 -2.56 3.54 -0.02 -1.26 -4.48 135.00 131.77 2wr7 n PRO 220 Ca -0.19 0.23 -0.41 0.00 -2.02 0.00 0.00 63.50 61.11 2wr7 n PRO 220 Cb 0.57 -1.45 -0.04 0.00 -0.02 0.00 0.00 33.50 32.55 2wr7 n PRO 220 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2wr7 s LYS 221 N -1.07 4.60 -0.14 -0.52 1.02 -1.26 -4.58 119.74 117.79 2wr7 s LYS 221 Ca 0.65 1.65 -0.01 0.00 0.02 0.00 0.00 55.97 58.27 2wr7 s LYS 221 Cb -0.85 -3.32 0.04 0.00 -0.52 0.00 0.00 37.83 33.18 2wr7 s LYS 221 CO 0.57 0.06 -0.01 0.08 -0.92 0.00 0.00 175.35 175.13 2wr7 s VAL 222 N 0.04 0.70 -1.46 3.17 1.01 -0.47 -4.58 120.40 118.80 2wr7 s VAL 222 Ca 0.50 -0.33 -0.04 0.00 0.00 0.00 0.00 61.98 62.11 2wr7 s VAL 222 Cb -0.28 -0.94 0.03 0.00 0.00 0.00 0.00 36.38 35.20 2wr7 s VAL 222 CO 0.33 0.10 0.55 0.59 0.00 0.00 0.00 175.10 176.67 2wr7 n ASN 223 N 5.02 -1.23 0.00 3.32 3.02 -1.26 -2.03 115.26 122.10 2wr7 n ASN 223 Ca -0.10 -0.97 0.00 0.00 -0.03 0.00 0.00 54.58 53.48 2wr7 n ASN 223 Cb 0.49 -3.15 0.00 0.00 -0.61 0.00 0.00 39.78 36.51 2wr7 n ASN 223 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wr7 n GLY 224 N -1.83 0.31 3.60 7.41 0.00 -1.26 -4.78 105.19 108.63 2wr7 n GLY 224 Ca -0.22 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.46 2wr7 n GLY 224 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wr7 s LEU 225 N 0.00 3.30 0.08 0.99 1.43 -0.86 -4.95 118.68 118.67 2wr7 s LEU 225 Ca 0.00 0.01 0.23 0.00 -1.03 0.00 0.00 54.13 53.33 2wr7 s LEU 225 Cb 0.00 -1.74 -0.05 0.00 0.03 0.00 0.00 46.19 44.42 2wr7 s LEU 225 CO 0.00 0.33 0.91 0.61 0.23 0.00 0.00 176.35 178.43 2wr7 n GLY 226 N 2.45 -1.24 3.86 -3.19 0.00 -1.26 -1.37 105.19 104.44 2wr7 n GLY 226 Ca -0.18 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.16 2wr7 n GLY 226 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wr7 s SER 227 N -4.49 5.33 0.06 1.61 1.04 -1.26 -4.13 113.70 111.86 2wr7 s SER 227 Ca -0.00 1.24 0.01 0.00 0.48 0.00 0.00 55.95 57.68 2wr7 s SER 227 Cb 0.13 -2.06 -0.03 0.00 0.10 0.00 0.00 66.02 64.15 2wr7 s SER 227 CO 0.82 -1.43 -0.05 -0.13 0.98 0.00 0.00 173.24 173.43 2wr7 s ARG 228 N -5.27 0.63 -0.19 4.02 1.81 -0.16 -4.67 118.95 115.12 2wr7 s ARG 228 Ca 0.58 -1.08 0.01 0.00 -1.72 0.00 0.00 55.73 53.53 2wr7 s ARG 228 Cb -0.12 -0.05 0.02 0.00 -0.45 0.00 0.00 34.95 34.35 2wr7 s ARG 228 CO 0.53 -0.04 -0.18 -1.64 -0.68 0.00 0.00 175.30 173.29 2wr7 s MET 229 N -3.04 2.84 -0.43 3.54 -1.94 0.55 -0.54 119.30 120.28 2wr7 s MET 229 Ca 0.02 -0.86 -0.14 0.00 -1.71 0.00 0.00 55.69 53.00 2wr7 s MET 229 Cb 0.01 -2.56 0.05 0.00 2.01 0.00 0.00 34.83 34.33 2wr7 s MET 229 CO -0.05 -0.25 0.31 -2.00 -0.01 0.00 0.00 175.02 173.02 2wr7 s GLU 230 N 1.29 2.91 0.21 2.03 2.12 0.34 -0.71 118.70 126.89 2wr7 s GLU 230 Ca 0.03 -1.19 -0.08 0.00 0.36 0.00 0.00 54.97 54.09 2wr7 s GLU 230 Cb -0.14 -3.97 -0.07 0.00 0.26 0.00 0.00 34.13 30.21 2wr7 s GLU 230 CO -0.12 -0.86 0.51 -0.06 -0.54 0.00 0.00 175.26 174.19 2wr7 s PHE 231 N 1.62 3.44 0.08 5.30 0.40 0.13 -1.03 117.98 127.91 2wr7 s PHE 231 Ca 0.04 0.80 -0.03 0.00 -0.60 0.00 0.00 56.93 57.14 2wr7 s PHE 231 Cb -0.21 -2.20 -0.03 0.00 0.51 0.00 0.00 43.02 41.09 2wr7 s PHE 231 CO 0.07 0.31 0.04 -1.12 0.70 0.00 0.00 175.22 175.22 2wr7 s SER 232 N -2.38 0.37 0.24 1.36 0.01 0.08 -1.24 113.70 112.14 2wr7 s SER 232 Ca 0.46 -0.97 0.01 0.00 1.31 0.00 0.00 55.95 56.76 2wr7 s SER 232 Cb -0.11 0.26 -0.04 0.00 0.21 0.00 0.00 66.02 66.34 2wr7 s SER 232 CO 0.22 -0.66 0.19 -1.66 0.41 0.00 0.00 173.24 171.74 2wr7 s TRP 233 N -3.94 1.32 0.09 2.43 1.48 -1.26 -1.08 118.94 117.99 2wr7 s TRP 233 Ca 0.10 -1.45 -0.25 0.00 -1.06 0.00 0.00 56.10 53.44 2wr7 s TRP 233 Cb 0.07 -0.58 0.08 0.00 -1.16 0.00 0.00 33.47 31.88 2wr7 s TRP 233 CO -0.07 -0.73 0.73 -0.08 -4.06 0.00 0.00 176.95 172.73 2wr7 s THR 234 N -3.92 0.00 -0.31 0.66 -1.32 -0.49 -5.00 115.64 105.27 2wr7 s THR 234 Ca 0.39 -0.03 -0.09 0.00 -1.21 0.00 0.00 61.69 60.74 2wr7 s THR 234 Cb 0.05 -1.04 -0.01 0.00 -1.51 0.00 0.00 72.50 70.00 2wr7 s THR 234 CO 0.17 0.00 0.15 -0.76 -2.21 0.00 0.00 174.62 171.97 2wr7 s LEU 235 N -2.65 4.10 -0.16 9.08 1.43 -1.26 -1.13 118.68 128.09 2wr7 s LEU 235 Ca 0.03 -0.53 -0.24 0.00 -1.03 0.00 0.00 54.13 52.36 2wr7 s LEU 235 Cb -0.01 -2.00 -0.02 0.00 0.03 0.00 0.00 46.19 44.19 2wr7 s LEU 235 CO -0.11 -0.19 0.78 -0.22 0.23 0.00 0.00 176.35 176.84 2wr7 s LEU 236 N 1.61 4.19 0.74 1.79 2.96 0.85 -4.87 118.68 125.95 2wr7 s LEU 236 Ca 0.05 1.13 -0.11 0.00 -0.22 0.00 0.00 54.13 54.97 2wr7 s LEU 236 Cb -0.17 -3.16 0.03 0.00 0.50 0.00 0.00 46.19 43.39 2wr7 s LEU 236 CO 0.06 -0.34 1.07 -1.81 -1.32 0.00 0.00 176.35 174.02 2wr7 s ASP 237 N 1.11 4.99 -0.07 3.68 1.01 -1.26 -1.23 116.67 124.90 2wr7 s ASP 237 Ca 0.37 1.59 -0.34 0.00 0.71 0.00 0.00 52.55 54.88 2wr7 s ASP 237 Cb -0.17 -2.40 -0.11 0.00 1.01 0.00 0.00 42.92 41.25 2wr7 s ASP 237 CO 0.13 -1.69 1.90 0.23 0.21 0.00 0.00 175.17 175.95 2wr7 n MET 238 N -3.28 2.29 -0.79 8.23 2.81 -1.26 -1.23 117.12 123.89 2wr7 n MET 238 Ca 0.08 0.84 0.00 0.00 -1.81 0.00 0.00 57.70 56.81 2wr7 n MET 238 Cb 0.54 -2.70 0.00 0.00 -0.71 0.00 0.00 33.22 30.35 2wr7 n MET 238 CO 0.00 0.00 0.00 0.91 1.51 0.00 0.00 175.97 178.39 2wr7 n TRP 239 N 6.77 0.00 -2.04 2.03 7.02 0.37 -5.01 117.44 126.58 2wr7 n TRP 239 Ca 0.22 0.00 -0.28 0.00 -1.02 0.00 0.00 57.50 56.42 2wr7 n TRP 239 Cb 0.31 0.00 0.07 0.00 -2.42 0.00 0.00 31.31 29.28 2wr7 n TRP 239 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 2wr7 s ASP 240 N -3.10 4.79 0.01 -0.99 3.68 -0.36 -4.69 116.67 116.00 2wr7 s ASP 240 Ca 0.00 0.69 0.06 0.00 2.13 0.00 0.00 52.55 55.43 2wr7 s ASP 240 Cb 0.00 -1.31 -0.02 0.00 -1.45 0.00 0.00 42.92 40.14 2wr7 s ASP 240 CO 0.00 -1.68 -0.18 -0.89 0.13 0.00 0.00 175.17 172.55 2wr7 s THR 241 N -3.40 1.44 -0.07 1.71 2.01 -1.26 -0.39 115.64 115.68 2wr7 s THR 241 Ca 0.60 -0.92 -0.01 0.00 0.31 0.00 0.00 61.69 61.68 2wr7 s THR 241 Cb -0.11 -1.22 -0.03 0.00 0.01 0.00 0.00 72.50 71.14 2wr7 s THR 241 CO 0.47 0.29 -0.01 -0.51 -0.69 0.00 0.00 174.62 174.17 2wr7 s ILE 242 N -0.58 4.16 -0.17 1.82 2.07 -0.31 -4.36 121.20 123.83 2wr7 s ILE 242 Ca 0.06 -0.35 0.01 0.00 -1.41 0.00 0.00 60.65 58.96 2wr7 s ILE 242 Cb -0.08 -2.75 0.03 0.00 0.13 0.00 0.00 42.46 39.79 2wr7 s ILE 242 CO 0.00 0.57 -0.13 0.20 -1.91 0.00 0.00 174.94 173.68 2wr7 s ASN 243 N -0.96 3.02 -0.12 4.50 0.01 0.08 -1.63 114.94 119.84 2wr7 s ASN 243 Ca 0.14 -0.67 -0.07 0.00 -0.71 0.00 0.00 52.86 51.55 2wr7 s ASN 243 Cb -0.11 -1.22 -0.04 0.00 0.41 0.00 0.00 41.25 40.29 2wr7 s ASN 243 CO 0.03 -0.09 0.14 -0.36 -1.51 0.00 0.00 177.10 175.31 2wr7 s PHE 244 N 1.44 3.59 -0.00 2.20 0.40 0.67 -2.10 117.98 124.18 2wr7 s PHE 244 Ca 0.02 0.52 -0.01 0.00 -0.60 0.00 0.00 56.93 56.87 2wr7 s PHE 244 Cb -0.14 -1.94 0.00 0.00 0.51 0.00 0.00 43.02 41.45 2wr7 s PHE 244 CO -0.10 0.74 0.01 -2.00 0.70 0.00 0.00 175.22 174.57 2wr7 s GLU 245 N -1.04 0.04 -0.28 0.44 2.12 -0.72 -1.58 118.70 117.68 2wr7 s GLU 245 Ca 0.15 -0.02 -0.24 0.00 0.36 0.00 0.00 54.97 55.22 2wr7 s GLU 245 Cb -0.12 0.02 0.09 0.00 0.26 0.00 0.00 34.13 34.38 2wr7 s GLU 245 CO 0.04 -0.01 0.83 0.45 -0.54 0.00 0.00 175.26 176.04 2wr7 s SER 246 N -0.09 -0.66 -0.20 -1.70 0.15 0.05 -0.81 113.70 110.43 2wr7 s SER 246 Ca -0.01 1.23 0.15 0.00 0.70 0.00 0.00 55.95 58.02 2wr7 s SER 246 Cb -0.01 1.25 0.80 0.00 -1.71 0.00 0.00 66.02 66.35 2wr7 s SER 246 CO -0.00 -0.21 1.72 0.35 1.20 0.00 0.00 173.24 176.30 2wr7 n THR 247 N 2.77 2.49 0.00 6.45 -2.24 -1.01 -0.94 114.28 121.80 2wr7 n THR 247 Ca -0.14 -1.35 0.00 0.00 -2.27 0.00 0.00 64.05 60.28 2wr7 n THR 247 Cb 0.56 -0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 2wr7 n THR 247 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wr7 n GLY 248 N 0.77 4.52 3.04 3.38 0.00 -1.25 -4.72 105.19 110.94 2wr7 n GLY 248 Ca 0.27 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 45.02 2wr7 n GLY 248 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wr7 n ASN 249 N 0.00 0.00 -4.71 1.61 3.02 -1.26 -4.07 115.26 109.85 2wr7 n ASN 249 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.13 2wr7 n ASN 249 Cb 0.00 -0.07 -0.03 0.00 -0.61 0.00 0.00 39.78 39.07 2wr7 n ASN 249 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2wr7 s LEU 250 N 0.00 4.36 -0.50 3.41 2.96 -1.26 -0.94 118.68 126.72 2wr7 s LEU 250 Ca 0.00 2.38 -0.13 0.00 -0.22 0.00 0.00 54.13 56.16 2wr7 s LEU 250 Cb 0.00 -3.58 0.12 0.00 0.50 0.00 0.00 46.19 43.23 2wr7 s LEU 250 CO 0.00 -0.73 0.41 -0.63 -1.32 0.00 0.00 176.35 174.08 2wr7 s ILE 251 N 1.51 4.74 0.48 6.68 -1.09 0.35 -3.44 121.20 130.42 2wr7 s ILE 251 Ca 0.67 -1.58 -0.19 0.00 -2.23 0.00 0.00 60.65 57.32 2wr7 s ILE 251 Cb -0.38 -4.04 -0.09 0.00 -1.58 0.00 0.00 42.46 36.37 2wr7 s ILE 251 CO 0.30 -0.79 0.98 0.00 -1.23 0.00 0.00 174.94 174.21 2wr7 s ALA 252 N 1.49 3.01 0.32 9.38 0.00 -0.65 -0.34 121.76 134.98 2wr7 s ALA 252 Ca 0.04 0.35 -0.21 0.00 0.00 0.00 0.00 51.96 52.14 2wr7 s ALA 252 Cb -0.28 -3.16 -0.09 0.00 0.00 0.00 0.00 23.12 19.59 2wr7 s ALA 252 CO 0.02 -0.11 0.84 -1.25 0.00 0.00 0.00 175.76 175.26 2wr7 s PRO 253 N -3.55 4.30 -0.21 0.00 0.05 -1.26 0.45 135.00 134.78 2wr7 s PRO 253 Ca 0.62 1.02 -0.06 0.00 0.05 0.00 0.00 61.00 62.63 2wr7 s PRO 253 Cb -0.11 -2.61 -0.20 0.00 0.05 0.00 0.00 34.50 31.63 2wr7 s PRO 253 CO 0.22 0.22 0.02 -1.91 0.05 0.00 0.00 177.00 175.59 2wr7 n GLU 254 N 0.16 0.67 -4.03 4.56 2.13 -0.30 -4.39 120.64 119.43 2wr7 n GLU 254 Ca 0.02 0.26 -0.22 0.00 0.66 0.00 0.00 57.16 57.88 2wr7 n GLU 254 Cb 0.52 -1.61 -0.04 0.00 0.27 0.00 0.00 31.44 30.57 2wr7 n GLU 254 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 2wr7 s TYR 255 N -2.51 3.03 0.29 4.31 1.51 -1.24 0.33 117.35 123.06 2wr7 s TYR 255 Ca -0.30 -0.17 0.04 0.00 -1.01 0.00 0.00 57.07 55.62 2wr7 s TYR 255 Cb 0.09 -1.51 -0.06 0.00 -0.11 0.00 0.00 41.96 40.37 2wr7 s TYR 255 CO 0.64 0.42 0.02 0.20 -1.11 0.00 0.00 175.55 175.73 2wr7 s GLY 256 N -3.88 1.88 -0.26 0.71 0.00 0.68 -4.77 107.32 101.68 2wr7 s GLY 256 Ca 0.35 -1.95 0.02 0.00 0.00 0.00 0.00 44.72 43.15 2wr7 s GLY 256 CO 0.25 -1.77 -0.06 -1.36 0.00 0.00 0.00 173.10 170.16 2wr7 s PHE 257 N -3.31 2.90 0.32 1.90 0.40 -0.19 -0.91 117.98 119.10 2wr7 s PHE 257 Ca 0.33 -2.14 -0.29 0.00 -0.60 0.00 0.00 56.93 54.23 2wr7 s PHE 257 Cb 0.07 -1.89 -0.11 0.00 0.51 0.00 0.00 43.02 41.60 2wr7 s PHE 257 CO 0.13 -0.84 1.52 0.15 0.70 0.00 0.00 175.22 176.88 2wr7 s LYS 258 N 1.22 4.15 -0.10 0.44 1.02 0.98 -0.89 119.74 126.56 2wr7 s LYS 258 Ca -0.05 2.53 -0.06 0.00 0.02 0.00 0.00 55.97 58.40 2wr7 s LYS 258 Cb -0.19 -3.01 0.04 0.00 -0.52 0.00 0.00 37.83 34.14 2wr7 s LYS 258 CO -0.07 -0.55 0.25 -1.50 -0.92 0.00 0.00 175.35 172.57 2wr7 s ILE 259 N -0.48 -0.03 -0.09 2.17 2.07 -0.03 -2.05 121.20 122.77 2wr7 s ILE 259 Ca 0.58 0.10 -0.01 0.00 -1.41 0.00 0.00 60.65 59.91 2wr7 s ILE 259 Cb -0.46 -0.38 0.03 0.00 0.13 0.00 0.00 42.46 41.77 2wr7 s ILE 259 CO 0.53 0.04 -0.03 -0.55 -1.91 0.00 0.00 174.94 173.02 2wr7 s SER 260 N 0.94 1.80 0.06 4.50 0.15 -0.53 -3.77 113.70 116.84 2wr7 s SER 260 Ca -0.07 -0.18 0.03 0.00 0.70 0.00 0.00 55.95 56.44 2wr7 s SER 260 Cb -0.08 -0.61 -0.03 0.00 -1.71 0.00 0.00 66.02 63.60 2wr7 s SER 260 CO -0.06 -0.16 -0.10 -1.59 1.20 0.00 0.00 173.24 172.53 2wr7 s LYS 261 N 1.81 0.68 0.00 5.44 -2.85 -1.26 -0.85 119.74 122.71 2wr7 s LYS 261 Ca 0.04 -0.89 0.00 0.00 -1.00 0.00 0.00 55.97 54.12 2wr7 s LYS 261 Cb -0.12 -0.52 0.00 0.00 -2.06 0.00 0.00 37.83 35.13 2wr7 s LYS 261 CO -0.06 0.10 0.00 2.89 0.10 0.00 0.00 175.35 178.38 2wr7 n ARG 262 N 1.25 0.00 0.00 1.78 1.85 -1.26 -4.98 116.66 115.30 2wr7 n ARG 262 Ca -0.21 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.64 2wr7 n ARG 262 Cb 0.55 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.96 2wr7 n ARG 262 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2wr7 n GLY 263 N 0.00 0.66 0.78 2.89 0.00 -1.26 -5.08 105.19 103.18 2wr7 n GLY 263 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2wr7 n GLY 263 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2wr7 n SER 264 N 0.00 -4.76 0.00 1.61 2.88 -1.26 -5.11 113.62 106.98 2wr7 n SER 264 Ca 0.00 0.61 0.00 0.00 -1.33 0.00 0.00 58.87 58.15 2wr7 n SER 264 Cb 0.00 -1.86 0.00 0.00 -0.75 0.00 0.00 64.21 61.60 2wr7 n SER 264 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2wr7 n SER 265 N -0.93 0.00 -3.63 -3.46 2.88 -1.26 -4.94 113.62 102.28 2wr7 n SER 265 Ca 0.00 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.50 2wr7 n SER 265 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 2wr7 n SER 265 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2wr7 s GLY 266 N 0.00 -0.34 0.01 0.46 0.00 -1.26 -4.69 107.32 101.49 2wr7 s GLY 266 Ca 0.00 0.69 -0.16 0.00 0.00 0.00 0.00 44.72 45.24 2wr7 s GLY 266 CO 0.00 0.19 0.46 -0.42 0.00 0.00 0.00 173.10 173.33 2wr7 s ILE 267 N -2.96 4.97 -0.32 0.90 1.01 -1.26 -2.87 121.20 120.67 2wr7 s ILE 267 Ca 0.10 0.96 -0.06 0.00 0.00 0.00 0.00 60.65 61.65 2wr7 s ILE 267 Cb -0.00 -3.78 0.03 0.00 0.01 0.00 0.00 42.46 38.72 2wr7 s ILE 267 CO -0.03 0.54 0.08 -0.32 0.00 0.00 0.00 174.94 175.21 2wr7 s MET 268 N -0.86 2.80 -0.28 2.79 -2.45 0.65 -4.86 119.30 117.10 2wr7 s MET 268 Ca 0.25 -1.05 -0.29 0.00 -1.25 0.00 0.00 55.69 53.35 2wr7 s MET 268 Cb -0.17 -3.39 -0.00 0.00 1.25 0.00 0.00 34.83 32.52 2wr7 s MET 268 CO 0.15 -0.57 1.31 0.15 1.05 0.00 0.00 175.02 177.11 2wr7 s LYS 269 N 1.43 3.95 0.17 4.11 -0.14 -1.25 -2.29 119.74 125.72 2wr7 s LYS 269 Ca -0.00 1.32 -0.24 0.00 -1.36 0.00 0.00 55.97 55.69 2wr7 s LYS 269 Cb -0.18 -3.87 0.06 0.00 -1.68 0.00 0.00 37.83 32.15 2wr7 s LYS 269 CO 0.02 -1.07 0.82 -0.08 -0.76 0.00 0.00 175.35 174.28 2wr7 s THR 270 N 4.29 0.00 -0.80 2.17 -1.32 -0.78 -4.85 115.64 114.36 2wr7 s THR 270 Ca 0.57 -0.57 0.13 0.00 -1.21 0.00 0.00 61.69 60.60 2wr7 s THR 270 Cb -0.18 -1.70 -0.09 0.00 -1.51 0.00 0.00 72.50 69.02 2wr7 s THR 270 CO 0.22 0.00 0.61 -0.62 -2.21 0.00 0.00 174.62 172.62 2wr7 n GLU 271 N -0.42 2.53 0.00 7.08 -0.58 -1.26 -3.92 120.64 124.07 2wr7 n GLU 271 Ca -0.07 -0.23 0.00 0.00 -0.42 0.00 0.00 57.16 56.43 2wr7 n GLU 271 Cb 0.61 -1.12 0.00 0.00 -0.57 0.00 0.00 31.44 30.36 2wr7 n GLU 271 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wr7 n GLY 272 N 1.21 -1.74 3.15 0.62 0.00 -1.26 -5.10 105.19 102.07 2wr7 n GLY 272 Ca 0.03 -1.51 -0.11 0.00 0.00 0.00 0.00 46.02 44.43 2wr7 n GLY 272 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wr7 s THR 273 N -0.42 0.09 0.54 2.61 -4.23 -1.26 -5.01 115.64 107.95 2wr7 s THR 273 Ca 0.00 -0.72 -0.21 0.00 -1.18 0.00 0.00 61.69 59.58 2wr7 s THR 273 Cb 0.00 -0.60 -0.07 0.00 1.34 0.00 0.00 72.50 73.17 2wr7 s THR 273 CO 0.00 -0.40 0.97 -0.11 -0.54 0.00 0.00 174.62 174.54 2wr7 n LEU 274 N 1.20 3.21 0.00 4.79 7.94 -1.26 -4.45 117.00 128.43 2wr7 n LEU 274 Ca -0.21 0.89 0.00 0.00 -1.11 0.00 0.00 56.01 55.57 2wr7 n LEU 274 Cb 0.56 -1.37 0.00 0.00 0.53 0.00 0.00 43.42 43.14 2wr7 n LEU 274 CO 0.21 -1.74 0.16 -0.62 -1.11 0.00 0.00 177.39 174.29 2wr7 n GLU 275 N -0.53 -0.06 -2.91 1.96 1.02 -0.84 -4.99 120.64 114.30 2wr7 n GLU 275 Ca 0.12 -0.36 -0.05 0.00 -0.02 0.00 0.00 57.16 56.85 2wr7 n GLU 275 Cb 0.44 -0.70 0.02 0.00 -0.02 0.00 0.00 31.44 31.18 2wr7 n GLU 275 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2wr7 n ASN 276 N -0.04 -6.59 0.00 1.62 5.15 -1.26 -5.07 115.26 109.07 2wr7 n ASN 276 Ca 0.00 -0.28 0.00 0.00 -0.60 0.00 0.00 54.58 53.70 2wr7 n ASN 276 Cb 0.20 -4.65 0.00 0.00 -0.53 0.00 0.00 39.78 34.81 2wr7 n ASN 276 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2wr7 s GLU 278 N 1.33 0.93 -0.12 0.00 2.56 -1.26 -3.61 118.70 118.53 2wr7 s GLU 278 Ca 0.00 -1.32 -0.32 0.00 0.00 0.00 0.00 54.97 53.32 2wr7 s GLU 278 Cb 0.00 -0.49 0.12 0.00 2.00 0.00 0.00 34.13 35.77 2wr7 s GLU 278 CO 0.00 0.05 1.08 -0.08 -0.56 0.00 0.00 175.26 175.75 2wr7 s THR 279 N -3.10 0.00 -0.48 -1.70 -1.32 -1.07 -4.86 115.64 103.10 2wr7 s THR 279 Ca 0.12 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.64 2wr7 s THR 279 Cb 0.01 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 70.02 2wr7 s THR 279 CO -0.01 0.00 0.54 0.29 -2.21 0.00 0.00 174.62 173.23 2wr7 n LYS 280 N -0.14 1.03 -3.48 7.08 5.02 -1.26 -2.07 118.16 124.33 2wr7 n LYS 280 Ca -0.03 -0.59 -0.17 0.00 -2.02 0.00 0.00 58.31 55.50 2wr7 n LYS 280 Cb 0.60 -1.00 -0.12 0.00 -0.02 0.00 0.00 35.03 34.49 2wr7 n LYS 280 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wr7 s GLN 282 N 2.36 3.31 0.14 0.00 2.00 -0.01 -1.60 119.66 125.87 2wr7 s GLN 282 Ca 0.07 -0.35 0.06 0.00 -2.00 0.00 0.00 55.36 53.15 2wr7 s GLN 282 Cb -0.15 -2.96 -0.04 0.00 0.80 0.00 0.00 33.01 30.66 2wr7 s GLN 282 CO -0.12 0.61 -0.14 0.95 -0.50 0.00 0.00 175.29 176.09 2wr7 s THR 283 N -0.59 1.41 -0.18 -0.34 -4.23 -0.50 -1.10 115.64 110.11 2wr7 s THR 283 Ca 0.10 -1.88 0.17 0.00 -1.18 0.00 0.00 61.69 58.90 2wr7 s THR 283 Cb -0.12 -1.70 0.17 0.00 1.34 0.00 0.00 72.50 72.19 2wr7 s THR 283 CO 0.02 -0.50 1.48 -2.65 -0.54 0.00 0.00 174.62 172.43 2wr7 n PRO 284 N 0.22 0.11 -0.09 3.99 -0.02 -1.26 -1.55 135.00 136.41 2wr7 n PRO 284 Ca -0.13 0.60 -0.08 0.00 -2.02 0.00 0.00 63.50 61.87 2wr7 n PRO 284 Cb 0.58 -1.97 -0.16 0.00 -0.02 0.00 0.00 33.50 31.93 2wr7 n PRO 284 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2wr7 n LEU 285 N -2.12 0.03 0.00 2.45 4.77 -1.26 -4.96 117.00 115.91 2wr7 n LEU 285 Ca -0.01 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2wr7 n LEU 285 Cb 0.13 0.45 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 2wr7 n LEU 285 CO 0.08 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 2wr7 n GLY 286 N 1.70 -0.29 3.88 -0.72 0.00 -0.59 -3.98 105.19 105.18 2wr7 n GLY 286 Ca -0.30 -1.11 -0.33 0.00 0.00 0.00 0.00 46.02 44.28 2wr7 n GLY 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wr7 s ALA 287 N -2.00 3.71 -0.18 4.61 0.00 -0.95 -1.41 121.76 125.54 2wr7 s ALA 287 Ca 0.00 -0.40 -0.04 0.00 0.00 0.00 0.00 51.96 51.53 2wr7 s ALA 287 Cb 0.00 -2.27 -0.02 0.00 0.00 0.00 0.00 23.12 20.83 2wr7 s ALA 287 CO 0.00 0.58 -0.04 0.42 0.00 0.00 0.00 175.76 176.72 2wr7 s ILE 288 N -1.56 3.63 -0.38 0.00 1.01 -0.63 -1.50 121.20 121.78 2wr7 s ILE 288 Ca 0.38 -0.43 0.04 0.00 0.00 0.00 0.00 60.65 60.64 2wr7 s ILE 288 Cb -0.13 -2.62 0.11 0.00 0.01 0.00 0.00 42.46 39.83 2wr7 s ILE 288 CO 0.21 0.46 0.11 0.21 0.00 0.00 0.00 174.94 175.92 2wr7 s ASN 289 N 0.87 4.61 0.08 3.58 2.47 -1.26 -4.14 114.94 121.14 2wr7 s ASN 289 Ca -0.01 -2.35 -0.17 0.00 0.42 0.00 0.00 52.86 50.75 2wr7 s ASN 289 Cb -0.15 -1.59 0.03 0.00 -1.45 0.00 0.00 41.25 38.10 2wr7 s ASN 289 CO 0.01 -0.34 0.40 0.28 -3.72 0.00 0.00 177.10 173.73 2wr7 s THR 290 N 0.63 0.06 -1.50 -5.21 -1.32 -1.26 -5.00 115.64 102.04 2wr7 s THR 290 Ca 0.13 -0.53 0.17 0.00 -1.21 0.00 0.00 61.69 60.24 2wr7 s THR 290 Cb -0.21 -1.05 -0.01 0.00 -1.51 0.00 0.00 72.50 69.72 2wr7 s THR 290 CO -0.07 -0.29 0.87 0.35 -2.21 0.00 0.00 174.62 173.27 2wr7 n THR 291 N 0.18 0.00 -2.00 5.08 -2.24 -1.26 -4.99 114.28 109.04 2wr7 n THR 291 Ca -0.17 -0.32 -0.41 0.00 -2.27 0.00 0.00 64.05 60.87 2wr7 n THR 291 Cb 0.62 1.19 -0.02 0.00 -2.10 0.00 0.00 70.33 70.02 2wr7 n THR 291 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2wr7 s LEU 292 N -2.09 4.39 0.23 3.22 1.43 -1.26 -4.93 118.68 119.66 2wr7 s LEU 292 Ca 0.14 2.72 0.24 0.00 -1.03 0.00 0.00 54.13 56.20 2wr7 s LEU 292 Cb 0.13 -3.63 0.91 0.00 0.03 0.00 0.00 46.19 43.64 2wr7 s LEU 292 CO 0.43 -0.69 1.74 -2.65 0.23 0.00 0.00 176.35 175.40 2wr7 n PRO 293 N 1.86 0.21 -4.05 1.29 -0.02 -1.26 -4.61 135.00 128.43 2wr7 n PRO 293 Ca 0.05 0.33 -0.09 0.00 -2.02 0.00 0.00 63.50 61.76 2wr7 n PRO 293 Cb 0.40 -1.83 -0.11 0.00 -0.02 0.00 0.00 33.50 31.95 2wr7 n PRO 293 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 2wr7 s PHE 294 N -3.22 0.48 0.24 6.00 0.40 -1.24 -1.39 117.98 119.25 2wr7 s PHE 294 Ca 0.07 -0.70 -0.10 0.00 -0.60 0.00 0.00 56.93 55.59 2wr7 s PHE 294 Cb 0.11 -0.32 -0.01 0.00 0.51 0.00 0.00 43.02 43.31 2wr7 s PHE 294 CO 0.47 -0.21 0.42 -3.38 0.70 0.00 0.00 175.22 173.22 2wr7 s HIS 295 N -2.31 0.52 0.00 0.36 -3.43 -0.59 -1.15 115.29 108.70 2wr7 s HIS 295 Ca -0.06 -0.86 0.25 0.00 -0.80 0.00 0.00 55.06 53.59 2wr7 s HIS 295 Cb -0.04 0.05 0.41 0.00 -1.43 0.00 0.00 32.58 31.57 2wr7 s HIS 295 CO -0.03 -0.94 1.16 0.27 -2.00 0.00 0.00 174.74 173.20 2wr7 n ASN 296 N -0.39 0.89 0.14 7.38 6.94 -1.03 -1.32 115.26 127.86 2wr7 n ASN 296 Ca -0.01 -2.00 -0.13 0.00 -0.02 0.00 0.00 54.58 52.42 2wr7 n ASN 296 Cb 0.63 -0.27 -0.08 0.00 -2.36 0.00 0.00 39.78 37.70 2wr7 n ASN 296 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 2wr7 h VAL 297 N 6.89 0.77 -1.58 3.53 2.07 -1.88 -3.47 116.25 122.58 2wr7 h VAL 297 Ca -0.25 -0.57 0.06 0.00 0.82 0.00 0.00 66.70 66.76 2wr7 h VAL 297 Cb 1.87 1.08 -0.26 0.00 -1.52 0.00 0.00 31.29 32.46 2wr7 h VAL 297 CO 0.08 0.12 0.47 -2.28 0.02 0.00 0.00 177.57 175.97 2wr7 s HIS 298 N -4.82 -0.46 0.32 1.57 2.46 -1.26 -5.01 115.29 108.10 2wr7 s HIS 298 Ca -0.14 1.12 0.15 0.00 0.47 0.00 0.00 55.06 56.65 2wr7 s HIS 298 Cb 0.03 0.37 0.71 0.00 -0.13 0.00 0.00 32.58 33.55 2wr7 s HIS 298 CO 0.57 -0.22 1.79 -1.00 -2.47 0.00 0.00 174.74 173.41 2wr7 h PRO 299 N 4.15 0.00 -4.29 2.88 0.13 -1.99 -3.40 132.00 129.48 2wr7 h PRO 299 Ca -0.28 0.00 -0.76 0.00 -0.87 0.00 0.00 66.00 64.09 2wr7 h PRO 299 Cb 1.18 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.08 2wr7 h PRO 299 CO 0.11 0.40 0.72 -0.51 -0.23 0.00 0.00 178.00 178.48 2wr7 s LEU 300 N -7.82 5.78 0.27 1.56 1.43 -1.26 -4.84 118.68 113.81 2wr7 s LEU 300 Ca -0.02 -2.88 0.10 0.00 -1.03 0.00 0.00 54.13 50.29 2wr7 s LEU 300 Cb 0.13 -2.31 -0.04 0.00 0.03 0.00 0.00 46.19 44.00 2wr7 s LEU 300 CO 0.71 -0.65 -0.01 0.42 0.23 0.00 0.00 176.35 177.05 2wr7 s THR 301 N 0.73 3.34 -0.05 5.49 -4.23 -1.26 -4.07 115.64 115.59 2wr7 s THR 301 Ca 0.32 -1.94 0.01 0.00 -1.18 0.00 0.00 61.69 58.90 2wr7 s THR 301 Cb -0.07 -2.82 0.02 0.00 1.34 0.00 0.00 72.50 70.98 2wr7 s THR 301 CO -0.06 -0.36 -0.06 -0.63 -0.54 0.00 0.00 174.62 172.97 2wr7 s ILE 302 N -2.35 0.66 -1.43 2.99 1.01 -0.26 -3.89 121.20 117.94 2wr7 s ILE 302 Ca 0.32 -0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.77 2wr7 s ILE 302 Cb -0.06 -0.67 0.00 0.00 0.01 0.00 0.00 42.46 41.75 2wr7 s ILE 302 CO 0.20 0.25 0.00 0.61 0.00 0.00 0.00 174.94 176.00 2wr7 n GLY 303 N 4.03 0.56 3.23 6.18 0.00 -0.46 -0.83 105.19 117.91 2wr7 n GLY 303 Ca -0.24 -2.07 -0.42 0.00 0.00 0.00 0.00 46.02 43.29 2wr7 n GLY 303 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wr7 s GLU 304 N -0.57 2.68 0.38 1.61 2.02 -0.13 -0.87 118.70 123.82 2wr7 s GLU 304 Ca 0.00 -1.89 0.08 0.00 0.02 0.00 0.00 54.97 53.18 2wr7 s GLU 304 Cb 0.00 -4.03 -0.06 0.00 0.10 0.00 0.00 34.13 30.15 2wr7 s GLU 304 CO 0.00 -1.23 0.08 0.00 0.02 0.00 0.00 175.26 174.13 2wr7 s PRO 306 N -3.79 -0.06 0.13 0.00 0.02 -1.26 -4.79 135.00 125.24 2wr7 s PRO 306 Ca 0.37 0.40 -0.30 0.00 0.02 0.00 0.00 61.00 61.49 2wr7 s PRO 306 Cb 0.03 -1.69 -0.07 0.00 0.02 0.00 0.00 34.50 32.80 2wr7 s PRO 306 CO 0.20 -3.04 1.11 0.15 -0.33 0.00 0.00 177.00 175.10 2wr7 s LYS 307 N -5.02 4.55 -0.10 5.54 3.01 -0.48 -4.75 119.74 122.49 2wr7 s LYS 307 Ca 0.67 1.70 -0.27 0.00 -1.01 0.00 0.00 55.97 57.06 2wr7 s LYS 307 Cb -0.17 -3.31 -0.02 0.00 -1.01 0.00 0.00 37.83 33.31 2wr7 s LYS 307 CO 0.58 -0.02 0.88 -0.47 0.51 0.00 0.00 175.35 176.83 2wr7 s TYR 308 N 0.22 3.53 0.06 3.18 5.04 -1.26 -1.54 117.35 126.59 2wr7 s TYR 308 Ca 0.52 1.44 0.04 0.00 -2.44 0.00 0.00 57.07 56.63 2wr7 s TYR 308 Cb -0.29 -3.04 -0.03 0.00 0.35 0.00 0.00 41.96 38.96 2wr7 s TYR 308 CO 0.33 -0.12 -0.13 0.54 -1.34 0.00 0.00 175.55 174.83 2wr7 s VAL 309 N 1.61 0.97 -0.72 3.14 0.11 -0.44 -4.75 120.40 120.32 2wr7 s VAL 309 Ca 0.44 -1.24 -0.05 0.00 -2.93 0.00 0.00 61.98 58.20 2wr7 s VAL 309 Cb -0.18 -0.96 0.03 0.00 -1.53 0.00 0.00 36.38 33.74 2wr7 s VAL 309 CO 0.18 -0.26 2.77 0.29 -3.33 0.00 0.00 175.10 174.75 2wr7 n LYS 310 N 1.34 3.09 -4.35 1.54 5.02 -1.26 -4.45 118.16 119.08 2wr7 n LYS 310 Ca -0.21 -2.52 -0.25 0.00 -2.02 0.00 0.00 58.31 53.31 2wr7 n LYS 310 Cb 0.54 -2.31 -0.12 0.00 -0.02 0.00 0.00 35.03 33.12 2wr7 n LYS 310 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2wr7 s SER 311 N 0.65 2.95 -0.16 4.39 0.01 -1.26 -5.03 113.70 115.24 2wr7 s SER 311 Ca 0.59 -0.80 0.16 0.00 1.31 0.00 0.00 55.95 57.21 2wr7 s SER 311 Cb 0.31 -0.19 -0.24 0.00 0.21 0.00 0.00 66.02 66.11 2wr7 s SER 311 CO -0.15 0.07 0.22 -0.62 0.41 0.00 0.00 173.24 173.16 2wr7 n GLU 312 N 0.60 0.67 -3.73 12.44 1.02 -1.26 -4.80 120.64 125.58 2wr7 n GLU 312 Ca -0.15 0.08 -0.13 0.00 -0.02 0.00 0.00 57.16 56.94 2wr7 n GLU 312 Cb 0.55 -1.59 -0.10 0.00 -0.02 0.00 0.00 31.44 30.27 2wr7 n GLU 312 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 2wr7 s LYS 313 N -2.52 0.43 -0.49 3.49 -2.85 -1.26 -5.10 119.74 111.44 2wr7 s LYS 313 Ca -0.10 0.57 0.03 0.00 -1.00 0.00 0.00 55.97 55.48 2wr7 s LYS 313 Cb 0.07 0.17 0.14 0.00 -2.06 0.00 0.00 37.83 36.15 2wr7 s LYS 313 CO 0.82 -0.07 0.29 -0.51 0.10 0.00 0.00 175.35 175.98 2wr7 s LEU 314 N 0.43 3.18 -0.23 2.77 1.43 -1.26 -5.06 118.68 119.95 2wr7 s LEU 314 Ca -0.02 -2.93 -0.05 0.00 -1.03 0.00 0.00 54.13 50.10 2wr7 s LEU 314 Cb -0.04 -1.18 -0.02 0.00 0.03 0.00 0.00 46.19 44.99 2wr7 s LEU 314 CO -0.02 -0.22 0.01 -0.69 0.23 0.00 0.00 176.35 175.66 2wr7 s VAL 315 N -0.07 3.83 -0.29 -1.59 1.01 -1.26 -2.13 120.40 119.90 2wr7 s VAL 315 Ca 0.20 -0.34 -0.09 0.00 0.00 0.00 0.00 61.98 61.75 2wr7 s VAL 315 Cb -0.19 -2.76 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 2wr7 s VAL 315 CO -0.04 0.39 0.14 -0.22 0.00 0.00 0.00 175.10 175.37 2wr7 s LEU 316 N 1.45 3.90 0.29 3.92 2.96 -0.50 -4.62 118.68 126.08 2wr7 s LEU 316 Ca 0.05 -0.32 -0.29 0.00 -0.22 0.00 0.00 54.13 53.35 2wr7 s LEU 316 Cb -0.15 -2.01 -0.10 0.00 0.50 0.00 0.00 46.19 44.43 2wr7 s LEU 316 CO 0.00 -0.12 1.44 0.00 -1.32 0.00 0.00 176.35 176.35 2wr7 s ALA 317 N 1.65 3.61 -0.03 5.97 0.00 -1.26 -0.28 121.76 131.42 2wr7 s ALA 317 Ca 0.06 1.38 0.01 0.00 0.00 0.00 0.00 51.96 53.41 2wr7 s ALA 317 Cb -0.16 -3.56 -0.03 0.00 0.00 0.00 0.00 23.12 19.37 2wr7 s ALA 317 CO 0.07 -0.80 -0.01 0.25 0.00 0.00 0.00 175.76 175.26 2wr7 n THR 318 N 1.72 0.19 -2.53 0.00 -2.24 -0.96 -4.85 114.28 105.60 2wr7 n THR 318 Ca 0.05 -0.09 -0.24 0.00 -2.27 0.00 0.00 64.05 61.50 2wr7 n THR 318 Cb 0.40 -0.74 0.13 0.00 -2.10 0.00 0.00 70.33 68.02 2wr7 n THR 318 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wr7 n GLY 319 N 3.14 0.40 3.76 3.38 0.00 -1.00 -4.93 105.19 109.93 2wr7 n GLY 319 Ca -0.05 -1.99 -0.30 0.00 0.00 0.00 0.00 46.02 43.68 2wr7 n GLY 319 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2wr7 s LEU 320 N 0.00 1.76 -0.06 0.99 2.34 -1.26 -4.66 118.68 117.78 2wr7 s LEU 320 Ca 0.67 0.59 -0.30 0.00 0.06 0.00 0.00 54.13 55.16 2wr7 s LEU 320 Cb -0.04 -2.59 -0.04 0.00 -0.56 0.00 0.00 46.19 42.96 2wr7 s LEU 320 CO 0.45 -3.22 1.46 -0.60 -1.06 0.00 0.00 176.35 173.38 2wr7 s ARG 321 N -5.54 4.23 -0.07 1.48 3.52 -1.26 -0.52 118.95 120.79 2wr7 s ARG 321 Ca 0.70 1.97 -0.30 0.00 -0.13 0.00 0.00 55.73 57.97 2wr7 s ARG 321 Cb -0.09 -3.77 -0.04 0.00 -1.56 0.00 0.00 34.95 29.49 2wr7 s ARG 321 CO 0.54 -0.71 1.30 1.21 -0.81 0.00 0.00 175.30 176.83 2wr7 s ASN 322 N 2.44 6.95 -0.49 -2.12 3.84 0.62 -4.72 114.94 121.44 2wr7 s ASN 322 Ca 0.65 1.89 0.04 0.00 0.21 0.00 0.00 52.86 55.66 2wr7 s ASN 322 Cb -0.30 -2.55 0.17 0.00 -0.55 0.00 0.00 41.25 38.02 2wr7 s ASN 322 CO 0.24 -0.68 0.38 0.52 -2.79 0.00 0.00 177.10 174.78 2wr7 n VAL 323 N 4.86 -0.44 0.49 -5.21 0.31 -1.26 -4.81 118.33 112.26 2wr7 n VAL 323 Ca 0.13 -3.82 0.00 0.00 -0.01 0.00 0.00 64.34 60.64 2wr7 n VAL 323 Cb 0.45 -1.80 0.00 0.00 -0.91 0.00 0.00 33.84 31.58 2wr7 n VAL 323 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2wr7 n PRO 324 N 2.59 0.41 0.00 5.55 -0.02 -1.26 -0.41 135.00 141.86 2wr7 n PRO 324 Ca 0.27 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 2wr7 n PRO 324 Cb 0.45 -1.16 0.00 0.00 -0.02 0.00 0.00 33.50 32.76 2wr7 n PRO 324 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wr7 n GLY 330 N 0.21 3.35 0.59 -1.23 0.00 -1.26 -4.43 105.19 102.42 2wr7 n GLY 330 Ca 0.00 -1.61 0.40 0.00 0.00 0.00 0.00 46.02 44.81 2wr7 n GLY 330 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wr7 h LEU 331 N 0.00 0.00 -2.14 0.99 4.07 -1.95 -1.70 115.31 114.59 2wr7 h LEU 331 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2wr7 h LEU 331 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 2wr7 h LEU 331 CO 0.00 0.00 0.00 0.49 -1.08 0.00 0.00 178.44 177.85 2wr7 n PHE 332 N -3.93 0.28 -0.92 1.13 3.01 -1.26 -4.99 117.46 110.78 2wr7 n PHE 332 Ca 0.31 -0.22 0.00 0.00 1.01 0.00 0.00 57.45 58.55 2wr7 n PHE 332 Cb 1.51 -0.01 0.00 0.00 -0.01 0.00 0.00 39.48 40.98 2wr7 n PHE 332 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2wr7 n GLY 333 N 0.89 0.00 0.00 1.37 0.00 -0.64 -4.82 105.19 101.99 2wr7 n GLY 333 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2wr7 n GLY 333 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wr7 n ALA 334 N 0.97 0.00 -1.68 4.61 0.00 -1.26 -0.69 120.51 122.46 2wr7 n ALA 334 Ca 0.00 -0.12 -0.45 0.00 0.00 0.00 0.00 53.44 52.86 2wr7 n ALA 334 Cb 0.44 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.85 2wr7 n ALA 334 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2wr7 n ILE 335 N -2.04 0.45 -2.90 0.00 5.41 -1.26 -0.22 119.36 118.80 2wr7 n ILE 335 Ca 0.00 -0.08 -0.21 0.00 1.00 0.00 0.00 62.75 63.46 2wr7 n ILE 335 Cb 0.00 -1.95 0.01 0.00 -0.71 0.00 0.00 39.64 36.99 2wr7 n ILE 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2wr7 n ALA 336 N 5.92 -0.90 -2.10 -1.39 0.00 -0.76 -4.55 120.51 116.74 2wr7 n ALA 336 Ca 0.20 0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.84 2wr7 n ALA 336 Cb 0.33 -3.06 0.00 0.00 0.00 0.00 0.00 19.45 16.72 2wr7 n ALA 336 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wr7 n GLY 337 N -1.27 2.82 0.04 0.00 0.00 0.69 -4.86 105.19 102.61 2wr7 n GLY 337 Ca -0.12 -0.31 0.13 0.00 0.00 0.00 0.00 46.02 45.72 2wr7 n GLY 337 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2wr7 n PHE 338 N 0.00 0.37 -3.71 1.61 1.16 0.14 -3.93 117.46 113.10 2wr7 n PHE 338 Ca 0.00 0.11 -0.37 0.00 -1.87 0.00 0.00 57.45 55.32 2wr7 n PHE 338 Cb 0.00 -0.68 -0.10 0.00 -1.61 0.00 0.00 39.48 37.09 2wr7 n PHE 338 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 2wr7 s ILE 339 N -3.04 3.66 0.34 1.97 1.01 -0.79 -3.95 121.20 120.40 2wr7 s ILE 339 Ca 0.12 -2.45 0.03 0.00 0.00 0.00 0.00 60.65 58.35 2wr7 s ILE 339 Cb 0.16 -3.43 0.28 0.00 0.01 0.00 0.00 42.46 39.48 2wr7 s ILE 339 CO 0.55 -0.80 1.97 -0.33 0.00 0.00 0.00 174.94 176.33 2wr7 h GLU 340 N 7.62 0.86 -4.84 2.79 5.08 -1.80 -2.02 114.58 122.26 2wr7 h GLU 340 Ca -0.08 -0.05 -0.40 0.00 -1.00 0.00 0.00 59.36 57.83 2wr7 h GLU 340 Cb 1.01 -0.19 -0.14 0.00 0.50 0.00 0.00 28.75 29.92 2wr7 h GLU 340 CO 0.73 0.57 -0.56 0.20 -1.00 0.00 0.00 179.01 178.94 2wr7 s GLY 341 N -3.47 2.00 0.70 -3.84 0.00 -1.26 -4.12 107.32 97.32 2wr7 s GLY 341 Ca -0.10 -1.79 -0.02 0.00 0.00 0.00 0.00 44.72 42.80 2wr7 s GLY 341 CO 0.78 -1.54 0.96 0.61 0.00 0.00 0.00 173.10 173.91 2wr7 n GLY 342 N -0.54 0.33 2.77 0.20 0.00 0.46 -4.62 105.19 103.79 2wr7 n GLY 342 Ca 0.02 -1.98 -0.29 0.00 0.00 0.00 0.00 46.02 43.77 2wr7 n GLY 342 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2wr7 s TRP 343 N -2.94 1.67 -0.09 1.61 0.51 -0.04 -4.86 118.94 114.81 2wr7 s TRP 343 Ca 0.62 -1.51 0.30 0.00 -2.12 0.00 0.00 56.10 53.38 2wr7 s TRP 343 Cb -0.03 -1.52 1.32 0.00 -0.81 0.00 0.00 33.47 32.43 2wr7 s TRP 343 CO 0.41 -0.79 1.89 1.96 -0.51 0.00 0.00 176.95 179.92 2wr7 h GLN 344 N 8.10 0.00 -0.69 4.98 4.20 -1.87 -2.13 115.11 127.70 2wr7 h GLN 344 Ca -0.15 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.53 2wr7 h GLN 344 Cb 1.05 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.80 2wr7 h GLN 344 CO 0.42 0.00 0.32 0.78 -0.67 0.00 0.00 178.83 179.68 2wr7 h GLY 345 N 1.69 1.05 -5.52 3.46 0.00 -1.92 -3.40 103.07 98.43 2wr7 h GLY 345 Ca 0.00 -0.51 -0.57 0.00 0.00 0.00 0.00 47.33 46.24 2wr7 h GLY 345 CO 0.00 0.49 0.85 -0.29 0.00 0.00 0.00 176.54 177.58 2wr7 s MET 346 N -5.54 4.11 0.00 4.80 -2.45 -0.81 -4.86 119.30 114.55 2wr7 s MET 346 Ca -0.11 1.18 0.00 0.00 -1.25 0.00 0.00 55.69 55.51 2wr7 s MET 346 Cb 0.16 -3.72 0.00 0.00 1.25 0.00 0.00 34.83 32.52 2wr7 s MET 346 CO 0.80 -0.84 0.00 -0.89 1.05 0.00 0.00 175.02 175.14 2wr7 n ILE 347 N 5.74 0.00 -0.04 10.11 5.41 -1.26 -4.68 119.36 134.64 2wr7 n ILE 347 Ca 0.12 -0.38 -0.15 0.00 1.00 0.00 0.00 62.75 63.35 2wr7 n ILE 347 Cb 0.47 0.89 -0.04 0.00 -0.71 0.00 0.00 39.64 40.24 2wr7 n ILE 347 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 2wr7 h ASP 348 N 0.00 0.90 0.00 4.38 3.32 -1.97 -3.49 116.42 119.56 2wr7 h ASP 348 Ca 0.00 -0.54 0.00 0.00 0.02 0.00 0.00 57.03 56.51 2wr7 h ASP 348 Cb 0.00 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.29 2wr7 h ASP 348 CO 0.00 1.33 0.00 0.61 -1.72 0.00 0.00 179.24 179.46 2wr7 n GLY 349 N 0.53 3.68 0.10 2.75 0.00 -1.26 -4.98 105.19 106.01 2wr7 n GLY 349 Ca -0.06 -0.82 -0.09 0.00 0.00 0.00 0.00 46.02 45.05 2wr7 n GLY 349 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2wr7 n TRP 350 N 0.00 0.10 -4.09 1.61 8.01 -1.26 -4.57 117.44 117.24 2wr7 n TRP 350 Ca 0.00 0.04 -0.11 0.00 -1.31 0.00 0.00 57.50 56.11 2wr7 n TRP 350 Cb 0.00 -1.00 -0.11 0.00 -2.01 0.00 0.00 31.31 28.19 2wr7 n TRP 350 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.69 177.39 2wr7 s TYR 351 N -2.53 0.69 -0.79 -5.99 1.51 -1.26 -0.78 117.35 108.19 2wr7 s TYR 351 Ca -0.09 -0.68 0.00 0.00 -1.01 0.00 0.00 57.07 55.29 2wr7 s TYR 351 Cb 0.06 -0.42 0.00 0.00 -0.11 0.00 0.00 41.96 41.50 2wr7 s TYR 351 CO 0.83 -0.14 0.00 0.41 -1.11 0.00 0.00 175.55 175.54 2wr7 n GLY 352 N 0.90 -0.91 3.38 0.71 0.00 -0.51 0.50 105.19 109.26 2wr7 n GLY 352 Ca -0.19 -0.77 -0.20 0.00 0.00 0.00 0.00 46.02 44.86 2wr7 n GLY 352 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wr7 s TYR 353 N -3.00 1.88 -0.12 1.61 1.51 0.13 -1.27 117.35 118.09 2wr7 s TYR 353 Ca 0.00 -0.50 -0.12 0.00 -1.01 0.00 0.00 57.07 55.44 2wr7 s TYR 353 Cb 0.00 -0.85 -0.04 0.00 -0.11 0.00 0.00 41.96 40.96 2wr7 s TYR 353 CO 0.00 0.47 -0.24 1.58 -1.11 0.00 0.00 175.55 176.24 2wr7 n HIS 354 N -0.45 0.00 -1.62 2.71 -0.00 -1.26 -1.07 115.22 113.53 2wr7 n HIS 354 Ca -0.07 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.11 2wr7 n HIS 354 Cb 0.60 -0.35 0.00 0.00 -0.12 0.00 0.00 29.99 30.13 2wr7 n HIS 354 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41 2wr7 n HIS 355 N -3.86 -3.72 -3.97 1.57 -0.00 -1.26 -3.37 115.22 100.60 2wr7 n HIS 355 Ca -0.10 2.18 -0.34 0.00 -0.00 0.00 0.00 57.72 59.46 2wr7 n HIS 355 Cb 0.36 -3.25 -0.15 0.00 -0.00 0.00 0.00 29.99 26.95 2wr7 n HIS 355 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2wr7 s SER 356 N -0.67 3.97 0.36 4.39 0.15 -1.26 -2.78 113.70 117.86 2wr7 s SER 356 Ca 0.00 -0.54 0.08 0.00 0.70 0.00 0.00 55.95 56.20 2wr7 s SER 356 Cb 0.00 -1.65 -0.07 0.00 -1.71 0.00 0.00 66.02 62.59 2wr7 s SER 356 CO 0.00 -0.03 -0.06 0.21 1.20 0.00 0.00 173.24 174.56 2wr7 s ASN 357 N 1.40 3.64 -0.09 5.45 3.84 0.16 -4.98 114.94 124.36 2wr7 s ASN 357 Ca 0.05 -1.26 0.08 0.00 0.21 0.00 0.00 52.86 51.94 2wr7 s ASN 357 Cb -0.14 -0.34 0.40 0.00 -0.55 0.00 0.00 41.25 40.62 2wr7 s ASN 357 CO -0.06 -0.30 1.16 -0.90 -2.79 0.00 0.00 177.10 174.21 2wr7 n ASP 358 N -0.82 3.10 -0.05 -4.21 5.75 -1.26 -3.20 116.55 115.85 2wr7 n ASP 358 Ca -0.05 -2.37 0.01 0.00 -0.01 0.00 0.00 54.79 52.37 2wr7 n ASP 358 Cb 0.65 -0.52 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 2wr7 n ASP 358 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2wr7 n GLN 359 N 0.38 2.27 -1.61 0.11 6.02 -1.26 -5.13 117.38 118.16 2wr7 n GLN 359 Ca 0.14 -0.37 0.00 0.00 -0.01 0.00 0.00 57.00 56.76 2wr7 n GLN 359 Cb 0.64 -0.85 0.00 0.00 1.02 0.00 0.00 30.24 31.05 2wr7 n GLN 359 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wr7 n GLY 360 N 0.51 -0.15 3.63 1.08 0.00 -1.19 -5.13 105.19 103.95 2wr7 n GLY 360 Ca 0.01 -1.66 -0.29 0.00 0.00 0.00 0.00 46.02 44.09 2wr7 n GLY 360 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2wr7 s SER 361 N -2.78 3.54 -0.22 1.61 0.01 -1.26 0.39 113.70 114.99 2wr7 s SER 361 Ca 0.00 -1.56 -0.35 0.00 1.31 0.00 0.00 55.95 55.35 2wr7 s SER 361 Cb 0.00 0.24 0.15 0.00 0.21 0.00 0.00 66.02 66.62 2wr7 s SER 361 CO 0.00 -0.75 1.25 -0.83 0.41 0.00 0.00 173.24 173.31 2wr7 s GLY 362 N -3.73 -0.24 -0.07 3.44 0.00 -1.12 -4.98 107.32 100.63 2wr7 s GLY 362 Ca 0.20 1.80 0.01 0.00 0.00 0.00 0.00 44.72 46.73 2wr7 s GLY 362 CO 0.10 0.63 -0.09 -0.19 0.00 0.00 0.00 173.10 173.55 2wr7 s TYR 363 N -2.16 2.87 -0.09 1.90 1.51 -1.26 -4.03 117.35 116.10 2wr7 s TYR 363 Ca 0.09 -0.11 -0.04 0.00 -1.01 0.00 0.00 57.07 56.00 2wr7 s TYR 363 Cb -0.01 -1.72 0.04 0.00 -0.11 0.00 0.00 41.96 40.17 2wr7 s TYR 363 CO -0.04 0.21 0.20 0.00 -1.11 0.00 0.00 175.55 174.82 2wr7 s ALA 364 N -0.59 -0.43 0.40 3.71 0.00 -0.24 -5.01 121.76 119.59 2wr7 s ALA 364 Ca 0.09 0.86 -0.24 0.00 0.00 0.00 0.00 51.96 52.67 2wr7 s ALA 364 Cb -0.12 -0.58 -0.09 0.00 0.00 0.00 0.00 23.12 22.33 2wr7 s ALA 364 CO 0.02 -0.21 1.04 0.00 0.00 0.00 0.00 175.76 176.61 2wr7 s ALA 365 N 1.30 3.09 -0.64 0.00 0.00 -1.26 0.17 121.76 124.42 2wr7 s ALA 365 Ca -0.09 0.68 -0.28 0.00 0.00 0.00 0.00 51.96 52.28 2wr7 s ALA 365 Cb -0.11 -3.26 0.03 0.00 0.00 0.00 0.00 23.12 19.77 2wr7 s ALA 365 CO -0.07 -0.18 1.27 0.34 0.00 0.00 0.00 175.76 177.11 2wr7 s ASP 366 N -1.58 6.27 0.19 0.00 2.15 0.18 -4.84 116.67 119.04 2wr7 s ASP 366 Ca 0.57 -0.10 -0.10 0.00 0.43 0.00 0.00 52.55 53.36 2wr7 s ASP 366 Cb -0.21 -2.55 0.10 0.00 -0.30 0.00 0.00 42.92 39.95 2wr7 s ASP 366 CO 0.27 -1.67 1.71 0.11 -0.17 0.00 0.00 175.17 175.42 2wr7 h LYS 367 N 10.02 1.03 -0.02 4.34 1.57 -1.94 -2.00 116.57 129.56 2wr7 h LYS 367 Ca -0.26 -0.23 -0.00 0.00 -1.87 0.00 0.00 60.65 58.29 2wr7 h LYS 367 Cb 1.06 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.22 2wr7 h LYS 367 CO 1.22 0.90 0.00 1.49 -0.57 0.00 0.00 179.45 182.50 2wr7 h GLU 368 N 0.96 0.04 -0.18 3.15 4.81 -1.97 -1.16 114.58 120.22 2wr7 h GLU 368 Ca 0.21 -0.01 -0.13 0.00 -0.13 0.00 0.00 59.36 59.31 2wr7 h GLU 368 Cb 0.31 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 2wr7 h GLU 368 CO -0.00 0.27 -0.43 0.66 -0.73 0.00 0.00 179.01 178.78 2wr7 h SER 369 N -0.21 0.46 -0.04 1.04 4.64 -1.95 -1.65 113.55 115.84 2wr7 h SER 369 Ca 0.01 -0.20 -0.00 0.00 -0.47 0.00 0.00 61.79 61.12 2wr7 h SER 369 Cb 0.25 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.21 2wr7 h SER 369 CO 0.00 0.83 0.02 0.74 -0.87 0.00 0.00 176.83 177.55 2wr7 h THR 370 N 0.35 1.08 -0.85 2.95 2.02 -1.27 -2.08 112.91 115.11 2wr7 h THR 370 Ca 0.03 -0.24 0.11 0.00 0.77 0.00 0.00 66.41 67.08 2wr7 h THR 370 Cb 0.90 1.17 -0.06 0.00 -1.74 0.00 0.00 68.15 68.42 2wr7 h THR 370 CO 0.08 0.07 0.55 -0.61 0.37 0.00 0.00 175.52 175.97 2wr7 h GLN 371 N -0.03 0.73 0.00 6.66 5.75 -0.96 0.21 115.11 127.47 2wr7 h GLN 371 Ca 0.01 -0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.47 2wr7 h GLN 371 Cb 0.09 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 28.48 2wr7 h GLN 371 CO -0.00 0.48 -0.00 -0.22 -2.65 0.00 0.00 178.83 176.44 2wr7 h LYS 372 N 0.75 -0.00 -0.95 1.69 3.64 -1.13 -1.38 116.57 119.18 2wr7 h LYS 372 Ca 0.40 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.79 2wr7 h LYS 372 Cb 0.53 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.31 2wr7 h LYS 372 CO -0.17 0.45 0.63 0.00 -2.27 0.00 0.00 179.45 178.09 2wr7 h ALA 373 N 0.54 1.32 0.16 5.00 0.00 -1.04 0.75 119.26 125.99 2wr7 h ALA 373 Ca -0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2wr7 h ALA 373 Cb 0.45 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2wr7 h ALA 373 CO 0.00 0.63 -0.08 0.35 0.00 0.00 0.00 179.25 180.16 2wr7 h PHE 374 N 1.29 -0.20 -0.52 0.00 3.57 -0.82 0.28 116.94 120.55 2wr7 h PHE 374 Ca 0.35 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.94 2wr7 h PHE 374 Cb -0.15 0.07 -0.08 0.00 2.79 0.00 0.00 35.95 38.57 2wr7 h PHE 374 CO 0.00 -0.04 0.04 -0.44 -2.23 0.00 0.00 178.31 175.63 2wr7 h ASP 375 N -0.31 -0.15 0.13 0.41 3.32 -0.97 0.12 116.42 118.98 2wr7 h ASP 375 Ca -0.02 0.11 0.01 0.00 0.02 0.00 0.00 57.03 57.16 2wr7 h ASP 375 Cb 0.24 0.19 -0.05 0.00 0.22 0.00 0.00 39.33 39.93 2wr7 h ASP 375 CO 0.04 -0.05 -0.50 1.23 -1.72 0.00 0.00 179.24 178.24 2wr7 h GLY 376 N 0.16 -1.07 0.89 2.75 0.00 0.01 0.72 103.07 106.52 2wr7 h GLY 376 Ca 0.27 0.61 0.03 0.00 0.00 0.00 0.00 47.33 48.23 2wr7 h GLY 376 CO -0.41 -0.27 0.42 -2.22 0.00 0.00 0.00 176.54 174.07 2wr7 h ILE 377 N -0.74 1.10 -0.11 2.60 1.08 -0.28 -0.71 117.51 120.46 2wr7 h ILE 377 Ca 0.00 -0.29 0.04 0.00 -0.39 0.00 0.00 64.86 64.23 2wr7 h ILE 377 Cb 0.75 0.19 -0.05 0.00 -3.07 0.00 0.00 36.82 34.63 2wr7 h ILE 377 CO -0.27 0.15 -0.23 0.74 -0.69 0.00 0.00 178.15 177.85 2wr7 h THR 378 N 0.84 0.44 -0.22 -0.27 2.02 -0.10 0.16 112.91 115.78 2wr7 h THR 378 Ca 0.27 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.50 2wr7 h THR 378 Cb -0.00 0.44 -0.06 0.00 -1.74 0.00 0.00 68.15 66.78 2wr7 h THR 378 CO -0.10 0.00 -0.22 0.78 0.37 0.00 0.00 175.52 176.36 2wr7 h ASN 379 N -0.31 -0.69 -0.40 4.18 2.35 -0.61 0.23 115.58 120.35 2wr7 h ASN 379 Ca 0.09 0.13 0.08 0.00 -0.55 0.00 0.00 56.30 56.05 2wr7 h ASN 379 Cb 0.45 0.33 -0.07 0.00 0.05 0.00 0.00 38.32 39.08 2wr7 h ASN 379 CO -0.29 -0.26 -0.04 0.50 -1.65 0.00 0.00 177.43 175.70 2wr7 h LYS 380 N -0.23 0.06 -0.54 0.81 3.64 0.24 0.16 116.57 120.71 2wr7 h LYS 380 Ca 0.13 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.55 2wr7 h LYS 380 Cb 0.43 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.19 2wr7 h LYS 380 CO -0.35 0.04 0.29 0.28 -2.27 0.00 0.00 179.45 177.44 2wr7 h VAL 381 N 0.06 0.99 0.00 2.00 2.07 -0.44 -2.03 116.25 118.90 2wr7 h VAL 381 Ca 0.19 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 2wr7 h VAL 381 Cb 0.28 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 2wr7 h VAL 381 CO -0.36 0.10 -0.13 0.78 0.02 0.00 0.00 177.57 177.98 2wr7 h ASN 382 N 0.57 0.00 0.05 0.57 2.35 0.23 -0.53 115.58 118.82 2wr7 h ASN 382 Ca 0.23 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.83 2wr7 h ASN 382 Cb 0.10 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.49 2wr7 h ASN 382 CO -0.14 0.13 -0.63 0.28 -1.65 0.00 0.00 177.43 175.42 2wr7 h SER 383 N 0.00 0.47 -0.74 5.81 0.02 -0.21 0.39 113.55 119.28 2wr7 h SER 383 Ca -0.00 -0.84 0.06 0.00 -0.84 0.00 0.00 61.79 60.17 2wr7 h SER 383 Cb 0.31 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 62.66 2wr7 h SER 383 CO 0.02 1.25 0.49 0.58 -1.14 0.00 0.00 176.83 178.03 2wr7 h VAL 384 N -0.26 1.04 0.11 2.27 2.07 -1.15 -3.04 116.25 117.29 2wr7 h VAL 384 Ca -0.09 -0.27 -0.32 0.00 0.82 0.00 0.00 66.70 66.84 2wr7 h VAL 384 Cb 1.40 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 2wr7 h VAL 384 CO 0.12 0.15 -1.68 0.40 0.02 0.00 0.00 177.57 176.58 2wr7 h ILE 385 N 0.80 0.83 -0.00 4.57 2.04 -0.88 -3.40 117.51 121.47 2wr7 h ILE 385 Ca 0.32 -2.36 0.00 0.00 1.00 0.00 0.00 64.86 63.82 2wr7 h ILE 385 Cb 0.23 2.56 0.00 0.00 -0.74 0.00 0.00 36.82 38.87 2wr7 h ILE 385 CO -0.11 0.75 -0.17 -1.84 0.00 0.00 0.00 178.15 176.79 2wr7 n GLU 386 N -3.77 0.17 0.03 2.37 0.28 0.14 -3.49 120.64 116.36 2wr7 n GLU 386 Ca -0.29 -0.05 0.13 0.00 -0.16 0.00 0.00 57.16 56.79 2wr7 n GLU 386 Cb 0.95 -1.50 0.32 0.00 1.43 0.00 0.00 31.44 32.64 2wr7 n GLU 386 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2wr7 n LYS 387 N -1.37 0.12 -2.06 3.44 4.76 -1.15 -4.81 118.16 117.09 2wr7 n LYS 387 Ca 0.09 0.05 -0.43 0.00 -2.87 0.00 0.00 58.31 55.15 2wr7 n LYS 387 Cb 0.32 -1.59 -0.03 0.00 -1.84 0.00 0.00 35.03 31.89 2wr7 n LYS 387 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 2wr7 s MET 388 N -3.06 3.49 -0.21 1.97 1.75 -1.23 -4.96 119.30 117.05 2wr7 s MET 388 Ca 0.10 1.44 -0.29 0.00 -1.25 0.00 0.00 55.69 55.69 2wr7 s MET 388 Cb 0.16 -4.14 0.01 0.00 2.84 0.00 0.00 34.83 33.70 2wr7 s MET 388 CO 0.66 -1.67 1.04 1.21 -0.65 0.00 0.00 175.02 175.61 2wr7 s ASN 389 N 5.35 7.12 -0.21 1.11 2.47 -1.26 -5.03 114.94 124.49 2wr7 s ASN 389 Ca 0.76 1.40 -0.01 0.00 0.42 0.00 0.00 52.86 55.43 2wr7 s ASN 389 Cb -0.22 -2.54 0.01 0.00 -1.45 0.00 0.00 41.25 37.05 2wr7 s ASN 389 CO 0.33 -0.64 -0.11 0.28 -3.72 0.00 0.00 177.10 173.23 2wr7 s THR 390 N 3.04 2.72 0.40 -5.21 -1.32 -1.26 -5.05 115.64 108.96 2wr7 s THR 390 Ca 0.45 -0.78 0.07 0.00 -1.21 0.00 0.00 61.69 60.22 2wr7 s THR 390 Cb -0.16 -2.23 -0.08 0.00 -1.51 0.00 0.00 72.50 68.53 2wr7 s THR 390 CO 0.08 0.43 0.01 0.00 -2.21 0.00 0.00 174.62 172.93 2wr7 s GLN 391 N 1.37 1.96 0.04 7.08 -2.07 -1.26 -4.96 119.66 121.82 2wr7 s GLN 391 Ca 0.04 -2.08 -0.30 0.00 -1.82 0.00 0.00 55.36 51.20 2wr7 s GLN 391 Cb -0.14 -1.67 -0.05 0.00 -1.09 0.00 0.00 33.01 30.06 2wr7 s GLN 391 CO -0.08 -0.03 1.14 0.12 -1.32 0.00 0.00 175.29 175.12 2wr7 s PHE 392 N -2.69 3.50 0.02 9.60 5.36 -1.26 -4.31 117.98 128.20 2wr7 s PHE 392 Ca 0.35 1.42 -0.15 0.00 -0.96 0.00 0.00 56.93 57.59 2wr7 s PHE 392 Cb 0.09 -3.33 0.02 0.00 -0.34 0.00 0.00 43.02 39.46 2wr7 s PHE 392 CO 0.18 -0.91 0.33 -1.21 -1.46 0.00 0.00 175.22 172.15 2wr7 s GLU 393 N 1.05 0.77 -0.20 10.12 8.01 -0.05 -4.96 118.70 133.43 2wr7 s GLU 393 Ca 0.57 -0.35 0.15 0.00 0.01 0.00 0.00 54.97 55.34 2wr7 s GLU 393 Cb -0.27 0.34 -0.23 0.00 -4.31 0.00 0.00 34.13 29.66 2wr7 s GLU 393 CO 0.29 -0.24 0.02 0.00 0.01 0.00 0.00 175.26 175.34 2wr7 n ALA 394 N 0.85 1.51 -0.49 5.21 0.00 -1.26 -1.35 120.51 124.98 2wr7 n ALA 394 Ca -0.20 -1.25 0.00 0.00 0.00 0.00 0.00 53.44 51.99 2wr7 n ALA 394 Cb 0.58 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.88 2wr7 n ALA 394 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2wr7 n VAL 395 N -2.81 0.00 -1.65 0.00 0.31 -1.25 -4.20 118.33 108.73 2wr7 n VAL 395 Ca -0.34 0.00 -0.55 0.00 -0.01 0.00 0.00 64.34 63.44 2wr7 n VAL 395 Cb 1.10 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.97 2wr7 n VAL 395 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wr7 n GLY 396 N 0.00 0.65 3.30 2.92 0.00 -1.26 -4.97 105.19 105.83 2wr7 n GLY 396 Ca 0.00 0.81 -0.16 0.00 0.00 0.00 0.00 46.02 46.67 2wr7 n GLY 396 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wr7 s LYS 397 N 1.92 1.24 -0.13 1.61 1.02 -1.26 -4.60 119.74 119.54 2wr7 s LYS 397 Ca 0.91 -1.60 0.02 0.00 0.02 0.00 0.00 55.97 55.32 2wr7 s LYS 397 Cb -1.01 -0.65 -0.00 0.00 -0.52 0.00 0.00 37.83 35.64 2wr7 s LYS 397 CO 0.56 -0.02 -0.18 -1.21 -0.92 0.00 0.00 175.35 173.57 2wr7 s GLU 398 N -3.81 3.17 0.03 1.68 0.41 -1.26 -5.10 118.70 113.82 2wr7 s GLU 398 Ca 0.24 -0.79 0.03 0.00 -0.41 0.00 0.00 54.97 54.05 2wr7 s GLU 398 Cb 0.04 -2.51 -0.02 0.00 -1.78 0.00 0.00 34.13 29.86 2wr7 s GLU 398 CO 0.06 0.09 -0.10 -0.06 -0.49 0.00 0.00 175.26 174.76 2wr7 s PHE 399 N 0.60 0.91 0.91 1.61 0.08 -1.26 -4.96 117.98 115.87 2wr7 s PHE 399 Ca -0.10 -0.32 -0.14 0.00 0.12 0.00 0.00 56.93 56.49 2wr7 s PHE 399 Cb -0.16 -0.55 0.14 0.00 -0.57 0.00 0.00 43.02 41.88 2wr7 s PHE 399 CO 0.03 -0.01 1.19 -1.54 -0.10 0.00 0.00 175.22 174.79 2wr7 s SER 400 N -0.97 3.55 0.48 1.36 1.04 -1.26 -4.90 113.70 113.00 2wr7 s SER 400 Ca -0.01 0.73 0.14 0.00 0.48 0.00 0.00 55.95 57.29 2wr7 s SER 400 Cb -0.07 -1.13 1.12 0.00 0.10 0.00 0.00 66.02 66.04 2wr7 s SER 400 CO 0.01 -2.50 2.07 0.78 0.98 0.00 0.00 173.24 174.58 2wr7 h ASN 401 N -1.47 0.05 -0.18 7.02 2.35 -2.03 -0.08 115.58 121.23 2wr7 h ASN 401 Ca -0.47 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.27 2wr7 h ASN 401 Cb 1.31 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.67 2wr7 h ASN 401 CO 0.56 0.11 0.00 0.18 -1.65 0.00 0.00 177.43 176.63 2wr7 n LEU 402 N -4.44 1.12 -2.28 1.61 4.77 -1.26 -3.96 117.00 112.56 2wr7 n LEU 402 Ca -0.02 -0.54 -0.27 0.00 -0.03 0.00 0.00 56.01 55.15 2wr7 n LEU 402 Cb 0.15 -0.12 0.02 0.00 -2.33 0.00 0.00 43.42 41.14 2wr7 n LEU 402 CO 0.35 0.27 0.39 -0.62 -1.33 0.00 0.00 177.39 176.45 2wr7 n GLU 403 N 0.07 3.41 0.11 3.23 1.02 -0.04 -4.82 120.64 123.61 2wr7 n GLU 403 Ca 0.10 -4.18 -0.02 0.00 -0.02 0.00 0.00 57.16 53.04 2wr7 n GLU 403 Cb 0.20 -2.27 0.05 0.00 -0.02 0.00 0.00 31.44 29.39 2wr7 n GLU 403 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2wr7 h ARG 404 N 2.37 0.00 -0.25 3.49 3.08 -1.72 -2.58 114.38 118.78 2wr7 h ARG 404 Ca 0.38 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.39 2wr7 h ARG 404 Cb 1.14 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.18 2wr7 h ARG 404 CO 0.91 0.74 0.01 0.00 -1.07 0.00 0.00 179.97 180.56 2wr7 h ARG 405 N 0.00 0.43 -0.08 0.04 3.08 -1.94 -1.21 114.38 114.69 2wr7 h ARG 405 Ca -0.01 -0.13 0.03 0.00 0.07 0.00 0.00 59.98 59.94 2wr7 h ARG 405 Cb 1.40 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 31.38 2wr7 h ARG 405 CO 0.10 0.59 -0.08 1.25 -1.07 0.00 0.00 179.97 180.76 2wr7 h LEU 406 N 0.22 -0.24 -1.37 3.04 5.85 -1.94 0.24 115.31 121.11 2wr7 h LEU 406 Ca 0.07 0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.92 2wr7 h LEU 406 Cb 0.39 0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.49 2wr7 h LEU 406 CO 0.01 -0.11 0.49 -0.08 -0.34 0.00 0.00 178.44 178.41 2wr7 h GLU 407 N -0.10 0.72 -0.08 1.25 4.81 -1.44 -1.58 114.58 118.17 2wr7 h GLU 407 Ca 0.06 -0.04 -0.15 0.00 -0.13 0.00 0.00 59.36 59.10 2wr7 h GLU 407 Cb 0.18 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 2wr7 h GLU 407 CO -0.14 0.48 -0.59 -0.97 -0.73 0.00 0.00 179.01 177.05 2wr7 h ASN 408 N 0.74 0.29 0.39 1.04 -0.73 0.07 -0.94 115.58 116.45 2wr7 h ASN 408 Ca 0.33 -0.16 -0.02 0.00 1.87 0.00 0.00 56.30 58.32 2wr7 h ASN 408 Cb 0.32 -0.08 0.00 0.00 0.27 0.00 0.00 38.32 38.83 2wr7 h ASN 408 CO -0.12 0.82 -0.19 0.25 -0.37 0.00 0.00 177.43 177.82 2wr7 h LEU 409 N 0.19 -0.44 -0.80 0.34 6.46 0.20 -1.10 115.31 120.16 2wr7 h LEU 409 Ca -0.00 -0.07 0.19 0.00 -0.12 0.00 0.00 57.88 57.87 2wr7 h LEU 409 Cb 1.09 0.11 -0.13 0.00 -0.73 0.00 0.00 40.66 41.01 2wr7 h LEU 409 CO 0.09 -0.19 0.16 -1.13 -0.62 0.00 0.00 178.44 176.76 2wr7 h ASN 410 N -0.68 -0.07 -0.60 1.25 -1.24 -1.22 -0.19 115.58 112.82 2wr7 h ASN 410 Ca -0.05 0.18 -0.02 0.00 0.71 0.00 0.00 56.30 57.11 2wr7 h ASN 410 Cb 0.49 0.25 -0.03 0.00 0.73 0.00 0.00 38.32 39.77 2wr7 h ASN 410 CO 0.09 -0.11 0.30 0.50 -1.29 0.00 0.00 177.43 176.91 2wr7 h LYS 411 N 0.21 0.85 -0.94 6.67 3.64 -0.99 -2.00 116.57 124.02 2wr7 h LYS 411 Ca 0.47 -0.12 0.03 0.00 -1.27 0.00 0.00 60.65 59.76 2wr7 h LYS 411 Cb 0.86 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.47 2wr7 h LYS 411 CO -0.60 0.68 0.61 -0.22 -2.27 0.00 0.00 179.45 177.66 2wr7 h LYS 412 N 0.81 1.17 0.13 1.90 1.63 0.23 -0.84 116.57 121.60 2wr7 h LYS 412 Ca 0.21 -0.07 -0.01 0.00 -0.85 0.00 0.00 60.65 59.93 2wr7 h LYS 412 Cb 0.10 -0.26 0.00 0.00 -0.60 0.00 0.00 32.23 31.47 2wr7 h LYS 412 CO -0.03 0.77 -0.06 1.98 -3.45 0.00 0.00 179.45 178.66 2wr7 h MET 413 N 1.21 -0.17 -0.19 1.90 4.05 -0.98 0.42 114.93 121.16 2wr7 h MET 413 Ca 0.37 0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 59.76 2wr7 h MET 413 Cb -0.03 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.79 2wr7 h MET 413 CO -0.11 0.06 -0.07 1.49 0.23 0.00 0.00 176.91 178.51 2wr7 h GLU 414 N -0.38 0.28 0.07 0.39 4.57 -1.09 -0.37 114.58 118.04 2wr7 h GLU 414 Ca -0.02 -0.06 -0.26 0.00 -1.18 0.00 0.00 59.36 57.84 2wr7 h GLU 414 Cb 0.31 -0.04 0.01 0.00 -0.16 0.00 0.00 28.75 28.87 2wr7 h GLU 414 CO 0.03 0.37 -1.11 -0.44 -1.18 0.00 0.00 179.01 176.68 2wr7 h ASP 415 N 0.27 0.65 0.07 1.04 5.19 -1.14 -1.34 116.42 121.16 2wr7 h ASP 415 Ca 0.06 -0.58 0.01 0.00 -0.62 0.00 0.00 57.03 55.90 2wr7 h ASP 415 Cb 0.31 -0.20 -0.01 0.00 0.18 0.00 0.00 39.33 39.60 2wr7 h ASP 415 CO 0.01 1.40 -0.09 1.23 -3.12 0.00 0.00 179.24 178.67 2wr7 h GLY 416 N 0.94 -0.17 1.46 2.75 0.00 -0.11 -0.29 103.07 107.65 2wr7 h GLY 416 Ca -0.13 0.11 -0.08 0.00 0.00 0.00 0.00 47.33 47.23 2wr7 h GLY 416 CO 0.20 -0.10 -0.10 0.74 0.00 0.00 0.00 176.54 177.28 2wr7 h PHE 417 N -0.20 0.70 -0.72 5.60 0.05 -1.19 -1.56 116.94 119.63 2wr7 h PHE 417 Ca 0.01 -0.11 0.00 0.00 3.82 0.00 0.00 57.97 61.69 2wr7 h PHE 417 Cb 0.20 -0.19 -0.04 0.00 2.00 0.00 0.00 35.95 37.93 2wr7 h PHE 417 CO -0.12 0.73 0.47 1.25 -0.18 0.00 0.00 178.31 180.45 2wr7 h LEU 418 N 0.60 0.83 -0.09 1.54 5.85 -0.89 -2.38 115.31 120.76 2wr7 h LEU 418 Ca 0.11 -0.03 -0.14 0.00 0.84 0.00 0.00 57.88 58.66 2wr7 h LEU 418 Cb 0.53 -0.21 0.01 0.00 0.37 0.00 0.00 40.66 41.36 2wr7 h LEU 418 CO 0.03 0.61 -0.49 0.44 -0.34 0.00 0.00 178.44 178.69 2wr7 h ASP 419 N 0.97 0.59 0.08 1.25 3.32 -0.56 -2.69 116.42 119.38 2wr7 h ASP 419 Ca 0.26 -0.65 0.00 0.00 0.02 0.00 0.00 57.03 56.67 2wr7 h ASP 419 Cb -0.10 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 2wr7 h ASP 419 CO -0.06 1.15 -0.09 0.58 -1.72 0.00 0.00 179.24 179.10 2wr7 h VAL 420 N 0.08 0.79 0.00 -1.35 2.07 -1.11 -0.77 116.25 115.97 2wr7 h VAL 420 Ca -0.03 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.44 2wr7 h VAL 420 Cb 1.14 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 2wr7 h VAL 420 CO 0.10 0.00 -0.23 -0.50 0.02 0.00 0.00 177.57 176.96 2wr7 h TRP 421 N -0.19 0.00 0.12 1.57 4.06 -1.56 -0.72 115.95 119.22 2wr7 h TRP 421 Ca 0.01 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.95 2wr7 h TRP 421 Cb 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.35 2wr7 h TRP 421 CO -0.12 0.23 -0.06 1.15 -3.56 0.00 0.00 178.44 176.09 2wr7 h THR 422 N 0.00 0.90 -0.82 1.49 2.02 -1.08 0.36 112.91 115.78 2wr7 h THR 422 Ca -0.00 -1.30 0.10 0.00 0.77 0.00 0.00 66.41 65.98 2wr7 h THR 422 Cb 0.46 1.56 -0.08 0.00 -1.74 0.00 0.00 68.15 68.36 2wr7 h THR 422 CO 0.03 0.25 0.46 0.22 0.37 0.00 0.00 175.52 176.85 2wr7 h TYR 423 N -0.90 0.83 -0.46 3.16 3.20 -1.15 0.25 116.97 121.90 2wr7 h TYR 423 Ca -0.02 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.79 2wr7 h TYR 423 Cb 0.54 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.54 2wr7 h TYR 423 CO 0.10 0.32 -0.08 -0.91 -1.64 0.00 0.00 178.16 175.95 2wr7 h ASN 424 N 0.76 0.87 -0.29 -2.11 2.35 -1.14 -2.54 115.58 113.47 2wr7 h ASN 424 Ca 0.40 -0.35 -0.12 0.00 -0.55 0.00 0.00 56.30 55.68 2wr7 h ASN 424 Cb 0.40 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 2wr7 h ASN 424 CO -0.26 1.01 -0.27 0.00 -1.65 0.00 0.00 177.43 176.26 2wr7 h ALA 425 N 0.88 0.82 -0.14 -0.83 0.00 -0.15 -1.21 119.26 118.63 2wr7 h ALA 425 Ca 0.12 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 2wr7 h ALA 425 Cb 0.62 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2wr7 h ALA 425 CO 0.04 0.64 0.03 0.93 0.00 0.00 0.00 179.25 180.89 2wr7 h GLU 426 N 0.67 0.23 -0.21 0.00 4.39 -0.92 -2.71 114.58 116.04 2wr7 h GLU 426 Ca 0.08 -0.06 -0.18 0.00 0.34 0.00 0.00 59.36 59.54 2wr7 h GLU 426 Cb 0.79 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.41 2wr7 h GLU 426 CO 0.07 0.41 -0.61 -0.07 -1.16 0.00 0.00 179.01 177.64 2wr7 h LEU 427 N 0.02 0.80 -0.28 1.33 4.07 -1.43 -1.83 115.31 117.99 2wr7 h LEU 427 Ca 0.04 -0.45 0.06 0.00 0.08 0.00 0.00 57.88 57.61 2wr7 h LEU 427 Cb 0.28 -0.23 -0.06 0.00 1.08 0.00 0.00 40.66 41.74 2wr7 h LEU 427 CO 0.00 1.22 -0.09 0.25 -1.08 0.00 0.00 178.44 178.75 2wr7 h LEU 428 N 0.52 -0.31 0.30 1.67 5.85 -1.24 0.76 115.31 122.86 2wr7 h LEU 428 Ca -0.01 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 2wr7 h LEU 428 Cb 1.20 0.19 0.00 0.00 0.37 0.00 0.00 40.66 42.42 2wr7 h LEU 428 CO 0.12 -0.11 -0.14 0.58 -0.34 0.00 0.00 178.44 178.55 2wr7 h VAL 429 N -0.02 0.72 -0.22 1.05 2.07 -1.36 0.35 116.25 118.84 2wr7 h VAL 429 Ca 0.14 -0.07 0.06 0.00 0.82 0.00 0.00 66.70 67.65 2wr7 h VAL 429 Cb 0.23 0.76 -0.06 0.00 -1.52 0.00 0.00 31.29 30.70 2wr7 h VAL 429 CO -0.30 0.01 -0.19 -0.07 0.02 0.00 0.00 177.57 177.04 2wr7 h LEU 430 N -0.43 -0.61 -0.54 2.57 3.38 -1.10 -0.51 115.31 118.07 2wr7 h LEU 430 Ca -0.04 0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 2wr7 h LEU 430 Cb 0.33 0.30 -0.02 0.00 0.09 0.00 0.00 40.66 41.35 2wr7 h LEU 430 CO 0.07 -0.23 0.18 0.24 0.09 0.00 0.00 178.44 178.79 2wr7 h MET 431 N -0.20 0.83 0.00 1.13 2.86 0.83 -2.82 114.93 117.56 2wr7 h MET 431 Ca 0.13 -0.17 -0.09 0.00 -2.06 0.00 0.00 59.70 57.51 2wr7 h MET 431 Cb 0.39 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 2wr7 h MET 431 CO -0.33 0.75 -0.41 0.93 1.06 0.00 0.00 176.91 178.91 2wr7 h GLU 432 N 0.75 0.00 -0.54 1.72 4.39 -0.23 -2.91 114.58 117.76 2wr7 h GLU 432 Ca 0.18 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.78 2wr7 h GLU 432 Cb 0.25 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 2wr7 h GLU 432 CO -0.01 0.41 -0.04 -0.91 -1.16 0.00 0.00 179.01 177.31 2wr7 h ASN 433 N 0.00 0.96 0.38 1.42 4.21 -0.95 -0.62 115.58 120.98 2wr7 h ASN 433 Ca -0.00 -0.32 -0.17 0.00 1.21 0.00 0.00 56.30 57.01 2wr7 h ASN 433 Cb 0.99 -0.26 -0.01 0.00 -1.12 0.00 0.00 38.32 37.92 2wr7 h ASN 433 CO 0.05 1.06 -0.72 1.05 -1.29 0.00 0.00 177.43 177.57 2wr7 h GLU 434 N 0.85 0.29 -0.30 0.81 4.11 -1.52 -2.16 114.58 116.66 2wr7 h GLU 434 Ca 0.15 -0.24 -0.06 0.00 0.07 0.00 0.00 59.36 59.27 2wr7 h GLU 434 Cb 0.58 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 2wr7 h GLU 434 CO 0.03 0.90 -0.07 0.00 0.07 0.00 0.00 179.01 179.94 2wr7 h ARG 435 N 0.20 0.48 -0.05 1.06 2.47 -1.35 -0.35 114.38 116.85 2wr7 h ARG 435 Ca -0.03 -0.12 -0.01 0.00 -1.26 0.00 0.00 59.98 58.56 2wr7 h ARG 435 Cb 1.29 -0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 29.55 2wr7 h ARG 435 CO 0.12 0.57 -0.01 1.15 0.56 0.00 0.00 179.97 182.36 2wr7 h THR 436 N 0.46 1.28 -0.58 2.04 2.02 -0.89 0.14 112.91 117.38 2wr7 h THR 436 Ca 0.09 -0.87 -0.09 0.00 0.77 0.00 0.00 66.41 66.32 2wr7 h THR 436 Cb 0.42 1.78 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 2wr7 h THR 436 CO 0.02 0.24 0.02 -0.07 0.37 0.00 0.00 175.52 176.10 2wr7 h LEU 437 N -0.25 0.98 -0.86 2.58 3.38 -1.12 -0.55 115.31 119.47 2wr7 h LEU 437 Ca 0.01 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.71 2wr7 h LEU 437 Cb 0.38 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 2wr7 h LEU 437 CO 0.00 1.04 0.56 0.44 0.09 0.00 0.00 178.44 180.57 2wr7 h ASP 438 N 0.90 0.95 -0.38 -0.43 3.32 -1.04 -1.05 116.42 118.68 2wr7 h ASP 438 Ca 0.17 -0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.24 2wr7 h ASP 438 Cb 0.52 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.81 2wr7 h ASP 438 CO 0.03 0.67 0.15 0.15 -1.72 0.00 0.00 179.24 178.52 2wr7 h PHE 439 N 1.12 0.28 -0.76 4.55 3.57 0.42 0.11 116.94 126.22 2wr7 h PHE 439 Ca 0.33 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.80 2wr7 h PHE 439 Cb -0.05 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.59 2wr7 h PHE 439 CO -0.02 0.12 0.28 0.45 -2.23 0.00 0.00 178.31 176.92 2wr7 h HIS 440 N 0.32 1.17 0.38 0.41 3.86 -0.83 -1.59 115.15 118.87 2wr7 h HIS 440 Ca 0.17 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 2wr7 h HIS 440 Cb 0.13 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.24 2wr7 h HIS 440 CO -0.13 0.90 -0.26 0.22 0.86 0.00 0.00 177.93 179.52 2wr7 h ASP 441 N 1.11 -0.66 -0.97 2.45 -0.00 -0.48 -2.34 116.42 115.53 2wr7 h ASP 441 Ca 0.25 0.05 0.16 0.00 -0.00 0.00 0.00 57.03 57.49 2wr7 h ASP 441 Cb 0.24 0.20 -0.09 0.00 -0.00 0.00 0.00 39.33 39.69 2wr7 h ASP 441 CO -0.02 -0.40 0.61 -1.28 -0.00 0.00 0.00 179.24 178.15 2wr7 h SER 442 N -0.62 0.76 -0.81 2.28 0.87 -0.63 -0.98 113.55 114.42 2wr7 h SER 442 Ca -0.04 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2wr7 h SER 442 Cb 0.53 -0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 62.37 2wr7 h SER 442 CO 0.02 0.34 0.51 0.78 -0.53 0.00 0.00 176.83 177.95 2wr7 h ASN 443 N 0.78 0.95 -0.03 6.23 2.35 -0.81 0.85 115.58 125.89 2wr7 h ASN 443 Ca 0.52 -0.04 -0.10 0.00 -0.55 0.00 0.00 56.30 56.13 2wr7 h ASN 443 Cb 0.77 -0.24 0.01 0.00 0.05 0.00 0.00 38.32 38.91 2wr7 h ASN 443 CO -0.29 0.71 -0.35 0.58 -1.65 0.00 0.00 177.43 176.42 2wr7 h VAL 444 N 1.10 1.46 -0.71 2.81 2.07 -0.79 0.18 116.25 122.37 2wr7 h VAL 444 Ca 0.29 -1.86 0.14 0.00 0.82 0.00 0.00 66.70 66.09 2wr7 h VAL 444 Cb -0.09 2.52 -0.13 0.00 -1.52 0.00 0.00 31.29 32.07 2wr7 h VAL 444 CO -0.06 0.53 -0.24 0.50 0.02 0.00 0.00 177.57 178.32 2wr7 h LYS 445 N -0.25 -0.05 -0.16 1.57 1.63 -1.13 0.30 116.57 118.48 2wr7 h LYS 445 Ca -0.03 0.00 -0.10 0.00 -0.85 0.00 0.00 60.65 59.67 2wr7 h LYS 445 Cb 1.05 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.68 2wr7 h LYS 445 CO 0.07 -0.03 -0.34 -0.91 -3.45 0.00 0.00 179.45 174.79 2wr7 h ASN 446 N -0.05 0.33 0.57 4.20 2.35 -0.57 0.76 115.58 123.18 2wr7 h ASN 446 Ca 0.32 -0.13 -0.03 0.00 -0.55 0.00 0.00 56.30 55.92 2wr7 h ASN 446 Cb 0.55 -0.09 0.01 0.00 0.05 0.00 0.00 38.32 38.83 2wr7 h ASN 446 CO -0.75 0.66 -0.27 0.25 -1.65 0.00 0.00 177.43 175.67 2wr7 h LEU 447 N 0.28 -0.65 -0.50 1.61 5.85 0.14 -0.50 115.31 121.54 2wr7 h LEU 447 Ca 0.03 -0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.81 2wr7 h LEU 447 Cb 0.74 0.17 -0.10 0.00 0.37 0.00 0.00 40.66 41.83 2wr7 h LEU 447 CO 0.06 -0.30 -0.32 0.22 -0.34 0.00 0.00 178.44 177.75 2wr7 h TYR 448 N -1.02 -0.88 -0.81 1.25 3.20 -0.09 -1.91 116.97 116.71 2wr7 h TYR 448 Ca -0.08 0.06 0.03 0.00 3.14 0.00 0.00 58.73 61.89 2wr7 h TYR 448 Cb 0.65 0.46 -0.05 0.00 1.54 0.00 0.00 36.73 39.33 2wr7 h TYR 448 CO 0.00 -0.38 0.52 -0.44 -1.64 0.00 0.00 178.16 176.23 2wr7 h ASP 449 N -0.20 0.86 -0.73 -2.11 3.32 0.55 -1.56 116.42 116.55 2wr7 h ASP 449 Ca 0.21 -0.00 0.12 0.00 0.02 0.00 0.00 57.03 57.37 2wr7 h ASP 449 Cb 0.54 -0.19 -0.08 0.00 0.22 0.00 0.00 39.33 39.81 2wr7 h ASP 449 CO -0.61 0.59 0.32 0.50 -1.72 0.00 0.00 179.24 178.32 2wr7 h LYS 450 N 1.01 0.49 -0.35 3.56 3.64 -0.33 -1.29 116.57 123.29 2wr7 h LYS 450 Ca 0.32 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.60 2wr7 h LYS 450 Cb 0.01 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 2wr7 h LYS 450 CO -0.11 0.32 -0.06 0.28 -2.27 0.00 0.00 179.45 177.61 2wr7 h VAL 451 N 0.51 1.27 -0.47 2.00 2.07 -0.95 -3.29 116.25 117.39 2wr7 h VAL 451 Ca 0.39 -1.09 0.05 0.00 0.82 0.00 0.00 66.70 66.86 2wr7 h VAL 451 Cb 0.52 1.26 -0.05 0.00 -1.52 0.00 0.00 31.29 31.51 2wr7 h VAL 451 CO -0.35 0.36 0.20 -0.09 0.02 0.00 0.00 177.57 177.71 2wr7 h ARG 452 N 0.46 0.39 0.00 1.57 2.43 -0.55 -2.34 114.38 116.35 2wr7 h ARG 452 Ca 0.09 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2wr7 h ARG 452 Cb 0.55 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.01 2wr7 h ARG 452 CO 0.03 0.26 0.00 -1.33 -1.51 0.00 0.00 179.97 177.42 2wr7 n MET 453 N -4.95 0.11 -0.08 0.20 2.81 -0.56 -2.16 117.12 112.49 2wr7 n MET 453 Ca 0.04 0.42 -0.08 0.00 -1.81 0.00 0.00 57.70 56.27 2wr7 n MET 453 Cb 0.15 -1.73 -0.03 0.00 -0.71 0.00 0.00 33.22 30.90 2wr7 n MET 453 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2wr7 n GLN 454 N -1.94 0.48 -0.16 0.03 6.02 -0.93 -4.48 117.38 116.41 2wr7 n GLN 454 Ca 0.02 0.50 0.16 0.00 -0.01 0.00 0.00 57.00 57.66 2wr7 n GLN 454 Cb 0.15 -1.67 0.51 0.00 1.02 0.00 0.00 30.24 30.25 2wr7 n GLN 454 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2wr7 h LEU 455 N -1.00 0.37 0.00 1.08 3.38 -1.35 -3.45 115.31 114.35 2wr7 h LEU 455 Ca -0.06 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2wr7 h LEU 455 Cb 0.69 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2wr7 h LEU 455 CO -0.04 0.19 0.00 0.54 0.09 0.00 0.00 178.44 179.22 2wr7 n ARG 456 N -4.47 0.00 0.09 1.13 1.74 -0.92 -1.50 116.66 112.72 2wr7 n ARG 456 Ca 0.14 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.18 2wr7 n ARG 456 Cb 0.54 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.91 2wr7 n ARG 456 CO 0.00 0.00 0.00 -0.44 -1.52 0.00 0.00 177.63 175.67 2wr7 h ASP 457 N 0.00 0.00 0.00 0.55 3.32 -1.92 -3.35 116.42 115.03 2wr7 h ASP 457 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2wr7 h ASP 457 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2wr7 h ASP 457 CO 0.00 0.83 0.00 0.59 -1.72 0.00 0.00 179.24 178.94 2wr7 n ASN 458 N -3.31 0.00 -3.95 6.45 5.03 -0.56 -4.68 115.26 114.24 2wr7 n ASN 458 Ca 0.01 -0.38 -0.10 0.00 0.87 0.00 0.00 54.58 54.98 2wr7 n ASN 458 Cb 0.87 0.00 -0.11 0.00 -1.02 0.00 0.00 39.78 39.52 2wr7 n ASN 458 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 2wr7 s VAL 459 N -2.00 0.09 -0.05 2.41 -7.23 -1.26 0.13 120.40 112.49 2wr7 s VAL 459 Ca 0.15 -0.72 -0.21 0.00 -1.81 0.00 0.00 61.98 59.39 2wr7 s VAL 459 Cb 0.07 -0.24 -0.05 0.00 0.56 0.00 0.00 36.38 36.72 2wr7 s VAL 459 CO 0.12 -0.40 0.61 -0.75 -0.31 0.00 0.00 175.10 174.37 2wr7 s LYS 460 N -1.19 4.36 -0.77 4.82 2.20 0.30 -4.88 119.74 124.58 2wr7 s LYS 460 Ca -0.13 0.73 -0.19 0.00 -0.36 0.00 0.00 55.97 56.01 2wr7 s LYS 460 Cb -0.08 -3.39 0.12 0.00 -1.51 0.00 0.00 37.83 32.96 2wr7 s LYS 460 CO -0.00 0.23 0.95 -2.00 -0.36 0.00 0.00 175.35 174.16 2wr7 s GLU 461 N 0.29 3.35 0.47 4.03 2.12 -1.26 -0.35 118.70 127.34 2wr7 s GLU 461 Ca 0.32 -1.51 0.14 0.00 0.36 0.00 0.00 54.97 54.29 2wr7 s GLU 461 Cb -0.17 -4.54 1.08 0.00 0.26 0.00 0.00 34.13 30.75 2wr7 s GLU 461 CO 0.16 -1.68 2.04 -0.07 -0.54 0.00 0.00 175.26 175.18 2wr7 h LEU 462 N 10.25 0.03 0.00 2.70 3.38 -1.71 -3.47 115.31 126.49 2wr7 h LEU 462 Ca -0.07 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2wr7 h LEU 462 Cb 1.05 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2wr7 h LEU 462 CO 1.09 0.13 0.00 0.61 0.09 0.00 0.00 178.44 180.36 2wr7 n GLY 463 N -1.20 0.28 1.58 0.83 0.00 -1.26 -4.90 105.19 100.52 2wr7 n GLY 463 Ca -0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.09 2wr7 n GLY 463 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2wr7 n ASN 464 N 0.00 4.80 0.00 1.61 0.23 -1.26 -4.75 115.26 115.90 2wr7 n ASN 464 Ca 0.00 -2.49 0.00 0.00 -0.53 0.00 0.00 54.58 51.56 2wr7 n ASN 464 Cb 0.00 -0.58 0.00 0.00 -2.08 0.00 0.00 39.78 37.12 2wr7 n ASN 464 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2wr7 n GLY 465 N 1.05 0.76 3.68 4.83 0.00 -1.25 -4.57 105.19 109.68 2wr7 n GLY 465 Ca 0.26 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.94 2wr7 n GLY 465 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wr7 s PHE 467 N -0.96 3.00 -0.19 0.00 0.40 -1.26 -1.66 117.98 117.31 2wr7 s PHE 467 Ca 0.16 -1.19 -0.21 0.00 -0.60 0.00 0.00 56.93 55.08 2wr7 s PHE 467 Cb -0.11 -2.10 -0.02 0.00 0.51 0.00 0.00 43.02 41.30 2wr7 s PHE 467 CO 0.05 -0.63 0.65 -2.00 0.70 0.00 0.00 175.22 173.99 2wr7 s GLU 468 N 1.42 4.23 0.09 0.44 2.12 0.53 -4.87 118.70 122.66 2wr7 s GLU 468 Ca 0.04 0.66 -0.30 0.00 0.36 0.00 0.00 54.97 55.72 2wr7 s GLU 468 Cb -0.15 -3.57 -0.06 0.00 0.26 0.00 0.00 34.13 30.61 2wr7 s GLU 468 CO -0.04 -0.24 1.11 -0.06 -0.54 0.00 0.00 175.26 175.49 2wr7 s PHE 469 N 1.90 3.56 -0.03 5.30 0.40 -1.26 0.11 117.98 127.96 2wr7 s PHE 469 Ca 0.30 1.51 -0.22 0.00 -0.60 0.00 0.00 56.93 57.92 2wr7 s PHE 469 Cb -0.16 -3.29 -0.15 0.00 0.51 0.00 0.00 43.02 39.93 2wr7 s PHE 469 CO 0.11 -0.70 0.99 1.88 0.70 0.00 0.00 175.22 178.19 2wr7 h TYR 470 N 6.12 -0.32 -3.60 0.36 0.99 -0.65 -3.46 116.97 116.41 2wr7 h TYR 470 Ca -0.43 -0.01 -0.42 0.00 2.00 0.00 0.00 58.73 59.88 2wr7 h TYR 470 Cb 1.21 0.11 0.19 0.00 1.00 0.00 0.00 36.73 39.24 2wr7 h TYR 470 CO 0.65 0.04 0.22 -3.38 -0.00 0.00 0.00 178.16 175.69 2wr7 s HIS 471 N -3.91 0.59 -0.06 4.88 -3.43 -1.26 -5.04 115.29 107.06 2wr7 s HIS 471 Ca -0.13 0.37 -0.11 0.00 -0.80 0.00 0.00 55.06 54.39 2wr7 s HIS 471 Cb 0.01 -3.70 -0.05 0.00 -1.43 0.00 0.00 32.58 27.41 2wr7 s HIS 471 CO 0.47 -3.65 0.29 0.15 -2.00 0.00 0.00 174.74 170.00 2wr7 s LYS 472 N -5.61 3.73 -0.38 -0.38 1.02 -1.26 -5.06 119.74 111.80 2wr7 s LYS 472 Ca 0.73 0.16 0.01 0.00 0.02 0.00 0.00 55.97 56.89 2wr7 s LYS 472 Cb -0.07 -3.22 0.13 0.00 -0.52 0.00 0.00 37.83 34.15 2wr7 s LYS 472 CO 0.55 0.70 0.20 0.00 -0.92 0.00 0.00 175.35 175.88 2wr7 n ASP 474 N 4.04 -0.52 -0.26 0.00 3.85 -1.26 -4.53 116.55 117.87 2wr7 n ASP 474 Ca 0.07 -0.89 0.04 0.00 -0.71 0.00 0.00 54.79 53.29 2wr7 n ASP 474 Cb 0.37 -0.20 0.17 0.00 -1.35 0.00 0.00 41.12 40.11 2wr7 n ASP 474 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.20 176.63 2wr7 h ASP 475 N -0.78 0.43 -0.08 -1.12 5.19 -2.00 0.24 116.42 118.30 2wr7 h ASP 475 Ca -0.08 0.08 0.02 0.00 -0.62 0.00 0.00 57.03 56.42 2wr7 h ASP 475 Cb 0.24 0.02 -0.02 0.00 0.18 0.00 0.00 39.33 39.75 2wr7 h ASP 475 CO 0.06 0.21 -0.03 -0.33 -3.12 0.00 0.00 179.24 176.03 2wr7 h GLU 476 N 0.56 -0.01 0.00 3.56 4.39 -2.00 -1.63 114.58 119.45 2wr7 h GLU 476 Ca 0.39 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.96 2wr7 h GLU 476 Cb 0.49 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.13 2wr7 h GLU 476 CO -0.32 -0.01 -0.62 0.00 -1.16 0.00 0.00 179.01 176.90 2wr7 h MET 478 N 0.00 -0.08 -0.87 0.00 2.86 -0.24 -1.98 114.93 114.62 2wr7 h MET 478 Ca -0.01 0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.68 2wr7 h MET 478 Cb 1.11 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 32.74 2wr7 h MET 478 CO 0.08 -0.06 0.57 -0.91 1.06 0.00 0.00 176.91 177.65 2wr7 h ASN 479 N -0.09 0.92 0.02 1.22 2.35 -1.17 -0.26 115.58 118.58 2wr7 h ASN 479 Ca 0.09 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2wr7 h ASN 479 Cb 0.22 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.38 2wr7 h ASN 479 CO -0.21 0.63 -0.02 0.77 -1.65 0.00 0.00 177.43 176.95 2wr7 h SER 480 N 1.07 0.00 0.02 5.81 4.64 -0.98 0.60 113.55 124.70 2wr7 h SER 480 Ca 0.35 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.67 2wr7 h SER 480 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2wr7 h SER 480 CO -0.11 0.02 -0.01 0.58 -0.87 0.00 0.00 176.83 176.44 2wr7 h VAL 481 N 0.00 1.36 0.00 0.95 2.07 -0.38 -1.05 116.25 119.20 2wr7 h VAL 481 Ca -0.00 -1.90 -0.01 0.00 0.82 0.00 0.00 66.70 65.62 2wr7 h VAL 481 Cb 0.04 2.52 -0.00 0.00 -1.52 0.00 0.00 31.29 32.32 2wr7 h VAL 481 CO 0.00 0.44 -0.03 0.11 0.02 0.00 0.00 177.57 178.12 2wr7 h LYS 482 N -0.95 0.00 0.18 1.57 1.57 -0.81 -3.12 116.57 115.02 2wr7 h LYS 482 Ca -0.00 0.00 -0.28 0.00 -1.87 0.00 0.00 60.65 58.50 2wr7 h LYS 482 Cb 0.74 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.08 2wr7 h LYS 482 CO 0.00 0.03 -1.20 -0.91 -0.57 0.00 0.00 179.45 176.80 2wr7 h ASN 483 N 0.00 0.74 0.00 0.86 2.35 0.12 -3.48 115.58 116.17 2wr7 h ASN 483 Ca -0.00 -0.90 0.00 0.00 -0.55 0.00 0.00 56.30 54.85 2wr7 h ASN 483 Cb 0.17 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.31 2wr7 h ASN 483 CO 0.00 1.58 0.00 0.61 -1.65 0.00 0.00 177.43 177.97 2wr7 n GLY 484 N 1.60 1.28 0.00 2.83 0.00 -1.15 -5.07 105.19 104.68 2wr7 n GLY 484 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2wr7 n GLY 484 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2wr7 n THR 485 N 0.00 0.00 -1.22 2.61 -1.04 -0.51 -4.97 114.28 109.15 2wr7 n THR 485 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2wr7 n THR 485 Cb 0.00 -0.63 0.00 0.00 -1.82 0.00 0.00 70.33 67.88 2wr7 n THR 485 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wr7 n TYR 486 N 0.00 -0.75 -1.22 -1.42 9.36 -0.52 -4.93 117.16 117.68 2wr7 n TYR 486 Ca 0.00 0.40 0.00 0.00 3.32 0.00 0.00 57.90 61.62 2wr7 n TYR 486 Cb 0.00 -1.00 0.00 0.00 -0.63 0.00 0.00 39.34 37.71 2wr7 n TYR 486 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61