#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wrf n VAL 9 N 2.86 2.62 -0.37 0.00 0.31 -1.20 -1.09 118.33 121.46 2wrf n VAL 9 Ca -0.17 -5.36 0.00 0.00 -0.01 0.00 0.00 64.34 58.79 2wrf n VAL 9 Cb 0.52 -1.79 0.00 0.00 -0.91 0.00 0.00 33.84 31.66 2wrf n VAL 9 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wrf n GLY 10 N 0.38 0.03 3.29 2.92 0.00 -1.24 -4.86 105.19 105.71 2wrf n GLY 10 Ca 0.30 -1.69 -0.17 0.00 0.00 0.00 0.00 46.02 44.46 2wrf n GLY 10 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2wrf s TYR 11 N 0.44 1.51 0.00 1.61 -0.85 -1.26 -3.68 117.35 115.12 2wrf s TYR 11 Ca 0.00 -1.42 0.00 0.00 -0.52 0.00 0.00 57.07 55.13 2wrf s TYR 11 Cb 0.00 -0.75 0.00 0.00 0.38 0.00 0.00 41.96 41.59 2wrf s TYR 11 CO 0.00 -0.61 0.00 1.58 -1.52 0.00 0.00 175.55 175.00 2wrf n HIS 12 N -0.50 -1.85 -2.85 -3.49 -0.00 1.00 -1.01 115.22 106.51 2wrf n HIS 12 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.75 2wrf n HIS 12 Cb 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.64 2wrf n HIS 12 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2wrf n SER 13 N -1.75 0.00 0.00 0.26 2.88 -1.26 -3.93 113.62 109.81 2wrf n SER 13 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2wrf n SER 13 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2wrf n SER 13 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2wrf n ASN 14 N 2.16 0.00 -3.28 -3.46 0.23 -1.26 -4.88 115.26 104.77 2wrf n ASN 14 Ca 0.00 0.00 -0.24 0.00 -0.53 0.00 0.00 54.58 53.81 2wrf n ASN 14 Cb 0.00 0.00 -0.05 0.00 -2.08 0.00 0.00 39.78 37.65 2wrf n ASN 14 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2wrf n ASN 15 N 0.00 1.51 -4.66 0.53 3.02 -1.26 -4.84 115.26 109.57 2wrf n ASN 15 Ca 0.00 -2.31 -0.32 0.00 -0.03 0.00 0.00 54.58 51.92 2wrf n ASN 15 Cb 0.00 -0.69 -0.09 0.00 -0.61 0.00 0.00 39.78 38.39 2wrf n ASN 15 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2wrf s SER 16 N 5.35 4.95 -0.22 6.41 0.15 -1.26 -5.02 113.70 124.07 2wrf s SER 16 Ca 0.37 -0.10 0.14 0.00 0.70 0.00 0.00 55.95 57.05 2wrf s SER 16 Cb 0.09 -1.22 0.45 0.00 -1.71 0.00 0.00 66.02 63.63 2wrf s SER 16 CO 0.12 0.25 1.18 0.35 1.20 0.00 0.00 173.24 176.34 2wrf n THR 17 N 1.18 1.84 -2.46 6.45 -2.24 -1.26 -4.79 114.28 113.01 2wrf n THR 17 Ca -0.14 -3.23 -0.43 0.00 -2.27 0.00 0.00 64.05 57.99 2wrf n THR 17 Cb 0.52 -0.12 -0.02 0.00 -2.10 0.00 0.00 70.33 68.62 2wrf n THR 17 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2wrf s GLU 18 N -3.01 3.89 -0.34 -0.78 2.02 -1.26 -4.95 118.70 114.26 2wrf s GLU 18 Ca 0.40 1.14 -0.14 0.00 0.02 0.00 0.00 54.97 56.39 2wrf s GLU 18 Cb 0.38 -3.88 -0.01 0.00 0.10 0.00 0.00 34.13 30.72 2wrf s GLU 18 CO -0.04 -1.16 0.29 0.15 0.02 0.00 0.00 175.26 174.53 2wrf s LYS 19 N 4.20 3.51 0.60 1.61 3.01 -1.26 -0.44 119.74 130.98 2wrf s LYS 19 Ca 0.55 -0.56 0.01 0.00 -1.01 0.00 0.00 55.97 54.96 2wrf s LYS 19 Cb -0.15 -3.81 0.07 0.00 -1.01 0.00 0.00 37.83 32.93 2wrf s LYS 19 CO 0.24 -0.49 0.84 0.14 0.51 0.00 0.00 175.35 176.59 2wrf s VAL 20 N 1.85 2.47 0.02 3.17 -7.23 -1.17 -4.69 120.40 114.82 2wrf s VAL 20 Ca 0.08 -0.67 0.07 0.00 -1.81 0.00 0.00 61.98 59.65 2wrf s VAL 20 Cb -0.17 -2.80 -0.02 0.00 0.56 0.00 0.00 36.38 33.95 2wrf s VAL 20 CO 0.11 0.00 -0.21 -1.81 -0.31 0.00 0.00 175.10 172.88 2wrf s ASP 21 N -4.54 2.43 0.20 4.85 1.11 -1.26 -1.35 116.67 118.12 2wrf s ASP 21 Ca 0.60 -0.45 0.03 0.00 0.18 0.00 0.00 52.55 52.91 2wrf s ASP 21 Cb -0.08 -0.23 -0.05 0.00 1.07 0.00 0.00 42.92 43.62 2wrf s ASP 21 CO 0.40 0.20 -0.01 0.42 1.18 0.00 0.00 175.17 177.37 2wrf s THR 22 N -0.65 0.91 -1.42 -1.27 -4.23 -1.12 -4.44 115.64 103.43 2wrf s THR 22 Ca 0.08 -2.02 0.22 0.00 -1.18 0.00 0.00 61.69 58.79 2wrf s THR 22 Cb -0.08 -2.23 0.39 0.00 1.34 0.00 0.00 72.50 71.91 2wrf s THR 22 CO 0.01 -0.40 1.73 0.00 -0.54 0.00 0.00 174.62 175.41 2wrf n ILE 23 N -0.34 0.30 -0.03 2.99 3.06 -1.26 -3.14 119.36 120.94 2wrf n ILE 23 Ca -0.06 0.08 -0.03 0.00 -2.50 0.00 0.00 62.75 60.23 2wrf n ILE 23 Cb 0.63 -0.70 -0.04 0.00 0.54 0.00 0.00 39.64 40.07 2wrf n ILE 23 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 2wrf n LEU 24 N -1.29 0.95 -4.04 9.51 4.77 -1.26 -5.03 117.00 120.60 2wrf n LEU 24 Ca 0.10 -0.01 -0.29 0.00 -0.03 0.00 0.00 56.01 55.78 2wrf n LEU 24 Cb 0.18 0.01 -0.17 0.00 -2.33 0.00 0.00 43.42 41.12 2wrf n LEU 24 CO 0.17 0.29 -0.49 -0.70 -1.33 0.00 0.00 177.39 175.33 2wrf s GLU 25 N -2.14 2.29 -0.30 3.23 2.12 -1.19 -5.09 118.70 117.62 2wrf s GLU 25 Ca -0.05 -0.57 -0.23 0.00 0.36 0.00 0.00 54.97 54.48 2wrf s GLU 25 Cb 0.02 -2.01 -0.00 0.00 0.26 0.00 0.00 34.13 32.40 2wrf s GLU 25 CO 0.21 -0.14 0.78 1.03 -0.54 0.00 0.00 175.26 176.60 2wrf s ARG 26 N 1.20 3.98 0.14 4.30 1.81 -1.26 -2.78 118.95 126.34 2wrf s ARG 26 Ca -0.01 0.60 0.00 0.00 -1.72 0.00 0.00 55.73 54.59 2wrf s ARG 26 Cb -0.14 -3.72 0.00 0.00 -0.45 0.00 0.00 34.95 30.64 2wrf s ARG 26 CO -0.06 -0.66 0.00 0.09 -0.68 0.00 0.00 175.30 173.99 2wrf n ASN 27 N 6.18 -5.67 -3.03 0.23 4.13 -1.25 -5.05 115.26 110.80 2wrf n ASN 27 Ca 0.04 0.70 -0.17 0.00 1.68 0.00 0.00 54.58 56.83 2wrf n ASN 27 Cb 0.48 -2.69 -0.03 0.00 -1.54 0.00 0.00 39.78 36.00 2wrf n ASN 27 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 2wrf n VAL 28 N 0.60 -0.48 -1.61 2.41 0.31 -0.45 -4.92 118.33 114.18 2wrf n VAL 28 Ca 0.00 -2.70 -0.63 0.00 -0.01 0.00 0.00 64.34 61.00 2wrf n VAL 28 Cb 0.00 -0.42 -0.09 0.00 -0.91 0.00 0.00 33.84 32.41 2wrf n VAL 28 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2wrf n THR 29 N 1.97 0.00 -4.22 2.52 -1.04 -1.26 -3.03 114.28 109.22 2wrf n THR 29 Ca 0.19 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 62.07 2wrf n THR 29 Cb 0.56 -0.40 -0.10 0.00 -1.82 0.00 0.00 70.33 68.56 2wrf n THR 29 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 2wrf s VAL 30 N 2.42 0.21 -0.12 12.58 -7.23 0.42 -1.46 120.40 127.21 2wrf s VAL 30 Ca 0.97 -1.98 -0.23 0.00 -1.81 0.00 0.00 61.98 58.92 2wrf s VAL 30 Cb -1.38 -2.43 -0.20 0.00 0.56 0.00 0.00 36.38 32.93 2wrf s VAL 30 CO 0.74 -0.11 0.65 0.71 -0.31 0.00 0.00 175.10 176.78 2wrf h THR 31 N 2.61 1.39 -3.92 5.32 1.35 -1.58 -3.39 112.91 114.69 2wrf h THR 31 Ca -0.36 -1.97 -0.39 0.00 -0.55 0.00 0.00 66.41 63.13 2wrf h THR 31 Cb 1.24 2.59 -0.30 0.00 -1.73 0.00 0.00 68.15 69.95 2wrf h THR 31 CO 0.57 0.46 -0.78 -1.00 -0.25 0.00 0.00 175.52 174.52 2wrf s HIS 32 N -2.25 0.78 0.10 4.73 3.76 -1.26 -4.94 115.29 116.20 2wrf s HIS 32 Ca -0.15 -0.16 -0.00 0.00 -0.15 0.00 0.00 55.06 54.59 2wrf s HIS 32 Cb -0.02 -0.53 -0.04 0.00 1.11 0.00 0.00 32.58 33.10 2wrf s HIS 32 CO 0.55 -0.05 -0.01 0.00 -0.85 0.00 0.00 174.74 174.38 2wrf s ALA 33 N -0.01 0.79 0.36 -1.40 0.00 -1.26 0.77 121.76 121.01 2wrf s ALA 33 Ca 0.00 -1.36 0.07 0.00 0.00 0.00 0.00 51.96 50.67 2wrf s ALA 33 Cb -0.05 0.47 -0.07 0.00 0.00 0.00 0.00 23.12 23.46 2wrf s ALA 33 CO -0.00 -0.38 -0.01 -1.14 0.00 0.00 0.00 175.76 174.23 2wrf s GLN 34 N -3.94 1.81 -0.03 0.00 0.74 -1.26 -4.70 119.66 112.27 2wrf s GLN 34 Ca 0.15 -1.99 0.06 0.00 0.05 0.00 0.00 55.36 53.63 2wrf s GLN 34 Cb 0.07 -1.42 -0.02 0.00 1.10 0.00 0.00 33.01 32.74 2wrf s GLN 34 CO -0.04 -0.03 -0.19 0.34 -0.55 0.00 0.00 175.29 174.82 2wrf s ASP 35 N -3.60 3.61 0.00 6.67 2.15 -1.26 -1.60 116.67 122.63 2wrf s ASP 35 Ca 0.34 -0.33 0.00 0.00 0.43 0.00 0.00 52.55 52.99 2wrf s ASP 35 Cb 0.07 -0.62 0.00 0.00 -0.30 0.00 0.00 42.92 42.08 2wrf s ASP 35 CO 0.16 0.33 0.18 2.30 -0.17 0.00 0.00 175.17 177.97 2wrf n ILE 36 N 2.28 0.00 -3.36 4.11 -5.35 -1.18 -4.92 119.36 110.95 2wrf n ILE 36 Ca -0.17 -0.23 -0.31 0.00 -0.27 0.00 0.00 62.75 61.77 2wrf n ILE 36 Cb 0.52 1.43 -0.06 0.00 -1.74 0.00 0.00 39.64 39.79 2wrf n ILE 36 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68 2wrf n LEU 37 N -0.10 4.40 -4.47 7.28 7.94 -1.26 -3.28 117.00 127.50 2wrf n LEU 37 Ca 0.00 -5.37 -0.47 0.00 -1.11 0.00 0.00 56.01 49.07 2wrf n LEU 37 Cb 0.11 -0.84 -0.02 0.00 0.53 0.00 0.00 43.42 43.20 2wrf n LEU 37 CO 0.00 1.93 0.21 1.21 -1.11 0.00 0.00 177.39 179.63 2wrf n GLU 38 N 1.08 0.52 0.00 1.96 4.07 -1.24 -4.77 120.64 122.25 2wrf n GLU 38 Ca 0.28 0.18 0.00 0.00 -0.06 0.00 0.00 57.16 57.56 2wrf n GLU 38 Cb 0.39 -1.32 0.00 0.00 -0.06 0.00 0.00 31.44 30.44 2wrf n GLU 38 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 2wrf n LYS 39 N 0.89 -0.22 -4.47 5.31 4.81 -1.26 -3.66 118.16 119.56 2wrf n LYS 39 Ca 0.15 -0.21 -0.24 0.00 -0.87 0.00 0.00 58.31 57.13 2wrf n LYS 39 Cb 0.28 -0.70 -0.13 0.00 0.02 0.00 0.00 35.03 34.50 2wrf n LYS 39 CO 0.00 0.00 0.00 -0.08 1.17 0.00 0.00 177.40 178.49 2wrf s THR 40 N -0.03 1.58 0.06 3.15 -1.32 -1.26 -4.80 115.64 113.03 2wrf s THR 40 Ca 0.00 -1.29 -0.14 0.00 -1.21 0.00 0.00 61.69 59.05 2wrf s THR 40 Cb 0.00 -1.41 0.02 0.00 -1.51 0.00 0.00 72.50 69.60 2wrf s THR 40 CO 0.00 0.07 0.31 -1.38 -2.21 0.00 0.00 174.62 171.41 2wrf s HIS 41 N -0.95 -0.09 0.00 9.09 -3.43 -1.26 -4.50 115.29 114.15 2wrf s HIS 41 Ca 0.06 -0.11 0.00 0.00 -0.80 0.00 0.00 55.06 54.20 2wrf s HIS 41 Cb -0.09 0.10 0.00 0.00 -1.43 0.00 0.00 32.58 31.16 2wrf s HIS 41 CO 0.03 -0.54 0.23 0.09 -2.00 0.00 0.00 174.74 172.54 2wrf n ASN 42 N 0.35 0.00 0.00 7.38 3.02 -1.19 -4.79 115.26 120.03 2wrf n ASN 42 Ca -0.18 0.23 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 2wrf n ASN 42 Cb 0.61 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.78 2wrf n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wrf n GLY 43 N -0.38 1.17 3.68 7.41 0.00 -1.26 -4.86 105.19 110.95 2wrf n GLY 43 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2wrf n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wrf s LYS 44 N 0.00 4.41 -0.22 1.61 1.02 -1.26 -4.72 119.74 120.57 2wrf s LYS 44 Ca 0.00 1.39 -0.29 0.00 0.02 0.00 0.00 55.97 57.09 2wrf s LYS 44 Cb 0.00 -3.55 -0.01 0.00 -0.52 0.00 0.00 37.83 33.75 2wrf s LYS 44 CO 0.00 -0.35 1.24 -0.51 -0.92 0.00 0.00 175.35 174.81 2wrf s LEU 45 N 2.13 4.07 0.00 3.17 1.43 -1.26 -2.76 118.68 125.46 2wrf s LEU 45 Ca 0.48 1.48 0.00 0.00 -1.03 0.00 0.00 54.13 55.06 2wrf s LEU 45 Cb -0.18 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.50 2wrf s LEU 45 CO 0.17 -0.85 0.00 0.00 0.23 0.00 0.00 176.35 175.90 2wrf s LYS 47 N 2.78 1.05 -0.18 0.00 1.02 -1.26 -4.58 119.74 118.58 2wrf s LYS 47 Ca 0.00 -1.18 -0.02 0.00 0.02 0.00 0.00 55.97 54.80 2wrf s LYS 47 Cb 0.00 0.34 -0.01 0.00 -0.52 0.00 0.00 37.83 37.65 2wrf s LYS 47 CO 0.00 -0.36 -0.10 -0.51 -0.92 0.00 0.00 175.35 173.46 2wrf s LEU 48 N -2.96 2.73 -0.46 3.17 1.02 -1.04 -1.90 118.68 119.24 2wrf s LEU 48 Ca 0.16 -0.39 0.00 0.00 0.02 0.00 0.00 54.13 53.92 2wrf s LEU 48 Cb 0.04 -1.65 0.00 0.00 0.02 0.00 0.00 46.19 44.60 2wrf s LEU 48 CO -0.02 0.06 0.00 0.59 0.02 0.00 0.00 176.35 177.00 2wrf n ASN 49 N 4.22 -1.47 0.00 2.29 4.13 -1.22 -1.13 115.26 122.08 2wrf n ASN 49 Ca -0.18 0.11 0.00 0.00 1.68 0.00 0.00 54.58 56.18 2wrf n ASN 49 Cb 0.52 -1.57 0.00 0.00 -1.54 0.00 0.00 39.78 37.19 2wrf n ASN 49 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2wrf n GLY 50 N -0.03 2.02 3.91 7.41 0.00 -1.26 -5.12 105.19 112.13 2wrf n GLY 50 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 2wrf n GLY 50 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wrf s ILE 51 N -1.83 5.37 0.43 -0.61 -1.09 -0.28 -5.01 121.20 118.17 2wrf s ILE 51 Ca 0.00 -0.28 -0.10 0.00 -2.23 0.00 0.00 60.65 58.04 2wrf s ILE 51 Cb 0.00 -3.61 -0.06 0.00 -1.58 0.00 0.00 42.46 37.21 2wrf s ILE 51 CO 0.00 0.17 0.79 -2.16 -1.23 0.00 0.00 174.94 172.51 2wrf s PRO 52 N -2.39 3.73 0.83 2.79 0.05 -1.26 -2.50 135.00 136.25 2wrf s PRO 52 Ca 0.34 0.44 -0.12 0.00 0.05 0.00 0.00 61.00 61.71 2wrf s PRO 52 Cb -0.13 -2.37 0.09 0.00 0.05 0.00 0.00 34.50 32.14 2wrf s PRO 52 CO 0.25 -0.09 1.10 -2.14 0.05 0.00 0.00 177.00 176.17 2wrf s PRO 53 N -4.08 1.82 -0.22 0.56 0.02 -1.26 -2.39 135.00 129.44 2wrf s PRO 53 Ca 0.51 0.67 -0.29 0.00 0.02 0.00 0.00 61.00 61.91 2wrf s PRO 53 Cb -0.10 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.53 2wrf s PRO 53 CO 0.35 -1.81 1.16 -1.17 -0.33 0.00 0.00 177.00 175.19 2wrf s LEU 54 N -5.91 4.09 -0.12 -5.54 2.96 -0.95 -4.90 118.68 108.30 2wrf s LEU 54 Ca 0.62 1.44 -0.27 0.00 -0.22 0.00 0.00 54.13 55.70 2wrf s LEU 54 Cb -0.15 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 42.98 2wrf s LEU 54 CO 0.55 -0.77 0.89 -1.61 -1.32 0.00 0.00 176.35 174.09 2wrf s GLU 55 N 3.47 4.37 -0.08 1.98 0.41 -1.26 -1.45 118.70 126.15 2wrf s GLU 55 Ca 0.49 1.16 0.06 0.00 -0.41 0.00 0.00 54.97 56.27 2wrf s GLU 55 Cb -0.17 -3.54 -0.09 0.00 -1.78 0.00 0.00 34.13 28.55 2wrf s GLU 55 CO 0.12 -0.26 0.01 1.28 -0.49 0.00 0.00 175.26 175.91 2wrf n LEU 56 N 4.91 0.50 0.00 1.80 4.77 -1.17 -4.78 117.00 123.03 2wrf n LEU 56 Ca 0.05 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2wrf n LEU 56 Cb 0.49 0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 2wrf n LEU 56 CO 0.50 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.43 2wrf n GLY 57 N 2.63 -0.33 0.83 -0.72 0.00 -1.26 -2.88 105.19 103.46 2wrf n GLY 57 Ca -0.13 -1.06 -0.00 0.00 0.00 0.00 0.00 46.02 44.83 2wrf n GLY 57 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2wrf n ASP 58 N -0.29 2.25 -4.73 1.61 9.92 -1.26 -4.16 116.55 119.89 2wrf n ASP 58 Ca 0.00 -2.03 -0.34 0.00 -0.53 0.00 0.00 54.79 51.88 2wrf n ASP 58 Cb 0.00 -0.51 -0.08 0.00 -0.64 0.00 0.00 41.12 39.89 2wrf n ASP 58 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2wrf s SER 60 N -1.20 6.26 0.58 0.00 0.15 -0.93 -4.72 113.70 113.83 2wrf s SER 60 Ca 0.17 0.54 0.27 0.00 0.70 0.00 0.00 55.95 57.63 2wrf s SER 60 Cb -0.12 -2.05 1.67 0.00 -1.71 0.00 0.00 66.02 63.81 2wrf s SER 60 CO 0.06 -0.38 2.17 0.40 1.20 0.00 0.00 173.24 176.70 2wrf h ILE 61 N 0.62 0.58 0.17 6.45 2.04 -1.97 0.21 117.51 125.62 2wrf h ILE 61 Ca -0.49 0.00 -0.36 0.00 1.00 0.00 0.00 64.86 65.01 2wrf h ILE 61 Cb 1.22 0.93 0.00 0.00 -0.74 0.00 0.00 36.82 38.23 2wrf h ILE 61 CO 0.61 0.00 -1.82 0.00 0.00 0.00 0.00 178.15 176.94 2wrf h ALA 62 N 1.90 0.23 -0.60 1.87 0.00 -1.93 -2.86 119.26 117.87 2wrf h ALA 62 Ca 0.04 -1.21 0.11 0.00 0.00 0.00 0.00 54.91 53.86 2wrf h ALA 62 Cb 0.23 0.53 -0.12 0.00 0.00 0.00 0.00 17.79 18.42 2wrf h ALA 62 CO -0.00 1.10 -0.26 0.78 0.00 0.00 0.00 179.25 180.86 2wrf h GLY 63 N 0.76 0.12 0.00 0.00 0.00 -0.88 -0.92 103.07 102.16 2wrf h GLY 63 Ca -0.37 0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.30 2wrf h GLY 63 CO 0.15 -0.23 0.00 1.87 0.00 0.00 0.00 176.54 178.34 2wrf n TRP 64 N -5.44 0.00 -0.31 5.60 -0.00 -0.07 -0.51 117.44 116.71 2wrf n TRP 64 Ca 0.06 0.00 0.14 0.00 -0.00 0.00 0.00 57.50 57.70 2wrf n TRP 64 Cb 0.35 0.00 0.32 0.00 -0.00 0.00 0.00 31.31 31.98 2wrf n TRP 64 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 2wrf h LEU 65 N 0.00 0.42 -0.75 5.87 3.38 -1.42 0.22 115.31 123.03 2wrf h LEU 65 Ca 0.00 0.15 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 2wrf h LEU 65 Cb 0.00 0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 2wrf h LEU 65 CO 0.00 0.03 0.19 -0.07 0.09 0.00 0.00 178.44 178.68 2wrf h LEU 66 N 0.45 1.08 0.00 1.67 3.38 -1.19 -3.46 115.31 117.24 2wrf h LEU 66 Ca 0.58 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.33 2wrf h LEU 66 Cb 1.09 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2wrf h LEU 66 CO -0.51 1.02 0.00 0.61 0.09 0.00 0.00 178.44 179.65 2wrf n GLY 67 N -0.71 1.87 3.60 0.83 0.00 0.76 -2.40 105.19 109.14 2wrf n GLY 67 Ca 0.06 0.00 -0.59 0.00 0.00 0.00 0.00 46.02 45.48 2wrf n GLY 67 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wrf n ASN 68 N 0.00 0.91 -1.56 1.61 2.85 0.34 -0.87 115.26 118.53 2wrf n ASN 68 Ca 0.00 1.15 -0.05 0.00 -0.11 0.00 0.00 54.58 55.57 2wrf n ASN 68 Cb 0.00 -1.00 0.01 0.00 1.24 0.00 0.00 39.78 40.04 2wrf n ASN 68 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 2wrf n PRO 69 N 2.72 1.23 0.00 1.20 -0.02 -1.26 -1.56 135.00 137.31 2wrf n PRO 69 Ca 0.23 -0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.24 2wrf n PRO 69 Cb 0.08 -1.18 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 2wrf n PRO 69 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2wrf n GLU 70 N 1.04 1.41 -0.62 -0.52 4.07 -1.26 -4.67 120.64 120.09 2wrf n GLU 70 Ca 0.09 -0.29 0.05 0.00 -0.06 0.00 0.00 57.16 56.95 2wrf n GLU 70 Cb 0.54 -0.77 0.28 0.00 -0.06 0.00 0.00 31.44 31.43 2wrf n GLU 70 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2wrf h ASP 72 N 2.12 0.84 0.00 0.00 3.45 -1.83 -3.37 116.42 117.63 2wrf h ASP 72 Ca 0.06 -0.45 -0.15 0.00 0.43 0.00 0.00 57.03 56.92 2wrf h ASP 72 Cb 1.66 -0.24 -0.00 0.00 -0.56 0.00 0.00 39.33 40.19 2wrf h ASP 72 CO 0.34 1.11 1.23 0.54 -1.57 0.00 0.00 179.24 180.90 2wrf n ARG 73 N -4.21 0.92 -3.92 3.56 5.12 -1.26 -4.78 116.66 112.09 2wrf n ARG 73 Ca -0.03 -0.74 -0.10 0.00 -1.93 0.00 0.00 57.85 55.05 2wrf n ARG 73 Cb 0.47 -2.01 -0.11 0.00 -1.16 0.00 0.00 32.46 29.65 2wrf n ARG 73 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2wrf s LEU 74 N 0.03 1.91 -0.50 0.55 0.20 -1.26 -5.08 118.68 114.54 2wrf s LEU 74 Ca 0.21 -0.27 -0.05 0.00 0.69 0.00 0.00 54.13 54.71 2wrf s LEU 74 Cb 0.07 0.31 0.13 0.00 -0.43 0.00 0.00 46.19 46.27 2wrf s LEU 74 CO -0.01 -0.26 0.33 -1.48 -0.29 0.00 0.00 176.35 174.63 2wrf s LEU 75 N -1.12 5.45 -0.15 -0.68 2.34 -1.26 -5.08 118.68 118.18 2wrf s LEU 75 Ca -0.12 -2.22 -0.12 0.00 0.06 0.00 0.00 54.13 51.73 2wrf s LEU 75 Cb -0.07 -1.91 -0.05 0.00 -0.56 0.00 0.00 46.19 43.61 2wrf s LEU 75 CO 0.00 -0.55 0.23 0.28 -1.06 0.00 0.00 176.35 175.25 2wrf s THR 76 N 0.88 5.35 -0.05 5.48 -1.32 -1.26 -4.59 115.64 120.12 2wrf s THR 76 Ca 0.10 0.41 0.04 0.00 -1.21 0.00 0.00 61.69 61.03 2wrf s THR 76 Cb -0.23 -3.55 -0.00 0.00 -1.51 0.00 0.00 72.50 67.21 2wrf s THR 76 CO -0.03 0.46 -0.18 0.54 -2.21 0.00 0.00 174.62 173.19 2wrf s VAL 77 N 0.06 1.52 0.00 5.08 0.11 -1.26 -5.03 120.40 120.89 2wrf s VAL 77 Ca 0.14 -0.76 -0.01 0.00 -2.93 0.00 0.00 61.98 58.43 2wrf s VAL 77 Cb -0.13 -1.31 -0.03 0.00 -1.53 0.00 0.00 36.38 33.39 2wrf s VAL 77 CO 0.03 0.44 0.89 -2.65 -3.33 0.00 0.00 175.10 170.47 2wrf n PRO 78 N 3.19 0.41 0.00 1.54 -0.02 -1.26 -4.65 135.00 134.21 2wrf n PRO 78 Ca -0.18 -0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.20 2wrf n PRO 78 Cb 0.53 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.56 2wrf n PRO 78 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2wrf n GLU 79 N 2.16 0.00 -3.61 -0.52 1.02 -1.26 -4.47 120.64 113.96 2wrf n GLU 79 Ca 0.04 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.10 2wrf n GLU 79 Cb 0.20 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.56 2wrf n GLU 79 CO 0.00 0.00 0.00 1.67 1.18 0.00 0.00 177.13 179.98 2wrf s TRP 80 N -2.00 -0.34 -0.12 -0.32 -2.14 -1.23 -4.64 118.94 108.14 2wrf s TRP 80 Ca 0.00 0.70 0.19 0.00 2.66 0.00 0.00 56.10 59.65 2wrf s TRP 80 Cb 0.00 0.43 -0.23 0.00 -3.10 0.00 0.00 33.47 30.57 2wrf s TRP 80 CO 0.00 -0.24 0.49 -1.13 -2.66 0.00 0.00 176.95 173.40 2wrf n SER 81 N 1.30 0.33 0.00 -2.66 3.41 -1.01 -3.34 113.62 111.66 2wrf n SER 81 Ca -0.10 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 2wrf n SER 81 Cb 0.57 0.99 0.00 0.00 -0.26 0.00 0.00 64.21 65.51 2wrf n SER 81 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wrf n TYR 82 N -2.65 0.00 -3.70 7.33 -0.00 -1.26 -4.72 117.16 112.17 2wrf n TYR 82 Ca -0.15 0.00 -0.13 0.00 -0.00 0.00 0.00 57.90 57.62 2wrf n TYR 82 Cb 0.85 0.00 -0.13 0.00 -0.00 0.00 0.00 39.34 40.06 2wrf n TYR 82 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.86 177.28 2wrf s ILE 83 N -2.18 -0.20 -0.18 -3.48 1.01 -1.25 -2.24 121.20 112.68 2wrf s ILE 83 Ca 0.00 0.20 -0.17 0.00 0.00 0.00 0.00 60.65 60.68 2wrf s ILE 83 Cb 0.00 -0.43 -0.04 0.00 0.01 0.00 0.00 42.46 42.00 2wrf s ILE 83 CO 0.00 0.08 0.45 -0.04 0.00 0.00 0.00 174.94 175.43 2wrf s MET 84 N 1.76 4.22 0.00 2.79 -1.94 -0.52 -1.45 119.30 124.15 2wrf s MET 84 Ca -0.05 0.32 0.03 0.00 -1.71 0.00 0.00 55.69 54.28 2wrf s MET 84 Cb -0.11 -3.52 -0.01 0.00 2.01 0.00 0.00 34.83 33.20 2wrf s MET 84 CO -0.09 -0.03 -0.09 -2.00 -0.01 0.00 0.00 175.02 172.80 2wrf s GLU 85 N 1.25 0.72 1.00 2.03 2.12 -0.95 -3.05 118.70 121.81 2wrf s GLU 85 Ca 0.22 -0.42 -0.11 0.00 0.36 0.00 0.00 54.97 55.02 2wrf s GLU 85 Cb -0.15 -0.68 0.19 0.00 0.26 0.00 0.00 34.13 33.75 2wrf s GLU 85 CO 0.09 0.18 1.10 0.15 -0.54 0.00 0.00 175.26 176.24 2wrf s LYS 86 N -0.47 0.33 0.00 4.30 3.01 -1.25 -2.58 119.74 123.08 2wrf s LYS 86 Ca 0.02 1.29 0.00 0.00 -1.01 0.00 0.00 55.97 56.27 2wrf s LYS 86 Cb -0.05 -1.67 0.00 0.00 -1.01 0.00 0.00 37.83 35.11 2wrf s LYS 86 CO -0.00 -3.02 0.88 -1.91 0.51 0.00 0.00 175.35 171.81 2wrf n GLU 87 N -4.47 0.00 -3.58 1.68 4.07 -1.26 -4.31 120.64 112.76 2wrf n GLU 87 Ca 0.09 0.44 -0.36 0.00 -0.06 0.00 0.00 57.16 57.27 2wrf n GLU 87 Cb 0.53 -1.41 -0.06 0.00 -0.06 0.00 0.00 31.44 30.44 2wrf n GLU 87 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2wrf n ASN 88 N -1.82 4.33 -4.31 4.31 4.13 -1.26 -5.08 115.26 115.56 2wrf n ASN 88 Ca 0.00 -3.17 -0.37 0.00 1.68 0.00 0.00 54.58 52.71 2wrf n ASN 88 Cb 0.00 -1.04 0.04 0.00 -1.54 0.00 0.00 39.78 37.24 2wrf n ASN 88 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 2wrf n PRO 89 N 2.12 0.15 -0.09 3.52 -0.02 -1.26 -4.94 135.00 134.49 2wrf n PRO 89 Ca 0.23 0.07 -0.16 0.00 -2.02 0.00 0.00 63.50 61.62 2wrf n PRO 89 Cb 0.37 -1.40 -0.11 0.00 -0.02 0.00 0.00 33.50 32.35 2wrf n PRO 89 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 2wrf h ARG 90 N -0.33 0.00 -4.43 -0.52 2.43 -1.12 -3.44 114.38 106.96 2wrf h ARG 90 Ca -0.44 0.00 -0.71 0.00 -0.81 0.00 0.00 59.98 58.02 2wrf h ARG 90 Cb 1.38 0.00 -0.29 0.00 -0.42 0.00 0.00 29.97 30.63 2wrf h ARG 90 CO 0.39 0.87 -0.47 -0.80 -1.51 0.00 0.00 179.97 178.45 2wrf s ASN 91 N -6.44 5.58 0.00 -3.80 0.02 0.44 -4.93 114.94 105.81 2wrf s ASN 91 Ca -0.22 -1.65 0.00 0.00 -1.02 0.00 0.00 52.86 49.97 2wrf s ASN 91 Cb 0.02 -1.96 0.00 0.00 0.02 0.00 0.00 41.25 39.32 2wrf s ASN 91 CO 0.57 -0.56 0.00 0.61 0.02 0.00 0.00 177.10 177.73 2wrf n GLY 92 N 4.87 0.18 3.16 0.66 0.00 -1.26 -2.19 105.19 110.61 2wrf n GLY 92 Ca -0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 2wrf n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wrf s LEU 93 N -2.34 5.56 0.14 0.99 1.43 -1.26 -2.50 118.68 120.70 2wrf s LEU 93 Ca 0.00 -2.37 -0.25 0.00 -1.03 0.00 0.00 54.13 50.49 2wrf s LEU 93 Cb 0.00 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 2wrf s LEU 93 CO 0.00 -0.53 1.62 0.00 0.23 0.00 0.00 176.35 177.66 2wrf s TYR 95 N -6.03 3.14 0.45 0.00 5.04 -1.26 -4.73 117.35 113.96 2wrf s TYR 95 Ca -0.15 0.89 -0.22 0.00 -2.44 0.00 0.00 57.07 55.15 2wrf s TYR 95 Cb 0.11 -3.52 -0.11 0.00 0.35 0.00 0.00 41.96 38.79 2wrf s TYR 95 CO 0.66 -0.73 0.78 -2.30 -1.34 0.00 0.00 175.55 172.63 2wrf n PRO 96 N 6.61 0.92 0.00 4.97 -0.02 -1.26 -4.60 135.00 141.62 2wrf n PRO 96 Ca 0.07 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 2wrf n PRO 96 Cb 0.48 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 2wrf n PRO 96 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wrf n GLY 97 N 1.48 -0.85 3.24 -1.23 0.00 -1.26 -0.69 105.19 105.88 2wrf n GLY 97 Ca 0.11 -0.21 -0.12 0.00 0.00 0.00 0.00 46.02 45.80 2wrf n GLY 97 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2wrf s SER 98 N -4.00 -0.12 -0.15 1.61 1.04 -0.85 -4.93 113.70 106.30 2wrf s SER 98 Ca 0.00 -0.14 -0.02 0.00 0.48 0.00 0.00 55.95 56.27 2wrf s SER 98 Cb 0.00 0.33 0.05 0.00 0.10 0.00 0.00 66.02 66.50 2wrf s SER 98 CO 0.00 -0.56 0.02 0.12 0.98 0.00 0.00 173.24 173.80 2wrf s PHE 99 N -2.19 0.98 -0.11 5.02 2.19 -1.26 -0.47 117.98 122.14 2wrf s PHE 99 Ca -0.08 -0.66 -0.30 0.00 0.33 0.00 0.00 56.93 56.23 2wrf s PHE 99 Cb -0.02 -0.99 -0.02 0.00 -1.31 0.00 0.00 43.02 40.68 2wrf s PHE 99 CO -0.01 -0.52 1.20 -0.80 1.83 0.00 0.00 175.22 176.91 2wrf s ASN 100 N 1.87 7.03 -0.54 6.13 0.01 0.57 -3.29 114.94 126.71 2wrf s ASN 100 Ca 0.01 1.72 -0.03 0.00 -0.71 0.00 0.00 52.86 53.85 2wrf s ASN 100 Cb -0.15 -2.55 0.00 0.00 0.41 0.00 0.00 41.25 38.96 2wrf s ASN 100 CO -0.07 -0.65 0.47 0.47 -1.51 0.00 0.00 177.10 175.81 2wrf n ASP 101 N 5.79 -3.35 0.18 -1.22 9.92 -1.26 -4.35 116.55 122.25 2wrf n ASP 101 Ca 0.12 -0.23 -0.14 0.00 -0.53 0.00 0.00 54.79 54.01 2wrf n ASP 101 Cb 0.46 -2.36 -0.08 0.00 -0.64 0.00 0.00 41.12 38.50 2wrf n ASP 101 CO 0.00 0.00 0.00 0.22 0.13 0.00 0.00 177.20 177.55 2wrf h TYR 102 N -1.02 -0.42 -0.01 1.24 3.20 -1.95 -2.47 116.97 115.53 2wrf h TYR 102 Ca -0.23 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.55 2wrf h TYR 102 Cb 1.15 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 39.55 2wrf h TYR 102 CO 0.20 -0.11 -0.37 0.93 -1.64 0.00 0.00 178.16 177.16 2wrf h GLU 103 N -0.73 0.02 0.00 1.82 3.07 -1.92 0.11 114.58 116.95 2wrf h GLU 103 Ca -0.05 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 2wrf h GLU 103 Cb 0.50 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.41 2wrf h GLU 103 CO 0.08 0.40 0.00 0.93 -1.40 0.00 0.00 179.01 179.01 2wrf h GLU 104 N 0.02 0.00 0.01 2.33 4.39 -1.89 -2.67 114.58 116.77 2wrf h GLU 104 Ca -0.00 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.44 2wrf h GLU 104 Cb 0.67 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.29 2wrf h GLU 104 CO 0.05 0.00 -1.43 -0.11 -1.16 0.00 0.00 179.01 176.36 2wrf n LEU 105 N -2.49 1.91 -0.18 1.33 7.94 0.26 -3.86 117.00 121.91 2wrf n LEU 105 Ca 0.01 0.40 -0.11 0.00 -1.11 0.00 0.00 56.01 55.20 2wrf n LEU 105 Cb 0.20 -0.96 -0.06 0.00 0.53 0.00 0.00 43.42 43.13 2wrf n LEU 105 CO 0.20 0.34 0.54 0.11 -1.11 0.00 0.00 177.39 177.46 2wrf h LYS 106 N -0.94 -0.28 -0.85 1.96 1.57 -1.17 0.91 116.57 117.76 2wrf h LYS 106 Ca -0.39 0.02 0.16 0.00 -1.87 0.00 0.00 60.65 58.57 2wrf h LYS 106 Cb 1.38 0.06 -0.06 0.00 0.08 0.00 0.00 32.23 33.69 2wrf h LYS 106 CO -0.22 -0.19 0.56 1.25 -0.57 0.00 0.00 179.45 180.28 2wrf h HIS 107 N -0.29 0.65 0.67 -1.35 2.76 -1.69 -1.14 115.15 114.75 2wrf h HIS 107 Ca 0.13 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.29 2wrf h HIS 107 Cb 0.57 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 29.33 2wrf h HIS 107 CO -0.72 0.22 -0.34 1.25 -1.30 0.00 0.00 177.93 177.05 2wrf h LEU 108 N 0.53 -0.80 -1.43 0.26 5.85 -0.97 -2.95 115.31 115.80 2wrf h LEU 108 Ca 0.43 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.19 2wrf h LEU 108 Cb 0.89 0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.13 2wrf h LEU 108 CO -0.18 -0.56 0.00 2.30 -0.34 0.00 0.00 178.44 179.66 2wrf n ILE 109 N -5.49 0.57 0.18 4.05 -5.35 -0.64 -4.02 119.36 108.66 2wrf n ILE 109 Ca -0.13 -0.30 0.05 0.00 -0.27 0.00 0.00 62.75 62.09 2wrf n ILE 109 Cb 0.38 -0.36 0.30 0.00 -1.74 0.00 0.00 39.64 38.21 2wrf n ILE 109 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 2wrf h SER 110 N 0.92 0.00 -3.47 7.28 4.64 -1.05 -3.41 113.55 118.46 2wrf h SER 110 Ca 0.00 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.97 2wrf h SER 110 Cb 0.74 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 62.49 2wrf h SER 110 CO 0.09 0.41 -0.75 -0.55 -0.87 0.00 0.00 176.83 175.16 2wrf s SER 111 N -6.47 0.56 0.32 4.97 0.15 -1.26 -4.01 113.70 107.96 2wrf s SER 111 Ca 0.00 -0.03 0.07 0.00 0.70 0.00 0.00 55.95 56.70 2wrf s SER 111 Cb 0.11 -0.24 -0.03 0.00 -1.71 0.00 0.00 66.02 64.15 2wrf s SER 111 CO 0.70 -0.11 0.26 1.33 1.20 0.00 0.00 173.24 176.61 2wrf n VAL 112 N 4.26 0.00 0.00 4.45 0.24 -1.21 -4.74 118.33 121.33 2wrf n VAL 112 Ca -0.24 -2.31 0.00 0.00 -2.04 0.00 0.00 64.34 59.76 2wrf n VAL 112 Cb 0.50 1.13 0.00 0.00 -1.47 0.00 0.00 33.84 34.00 2wrf n VAL 112 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 2wrf n THR 113 N -0.62 0.00 -2.22 3.34 5.66 0.11 -3.48 114.28 117.08 2wrf n THR 113 Ca 0.06 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.06 2wrf n THR 113 Cb 0.57 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.35 2wrf n THR 113 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2wrf n HIS 114 N 0.00 0.00 -3.50 1.09 -0.00 -1.15 -4.29 115.22 107.36 2wrf n HIS 114 Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 57.72 57.52 2wrf n HIS 114 Cb 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 29.99 29.86 2wrf n HIS 114 CO 0.00 0.00 0.00 0.12 -0.00 0.00 0.00 176.34 176.46 2wrf s PHE 115 N 1.78 -0.16 -0.06 -1.40 5.36 -1.26 -2.65 117.98 119.59 2wrf s PHE 115 Ca 0.00 -0.04 0.02 0.00 -0.96 0.00 0.00 56.93 55.95 2wrf s PHE 115 Cb 0.00 -0.49 0.02 0.00 -0.34 0.00 0.00 43.02 42.21 2wrf s PHE 115 CO 0.00 -0.66 -0.11 -2.00 -1.46 0.00 0.00 175.22 171.00 2wrf s GLU 116 N 2.28 1.52 -0.08 10.12 2.12 -0.71 -4.67 118.70 129.28 2wrf s GLU 116 Ca 0.07 -0.35 -0.18 0.00 0.36 0.00 0.00 54.97 54.86 2wrf s GLU 116 Cb -0.16 -1.30 -0.05 0.00 0.26 0.00 0.00 34.13 32.89 2wrf s GLU 116 CO -0.17 -0.00 0.50 0.21 -0.54 0.00 0.00 175.26 175.26 2wrf s LYS 117 N 0.75 4.29 -0.06 4.30 2.20 -1.26 0.18 119.74 130.14 2wrf s LYS 117 Ca -0.13 0.52 0.01 0.00 -0.36 0.00 0.00 55.97 56.01 2wrf s LYS 117 Cb -0.15 -3.39 0.02 0.00 -1.51 0.00 0.00 37.83 32.79 2wrf s LYS 117 CO 0.03 0.26 -0.07 0.14 -0.36 0.00 0.00 175.35 175.34 2wrf s VAL 118 N 0.28 0.77 -0.18 4.02 -7.23 -0.67 -4.96 120.40 112.43 2wrf s VAL 118 Ca 0.27 -0.24 -0.33 0.00 -1.81 0.00 0.00 61.98 59.88 2wrf s VAL 118 Cb -0.16 -0.76 -0.10 0.00 0.56 0.00 0.00 36.38 35.92 2wrf s VAL 118 CO 0.12 0.28 2.05 1.17 -0.31 0.00 0.00 175.10 178.42 2wrf n LYS 119 N 4.12 1.92 -0.03 4.82 4.81 -1.26 -2.40 118.16 130.14 2wrf n LYS 119 Ca -0.22 0.63 -0.01 0.00 -0.87 0.00 0.00 58.31 57.84 2wrf n LYS 119 Cb 0.51 -2.79 -0.06 0.00 0.02 0.00 0.00 35.03 32.71 2wrf n LYS 119 CO 0.00 0.00 0.00 0.44 1.17 0.00 0.00 177.40 179.01 2wrf n ILE 120 N 6.35 0.33 -3.13 3.15 -5.35 -0.29 -4.87 119.36 115.55 2wrf n ILE 120 Ca 0.29 -0.28 -0.21 0.00 -0.27 0.00 0.00 62.75 62.28 2wrf n ILE 120 Cb 0.33 -0.39 -0.04 0.00 -1.74 0.00 0.00 39.64 37.80 2wrf n ILE 120 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 2wrf n LEU 121 N -2.10 1.84 -3.40 7.28 4.77 -0.59 -4.86 117.00 119.95 2wrf n LEU 121 Ca -0.08 -5.19 -0.36 0.00 -0.03 0.00 0.00 56.01 50.35 2wrf n LEU 121 Cb 0.55 0.35 -0.02 0.00 -2.33 0.00 0.00 43.42 41.97 2wrf n LEU 121 CO 0.17 2.30 -0.09 -2.65 -1.33 0.00 0.00 177.39 175.79 2wrf n PRO 122 N 0.20 0.00 0.08 3.23 -0.02 -1.26 -4.77 135.00 132.45 2wrf n PRO 122 Ca 0.27 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.65 2wrf n PRO 122 Cb 0.58 -0.78 0.00 0.00 -0.02 0.00 0.00 33.50 33.28 2wrf n PRO 122 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2wrf h LYS 123 N 0.65 0.27 -0.02 -0.52 3.64 -1.95 -3.27 116.57 115.36 2wrf h LYS 123 Ca -0.23 -0.27 -0.00 0.00 -1.27 0.00 0.00 60.65 58.88 2wrf h LYS 123 Cb 1.12 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 33.01 2wrf h LYS 123 CO 0.42 0.96 0.01 0.38 -2.27 0.00 0.00 179.45 178.96 2wrf h ASP 124 N 0.16 0.03 0.00 4.20 2.03 -1.98 -3.20 116.42 117.66 2wrf h ASP 124 Ca -0.05 -0.14 0.00 0.00 -0.73 0.00 0.00 57.03 56.12 2wrf h ASP 124 Cb 1.45 -0.01 0.00 0.00 -0.83 0.00 0.00 39.33 39.94 2wrf h ASP 124 CO 0.13 0.16 0.00 -1.14 -1.03 0.00 0.00 179.24 177.36 2wrf n ARG 125 N -5.00 0.06 -0.68 4.15 0.63 -1.23 -2.38 116.66 112.20 2wrf n ARG 125 Ca -0.07 0.00 -0.00 0.00 -0.92 0.00 0.00 57.85 56.86 2wrf n ARG 125 Cb 0.09 -1.03 0.25 0.00 0.45 0.00 0.00 32.46 32.22 2wrf n ARG 125 CO 0.00 0.00 0.00 0.91 -2.51 0.00 0.00 177.63 176.03 2wrf n TRP 126 N 0.45 1.60 -0.04 -0.14 7.02 -1.21 -4.88 117.44 120.24 2wrf n TRP 126 Ca 0.00 -0.71 0.01 0.00 -1.02 0.00 0.00 57.50 55.78 2wrf n TRP 126 Cb 0.01 -0.47 0.02 0.00 -2.42 0.00 0.00 31.31 28.46 2wrf n TRP 126 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 2wrf n THR 127 N 0.19 -0.05 0.27 -0.99 -2.24 -1.00 -0.15 114.28 110.30 2wrf n THR 127 Ca 0.24 0.26 0.15 0.00 -2.27 0.00 0.00 64.05 62.44 2wrf n THR 127 Cb 1.00 -0.37 0.71 0.00 -2.10 0.00 0.00 70.33 69.57 2wrf n THR 127 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2wrf h GLN 128 N 0.00 0.00 -6.07 -0.78 4.20 -1.90 -3.45 115.11 107.11 2wrf h GLN 128 Ca 0.06 0.00 -0.54 0.00 0.06 0.00 0.00 58.65 58.23 2wrf h GLN 128 Cb 0.11 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.82 2wrf h GLN 128 CO -0.12 0.09 -0.49 -1.01 -0.67 0.00 0.00 178.83 176.62 2wrf s HIS 129 N -3.85 2.70 0.24 2.96 3.76 0.78 -4.40 115.29 117.48 2wrf s HIS 129 Ca -0.01 -0.44 -0.28 0.00 -0.15 0.00 0.00 55.06 54.18 2wrf s HIS 129 Cb 0.11 -1.82 -0.09 0.00 1.11 0.00 0.00 32.58 31.89 2wrf s HIS 129 CO 0.56 0.21 0.90 0.99 -0.85 0.00 0.00 174.74 176.56 2wrf s THR 130 N -2.47 4.16 -0.08 1.30 2.01 0.57 -4.87 115.64 116.27 2wrf s THR 130 Ca 0.40 1.95 0.12 0.00 0.31 0.00 0.00 61.69 64.47 2wrf s THR 130 Cb -0.01 -4.23 0.18 0.00 0.01 0.00 0.00 72.50 68.45 2wrf s THR 130 CO 0.24 0.44 1.08 0.35 -0.69 0.00 0.00 174.62 176.03 2wrf n THR 131 N 1.33 1.49 -2.50 -0.82 -2.24 -1.26 -1.71 114.28 108.57 2wrf n THR 131 Ca -0.02 -1.72 -0.16 0.00 -2.27 0.00 0.00 64.05 59.88 2wrf n THR 131 Cb 0.48 0.06 0.02 0.00 -2.10 0.00 0.00 70.33 68.79 2wrf n THR 131 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2wrf n THR 132 N -1.05 1.80 -2.40 4.28 -2.24 -1.26 -4.76 114.28 108.65 2wrf n THR 132 Ca 0.10 -3.84 -0.33 0.00 -2.27 0.00 0.00 64.05 57.71 2wrf n THR 132 Cb 0.51 -0.17 -0.02 0.00 -2.10 0.00 0.00 70.33 68.55 2wrf n THR 132 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2wrf s GLY 133 N -3.50 2.30 0.21 3.38 0.00 -1.25 -5.06 107.32 103.40 2wrf s GLY 133 Ca 0.39 0.44 -0.22 0.00 0.00 0.00 0.00 44.72 45.33 2wrf s GLY 133 CO -0.04 0.75 0.99 -0.32 0.00 0.00 0.00 173.10 174.47 2wrf s GLY 134 N -2.44 0.08 0.13 0.20 0.00 -1.26 -4.66 107.32 99.38 2wrf s GLY 134 Ca 0.64 -0.31 -0.11 0.00 0.00 0.00 0.00 44.72 44.94 2wrf s GLY 134 CO 0.26 1.57 0.30 -0.45 0.00 0.00 0.00 173.10 174.79 2wrf s SER 135 N -3.27 -0.02 0.00 1.64 0.15 0.13 -4.73 113.70 107.60 2wrf s SER 135 Ca 0.19 -0.64 0.26 0.00 0.70 0.00 0.00 55.95 56.45 2wrf s SER 135 Cb -0.03 0.43 0.66 0.00 -1.71 0.00 0.00 66.02 65.37 2wrf s SER 135 CO 0.06 -0.85 1.51 1.67 1.20 0.00 0.00 173.24 176.83 2wrf n GLN 136 N -0.18 0.72 -0.34 5.44 7.27 -1.26 -0.28 117.38 128.74 2wrf n GLN 136 Ca -0.12 -0.44 0.06 0.00 0.07 0.00 0.00 57.00 56.57 2wrf n GLN 136 Cb 0.63 -1.49 0.22 0.00 2.41 0.00 0.00 30.24 32.01 2wrf n GLN 136 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 2wrf h GLY 137 N 4.93 1.54 -4.51 1.69 0.00 -1.89 -3.26 103.07 101.58 2wrf h GLY 137 Ca 0.00 -0.39 -0.62 0.00 0.00 0.00 0.00 47.33 46.32 2wrf h GLY 137 CO 0.00 0.14 -0.36 0.00 0.00 0.00 0.00 176.54 176.32 2wrf s ALA 139 N -3.65 3.41 -0.17 0.00 0.00 -1.23 -3.18 121.76 116.94 2wrf s ALA 139 Ca 0.50 0.89 -0.14 0.00 0.00 0.00 0.00 51.96 53.20 2wrf s ALA 139 Cb 0.41 -3.44 -0.06 0.00 0.00 0.00 0.00 23.12 20.03 2wrf s ALA 139 CO -0.20 -0.41 -0.23 0.28 0.00 0.00 0.00 175.76 175.20 2wrf n VAL 140 N 3.49 1.47 -2.31 0.00 0.31 -1.09 -4.85 118.33 115.35 2wrf n VAL 140 Ca 0.08 0.12 0.04 0.00 -0.01 0.00 0.00 64.34 64.57 2wrf n VAL 140 Cb 0.46 -2.31 0.06 0.00 -0.91 0.00 0.00 33.84 31.14 2wrf n VAL 140 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2wrf n PHE 141 N -4.51 0.07 -3.78 3.52 3.72 -1.26 -4.78 117.46 110.44 2wrf n PHE 141 Ca -0.15 -0.79 -0.32 0.00 -0.05 0.00 0.00 57.45 56.13 2wrf n PHE 141 Cb 0.45 -0.18 -0.09 0.00 -0.94 0.00 0.00 39.48 38.71 2wrf n PHE 141 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 176.76 176.87 2wrf s ASP 142 N -2.35 5.38 0.73 4.37 3.84 -1.26 -5.14 116.67 122.24 2wrf s ASP 142 Ca 0.35 -3.77 -0.11 0.00 -0.00 0.00 0.00 52.55 49.02 2wrf s ASP 142 Cb 0.38 -1.77 0.03 0.00 -1.38 0.00 0.00 42.92 40.18 2wrf s ASP 142 CO -0.14 -0.14 1.07 0.20 -0.00 0.00 0.00 175.17 176.17 2wrf s ASN 143 N -0.80 5.08 0.34 2.11 0.02 -1.26 -4.91 114.94 115.52 2wrf s ASN 143 Ca 0.26 1.48 -0.25 0.00 -1.02 0.00 0.00 52.86 53.33 2wrf s ASN 143 Cb -0.06 -2.31 -0.14 0.00 0.02 0.00 0.00 41.25 38.75 2wrf s ASN 143 CO -0.14 -1.62 0.56 -2.65 0.02 0.00 0.00 177.10 173.27 2wrf n PRO 144 N -3.23 0.49 -0.30 -0.60 -0.02 -1.26 -2.69 135.00 127.40 2wrf n PRO 144 Ca 0.07 0.17 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 2wrf n PRO 144 Cb 0.55 -1.37 0.00 0.00 -0.02 0.00 0.00 33.50 32.66 2wrf n PRO 144 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2wrf n SER 145 N 1.60 0.00 -3.58 2.55 2.88 0.61 -4.72 113.62 112.97 2wrf n SER 145 Ca 0.13 -0.23 -0.05 0.00 -1.33 0.00 0.00 58.87 57.39 2wrf n SER 145 Cb 0.35 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.78 2wrf n SER 145 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 2wrf s PHE 146 N -3.65 -0.18 -0.34 0.66 5.36 -1.21 0.18 117.98 118.81 2wrf s PHE 146 Ca 0.00 0.12 -0.42 0.00 -0.96 0.00 0.00 56.93 55.67 2wrf s PHE 146 Cb 0.00 0.52 -0.17 0.00 -0.34 0.00 0.00 43.02 43.03 2wrf s PHE 146 CO 0.00 -0.27 1.69 1.19 -1.46 0.00 0.00 175.22 176.37 2wrf n PHE 147 N -0.09 1.94 0.20 10.12 3.72 -1.26 -4.65 117.46 127.44 2wrf n PHE 147 Ca -0.02 0.73 0.00 0.00 -0.05 0.00 0.00 57.45 58.12 2wrf n PHE 147 Cb 0.59 -2.38 0.00 0.00 -0.94 0.00 0.00 39.48 36.75 2wrf n PHE 147 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 176.76 179.60 2wrf n ARG 148 N 4.87 0.88 0.00 -1.08 1.85 -0.05 -1.88 116.66 121.25 2wrf n ARG 148 Ca 0.28 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 57.13 2wrf n ARG 148 Cb 0.07 -1.06 0.00 0.00 -1.05 0.00 0.00 32.46 30.42 2wrf n ARG 148 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2wrf n ASN 149 N 1.07 0.00 -4.40 2.89 3.02 -1.01 -4.89 115.26 111.95 2wrf n ASN 149 Ca 0.00 -0.61 -0.29 0.00 -0.03 0.00 0.00 54.58 53.65 2wrf n ASN 149 Cb 0.44 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.48 2wrf n ASN 149 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2wrf s MET 150 N 0.00 1.46 -0.18 3.52 -1.94 -0.79 -0.56 119.30 120.82 2wrf s MET 150 Ca 0.00 -1.32 -0.01 0.00 -1.71 0.00 0.00 55.69 52.65 2wrf s MET 150 Cb 0.00 -1.93 -0.00 0.00 2.01 0.00 0.00 34.83 34.91 2wrf s MET 150 CO 0.00 0.46 -0.12 0.08 -0.01 0.00 0.00 175.02 175.43 2wrf s VAL 151 N -1.05 2.89 -1.37 -6.03 1.01 -0.79 -4.81 120.40 110.24 2wrf s VAL 151 Ca 0.14 -0.68 -0.14 0.00 0.00 0.00 0.00 61.98 61.30 2wrf s VAL 151 Cb -0.10 -2.26 0.08 0.00 0.00 0.00 0.00 36.38 34.10 2wrf s VAL 151 CO 0.06 0.49 1.99 1.87 0.00 0.00 0.00 175.10 179.51 2wrf n TRP 152 N 4.31 3.87 -1.72 5.22 -0.00 -1.26 -1.45 117.44 126.41 2wrf n TRP 152 Ca -0.19 -2.94 -0.59 0.00 -0.00 0.00 0.00 57.50 53.78 2wrf n TRP 152 Cb 0.51 -2.47 -0.08 0.00 -0.00 0.00 0.00 31.31 29.28 2wrf n TRP 152 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 2wrf n LEU 153 N 6.38 2.19 -4.65 5.87 4.77 -1.26 -3.96 117.00 126.34 2wrf n LEU 153 Ca 0.48 1.09 -0.30 0.00 -0.03 0.00 0.00 56.01 57.26 2wrf n LEU 153 Cb 0.41 -1.10 -0.08 0.00 -2.33 0.00 0.00 43.42 40.32 2wrf n LEU 153 CO 0.83 -0.50 -0.23 0.42 -1.33 0.00 0.00 177.39 176.59 2wrf s THR 154 N 3.44 0.91 0.53 -5.08 -4.23 -0.69 -4.65 115.64 105.87 2wrf s THR 154 Ca 0.99 -2.00 -0.20 0.00 -1.18 0.00 0.00 61.69 59.31 2wrf s THR 154 Cb -1.14 -2.24 -0.07 0.00 1.34 0.00 0.00 72.50 70.39 2wrf s THR 154 CO 0.68 0.00 1.10 -1.59 -0.54 0.00 0.00 174.62 174.28 2wrf s LYS 155 N -3.80 3.49 -0.07 3.99 -2.85 -1.00 -0.32 119.74 119.19 2wrf s LYS 155 Ca 0.14 1.54 0.05 0.00 -1.00 0.00 0.00 55.97 56.70 2wrf s LYS 155 Cb 0.02 -2.03 -0.01 0.00 -2.06 0.00 0.00 37.83 33.75 2wrf s LYS 155 CO 0.08 -0.72 -0.25 0.21 0.10 0.00 0.00 175.35 174.78 2wrf s LYS 156 N -3.27 2.73 5.75 1.78 2.20 -0.84 -4.26 119.74 123.84 2wrf s LYS 156 Ca 0.71 -0.89 0.00 0.00 -0.36 0.00 0.00 55.97 55.43 2wrf s LYS 156 Cb -0.22 -2.21 0.00 0.00 -1.51 0.00 0.00 37.83 33.90 2wrf s LYS 156 CO 0.25 0.30 0.00 0.41 -0.36 0.00 0.00 175.35 175.95 2wrf n GLY 157 N 3.16 2.15 1.01 5.54 0.00 -1.26 -2.52 105.19 113.27 2wrf n GLY 157 Ca -0.18 -0.51 0.11 0.00 0.00 0.00 0.00 46.02 45.44 2wrf n GLY 157 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2wrf n SER 158 N 2.91 3.19 -4.71 1.61 7.64 -1.26 -5.00 113.62 118.01 2wrf n SER 158 Ca 0.00 -1.94 -0.32 0.00 1.01 0.00 0.00 58.87 57.63 2wrf n SER 158 Cb 0.00 -0.18 -0.08 0.00 -1.01 0.00 0.00 64.21 62.94 2wrf n SER 158 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2wrf s ASN 159 N -1.46 5.21 -0.68 6.43 0.02 -1.05 -4.89 114.94 118.52 2wrf s ASN 159 Ca 0.33 -0.03 0.05 0.00 -1.02 0.00 0.00 52.86 52.19 2wrf s ASN 159 Cb 0.20 -1.36 0.17 0.00 0.02 0.00 0.00 41.25 40.28 2wrf s ASN 159 CO 0.28 0.24 0.48 -0.47 0.02 0.00 0.00 177.10 177.65 2wrf s TYR 160 N -1.19 3.35 0.50 2.20 5.04 -1.26 -1.99 117.35 124.01 2wrf s TYR 160 Ca 0.22 -3.25 -0.21 0.00 -2.44 0.00 0.00 57.07 51.39 2wrf s TYR 160 Cb -0.12 -2.55 -0.09 0.00 0.35 0.00 0.00 41.96 39.56 2wrf s TYR 160 CO 0.14 -0.57 0.85 -2.30 -1.34 0.00 0.00 175.55 172.33 2wrf n PRO 161 N 2.04 0.98 -1.67 4.97 -0.02 -1.26 -4.87 135.00 135.18 2wrf n PRO 161 Ca 0.21 0.36 -0.47 0.00 -2.02 0.00 0.00 63.50 61.58 2wrf n PRO 161 Cb 0.36 -1.95 -0.04 0.00 -0.02 0.00 0.00 33.50 31.84 2wrf n PRO 161 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2wrf n VAL 162 N -1.11 0.18 -3.20 -1.45 0.31 -1.26 -4.90 118.33 106.90 2wrf n VAL 162 Ca 0.11 -0.03 -0.39 0.00 -0.01 0.00 0.00 64.34 64.02 2wrf n VAL 162 Cb 0.43 -1.59 -0.05 0.00 -0.91 0.00 0.00 33.84 31.72 2wrf n VAL 162 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wrf s ALA 163 N 1.87 3.44 -0.05 3.52 0.00 0.09 -4.94 121.76 125.68 2wrf s ALA 163 Ca 0.84 -0.02 -0.02 0.00 0.00 0.00 0.00 51.96 52.76 2wrf s ALA 163 Cb -0.71 -2.77 0.03 0.00 0.00 0.00 0.00 23.12 19.67 2wrf s ALA 163 CO 0.43 0.03 0.04 0.15 0.00 0.00 0.00 175.76 176.41 2wrf s LYS 164 N 0.40 0.18 0.07 0.00 1.02 -1.26 -1.63 119.74 118.52 2wrf s LYS 164 Ca 0.31 0.27 0.06 0.00 0.02 0.00 0.00 55.97 56.63 2wrf s LYS 164 Cb -0.17 -0.71 -0.03 0.00 -0.52 0.00 0.00 37.83 36.40 2wrf s LYS 164 CO 0.15 -0.33 -0.17 0.20 -0.92 0.00 0.00 175.35 174.28 2wrf s GLY 165 N 2.09 1.00 -0.15 -3.33 0.00 -0.84 -4.96 107.32 101.14 2wrf s GLY 165 Ca 0.05 -1.04 -0.09 0.00 0.00 0.00 0.00 44.72 43.65 2wrf s GLY 165 CO -0.04 -1.02 0.37 -0.45 0.00 0.00 0.00 173.10 171.96 2wrf s SER 166 N -1.51 -0.45 -0.19 1.64 0.15 -1.26 -0.07 113.70 112.01 2wrf s SER 166 Ca 0.03 0.80 -0.04 0.00 0.70 0.00 0.00 55.95 57.44 2wrf s SER 166 Cb -0.09 0.69 0.06 0.00 -1.71 0.00 0.00 66.02 64.97 2wrf s SER 166 CO 0.02 -0.18 0.06 -0.47 1.20 0.00 0.00 173.24 173.88 2wrf s TYR 167 N 1.25 0.61 -0.67 3.44 5.04 -1.13 -5.00 117.35 120.89 2wrf s TYR 167 Ca -0.09 -0.60 -0.27 0.00 -2.44 0.00 0.00 57.07 53.68 2wrf s TYR 167 Cb -0.08 -0.86 0.03 0.00 0.35 0.00 0.00 41.96 41.39 2wrf s TYR 167 CO -0.11 -0.57 1.22 1.21 -1.34 0.00 0.00 175.55 175.97 2wrf s ASN 168 N 2.00 6.28 -0.42 4.32 3.84 -1.26 -2.20 114.94 127.50 2wrf s ASN 168 Ca 0.01 -0.26 -0.33 0.00 0.21 0.00 0.00 52.86 52.49 2wrf s ASN 168 Cb -0.17 -2.55 -0.12 0.00 -0.55 0.00 0.00 41.25 37.87 2wrf s ASN 168 CO -0.09 -1.67 2.27 -3.20 -2.79 0.00 0.00 177.10 171.62 2wrf n ASN 169 N 8.89 2.02 -0.74 -4.21 2.85 -0.37 -4.79 115.26 118.92 2wrf n ASN 169 Ca 0.05 0.26 0.07 0.00 -0.11 0.00 0.00 54.58 54.85 2wrf n ASN 169 Cb 0.49 -1.28 0.14 0.00 1.24 0.00 0.00 39.78 40.37 2wrf n ASN 169 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 2wrf n THR 170 N 7.36 0.59 0.14 -0.44 5.66 -1.26 -2.75 114.28 123.57 2wrf n THR 170 Ca 0.43 -0.79 0.00 0.00 -3.05 0.00 0.00 64.05 60.63 2wrf n THR 170 Cb 0.26 0.83 0.27 0.00 -1.55 0.00 0.00 70.33 70.15 2wrf n THR 170 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 2wrf h SER 171 N 2.76 0.09 0.00 1.09 4.64 -2.00 -3.47 113.55 116.66 2wrf h SER 171 Ca 0.00 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2wrf h SER 171 Cb 0.72 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 2wrf h SER 171 CO 0.00 0.51 0.00 0.61 -0.87 0.00 0.00 176.83 177.08 2wrf n GLY 172 N -0.23 2.32 3.61 -0.77 0.00 -1.26 -5.02 105.19 103.84 2wrf n GLY 172 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 2wrf n GLY 172 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wrf s GLU 173 N -0.59 2.46 0.67 1.61 2.56 -1.26 -4.97 118.70 119.18 2wrf s GLU 173 Ca 0.00 -0.81 -0.17 0.00 0.00 0.00 0.00 54.97 53.99 2wrf s GLU 173 Cb 0.00 -2.47 -0.01 0.00 2.00 0.00 0.00 34.13 33.65 2wrf s GLU 173 CO 0.00 0.57 1.01 1.04 -0.56 0.00 0.00 175.26 177.32 2wrf n GLN 174 N 1.18 0.72 -3.60 4.30 6.02 -1.26 -4.69 117.38 120.06 2wrf n GLN 174 Ca -0.14 0.30 -0.25 0.00 -0.01 0.00 0.00 57.00 56.89 2wrf n GLN 174 Cb 0.52 -2.25 -0.17 0.00 1.02 0.00 0.00 30.24 29.37 2wrf n GLN 174 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 2wrf s MET 175 N -3.14 0.07 -0.02 -1.09 1.75 -1.14 -0.07 119.30 115.66 2wrf s MET 175 Ca 0.76 -0.06 -0.30 0.00 -1.25 0.00 0.00 55.69 54.84 2wrf s MET 175 Cb -0.37 -1.78 -0.05 0.00 2.84 0.00 0.00 34.83 35.47 2wrf s MET 175 CO 0.47 -0.67 1.46 -1.17 -0.65 0.00 0.00 175.02 174.47 2wrf s LEU 176 N 2.15 4.31 -0.06 4.11 2.96 -0.37 -2.32 118.68 129.46 2wrf s LEU 176 Ca 0.02 2.13 0.05 0.00 -0.22 0.00 0.00 54.13 56.12 2wrf s LEU 176 Cb -0.16 -3.55 -0.01 0.00 0.50 0.00 0.00 46.19 42.97 2wrf s LEU 176 CO -0.09 -0.78 -0.22 -0.63 -1.32 0.00 0.00 176.35 173.30 2wrf s ILE 177 N 2.88 1.85 -0.10 6.68 1.01 -1.04 -1.97 121.20 130.52 2wrf s ILE 177 Ca 0.66 -0.94 0.02 0.00 0.00 0.00 0.00 60.65 60.39 2wrf s ILE 177 Cb -0.32 -1.58 0.01 0.00 0.01 0.00 0.00 42.46 40.58 2wrf s ILE 177 CO 0.26 0.52 -0.16 -0.63 0.00 0.00 0.00 174.94 174.93 2wrf s ILE 178 N 0.03 1.53 0.35 2.92 1.01 -1.26 -2.87 121.20 122.90 2wrf s ILE 178 Ca -0.07 -0.68 0.08 0.00 0.00 0.00 0.00 60.65 59.97 2wrf s ILE 178 Cb -0.14 -1.37 -0.07 0.00 0.01 0.00 0.00 42.46 40.89 2wrf s ILE 178 CO 0.04 0.44 -0.05 -1.66 0.00 0.00 0.00 174.94 173.72 2wrf s TRP 179 N 0.76 2.31 0.26 3.97 -2.14 -1.11 -3.66 118.94 119.31 2wrf s TRP 179 Ca -0.11 -0.62 0.02 0.00 2.66 0.00 0.00 56.10 58.04 2wrf s TRP 179 Cb -0.16 -1.42 -0.04 0.00 -3.10 0.00 0.00 33.47 28.75 2wrf s TRP 179 CO 0.02 0.44 0.16 0.20 -2.66 0.00 0.00 176.95 175.12 2wrf s GLY 180 N -3.59 1.81 -0.19 3.67 0.00 0.06 -2.32 107.32 106.75 2wrf s GLY 180 Ca 0.33 -1.81 -0.05 0.00 0.00 0.00 0.00 44.72 43.19 2wrf s GLY 180 CO 0.16 -1.48 0.35 0.14 0.00 0.00 0.00 173.10 172.26 2wrf s VAL 181 N -3.83 -0.55 0.02 1.40 1.01 -0.38 -0.03 120.40 118.03 2wrf s VAL 181 Ca 0.38 0.12 -0.25 0.00 0.00 0.00 0.00 61.98 62.23 2wrf s VAL 181 Cb 0.06 -0.64 -0.05 0.00 0.00 0.00 0.00 36.38 35.75 2wrf s VAL 181 CO 0.17 0.01 0.76 -2.28 0.00 0.00 0.00 175.10 173.76 2wrf s HIS 182 N 2.52 3.70 -0.75 5.22 2.46 -0.93 -1.82 115.29 125.69 2wrf s HIS 182 Ca 0.03 1.43 -0.01 0.00 0.47 0.00 0.00 55.06 56.98 2wrf s HIS 182 Cb -0.13 -2.82 0.19 0.00 -0.13 0.00 0.00 32.58 29.68 2wrf s HIS 182 CO -0.12 0.22 0.59 -1.01 -2.47 0.00 0.00 174.74 171.95 2wrf s HIS 183 N 0.18 3.63 0.72 3.88 3.76 0.14 -4.75 115.29 122.85 2wrf s HIS 183 Ca 0.39 -2.94 -0.16 0.00 -0.15 0.00 0.00 55.06 52.20 2wrf s HIS 183 Cb -0.20 -3.16 0.03 0.00 1.11 0.00 0.00 32.58 30.36 2wrf s HIS 183 CO 0.22 -0.76 1.17 -2.30 -0.85 0.00 0.00 174.74 172.22 2wrf n PRO 184 N 2.80 0.62 0.23 8.40 -0.02 -1.26 -3.21 135.00 142.55 2wrf n PRO 184 Ca 0.15 0.28 0.14 0.00 -2.02 0.00 0.00 63.50 62.05 2wrf n PRO 184 Cb 0.37 -2.41 0.75 0.00 -0.02 0.00 0.00 33.50 32.19 2wrf n PRO 184 CO 0.00 0.00 0.00 -0.91 1.98 0.00 0.00 175.50 176.57 2wrf h ASN 185 N -0.19 0.00 0.00 2.55 -0.26 -1.85 -3.38 115.58 112.45 2wrf h ASN 185 Ca -0.48 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.26 2wrf h ASN 185 Cb 1.32 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.58 2wrf h ASN 185 CO 0.49 0.00 0.00 -0.90 -1.06 0.00 0.00 177.43 175.96 2wrf n ASP 186 N -2.52 0.00 -0.29 5.81 5.68 -1.26 -4.42 116.55 119.55 2wrf n ASP 186 Ca -0.02 0.00 0.07 0.00 -0.50 0.00 0.00 54.79 54.34 2wrf n ASP 186 Cb 0.13 0.00 0.18 0.00 -1.14 0.00 0.00 41.12 40.29 2wrf n ASP 186 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2wrf h GLU 187 N 0.00 0.06 -0.15 0.11 4.39 -1.98 -2.39 114.58 114.63 2wrf h GLU 187 Ca 0.00 -0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.48 2wrf h GLU 187 Cb 0.00 -0.01 0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2wrf h GLU 187 CO 0.00 0.04 -0.77 0.00 -1.16 0.00 0.00 179.01 177.12 2wrf h THR 188 N 0.06 1.29 -0.36 1.13 1.03 -1.99 -1.18 112.91 112.89 2wrf h THR 188 Ca 0.45 -1.99 0.10 0.00 -0.01 0.00 0.00 66.41 64.97 2wrf h THR 188 Cb 0.81 1.99 -0.01 0.00 -1.07 0.00 0.00 68.15 69.86 2wrf h THR 188 CO -0.77 0.63 0.26 -0.08 -0.01 0.00 0.00 175.52 175.55 2wrf h GLU 189 N 0.51 0.00 -0.24 0.00 4.81 -1.87 0.69 114.58 118.49 2wrf h GLU 189 Ca -0.05 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.11 2wrf h GLU 189 Cb 1.39 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.77 2wrf h GLU 189 CO 0.16 0.00 -0.13 0.37 -0.73 0.00 0.00 179.01 178.67 2wrf h GLN 190 N 0.00 0.51 0.01 1.92 5.75 -0.77 0.27 115.11 122.80 2wrf h GLN 190 Ca 0.17 -0.23 -0.24 0.00 -0.15 0.00 0.00 58.65 58.20 2wrf h GLN 190 Cb 0.69 -0.01 0.01 0.00 1.07 0.00 0.00 27.48 29.24 2wrf h GLN 190 CO -0.00 0.79 -0.99 0.00 -2.65 0.00 0.00 178.83 175.98 2wrf h ARG 191 N 0.23 0.45 -0.15 1.69 3.08 -0.67 0.12 114.38 119.13 2wrf h ARG 191 Ca 0.05 -0.51 0.05 0.00 0.07 0.00 0.00 59.98 59.64 2wrf h ARG 191 Cb 0.65 0.15 -0.06 0.00 0.08 0.00 0.00 29.97 30.78 2wrf h ARG 191 CO 0.04 1.16 -0.31 1.15 -1.07 0.00 0.00 179.97 180.94 2wrf h THR 192 N 0.25 0.30 0.05 2.04 2.02 0.45 0.20 112.91 118.22 2wrf h THR 192 Ca -0.09 0.00 -0.26 0.00 0.77 0.00 0.00 66.41 66.83 2wrf h THR 192 Cb 1.63 0.30 0.02 0.00 -1.74 0.00 0.00 68.15 68.37 2wrf h THR 192 CO 0.17 0.00 -1.03 -0.07 0.37 0.00 0.00 175.52 174.96 2wrf h LEU 193 N -0.37 0.82 -0.30 2.58 3.38 -0.94 -3.40 115.31 117.08 2wrf h LEU 193 Ca 0.10 -0.78 0.00 0.00 0.09 0.00 0.00 57.88 57.29 2wrf h LEU 193 Cb 0.53 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2wrf h LEU 193 CO -0.36 1.51 0.00 -1.22 0.09 0.00 0.00 178.44 178.46 2wrf n TYR 194 N -3.91 0.00 -3.83 1.13 4.01 0.39 -2.36 117.16 112.58 2wrf n TYR 194 Ca -0.12 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.26 2wrf n TYR 194 Cb 0.88 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.94 2wrf n TYR 194 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 2wrf n GLN 195 N -0.58 -0.84 0.00 -0.72 -0.06 0.68 -4.47 117.38 111.39 2wrf n GLN 195 Ca 0.00 0.36 0.00 0.00 -2.00 0.00 0.00 57.00 55.36 2wrf n GLN 195 Cb 0.01 -3.36 0.00 0.00 -4.06 0.00 0.00 30.24 22.83 2wrf n GLN 195 CO 0.00 0.00 0.00 0.27 -0.20 0.00 0.00 177.06 177.13 2wrf n ASN 196 N -2.43 0.00 -4.85 1.69 2.04 -1.26 -4.63 115.26 105.82 2wrf n ASN 196 Ca -0.12 0.00 -0.31 0.00 -0.44 0.00 0.00 54.58 53.72 2wrf n ASN 196 Cb 0.58 0.00 0.03 0.00 -2.53 0.00 0.00 39.78 37.87 2wrf n ASN 196 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 2wrf s VAL 197 N 0.00 4.29 0.00 3.53 1.01 -1.26 -3.66 120.40 124.31 2wrf s VAL 197 Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 61.98 62.72 2wrf s VAL 197 Cb 0.00 -3.63 0.00 0.00 0.00 0.00 0.00 36.38 32.75 2wrf s VAL 197 CO 0.00 -0.97 0.00 0.61 0.00 0.00 0.00 175.10 174.74 2wrf n GLY 198 N -2.46 0.50 3.76 4.51 0.00 -1.26 -5.05 105.19 105.19 2wrf n GLY 198 Ca 0.07 -0.90 -0.34 0.00 0.00 0.00 0.00 46.02 44.85 2wrf n GLY 198 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrf s ALA 199 N -2.00 2.45 -0.01 4.61 0.00 -1.24 -4.94 121.76 120.64 2wrf s ALA 199 Ca 0.00 0.75 -0.11 0.00 0.00 0.00 0.00 51.96 52.61 2wrf s ALA 199 Cb 0.00 -3.38 0.01 0.00 0.00 0.00 0.00 23.12 19.75 2wrf s ALA 199 CO 0.00 -1.28 0.22 1.52 0.00 0.00 0.00 175.76 176.22 2wrf s TYR 200 N -2.02 -0.06 -0.26 0.00 1.13 -1.26 -4.22 117.35 110.67 2wrf s TYR 200 Ca 0.71 0.06 0.03 0.00 -1.41 0.00 0.00 57.07 56.47 2wrf s TYR 200 Cb -0.25 0.02 0.06 0.00 -1.10 0.00 0.00 41.96 40.69 2wrf s TYR 200 CO 0.38 -0.33 -0.11 0.08 -2.51 0.00 0.00 175.55 173.06 2wrf s VAL 201 N -1.31 2.15 -0.22 -3.49 1.01 0.23 -2.45 120.40 116.33 2wrf s VAL 201 Ca -0.14 -1.61 -0.05 0.00 0.00 0.00 0.00 61.98 60.18 2wrf s VAL 201 Cb -0.06 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 2wrf s VAL 201 CO 0.03 -0.01 -0.00 -0.55 0.00 0.00 0.00 175.10 174.56 2wrf s SER 202 N 1.11 4.67 -0.09 3.32 0.15 0.42 -2.94 113.70 120.35 2wrf s SER 202 Ca -0.09 -0.29 0.04 0.00 0.70 0.00 0.00 55.95 56.32 2wrf s SER 202 Cb -0.20 -1.81 -0.01 0.00 -1.71 0.00 0.00 66.02 62.29 2wrf s SER 202 CO -0.05 0.00 -0.22 -0.69 1.20 0.00 0.00 173.24 173.48 2wrf s VAL 203 N 1.37 2.24 -0.03 4.45 1.01 -0.08 -1.28 120.40 128.08 2wrf s VAL 203 Ca 0.05 -0.97 -0.06 0.00 0.00 0.00 0.00 61.98 61.00 2wrf s VAL 203 Cb -0.15 -1.86 0.01 0.00 0.00 0.00 0.00 36.38 34.39 2wrf s VAL 203 CO 0.00 0.56 0.14 -0.83 0.00 0.00 0.00 175.10 174.97 2wrf s GLY 204 N 0.15 -0.04 0.00 4.51 0.00 -1.06 -0.50 107.32 110.39 2wrf s GLY 204 Ca -0.12 0.17 0.00 0.00 0.00 0.00 0.00 44.72 44.77 2wrf s GLY 204 CO 0.07 0.09 0.00 -1.30 0.00 0.00 0.00 173.10 171.95 2wrf n THR 205 N 2.38 0.00 0.29 0.90 -2.24 0.29 -1.69 114.28 114.21 2wrf n THR 205 Ca -0.17 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.77 2wrf n THR 205 Cb 0.58 0.00 0.89 0.00 -2.10 0.00 0.00 70.33 69.69 2wrf n THR 205 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2wrf h SER 206 N 0.00 0.00 0.00 3.42 0.02 -2.00 -3.24 113.55 111.75 2wrf h SER 206 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2wrf h SER 206 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2wrf h SER 206 CO 0.00 0.04 -0.21 0.35 -1.14 0.00 0.00 176.83 175.87 2wrf n THR 207 N -3.66 0.00 -5.11 -2.27 -2.24 -1.26 -5.05 114.28 94.69 2wrf n THR 207 Ca -0.02 -0.26 -0.31 0.00 -2.27 0.00 0.00 64.05 61.18 2wrf n THR 207 Cb 0.14 0.82 -0.17 0.00 -2.10 0.00 0.00 70.33 69.02 2wrf n THR 207 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2wrf s LEU 208 N -1.69 2.01 -0.10 3.22 0.20 -1.22 -5.10 118.68 116.00 2wrf s LEU 208 Ca 0.00 -0.51 -0.01 0.00 0.69 0.00 0.00 54.13 54.30 2wrf s LEU 208 Cb 0.00 -1.31 0.03 0.00 -0.43 0.00 0.00 46.19 44.48 2wrf s LEU 208 CO 0.00 0.14 -0.02 0.21 -0.29 0.00 0.00 176.35 176.40 2wrf s ASN 209 N 0.36 1.90 -0.03 3.68 2.47 -1.26 0.10 114.94 122.16 2wrf s ASN 209 Ca -0.17 -0.22 -0.01 0.00 0.42 0.00 0.00 52.86 52.88 2wrf s ASN 209 Cb -0.17 -0.58 0.03 0.00 -1.45 0.00 0.00 41.25 39.08 2wrf s ASN 209 CO 0.08 -0.18 0.05 -0.75 -3.72 0.00 0.00 177.10 172.57 2wrf s LYS 210 N 1.88 -0.04 0.36 0.43 2.20 0.35 -5.01 119.74 119.91 2wrf s LYS 210 Ca 0.04 0.26 0.06 0.00 -0.36 0.00 0.00 55.97 55.97 2wrf s LYS 210 Cb -0.13 -0.30 -0.01 0.00 -1.51 0.00 0.00 37.83 35.88 2wrf s LYS 210 CO -0.06 -0.21 0.51 0.50 -0.36 0.00 0.00 175.35 175.72 2wrf s ARG 211 N 1.36 3.09 -0.24 4.03 6.06 -1.26 -0.90 118.95 131.09 2wrf s ARG 211 Ca -0.06 -0.95 -0.27 0.00 -2.50 0.00 0.00 55.73 51.96 2wrf s ARG 211 Cb -0.13 -2.78 0.12 0.00 0.06 0.00 0.00 34.95 32.23 2wrf s ARG 211 CO -0.03 -0.01 1.03 -1.54 -2.50 0.00 0.00 175.30 172.24 2wrf s SER 212 N -4.19 -0.42 0.08 -2.12 1.04 -1.15 -4.93 113.70 102.01 2wrf s SER 212 Ca 0.46 0.72 0.10 0.00 0.48 0.00 0.00 55.95 57.71 2wrf s SER 212 Cb -0.10 0.70 -0.03 0.00 0.10 0.00 0.00 66.02 66.69 2wrf s SER 212 CO 0.32 -0.21 -0.25 -0.76 0.98 0.00 0.00 173.24 173.32 2wrf s LEU 213 N -0.18 2.23 0.13 2.42 1.43 -1.26 -0.60 118.68 122.85 2wrf s LEU 213 Ca 0.02 -0.64 -0.33 0.00 -1.03 0.00 0.00 54.13 52.14 2wrf s LEU 213 Cb -0.04 -1.19 -0.18 0.00 0.03 0.00 0.00 46.19 44.81 2wrf s LEU 213 CO -0.04 0.20 0.83 -2.65 0.23 0.00 0.00 176.35 174.93 2wrf n PRO 214 N 1.43 0.25 -3.13 1.29 -0.02 -1.26 -4.87 135.00 128.68 2wrf n PRO 214 Ca -0.18 0.09 -0.33 0.00 -2.02 0.00 0.00 63.50 61.07 2wrf n PRO 214 Cb 0.53 -1.36 -0.04 0.00 -0.02 0.00 0.00 33.50 32.61 2wrf n PRO 214 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2wrf n GLU 215 N 1.29 3.50 -1.72 -0.52 1.02 -1.26 -5.06 120.64 117.88 2wrf n GLU 215 Ca 0.18 -4.69 -0.42 0.00 -0.02 0.00 0.00 57.16 52.21 2wrf n GLU 215 Cb 0.19 -2.34 -0.03 0.00 -0.02 0.00 0.00 31.44 29.24 2wrf n GLU 215 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2wrf s ILE 216 N -3.19 2.08 0.05 -3.67 1.01 -1.26 -4.91 121.20 111.31 2wrf s ILE 216 Ca 0.39 0.00 -0.00 0.00 0.00 0.00 0.00 60.65 61.05 2wrf s ILE 216 Cb 0.16 -3.00 -0.04 0.00 0.01 0.00 0.00 42.46 39.59 2wrf s ILE 216 CO -0.02 0.00 -0.04 0.00 0.00 0.00 0.00 174.94 174.88 2wrf s ALA 217 N 1.43 0.54 -0.61 9.38 0.00 -1.26 -5.00 121.76 126.24 2wrf s ALA 217 Ca 0.76 -1.10 -0.22 0.00 0.00 0.00 0.00 51.96 51.39 2wrf s ALA 217 Cb -0.49 0.21 0.06 0.00 0.00 0.00 0.00 23.12 22.90 2wrf s ALA 217 CO 0.33 -0.28 0.91 0.99 0.00 0.00 0.00 175.76 177.70 2wrf s THR 218 N -3.27 4.42 0.30 0.00 2.01 -1.26 -4.63 115.64 113.21 2wrf s THR 218 Ca 0.03 -0.23 0.08 0.00 0.31 0.00 0.00 61.69 61.88 2wrf s THR 218 Cb 0.03 -4.59 -0.06 0.00 0.01 0.00 0.00 72.50 67.89 2wrf s THR 218 CO -0.07 -1.28 -0.08 0.00 -0.69 0.00 0.00 174.62 172.50 2wrf s ARG 219 N 3.82 1.63 0.80 4.92 3.03 -1.26 -5.16 118.95 126.73 2wrf s ARG 219 Ca 0.23 -1.82 -0.14 0.00 2.03 0.00 0.00 55.73 56.03 2wrf s ARG 219 Cb -0.16 -1.35 0.19 0.00 -1.03 0.00 0.00 34.95 32.60 2wrf s ARG 219 CO 0.13 0.09 0.89 -2.30 -1.13 0.00 0.00 175.30 172.97 2wrf n PRO 220 N -0.64 -1.73 -3.78 3.89 -0.02 -1.26 -4.88 135.00 126.58 2wrf n PRO 220 Ca -0.05 -1.39 -0.35 0.00 -2.02 0.00 0.00 63.50 59.68 2wrf n PRO 220 Cb 0.63 -1.09 -0.08 0.00 -0.02 0.00 0.00 33.50 32.94 2wrf n PRO 220 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2wrf s GLU 221 N -4.97 4.11 -0.26 -0.52 2.02 -1.26 -4.49 118.70 113.33 2wrf s GLU 221 Ca 0.53 -0.23 0.02 0.00 0.02 0.00 0.00 54.97 55.31 2wrf s GLU 221 Cb -0.03 -3.37 0.06 0.00 0.10 0.00 0.00 34.13 30.89 2wrf s GLU 221 CO 0.39 0.32 -0.07 0.08 0.02 0.00 0.00 175.26 176.01 2wrf s VAL 222 N 0.28 1.85 -0.99 2.63 1.01 -0.28 -4.52 120.40 120.38 2wrf s VAL 222 Ca 0.08 -1.50 -0.04 0.00 0.00 0.00 0.00 61.98 60.52 2wrf s VAL 222 Cb -0.11 -2.08 0.00 0.00 0.00 0.00 0.00 36.38 34.20 2wrf s VAL 222 CO -0.01 -0.13 0.85 0.59 0.00 0.00 0.00 175.10 176.40 2wrf n ASN 223 N 4.54 -4.01 0.00 3.32 4.13 -1.26 -2.85 115.26 119.12 2wrf n ASN 223 Ca -0.11 -0.44 0.00 0.00 1.68 0.00 0.00 54.58 55.71 2wrf n ASN 223 Cb 0.43 -4.00 0.00 0.00 -1.54 0.00 0.00 39.78 34.67 2wrf n ASN 223 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2wrf n GLY 224 N -1.43 0.00 3.65 7.41 0.00 -1.26 -4.65 105.19 108.90 2wrf n GLY 224 Ca -0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 2wrf n GLY 224 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wrf s GLN 225 N -1.80 4.01 0.01 1.61 -1.52 -1.13 -4.96 119.66 115.88 2wrf s GLN 225 Ca 0.00 -0.32 0.04 0.00 -1.95 0.00 0.00 55.36 53.13 2wrf s GLN 225 Cb 0.00 -3.26 -0.25 0.00 -0.22 0.00 0.00 33.01 29.28 2wrf s GLN 225 CO 0.00 0.26 0.87 0.78 -0.25 0.00 0.00 175.29 176.96 2wrf h GLY 226 N 6.75 0.13 -0.95 3.09 0.00 -1.87 -0.74 103.07 109.47 2wrf h GLY 226 Ca -0.38 -0.33 -0.41 0.00 0.00 0.00 0.00 47.33 46.22 2wrf h GLY 226 CO 0.71 0.28 0.01 -0.32 0.00 0.00 0.00 176.54 177.23 2wrf s GLY 227 N -4.98 1.50 0.03 4.60 0.00 -1.26 -4.74 107.32 102.48 2wrf s GLY 227 Ca -0.06 -0.76 -0.09 0.00 0.00 0.00 0.00 44.72 43.81 2wrf s GLY 227 CO 0.83 0.15 0.19 0.50 0.00 0.00 0.00 173.10 174.77 2wrf s ARG 228 N -5.11 0.66 -0.06 2.90 1.81 -1.20 -4.69 118.95 113.26 2wrf s ARG 228 Ca 0.69 -0.59 0.05 0.00 -1.72 0.00 0.00 55.73 54.17 2wrf s ARG 228 Cb -0.14 0.27 -0.01 0.00 -0.45 0.00 0.00 34.95 34.63 2wrf s ARG 228 CO 0.58 -0.18 -0.22 -1.64 -0.68 0.00 0.00 175.30 173.15 2wrf s MET 229 N -2.35 2.39 -0.16 3.54 -1.94 0.14 0.24 119.30 121.15 2wrf s MET 229 Ca -0.07 -0.80 0.01 0.00 -1.71 0.00 0.00 55.69 53.12 2wrf s MET 229 Cb -0.02 -1.99 0.01 0.00 2.01 0.00 0.00 34.83 34.84 2wrf s MET 229 CO -0.03 0.30 -0.18 -2.00 -0.01 0.00 0.00 175.02 173.10 2wrf s GLU 230 N -0.00 3.11 0.12 2.03 2.12 -0.75 -2.00 118.70 123.32 2wrf s GLU 230 Ca -0.06 -0.80 0.08 0.00 0.36 0.00 0.00 54.97 54.55 2wrf s GLU 230 Cb -0.14 -2.57 -0.04 0.00 0.26 0.00 0.00 34.13 31.65 2wrf s GLU 230 CO 0.04 -0.05 -0.14 -0.06 -0.54 0.00 0.00 175.26 174.51 2wrf s PHE 231 N 0.95 2.63 -0.15 5.30 0.08 0.38 -1.25 117.98 125.92 2wrf s PHE 231 Ca -0.03 -0.21 -0.16 0.00 0.12 0.00 0.00 56.93 56.64 2wrf s PHE 231 Cb -0.15 -1.38 0.04 0.00 -0.57 0.00 0.00 43.02 40.97 2wrf s PHE 231 CO -0.04 0.42 0.45 -1.12 -0.10 0.00 0.00 175.22 174.83 2wrf s SER 232 N -2.23 -0.45 0.46 1.36 0.01 -0.98 0.21 113.70 112.07 2wrf s SER 232 Ca 0.20 0.83 0.03 0.00 1.31 0.00 0.00 55.95 58.32 2wrf s SER 232 Cb -0.11 0.86 -0.01 0.00 0.21 0.00 0.00 66.02 66.97 2wrf s SER 232 CO 0.12 -0.20 0.11 -1.66 0.41 0.00 0.00 173.24 172.02 2wrf s TRP 233 N 0.05 1.77 0.20 2.43 1.48 -1.26 -2.77 118.94 120.84 2wrf s TRP 233 Ca -0.02 -1.26 -0.13 0.00 -1.06 0.00 0.00 56.10 53.64 2wrf s TRP 233 Cb -0.03 -1.26 0.05 0.00 -1.16 0.00 0.00 33.47 31.06 2wrf s TRP 233 CO 0.01 -0.21 0.63 -2.37 -4.06 0.00 0.00 176.95 170.95 2wrf n THR 234 N -1.07 0.00 -3.55 0.66 5.66 -1.14 -5.04 114.28 109.80 2wrf n THR 234 Ca -0.11 -0.54 -0.28 0.00 -3.05 0.00 0.00 64.05 60.08 2wrf n THR 234 Cb 0.65 0.61 -0.15 0.00 -1.55 0.00 0.00 70.33 69.89 2wrf n THR 234 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 2wrf s ILE 235 N -2.30 -0.09 -0.24 1.09 1.01 -1.26 -2.48 121.20 116.92 2wrf s ILE 235 Ca 0.13 -0.58 -0.29 0.00 0.00 0.00 0.00 60.65 59.92 2wrf s ILE 235 Cb -0.03 -0.86 -0.01 0.00 0.01 0.00 0.00 42.46 41.57 2wrf s ILE 235 CO 0.06 -0.59 1.31 -0.22 0.00 0.00 0.00 174.94 175.50 2wrf s LEU 236 N 2.12 3.99 0.77 2.97 2.96 -0.98 -4.88 118.68 125.63 2wrf s LEU 236 Ca 0.07 1.41 -0.11 0.00 -0.22 0.00 0.00 54.13 55.29 2wrf s LEU 236 Cb -0.16 -3.54 0.05 0.00 0.50 0.00 0.00 46.19 43.05 2wrf s LEU 236 CO -0.29 -0.97 1.09 -1.81 -1.32 0.00 0.00 176.35 173.04 2wrf s ASP 237 N 2.59 4.58 0.49 3.68 1.01 -1.26 -2.88 116.67 124.87 2wrf s ASP 237 Ca 0.57 1.76 -0.12 0.00 0.71 0.00 0.00 52.55 55.46 2wrf s ASP 237 Cb -0.19 -2.49 -0.10 0.00 1.01 0.00 0.00 42.92 41.15 2wrf s ASP 237 CO 0.20 -1.98 -0.28 -0.38 0.21 0.00 0.00 175.17 172.95 2wrf n ILE 238 N -3.48 0.00 -1.08 0.77 -0.00 -1.26 -1.63 119.36 112.67 2wrf n ILE 238 Ca 0.09 -0.34 0.00 0.00 -0.00 0.00 0.00 62.75 62.49 2wrf n ILE 238 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 40.17 2wrf n ILE 238 CO 0.00 0.00 0.00 0.79 -0.00 0.00 0.00 176.55 177.34 2wrf n TRP 239 N -1.31 0.00 -2.15 1.39 5.03 -1.11 -4.81 117.44 114.48 2wrf n TRP 239 Ca 0.03 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.56 2wrf n TRP 239 Cb 0.35 0.00 0.00 0.00 -1.03 0.00 0.00 31.31 30.63 2wrf n TRP 239 CO 0.00 0.00 0.00 -3.47 -0.03 0.00 0.00 177.69 174.19 2wrf n ASP 240 N 0.47 0.00 -3.37 -0.99 -0.08 -0.65 -4.89 116.55 107.04 2wrf n ASP 240 Ca 0.00 -0.16 0.02 0.00 -1.51 0.00 0.00 54.79 53.14 2wrf n ASP 240 Cb 0.00 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 43.42 2wrf n ASP 240 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 2wrf s THR 241 N 1.83 -0.53 0.70 5.18 -1.32 -1.26 -1.24 115.64 118.99 2wrf s THR 241 Ca 0.00 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.37 2wrf s THR 241 Cb 0.00 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 70.00 2wrf s THR 241 CO 0.00 0.00 1.07 -0.51 -2.21 0.00 0.00 174.62 172.97 2wrf s ILE 242 N 2.56 3.83 -0.08 5.08 2.07 -0.93 -4.57 121.20 129.16 2wrf s ILE 242 Ca -0.01 0.59 -0.05 0.00 -1.41 0.00 0.00 60.65 59.77 2wrf s ILE 242 Cb -0.07 -3.47 0.03 0.00 0.13 0.00 0.00 42.46 39.08 2wrf s ILE 242 CO -0.17 -0.78 0.19 0.20 -1.91 0.00 0.00 174.94 172.47 2wrf s ASN 243 N -4.07 -0.18 0.09 4.50 0.02 -0.68 -2.85 114.94 111.77 2wrf s ASN 243 Ca 0.58 0.38 0.07 0.00 -1.02 0.00 0.00 52.86 52.88 2wrf s ASN 243 Cb -0.13 0.33 -0.04 0.00 0.02 0.00 0.00 41.25 41.43 2wrf s ASN 243 CO 0.54 -0.11 -0.13 -0.36 0.02 0.00 0.00 177.10 177.05 2wrf s PHE 244 N 0.67 2.66 -0.22 2.20 0.08 0.90 -2.55 117.98 121.72 2wrf s PHE 244 Ca -0.05 -0.19 -0.11 0.00 0.12 0.00 0.00 56.93 56.69 2wrf s PHE 244 Cb -0.06 -1.42 0.07 0.00 -0.57 0.00 0.00 43.02 41.04 2wrf s PHE 244 CO -0.04 0.39 0.53 -2.00 -0.10 0.00 0.00 175.22 174.00 2wrf s GLU 245 N -2.04 0.51 -0.18 0.44 2.12 -0.41 -1.98 118.70 117.16 2wrf s GLU 245 Ca 0.19 1.02 -0.15 0.00 0.36 0.00 0.00 54.97 56.39 2wrf s GLU 245 Cb -0.11 0.13 0.05 0.00 0.26 0.00 0.00 34.13 34.46 2wrf s GLU 245 CO 0.11 -0.17 0.47 0.45 -0.54 0.00 0.00 175.26 175.58 2wrf s SER 246 N 1.72 -0.52 -0.27 -1.70 0.15 -0.64 0.16 113.70 112.60 2wrf s SER 246 Ca -0.09 0.96 0.13 0.00 0.70 0.00 0.00 55.95 57.66 2wrf s SER 246 Cb -0.08 0.95 0.80 0.00 -1.71 0.00 0.00 66.02 65.98 2wrf s SER 246 CO -0.16 -0.17 1.77 0.35 1.20 0.00 0.00 173.24 176.23 2wrf n THR 247 N 3.13 2.83 0.00 6.45 -2.24 -1.02 -0.73 114.28 122.70 2wrf n THR 247 Ca -0.15 -1.50 0.00 0.00 -2.27 0.00 0.00 64.05 60.13 2wrf n THR 247 Cb 0.57 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.49 2wrf n THR 247 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wrf n GLY 248 N 0.34 4.39 1.67 3.38 0.00 -1.26 -4.54 105.19 109.17 2wrf n GLY 248 Ca 0.32 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 45.25 2wrf n GLY 248 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wrf n ASN 249 N 0.00 0.00 -4.65 1.61 3.02 -1.26 -4.18 115.26 109.80 2wrf n ASN 249 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.13 2wrf n ASN 249 Cb 0.00 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.18 2wrf n ASN 249 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 2wrf n LEU 250 N 0.00 3.18 -4.21 3.41 7.94 -1.26 -2.20 117.00 123.86 2wrf n LEU 250 Ca 0.00 1.09 -0.33 0.00 -1.11 0.00 0.00 56.01 55.66 2wrf n LEU 250 Cb 0.00 -1.42 -0.15 0.00 0.53 0.00 0.00 43.42 42.38 2wrf n LEU 250 CO 0.00 -1.06 -0.49 -0.63 -1.11 0.00 0.00 177.39 174.11 2wrf s ILE 251 N -1.21 2.50 0.13 1.96 -1.09 0.95 -4.08 121.20 120.37 2wrf s ILE 251 Ca 0.61 -0.81 0.03 0.00 -2.23 0.00 0.00 60.65 58.26 2wrf s ILE 251 Cb -0.55 -2.07 -0.04 0.00 -1.58 0.00 0.00 42.46 38.22 2wrf s ILE 251 CO 0.58 0.51 0.19 0.00 -1.23 0.00 0.00 174.94 174.99 2wrf s ALA 252 N 1.10 3.77 0.71 9.38 0.00 -0.53 -0.76 121.76 135.42 2wrf s ALA 252 Ca 0.00 -1.07 -0.14 0.00 0.00 0.00 0.00 51.96 50.75 2wrf s ALA 252 Cb -0.14 -1.59 0.03 0.00 0.00 0.00 0.00 23.12 21.42 2wrf s ALA 252 CO -0.05 0.59 1.13 -1.25 0.00 0.00 0.00 175.76 176.18 2wrf s PRO 253 N -2.97 2.48 -0.13 0.00 0.05 -1.24 -1.89 135.00 131.30 2wrf s PRO 253 Ca 0.33 1.43 0.15 0.00 0.05 0.00 0.00 61.00 62.95 2wrf s PRO 253 Cb -0.11 -1.91 -0.21 0.00 0.05 0.00 0.00 34.50 32.32 2wrf s PRO 253 CO 0.26 -1.51 0.12 -1.91 0.05 0.00 0.00 177.00 174.01 2wrf n GLU 254 N -2.78 1.24 -4.59 4.56 2.13 0.28 -4.74 120.64 116.75 2wrf n GLU 254 Ca 0.11 -0.04 -0.23 0.00 0.66 0.00 0.00 57.16 57.66 2wrf n GLU 254 Cb 0.52 -1.40 -0.16 0.00 0.27 0.00 0.00 31.44 30.67 2wrf n GLU 254 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 2wrf s TYR 255 N -2.55 1.29 0.29 4.31 2.02 -1.25 -1.14 117.35 120.32 2wrf s TYR 255 Ca -0.07 -0.35 0.02 0.00 -0.37 0.00 0.00 57.07 56.29 2wrf s TYR 255 Cb 0.06 -0.89 0.05 0.00 -0.40 0.00 0.00 41.96 40.78 2wrf s TYR 255 CO 0.66 -0.13 0.40 0.41 -1.57 0.00 0.00 175.55 175.31 2wrf n GLY 256 N 3.24 1.29 2.94 0.71 0.00 -1.01 -4.67 105.19 107.68 2wrf n GLY 256 Ca -0.18 -2.07 -0.19 0.00 0.00 0.00 0.00 46.02 43.58 2wrf n GLY 256 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wrf s PHE 257 N -0.92 0.70 0.07 1.61 0.08 -0.83 -1.66 117.98 117.03 2wrf s PHE 257 Ca 0.28 -0.17 -0.30 0.00 0.12 0.00 0.00 56.93 56.86 2wrf s PHE 257 Cb -0.02 -0.55 -0.06 0.00 -0.57 0.00 0.00 43.02 41.82 2wrf s PHE 257 CO 0.18 -0.11 1.18 0.15 -0.10 0.00 0.00 175.22 176.52 2wrf s LYS 258 N 0.44 4.45 -0.09 0.44 1.02 0.47 -1.23 119.74 125.24 2wrf s LYS 258 Ca -0.06 1.76 -0.01 0.00 0.02 0.00 0.00 55.97 57.68 2wrf s LYS 258 Cb -0.10 -3.34 0.03 0.00 -0.52 0.00 0.00 37.83 33.91 2wrf s LYS 258 CO 0.00 -0.22 -0.01 -1.50 -0.92 0.00 0.00 175.35 172.71 2wrf s ILE 259 N 0.90 0.51 -0.22 2.17 2.07 0.90 -1.75 121.20 125.78 2wrf s ILE 259 Ca 0.57 -0.03 0.01 0.00 -1.41 0.00 0.00 60.65 59.80 2wrf s ILE 259 Cb -0.29 -0.68 0.05 0.00 0.13 0.00 0.00 42.46 41.67 2wrf s ILE 259 CO 0.30 0.23 -0.09 -0.44 -1.91 0.00 0.00 174.94 173.02 2wrf s SER 260 N 1.91 3.76 0.42 4.50 0.01 -1.08 -4.03 113.70 119.19 2wrf s SER 260 Ca 0.04 -1.08 0.08 0.00 1.31 0.00 0.00 55.95 56.30 2wrf s SER 260 Cb -0.13 -1.30 -0.02 0.00 0.21 0.00 0.00 66.02 64.79 2wrf s SER 260 CO -0.06 -0.18 0.41 -0.54 0.41 0.00 0.00 173.24 173.28 2wrf s LYS 261 N 1.32 2.58 0.00 12.44 1.02 -1.26 0.10 119.74 135.95 2wrf s LYS 261 Ca -0.04 -1.49 0.00 0.00 0.02 0.00 0.00 55.97 54.46 2wrf s LYS 261 Cb -0.18 -2.44 0.00 0.00 -0.52 0.00 0.00 37.83 34.69 2wrf s LYS 261 CO -0.07 -0.21 0.00 2.89 -0.92 0.00 0.00 175.35 177.04 2wrf n ARG 262 N -1.60 0.00 -3.52 1.68 1.85 -1.26 -4.93 116.66 108.88 2wrf n ARG 262 Ca 0.04 0.00 0.01 0.00 -1.00 0.00 0.00 57.85 56.90 2wrf n ARG 262 Cb 0.61 -0.04 0.01 0.00 -1.05 0.00 0.00 32.46 31.99 2wrf n ARG 262 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2wrf n GLY 263 N 0.00 0.44 3.00 2.89 0.00 -1.26 -5.18 105.19 105.08 2wrf n GLY 263 Ca 0.00 -1.04 -0.24 0.00 0.00 0.00 0.00 46.02 44.74 2wrf n GLY 263 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wrf n SER 264 N -0.98 -0.76 0.00 1.61 3.41 -1.26 -4.68 113.62 110.96 2wrf n SER 264 Ca 0.02 -1.24 0.00 0.00 -0.26 0.00 0.00 58.87 57.39 2wrf n SER 264 Cb 0.47 -0.82 0.00 0.00 -0.26 0.00 0.00 64.21 63.60 2wrf n SER 264 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2wrf n SER 265 N -4.05 0.00 -2.61 4.04 2.88 -1.26 -4.56 113.62 108.05 2wrf n SER 265 Ca 0.13 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.60 2wrf n SER 265 Cb 0.47 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.92 2wrf n SER 265 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2wrf n GLY 266 N -0.43 3.93 3.11 0.46 0.00 -1.26 -4.78 105.19 106.22 2wrf n GLY 266 Ca 0.00 -2.24 -0.27 0.00 0.00 0.00 0.00 46.02 43.51 2wrf n GLY 266 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wrf s ILE 267 N -1.32 1.47 -0.33 -0.61 1.01 -1.26 -3.77 121.20 116.39 2wrf s ILE 267 Ca 0.01 -0.69 -0.12 0.00 0.00 0.00 0.00 60.65 59.84 2wrf s ILE 267 Cb -0.00 -1.30 -0.02 0.00 0.01 0.00 0.00 42.46 41.15 2wrf s ILE 267 CO 0.01 0.43 0.23 -0.32 0.00 0.00 0.00 174.94 175.28 2wrf s MET 268 N 0.41 3.59 -0.99 2.79 -2.45 -0.53 -4.83 119.30 117.29 2wrf s MET 268 Ca -0.13 -0.58 -0.19 0.00 -1.25 0.00 0.00 55.69 53.55 2wrf s MET 268 Cb -0.15 -3.77 0.12 0.00 1.25 0.00 0.00 34.83 32.28 2wrf s MET 268 CO 0.05 -0.39 1.24 0.15 1.05 0.00 0.00 175.02 177.12 2wrf s LYS 269 N 1.73 3.68 0.13 4.11 1.02 -1.26 -2.25 119.74 126.90 2wrf s LYS 269 Ca 0.06 -1.78 0.03 0.00 0.02 0.00 0.00 55.97 54.30 2wrf s LYS 269 Cb -0.17 -5.03 -0.04 0.00 -0.52 0.00 0.00 37.83 32.07 2wrf s LYS 269 CO 0.11 -1.86 -0.07 -0.08 -0.92 0.00 0.00 175.35 172.53 2wrf s THR 270 N 2.94 0.86 -0.33 2.17 -1.32 -1.06 -4.79 115.64 114.10 2wrf s THR 270 Ca 0.37 -1.99 0.07 0.00 -1.21 0.00 0.00 61.69 58.93 2wrf s THR 270 Cb -0.03 -1.82 0.50 0.00 -1.51 0.00 0.00 72.50 69.63 2wrf s THR 270 CO -0.08 -0.75 1.49 -0.62 -2.21 0.00 0.00 174.62 172.45 2wrf n GLU 271 N -0.14 2.14 0.00 7.08 1.02 -1.26 -3.93 120.64 125.55 2wrf n GLU 271 Ca -0.10 -3.33 0.00 0.00 -0.02 0.00 0.00 57.16 53.70 2wrf n GLU 271 Cb 0.61 -1.92 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 2wrf n GLU 271 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wrf n GLY 272 N -1.06 2.89 3.07 0.62 0.00 -1.26 -5.14 105.19 104.31 2wrf n GLY 272 Ca 0.38 -2.01 -0.12 0.00 0.00 0.00 0.00 46.02 44.27 2wrf n GLY 272 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2wrf s THR 273 N 2.00 0.02 0.55 2.61 -1.32 -1.26 -4.99 115.64 113.25 2wrf s THR 273 Ca 0.00 -0.14 -0.20 0.00 -1.21 0.00 0.00 61.69 60.14 2wrf s THR 273 Cb 0.00 -0.30 -0.05 0.00 -1.51 0.00 0.00 72.50 70.65 2wrf s THR 273 CO 0.00 -0.08 1.21 -1.48 -2.21 0.00 0.00 174.62 172.06 2wrf s LEU 274 N -0.22 3.77 -0.19 9.08 2.34 -1.26 -4.34 118.68 127.86 2wrf s LEU 274 Ca -0.03 2.39 0.13 0.00 0.06 0.00 0.00 54.13 56.68 2wrf s LEU 274 Cb -0.03 -4.49 0.43 0.00 -0.56 0.00 0.00 46.19 41.54 2wrf s LEU 274 CO 0.01 -1.41 1.21 -0.62 -1.06 0.00 0.00 176.35 174.48 2wrf n GLU 275 N -1.26 1.55 -2.89 1.48 1.02 -0.80 -4.98 120.64 114.76 2wrf n GLU 275 Ca 0.12 -3.22 -0.02 0.00 -0.02 0.00 0.00 57.16 54.02 2wrf n GLU 275 Cb 0.49 -1.47 -0.02 0.00 -0.02 0.00 0.00 31.44 30.42 2wrf n GLU 275 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2wrf n ASN 276 N -0.89 -4.74 0.00 1.62 5.15 -1.26 -5.01 115.26 110.13 2wrf n ASN 276 Ca 0.19 1.11 0.00 0.00 -0.60 0.00 0.00 54.58 55.28 2wrf n ASN 276 Cb 0.77 -3.09 0.00 0.00 -0.53 0.00 0.00 39.78 36.93 2wrf n ASN 276 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2wrf s GLU 278 N 3.88 0.33 0.31 0.00 2.56 -1.26 -4.55 118.70 119.98 2wrf s GLU 278 Ca 0.00 0.50 -0.04 0.00 0.00 0.00 0.00 54.97 55.44 2wrf s GLU 278 Cb 0.00 0.11 -0.00 0.00 2.00 0.00 0.00 34.13 36.23 2wrf s GLU 278 CO 0.00 -0.06 0.43 -0.08 -0.56 0.00 0.00 175.26 174.99 2wrf s THR 279 N 0.86 0.00 0.00 -1.70 -1.32 -0.80 -4.73 115.64 107.95 2wrf s THR 279 Ca -0.04 -1.63 0.00 0.00 -1.21 0.00 0.00 61.69 58.81 2wrf s THR 279 Cb -0.04 -2.54 0.00 0.00 -1.51 0.00 0.00 72.50 68.41 2wrf s THR 279 CO -0.12 0.00 0.25 1.17 -2.21 0.00 0.00 174.62 173.71 2wrf n LYS 280 N -0.50 2.31 -3.28 7.08 3.00 -1.26 -3.44 118.16 122.06 2wrf n LYS 280 Ca 0.01 -0.25 -0.05 0.00 -0.00 0.00 0.00 58.31 58.02 2wrf n LYS 280 Cb 0.62 -0.73 -0.06 0.00 0.00 0.00 0.00 35.03 34.86 2wrf n LYS 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2wrf s GLN 282 N 2.65 2.60 -0.00 0.00 2.00 -0.59 -1.42 119.66 124.90 2wrf s GLN 282 Ca 0.15 -0.87 -0.13 0.00 -2.00 0.00 0.00 55.36 52.51 2wrf s GLN 282 Cb -0.15 -2.54 0.02 0.00 0.80 0.00 0.00 33.01 31.14 2wrf s GLN 282 CO -0.18 -0.63 0.26 0.99 -0.50 0.00 0.00 175.29 175.23 2wrf s THR 283 N -2.68 0.07 -1.46 -0.34 2.01 -0.14 -2.56 115.64 110.54 2wrf s THR 283 Ca 0.57 -0.56 0.09 0.00 0.31 0.00 0.00 61.69 62.10 2wrf s THR 283 Cb -0.10 -0.61 0.16 0.00 0.01 0.00 0.00 72.50 71.96 2wrf s THR 283 CO 0.37 -0.31 1.15 -2.65 -0.69 0.00 0.00 174.62 172.50 2wrf n PRO 284 N 1.24 0.13 -0.10 4.92 -0.02 -1.26 -2.38 135.00 137.53 2wrf n PRO 284 Ca -0.22 0.19 0.01 0.00 -2.02 0.00 0.00 63.50 61.47 2wrf n PRO 284 Cb 0.56 -1.50 0.02 0.00 -0.02 0.00 0.00 33.50 32.56 2wrf n PRO 284 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2wrf n LEU 285 N -1.27 0.85 0.00 2.45 4.77 -1.26 -4.88 117.00 117.65 2wrf n LEU 285 Ca 0.04 -1.13 0.00 0.00 -0.03 0.00 0.00 56.01 54.90 2wrf n LEU 285 Cb 0.07 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 2wrf n LEU 285 CO 0.07 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 2wrf n GLY 286 N -0.32 1.80 3.44 -0.72 0.00 -1.00 -4.18 105.19 104.21 2wrf n GLY 286 Ca 0.02 -1.64 -0.44 0.00 0.00 0.00 0.00 46.02 43.96 2wrf n GLY 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrf s ALA 287 N -1.69 3.48 -0.02 4.61 0.00 -1.11 -0.97 121.76 126.06 2wrf s ALA 287 Ca 0.00 -1.78 -0.30 0.00 0.00 0.00 0.00 51.96 49.88 2wrf s ALA 287 Cb 0.00 -3.06 -0.03 0.00 0.00 0.00 0.00 23.12 20.03 2wrf s ALA 287 CO 0.00 -1.66 1.02 0.42 0.00 0.00 0.00 175.76 175.54 2wrf s ILE 288 N 1.94 4.74 -0.16 0.00 1.01 -0.50 -3.16 121.20 125.06 2wrf s ILE 288 Ca 0.08 1.97 -0.00 0.00 0.00 0.00 0.00 60.65 62.70 2wrf s ILE 288 Cb -0.20 -4.27 0.04 0.00 0.01 0.00 0.00 42.46 38.04 2wrf s ILE 288 CO 0.10 0.12 -0.08 0.21 0.00 0.00 0.00 174.94 175.29 2wrf s ASN 289 N 1.05 2.84 0.09 3.58 2.47 -1.26 -4.09 114.94 119.62 2wrf s ASN 289 Ca 0.52 -0.64 -0.13 0.00 0.42 0.00 0.00 52.86 53.03 2wrf s ASN 289 Cb -0.22 -1.00 0.04 0.00 -1.45 0.00 0.00 41.25 38.62 2wrf s ASN 289 CO 0.26 -0.15 0.60 1.07 -3.72 0.00 0.00 177.10 175.16 2wrf n THR 290 N 4.83 0.00 -0.47 -5.21 5.66 -1.26 -5.03 114.28 112.80 2wrf n THR 290 Ca -0.13 -0.28 0.00 0.00 -3.05 0.00 0.00 64.05 60.58 2wrf n THR 290 Cb 0.48 0.42 0.00 0.00 -1.55 0.00 0.00 70.33 69.68 2wrf n THR 290 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 2wrf n THR 291 N -0.43 0.00 -1.06 1.09 -2.24 -1.26 -5.01 114.28 105.37 2wrf n THR 291 Ca -0.01 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.44 2wrf n THR 291 Cb 0.33 1.45 0.12 0.00 -2.10 0.00 0.00 70.33 70.13 2wrf n THR 291 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2wrf n LEU 292 N 0.00 2.71 0.14 3.22 4.77 -1.26 -4.79 117.00 121.79 2wrf n LEU 292 Ca 0.00 0.53 0.12 0.00 -0.03 0.00 0.00 56.01 56.64 2wrf n LEU 292 Cb 0.12 -1.39 0.27 0.00 -2.33 0.00 0.00 43.42 40.08 2wrf n LEU 292 CO 0.00 -2.40 0.73 -0.65 -1.33 0.00 0.00 177.39 173.75 2wrf h PRO 293 N -0.96 0.00 0.00 3.23 0.11 -1.83 -3.42 132.00 129.12 2wrf h PRO 293 Ca -0.45 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.59 2wrf h PRO 293 Cb 1.31 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.40 2wrf h PRO 293 CO 0.43 0.00 -0.05 1.19 -0.21 0.00 0.00 178.00 179.36 2wrf n PHE 294 N -2.57 0.02 0.00 0.65 3.72 -1.21 -1.92 117.46 116.16 2wrf n PHE 294 Ca 0.04 -0.28 0.00 0.00 -0.05 0.00 0.00 57.45 57.16 2wrf n PHE 294 Cb 0.48 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.01 2wrf n PHE 294 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 176.76 174.32 2wrf n HIS 295 N -0.10 0.00 -2.43 1.38 1.44 -0.16 -3.70 115.22 111.65 2wrf n HIS 295 Ca -0.01 0.00 -0.04 0.00 -2.01 0.00 0.00 57.72 55.67 2wrf n HIS 295 Cb 0.07 0.00 0.05 0.00 0.12 0.00 0.00 29.99 30.23 2wrf n HIS 295 CO 0.00 0.00 0.00 0.27 -2.81 0.00 0.00 176.34 173.80 2wrf n ASN 296 N 0.00 -1.09 0.00 4.39 6.94 -1.24 -2.06 115.26 122.20 2wrf n ASN 296 Ca 0.00 -2.12 0.00 0.00 -0.02 0.00 0.00 54.58 52.44 2wrf n ASN 296 Cb 0.00 0.46 0.00 0.00 -2.36 0.00 0.00 39.78 37.88 2wrf n ASN 296 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 2wrf n ILE 297 N -0.89 0.00 -3.90 1.53 5.41 -1.26 -4.99 119.36 115.26 2wrf n ILE 297 Ca -0.20 0.62 -0.11 0.00 1.00 0.00 0.00 62.75 64.06 2wrf n ILE 297 Cb 0.82 -1.24 -0.13 0.00 -0.71 0.00 0.00 39.64 38.38 2wrf n ILE 297 CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 2wrf s HIS 298 N -0.81 0.07 0.16 1.39 2.46 -1.26 -5.05 115.29 112.25 2wrf s HIS 298 Ca 0.00 -0.13 0.01 0.00 0.47 0.00 0.00 55.06 55.41 2wrf s HIS 298 Cb 0.00 -0.05 -0.02 0.00 -0.13 0.00 0.00 32.58 32.37 2wrf s HIS 298 CO 0.00 -0.07 1.36 -1.35 -2.47 0.00 0.00 174.74 172.22 2wrf h PRO 299 N 5.66 0.24 -3.96 2.88 0.11 -1.97 -3.38 132.00 131.57 2wrf h PRO 299 Ca -0.27 -0.26 -0.65 0.00 0.11 0.00 0.00 66.00 64.93 2wrf h PRO 299 Cb 1.21 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2wrf h PRO 299 CO 0.47 0.98 2.93 1.28 -0.21 0.00 0.00 178.00 183.45 2wrf n LEU 300 N -3.68 6.08 -4.89 2.35 4.77 -1.26 -4.82 117.00 115.55 2wrf n LEU 300 Ca -0.04 -3.66 -0.30 0.00 -0.03 0.00 0.00 56.01 51.97 2wrf n LEU 300 Cb 0.81 -1.42 -0.04 0.00 -2.33 0.00 0.00 43.42 40.44 2wrf n LEU 300 CO 0.48 0.74 0.28 0.42 -1.33 0.00 0.00 177.39 177.98 2wrf s THR 301 N 3.64 4.92 -0.22 -5.08 -4.23 -1.26 -4.43 115.64 108.98 2wrf s THR 301 Ca 0.52 0.36 0.00 0.00 -1.18 0.00 0.00 61.69 61.40 2wrf s THR 301 Cb 0.14 -3.69 0.06 0.00 1.34 0.00 0.00 72.50 70.35 2wrf s THR 301 CO -0.02 -0.29 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.10 2wrf s ILE 302 N -2.07 1.39 -0.32 2.99 1.01 -1.06 -1.23 121.20 121.90 2wrf s ILE 302 Ca 0.47 -1.09 0.00 0.00 0.00 0.00 0.00 60.65 60.03 2wrf s ILE 302 Cb -0.11 -1.67 0.00 0.00 0.01 0.00 0.00 42.46 40.70 2wrf s ILE 302 CO 0.27 -0.09 0.00 0.61 0.00 0.00 0.00 174.94 175.74 2wrf n GLY 303 N 4.73 0.27 3.56 6.18 0.00 0.26 -1.54 105.19 118.65 2wrf n GLY 303 Ca -0.12 -2.28 -0.29 0.00 0.00 0.00 0.00 46.02 43.33 2wrf n GLY 303 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wrf s GLU 304 N -0.13 2.58 0.23 1.61 2.02 -0.85 -3.29 118.70 120.88 2wrf s GLU 304 Ca 0.00 -0.13 0.11 0.00 0.02 0.00 0.00 54.97 54.97 2wrf s GLU 304 Cb 0.00 -4.94 -0.05 0.00 0.10 0.00 0.00 34.13 29.25 2wrf s GLU 304 CO 0.00 -3.24 -0.21 0.00 0.02 0.00 0.00 175.26 171.83 2wrf s PRO 306 N -3.13 2.05 0.74 0.00 0.02 -1.26 -4.79 135.00 128.63 2wrf s PRO 306 Ca 0.25 1.50 -0.15 0.00 0.02 0.00 0.00 61.00 62.62 2wrf s PRO 306 Cb -0.06 -1.85 0.04 0.00 0.02 0.00 0.00 34.50 32.65 2wrf s PRO 306 CO 0.12 -1.85 1.21 0.21 -0.33 0.00 0.00 177.00 176.36 2wrf s LYS 307 N -4.34 2.07 -0.32 5.54 2.47 -0.81 -4.68 119.74 119.67 2wrf s LYS 307 Ca 0.68 1.78 -0.08 0.00 -1.56 0.00 0.00 55.97 56.78 2wrf s LYS 307 Cb -0.23 -1.82 0.01 0.00 -1.46 0.00 0.00 37.83 34.33 2wrf s LYS 307 CO 0.50 -1.89 0.12 -0.47 0.16 0.00 0.00 175.35 173.77 2wrf s TYR 308 N -1.98 3.18 0.11 4.03 5.04 -1.26 -0.99 117.35 125.47 2wrf s TYR 308 Ca 0.75 -0.92 0.10 0.00 -2.44 0.00 0.00 57.07 54.56 2wrf s TYR 308 Cb -0.30 -2.31 -0.04 0.00 0.35 0.00 0.00 41.96 39.67 2wrf s TYR 308 CO 0.46 -0.57 -0.24 0.14 -1.34 0.00 0.00 175.55 174.00 2wrf s VAL 309 N 1.53 2.45 -0.34 3.14 -7.23 -0.87 -4.79 120.40 114.28 2wrf s VAL 309 Ca 0.03 -1.59 -0.00 0.00 -1.81 0.00 0.00 61.98 58.60 2wrf s VAL 309 Cb -0.18 -2.08 0.27 0.00 0.56 0.00 0.00 36.38 34.96 2wrf s VAL 309 CO 0.04 0.15 1.90 1.17 -0.31 0.00 0.00 175.10 178.05 2wrf n LYS 310 N 1.05 1.86 -4.51 4.82 4.81 -1.26 -4.57 118.16 120.36 2wrf n LYS 310 Ca -0.17 -1.76 -0.34 0.00 -0.87 0.00 0.00 58.31 55.17 2wrf n LYS 310 Cb 0.53 -1.69 -0.10 0.00 0.02 0.00 0.00 35.03 33.78 2wrf n LYS 310 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 2wrf s SER 311 N -0.13 4.91 0.03 3.14 1.04 -1.26 -5.06 113.70 116.37 2wrf s SER 311 Ca 0.34 0.05 -0.26 0.00 0.48 0.00 0.00 55.95 56.57 2wrf s SER 311 Cb 0.27 -1.30 -0.14 0.00 0.10 0.00 0.00 66.02 64.95 2wrf s SER 311 CO 0.01 0.37 1.24 -0.08 0.98 0.00 0.00 173.24 175.76 2wrf h GLU 312 N 5.20 -0.89 -4.42 4.02 4.57 -2.00 -3.46 114.58 117.60 2wrf h GLU 312 Ca -0.50 0.06 -0.52 0.00 -1.18 0.00 0.00 59.36 57.23 2wrf h GLU 312 Cb 1.18 0.20 -0.35 0.00 -0.16 0.00 0.00 28.75 29.63 2wrf h GLU 312 CO 0.53 -0.60 -0.81 -0.98 -1.18 0.00 0.00 179.01 175.98 2wrf s ARG 313 N -4.79 1.61 -0.89 1.92 1.70 -1.26 -5.07 118.95 112.17 2wrf s ARG 313 Ca -0.14 -0.35 -0.02 0.00 -0.47 0.00 0.00 55.73 54.76 2wrf s ARG 313 Cb 0.01 -1.45 0.22 0.00 -0.57 0.00 0.00 34.95 33.16 2wrf s ARG 313 CO 0.41 -0.08 0.78 -0.51 -1.08 0.00 0.00 175.30 174.81 2wrf s LEU 314 N 1.04 5.57 -0.27 -1.89 1.43 -1.26 -5.04 118.68 118.25 2wrf s LEU 314 Ca -0.08 -3.69 -0.20 0.00 -1.03 0.00 0.00 54.13 49.14 2wrf s LEU 314 Cb -0.15 -1.92 -0.02 0.00 0.03 0.00 0.00 46.19 44.14 2wrf s LEU 314 CO -0.01 -0.19 0.60 0.68 0.23 0.00 0.00 176.35 177.66 2wrf s VAL 315 N -1.30 4.99 0.00 -1.59 -7.23 -1.26 -3.09 120.40 110.92 2wrf s VAL 315 Ca 0.27 1.00 0.00 0.00 -1.81 0.00 0.00 61.98 61.44 2wrf s VAL 315 Cb -0.08 -3.93 0.00 0.00 0.56 0.00 0.00 36.38 32.93 2wrf s VAL 315 CO -0.12 -0.01 0.00 -0.11 -0.31 0.00 0.00 175.10 174.55 2wrf n LEU 316 N 5.72 0.00 0.00 1.32 0.00 -0.63 -4.62 117.00 118.79 2wrf n LEU 316 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.99 2wrf n LEU 316 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.91 2wrf n LEU 316 CO 0.43 0.00 0.00 0.00 0.00 0.00 0.00 177.39 177.82 2wrf n ALA 317 N -3.00 0.00 -2.46 1.96 0.00 -1.26 -4.64 120.51 111.11 2wrf n ALA 317 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.46 2wrf n ALA 317 Cb 0.00 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.50 2wrf n ALA 317 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2wrf n THR 318 N 0.00 0.73 0.00 0.00 -2.24 0.23 -4.69 114.28 108.31 2wrf n THR 318 Ca 0.00 -1.94 0.00 0.00 -2.27 0.00 0.00 64.05 59.84 2wrf n THR 318 Cb 0.00 0.83 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 2wrf n THR 318 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wrf n GLY 319 N -0.04 1.50 1.74 3.38 0.00 -0.62 -4.43 105.19 106.72 2wrf n GLY 319 Ca 0.10 -0.07 -0.21 0.00 0.00 0.00 0.00 46.02 45.84 2wrf n GLY 319 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2wrf n LEU 320 N 0.00 -3.21 -4.73 0.99 -0.00 -1.26 -3.93 117.00 104.85 2wrf n LEU 320 Ca 0.00 0.09 -0.30 0.00 -0.00 0.00 0.00 56.01 55.80 2wrf n LEU 320 Cb 0.00 -0.41 0.13 0.00 -0.00 0.00 0.00 43.42 43.13 2wrf n LEU 320 CO 0.00 -3.16 0.68 0.00 -0.00 0.00 0.00 177.39 174.91 2wrf s ARG 321 N -1.16 1.46 -0.10 1.47 1.70 -1.26 -2.31 118.95 118.75 2wrf s ARG 321 Ca 0.23 0.83 0.03 0.00 -0.47 0.00 0.00 55.73 56.35 2wrf s ARG 321 Cb -0.08 -1.83 0.01 0.00 -0.57 0.00 0.00 34.95 32.48 2wrf s ARG 321 CO 0.46 -2.10 -0.20 1.21 -1.08 0.00 0.00 175.30 173.59 2wrf s ASN 322 N -3.49 2.77 -0.38 -2.89 2.47 -0.54 -4.72 114.94 108.17 2wrf s ASN 322 Ca 0.63 -0.50 0.05 0.00 0.42 0.00 0.00 52.86 53.46 2wrf s ASN 322 Cb -0.17 -1.27 0.28 0.00 -1.45 0.00 0.00 41.25 38.64 2wrf s ASN 322 CO 0.56 0.10 1.24 1.33 -3.72 0.00 0.00 177.10 176.61 2wrf n VAL 323 N 3.76 0.00 -0.82 -5.21 0.24 -1.26 -4.84 118.33 110.19 2wrf n VAL 323 Ca -0.20 -1.10 -0.34 0.00 -2.04 0.00 0.00 64.34 60.67 2wrf n VAL 323 Cb 0.52 1.04 0.11 0.00 -1.47 0.00 0.00 33.84 34.04 2wrf n VAL 323 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 2wrf n PRO 324 N -0.09 -0.53 -2.95 7.34 -0.02 -1.26 -3.86 135.00 133.63 2wrf n PRO 324 Ca -0.07 -0.13 -0.43 0.00 -2.02 0.00 0.00 63.50 60.84 2wrf n PRO 324 Cb 0.74 -1.57 0.01 0.00 -0.02 0.00 0.00 33.50 32.66 2wrf n PRO 324 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2wrf n GLN 325 N -0.58 4.03 0.00 -0.52 6.02 -1.22 -4.71 117.38 120.41 2wrf n GLN 325 Ca 0.03 -4.29 0.00 0.00 -0.01 0.00 0.00 57.00 52.72 2wrf n GLN 325 Cb 0.58 -2.64 0.00 0.00 1.02 0.00 0.00 30.24 29.21 2wrf n GLN 325 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wrf n GLY 330 N 2.11 -0.59 0.12 1.08 0.00 -1.07 -5.00 105.19 101.84 2wrf n GLY 330 Ca 0.29 0.28 0.03 0.00 0.00 0.00 0.00 46.02 46.61 2wrf n GLY 330 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wrf h LEU 331 N 0.00 0.00 -1.32 0.99 -0.00 -1.93 -3.36 115.31 109.69 2wrf h LEU 331 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2wrf h LEU 331 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 2wrf h LEU 331 CO 0.00 0.46 -0.05 0.49 -0.00 0.00 0.00 178.44 179.35 2wrf n PHE 332 N -3.04 0.00 0.00 1.13 3.72 -1.26 -5.01 117.46 113.00 2wrf n PHE 332 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 2wrf n PHE 332 Cb 0.75 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.29 2wrf n PHE 332 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wrf n GLY 333 N 0.72 2.69 0.00 1.37 0.00 -1.26 -4.87 105.19 103.84 2wrf n GLY 333 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2wrf n GLY 333 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrf n ALA 334 N 0.00 -0.12 -1.81 4.61 0.00 -1.26 -1.09 120.51 120.83 2wrf n ALA 334 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 2wrf n ALA 334 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2wrf n ALA 334 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2wrf s ILE 335 N -1.50 2.35 -0.96 0.00 1.01 -1.26 -1.58 121.20 119.25 2wrf s ILE 335 Ca 0.00 0.30 -0.08 0.00 0.00 0.00 0.00 60.65 60.87 2wrf s ILE 335 Cb 0.00 -3.19 0.07 0.00 0.01 0.00 0.00 42.46 39.35 2wrf s ILE 335 CO 0.00 0.05 0.29 0.00 0.00 0.00 0.00 174.94 175.29 2wrf n ALA 336 N 1.98 -1.04 -2.77 9.38 0.00 -1.25 -2.59 120.51 124.22 2wrf n ALA 336 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 2wrf n ALA 336 Cb 0.39 -1.83 0.00 0.00 0.00 0.00 0.00 19.45 18.01 2wrf n ALA 336 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wrf n GLY 337 N -0.89 3.85 0.31 0.00 0.00 -0.62 -4.60 105.19 103.25 2wrf n GLY 337 Ca 0.00 -0.44 0.05 0.00 0.00 0.00 0.00 46.02 45.63 2wrf n GLY 337 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2wrf h PHE 338 N 0.00 0.49 -1.57 1.61 -5.15 -1.10 -2.76 116.94 108.46 2wrf h PHE 338 Ca 0.00 0.01 -0.71 0.00 -0.20 0.00 0.00 57.97 57.08 2wrf h PHE 338 Cb 0.00 -0.17 -0.13 0.00 0.22 0.00 0.00 35.95 35.87 2wrf h PHE 338 CO 0.00 0.30 1.71 0.42 -2.00 0.00 0.00 178.31 178.74 2wrf s ILE 339 N -5.47 4.59 0.41 0.88 1.01 -1.07 -4.39 121.20 117.15 2wrf s ILE 339 Ca -0.08 -2.23 0.31 0.00 0.00 0.00 0.00 60.65 58.66 2wrf s ILE 339 Cb 0.18 -5.04 0.48 0.00 0.01 0.00 0.00 42.46 38.09 2wrf s ILE 339 CO 0.73 -1.81 1.41 1.21 0.00 0.00 0.00 174.94 176.48 2wrf n GLU 340 N 6.98 -0.03 -3.16 2.79 2.13 -1.04 -3.95 120.64 124.37 2wrf n GLU 340 Ca 0.41 1.11 -0.08 0.00 0.66 0.00 0.00 57.16 59.27 2wrf n GLU 340 Cb 0.45 -2.23 0.01 0.00 0.27 0.00 0.00 31.44 29.94 2wrf n GLU 340 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2wrf n GLY 341 N -1.52 1.43 3.87 8.31 0.00 -1.26 -4.55 105.19 111.47 2wrf n GLY 341 Ca 0.37 -1.26 -0.21 0.00 0.00 0.00 0.00 46.02 44.92 2wrf n GLY 341 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wrf s GLY 342 N -2.58 2.14 -0.54 -0.02 0.00 -1.25 -4.47 107.32 100.60 2wrf s GLY 342 Ca 0.14 -1.90 -0.04 0.00 0.00 0.00 0.00 44.72 42.92 2wrf s GLY 342 CO 0.10 -1.71 0.36 -0.98 0.00 0.00 0.00 173.10 170.88 2wrf s TRP 343 N -2.48 3.49 0.47 1.90 0.51 -0.18 -3.42 118.94 119.23 2wrf s TRP 343 Ca 0.48 -2.44 0.33 0.00 -2.12 0.00 0.00 56.10 52.35 2wrf s TRP 343 Cb -0.03 -3.29 1.46 0.00 -0.81 0.00 0.00 33.47 30.80 2wrf s TRP 343 CO 0.28 -0.92 1.65 0.37 -0.51 0.00 0.00 176.95 177.82 2wrf h GLN 344 N 7.65 0.09 -0.89 4.98 5.75 -1.87 -0.71 115.11 130.10 2wrf h GLN 344 Ca -0.08 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.40 2wrf h GLN 344 Cb 1.01 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 29.50 2wrf h GLN 344 CO 0.73 0.06 0.50 0.78 -2.65 0.00 0.00 178.83 178.26 2wrf h GLY 345 N 0.09 1.32 -5.20 2.39 0.00 -1.96 -3.41 103.07 96.30 2wrf h GLY 345 Ca 0.79 -0.59 -0.57 0.00 0.00 0.00 0.00 47.33 46.96 2wrf h GLY 345 CO -0.29 0.56 0.46 -0.29 0.00 0.00 0.00 176.54 176.98 2wrf s MET 346 N -5.87 4.32 -0.22 4.80 -2.45 -0.27 -4.92 119.30 114.69 2wrf s MET 346 Ca -0.13 1.13 0.20 0.00 -1.25 0.00 0.00 55.69 55.64 2wrf s MET 346 Cb 0.17 -3.57 0.45 0.00 1.25 0.00 0.00 34.83 33.13 2wrf s MET 346 CO 0.82 -0.35 1.21 1.33 1.05 0.00 0.00 175.02 179.08 2wrf n VAL 347 N 4.73 0.74 -0.90 10.11 0.24 -1.26 -4.60 118.33 127.39 2wrf n VAL 347 Ca 0.06 -2.07 0.02 0.00 -2.04 0.00 0.00 64.34 60.31 2wrf n VAL 347 Cb 0.49 1.15 0.02 0.00 -1.47 0.00 0.00 33.84 34.03 2wrf n VAL 347 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2wrf n ASP 348 N -0.61 0.98 0.00 -1.34 5.75 -1.26 -5.10 116.55 114.97 2wrf n ASP 348 Ca -0.00 -1.82 0.00 0.00 -0.01 0.00 0.00 54.79 52.95 2wrf n ASP 348 Cb 0.86 -0.11 0.00 0.00 -1.03 0.00 0.00 41.12 40.85 2wrf n ASP 348 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wrf n GLY 349 N -0.38 -1.36 0.12 6.12 0.00 -1.26 -4.82 105.19 103.61 2wrf n GLY 349 Ca 0.03 -1.02 -0.17 0.00 0.00 0.00 0.00 46.02 44.86 2wrf n GLY 349 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2wrf n TRP 350 N 0.16 0.97 -4.48 1.61 8.01 -1.26 -4.59 117.44 117.86 2wrf n TRP 350 Ca 0.00 0.25 -0.21 0.00 -1.31 0.00 0.00 57.50 56.23 2wrf n TRP 350 Cb 0.00 -1.14 -0.14 0.00 -2.01 0.00 0.00 31.31 28.02 2wrf n TRP 350 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.69 177.39 2wrf s TYR 351 N -2.56 1.24 0.04 -5.99 2.02 -1.26 -0.00 117.35 110.84 2wrf s TYR 351 Ca -0.18 -0.30 -0.05 0.00 -0.37 0.00 0.00 57.07 56.17 2wrf s TYR 351 Cb 0.07 -0.76 0.02 0.00 -0.40 0.00 0.00 41.96 40.89 2wrf s TYR 351 CO 0.77 0.01 0.23 0.41 -1.57 0.00 0.00 175.55 175.41 2wrf n GLY 352 N 2.26 1.09 3.79 0.71 0.00 -1.24 0.25 105.19 112.05 2wrf n GLY 352 Ca -0.16 -0.96 -0.26 0.00 0.00 0.00 0.00 46.02 44.64 2wrf n GLY 352 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wrf s TYR 353 N -4.91 2.30 -0.29 1.61 2.02 -0.20 -3.70 117.35 114.18 2wrf s TYR 353 Ca 0.05 -0.68 0.02 0.00 -0.37 0.00 0.00 57.07 56.09 2wrf s TYR 353 Cb -0.01 -1.92 0.19 0.00 -0.40 0.00 0.00 41.96 39.82 2wrf s TYR 353 CO 0.01 0.02 0.59 -1.58 -1.57 0.00 0.00 175.55 173.01 2wrf s HIS 354 N -2.66 -1.70 -0.10 2.71 5.65 -0.25 -2.50 115.29 116.43 2wrf s HIS 354 Ca 0.36 1.37 -0.03 0.00 0.25 0.00 0.00 55.06 57.00 2wrf s HIS 354 Cb 0.02 0.42 -0.03 0.00 -1.18 0.00 0.00 32.58 31.81 2wrf s HIS 354 CO 0.20 -0.98 0.03 -3.38 -0.65 0.00 0.00 174.74 169.97 2wrf s HIS 355 N 2.83 3.25 -0.57 3.88 -3.43 -1.20 -1.22 115.29 118.83 2wrf s HIS 355 Ca 0.15 0.24 -0.12 0.00 -0.80 0.00 0.00 55.06 54.54 2wrf s HIS 355 Cb -0.13 -1.84 0.14 0.00 -1.43 0.00 0.00 32.58 29.33 2wrf s HIS 355 CO -0.23 0.50 0.48 -1.12 -2.00 0.00 0.00 174.74 172.36 2wrf s SER 356 N -0.81 6.02 0.32 7.38 0.01 -1.26 -4.04 113.70 121.32 2wrf s SER 356 Ca 0.13 -2.07 0.03 0.00 1.31 0.00 0.00 55.95 55.34 2wrf s SER 356 Cb -0.12 -2.10 0.03 0.00 0.21 0.00 0.00 66.02 64.04 2wrf s SER 356 CO 0.03 -0.71 0.23 -3.20 0.41 0.00 0.00 173.24 170.00 2wrf n ASN 357 N 4.76 2.06 0.10 2.44 5.15 -1.19 -4.93 115.26 123.66 2wrf n ASN 357 Ca -0.05 -2.12 0.07 0.00 -0.60 0.00 0.00 54.58 51.88 2wrf n ASN 357 Cb 0.41 -0.01 0.38 0.00 -0.53 0.00 0.00 39.78 40.03 2wrf n ASN 357 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2wrf n ASP 358 N -1.87 0.36 -3.68 1.20 8.00 -1.26 -3.93 116.55 115.36 2wrf n ASP 358 Ca -0.02 0.65 -0.29 0.00 0.71 0.00 0.00 54.79 55.84 2wrf n ASP 358 Cb 0.37 -0.71 -0.13 0.00 -0.02 0.00 0.00 41.12 40.63 2wrf n ASP 358 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2wrf s GLN 359 N -3.32 1.17 0.00 -1.24 -0.21 -1.26 -5.10 119.66 109.70 2wrf s GLN 359 Ca -0.00 -1.88 0.00 0.00 0.02 0.00 0.00 55.36 53.50 2wrf s GLN 359 Cb 0.05 -2.20 0.00 0.00 1.00 0.00 0.00 33.01 31.86 2wrf s GLN 359 CO 0.16 -1.16 0.00 0.41 -2.12 0.00 0.00 175.29 172.58 2wrf n GLY 360 N 3.67 1.49 0.47 3.09 0.00 -1.25 -4.98 105.19 107.68 2wrf n GLY 360 Ca 0.08 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2wrf n GLY 360 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2wrf n SER 361 N 1.14 -2.63 0.00 1.61 7.64 -1.26 -3.16 113.62 116.96 2wrf n SER 361 Ca 0.00 0.53 0.00 0.00 1.01 0.00 0.00 58.87 60.41 2wrf n SER 361 Cb 0.00 -0.79 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 2wrf n SER 361 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wrf n GLY 362 N -1.69 4.16 3.72 0.23 0.00 -1.26 -4.71 105.19 105.65 2wrf n GLY 362 Ca 0.00 -0.86 -0.33 0.00 0.00 0.00 0.00 46.02 44.83 2wrf n GLY 362 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wrf s TYR 363 N 0.00 3.16 -0.20 1.61 2.02 -1.26 -3.23 117.35 119.45 2wrf s TYR 363 Ca 0.00 0.14 -0.05 0.00 -0.37 0.00 0.00 57.07 56.80 2wrf s TYR 363 Cb 0.00 -1.71 0.10 0.00 -0.40 0.00 0.00 41.96 39.95 2wrf s TYR 363 CO 0.00 0.50 0.36 0.00 -1.57 0.00 0.00 175.55 174.84 2wrf s ALA 364 N -1.10 -0.96 0.32 3.71 0.00 -1.04 -5.02 121.76 117.66 2wrf s ALA 364 Ca 0.20 1.09 -0.28 0.00 0.00 0.00 0.00 51.96 52.97 2wrf s ALA 364 Cb -0.12 -1.40 -0.09 0.00 0.00 0.00 0.00 23.12 21.51 2wrf s ALA 364 CO 0.10 -0.96 1.13 0.00 0.00 0.00 0.00 175.76 176.04 2wrf s ALA 365 N 2.53 3.33 -1.08 0.00 0.00 -1.26 -1.03 121.76 124.25 2wrf s ALA 365 Ca 0.05 0.92 -0.20 0.00 0.00 0.00 0.00 51.96 52.73 2wrf s ALA 365 Cb -0.14 -3.34 0.08 0.00 0.00 0.00 0.00 23.12 19.72 2wrf s ALA 365 CO -0.13 -0.28 1.45 0.34 0.00 0.00 0.00 175.76 177.14 2wrf s ASP 366 N -0.97 6.65 0.43 0.00 2.15 0.14 -4.85 116.67 120.21 2wrf s ASP 366 Ca 0.49 -1.91 0.14 0.00 0.43 0.00 0.00 52.55 51.69 2wrf s ASP 366 Cb -0.31 -2.53 1.02 0.00 -0.30 0.00 0.00 42.92 40.80 2wrf s ASP 366 CO 0.40 -1.29 1.96 0.11 -0.17 0.00 0.00 175.17 176.19 2wrf h LYS 367 N 8.90 0.41 0.06 4.34 1.57 -1.90 -1.98 116.57 127.97 2wrf h LYS 367 Ca 0.26 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 59.03 2wrf h LYS 367 Cb 0.97 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.16 2wrf h LYS 367 CO 1.36 0.27 -0.19 1.49 -0.57 0.00 0.00 179.45 181.82 2wrf h GLU 368 N 0.43 -0.33 0.00 3.15 4.81 -1.96 0.17 114.58 120.85 2wrf h GLU 368 Ca 0.30 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.51 2wrf h GLU 368 Cb 0.61 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.06 2wrf h GLU 368 CO -0.09 -0.22 -0.22 0.66 -0.73 0.00 0.00 179.01 178.42 2wrf h SER 369 N -0.34 0.00 0.78 1.04 4.64 -1.86 -2.60 113.55 115.21 2wrf h SER 369 Ca 0.04 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.25 2wrf h SER 369 Cb 0.38 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 2wrf h SER 369 CO -0.13 0.22 -0.49 0.74 -0.87 0.00 0.00 176.83 176.29 2wrf h THR 370 N 0.00 1.13 0.08 2.95 2.02 -0.98 -2.95 112.91 115.16 2wrf h THR 370 Ca -0.00 -1.83 -0.00 0.00 0.77 0.00 0.00 66.41 65.34 2wrf h THR 370 Cb 1.01 2.06 0.00 0.00 -1.74 0.00 0.00 68.15 69.48 2wrf h THR 370 CO 0.03 0.48 -0.04 1.56 0.37 0.00 0.00 175.52 177.92 2wrf h GLN 371 N 0.00 -0.11 -0.50 6.66 1.08 -0.42 -1.14 115.11 120.68 2wrf h GLN 371 Ca -0.00 0.01 0.14 0.00 -1.45 0.00 0.00 58.65 57.35 2wrf h GLN 371 Cb 1.02 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 28.45 2wrf h GLN 371 CO 0.06 0.44 0.51 -0.22 -0.95 0.00 0.00 178.83 178.68 2wrf h LYS 372 N -0.80 0.00 0.00 1.46 3.64 -1.52 1.31 116.57 120.66 2wrf h LYS 372 Ca -0.01 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 2wrf h LYS 372 Cb 0.60 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.41 2wrf h LYS 372 CO 0.02 0.00 -0.14 0.00 -2.27 0.00 0.00 179.45 177.06 2wrf h ALA 373 N 1.45 0.03 -0.62 5.00 0.00 -1.50 -2.34 119.26 121.29 2wrf h ALA 373 Ca 0.24 -0.50 0.05 0.00 0.00 0.00 0.00 54.91 54.70 2wrf h ALA 373 Cb 1.25 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.09 2wrf h ALA 373 CO -0.00 0.08 0.41 0.27 0.00 0.00 0.00 179.25 180.01 2wrf h PHE 374 N -1.00 0.65 0.17 0.00 -0.00 0.15 -0.09 116.94 116.82 2wrf h PHE 374 Ca -0.04 0.02 -0.01 0.00 -0.00 0.00 0.00 57.97 57.94 2wrf h PHE 374 Cb 0.87 -0.22 0.00 0.00 -0.00 0.00 0.00 35.95 36.60 2wrf h PHE 374 CO 0.21 0.36 -0.08 -0.44 -0.00 0.00 0.00 178.31 178.36 2wrf h ASP 375 N 0.66 -0.19 0.80 -0.68 3.32 0.15 -2.78 116.42 117.71 2wrf h ASP 375 Ca 0.26 -0.20 -0.04 0.00 0.02 0.00 0.00 57.03 57.07 2wrf h ASP 375 Cb 0.18 0.05 0.01 0.00 0.22 0.00 0.00 39.33 39.79 2wrf h ASP 375 CO -0.07 0.10 -0.38 1.23 -1.72 0.00 0.00 179.24 178.39 2wrf h GLY 376 N -0.48 -1.12 0.07 2.75 0.00 -1.05 -2.97 103.07 100.27 2wrf h GLY 376 Ca -0.02 0.42 0.27 0.00 0.00 0.00 0.00 47.33 47.99 2wrf h GLY 376 CO 0.04 -0.41 0.70 -2.22 0.00 0.00 0.00 176.54 174.65 2wrf h ILE 377 N -1.28 0.47 0.15 2.60 1.08 -1.15 0.14 117.51 119.51 2wrf h ILE 377 Ca -0.11 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.35 2wrf h ILE 377 Cb 0.83 0.50 0.00 0.00 -3.07 0.00 0.00 36.82 35.08 2wrf h ILE 377 CO 0.18 0.00 -0.07 0.74 -0.69 0.00 0.00 178.15 178.31 2wrf h THR 378 N 0.00 0.97 -0.30 -0.27 2.02 -1.38 -2.21 112.91 111.75 2wrf h THR 378 Ca 0.44 -0.54 0.01 0.00 0.77 0.00 0.00 66.41 67.10 2wrf h THR 378 Cb 1.84 1.30 -0.02 0.00 -1.74 0.00 0.00 68.15 69.54 2wrf h THR 378 CO -0.00 0.13 0.20 0.78 0.37 0.00 0.00 175.52 176.99 2wrf h ASN 379 N -0.45 0.31 0.05 4.18 4.21 -0.60 0.31 115.58 123.59 2wrf h ASN 379 Ca -0.02 -0.01 -0.00 0.00 1.21 0.00 0.00 56.30 57.48 2wrf h ASN 379 Cb 0.36 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 37.48 2wrf h ASN 379 CO 0.03 0.22 -0.03 0.50 -1.29 0.00 0.00 177.43 176.87 2wrf h LYS 380 N 0.37 -0.07 -0.72 0.81 3.64 -1.20 0.73 116.57 120.12 2wrf h LYS 380 Ca 0.11 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2wrf h LYS 380 Cb 0.01 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.81 2wrf h LYS 380 CO -0.02 -0.03 0.45 0.28 -2.27 0.00 0.00 179.45 177.86 2wrf h VAL 381 N -0.09 1.20 -0.05 2.00 2.07 -0.67 -2.26 116.25 118.45 2wrf h VAL 381 Ca -0.01 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 2wrf h VAL 381 Cb 0.07 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.01 2wrf h VAL 381 CO 0.01 0.20 -0.01 0.78 0.02 0.00 0.00 177.57 178.57 2wrf h ASN 382 N 0.98 0.10 -0.33 0.57 2.35 -0.85 -2.64 115.58 115.77 2wrf h ASN 382 Ca 0.26 -0.37 0.07 0.00 -0.55 0.00 0.00 56.30 55.72 2wrf h ASN 382 Cb -0.06 -0.03 -0.07 0.00 0.05 0.00 0.00 38.32 38.21 2wrf h ASN 382 CO -0.05 0.45 -0.17 0.28 -1.65 0.00 0.00 177.43 176.29 2wrf h SER 383 N -0.25 -0.56 -1.02 5.81 0.02 -0.81 1.47 113.55 118.20 2wrf h SER 383 Ca 0.01 0.13 0.26 0.00 -0.84 0.00 0.00 61.79 61.35 2wrf h SER 383 Cb 0.40 0.31 -0.09 0.00 0.14 0.00 0.00 62.40 63.16 2wrf h SER 383 CO 0.01 -0.20 0.66 0.58 -1.14 0.00 0.00 176.83 176.73 2wrf h VAL 384 N -0.12 0.55 0.00 2.27 2.07 -1.37 -2.71 116.25 116.95 2wrf h VAL 384 Ca 0.17 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.55 2wrf h VAL 384 Cb 0.38 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 2wrf h VAL 384 CO -0.40 0.07 0.00 -0.38 0.02 0.00 0.00 177.57 176.88 2wrf n ILE 385 N -4.61 0.00 0.30 4.57 5.41 0.10 -4.49 119.36 120.64 2wrf n ILE 385 Ca 0.24 0.44 0.10 0.00 1.00 0.00 0.00 62.75 64.53 2wrf n ILE 385 Cb 0.85 -1.38 0.52 0.00 -0.71 0.00 0.00 39.64 38.92 2wrf n ILE 385 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2wrf h GLU 386 N 0.00 0.00 0.00 0.38 5.08 0.19 0.30 114.58 120.53 2wrf h GLU 386 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2wrf h GLU 386 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2wrf h GLU 386 CO 0.00 0.00 -0.60 1.63 -1.00 0.00 0.00 179.01 179.04 2wrf n LYS 387 N -2.62 0.01 -1.72 2.33 5.02 -1.02 -4.87 118.16 115.29 2wrf n LYS 387 Ca -0.01 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 55.86 2wrf n LYS 387 Cb 0.53 -1.51 -0.03 0.00 -0.02 0.00 0.00 35.03 34.01 2wrf n LYS 387 CO 0.00 0.00 0.00 -0.12 -0.52 0.00 0.00 177.40 176.76 2wrf n MET 388 N -1.52 2.72 -3.08 1.97 1.56 0.09 -4.98 117.12 113.89 2wrf n MET 388 Ca 0.05 0.98 -0.39 0.00 -0.27 0.00 0.00 57.70 58.07 2wrf n MET 388 Cb 0.34 -2.81 -0.06 0.00 2.15 0.00 0.00 33.22 32.84 2wrf n MET 388 CO 0.00 0.00 0.00 1.21 -0.73 0.00 0.00 175.97 176.45 2wrf s ASN 389 N 1.06 7.22 -0.07 6.12 3.04 -1.26 -5.06 114.94 125.98 2wrf s ASN 389 Ca 0.74 1.44 -0.03 0.00 0.04 0.00 0.00 52.86 55.05 2wrf s ASN 389 Cb -0.52 -2.44 0.04 0.00 -1.54 0.00 0.00 41.25 36.79 2wrf s ASN 389 CO 0.35 0.16 0.12 0.28 -3.04 0.00 0.00 177.10 174.96 2wrf s THR 390 N -0.71 -0.19 0.50 -5.21 -1.32 -1.26 -4.91 115.64 102.54 2wrf s THR 390 Ca 0.34 0.36 0.01 0.00 -1.21 0.00 0.00 61.69 61.19 2wrf s THR 390 Cb -0.21 -0.26 -0.02 0.00 -1.51 0.00 0.00 72.50 70.51 2wrf s THR 390 CO 0.23 0.14 0.01 -1.10 -2.21 0.00 0.00 174.62 171.68 2wrf s GLN 391 N 2.24 2.17 0.13 7.08 -0.21 -1.26 -4.99 119.66 124.82 2wrf s GLN 391 Ca 0.04 -2.38 -0.26 0.00 0.02 0.00 0.00 55.36 52.78 2wrf s GLN 391 Cb -0.12 -1.48 -0.07 0.00 1.00 0.00 0.00 33.01 32.34 2wrf s GLN 391 CO -0.05 -0.36 0.80 0.12 -2.12 0.00 0.00 175.29 173.68 2wrf s PHE 392 N -2.89 3.85 -0.27 0.91 5.36 -1.26 -3.63 117.98 120.04 2wrf s PHE 392 Ca 0.07 1.61 -0.25 0.00 -0.96 0.00 0.00 56.93 57.41 2wrf s PHE 392 Cb 0.02 -2.82 0.08 0.00 -0.34 0.00 0.00 43.02 39.97 2wrf s PHE 392 CO 0.04 0.41 0.80 -1.21 -1.46 0.00 0.00 175.22 173.80 2wrf s GLU 393 N -0.70 0.75 -0.17 10.12 8.01 -1.21 -4.89 118.70 130.61 2wrf s GLU 393 Ca 0.38 0.90 -0.07 0.00 0.01 0.00 0.00 54.97 56.19 2wrf s GLU 393 Cb -0.22 0.36 -0.04 0.00 -4.31 0.00 0.00 34.13 29.92 2wrf s GLU 393 CO 0.26 -0.09 0.06 0.00 0.01 0.00 0.00 175.26 175.49 2wrf s ALA 394 N 0.38 3.42 -0.14 5.21 0.00 -1.26 0.89 121.76 130.26 2wrf s ALA 394 Ca 0.01 -0.74 -0.03 0.00 0.00 0.00 0.00 51.96 51.19 2wrf s ALA 394 Cb -0.05 -1.86 -0.24 0.00 0.00 0.00 0.00 23.12 20.96 2wrf s ALA 394 CO -0.01 0.26 0.28 0.28 0.00 0.00 0.00 175.76 176.57 2wrf n VAL 395 N 3.25 1.72 -3.17 0.00 0.31 -0.37 -4.85 118.33 115.21 2wrf n VAL 395 Ca -0.17 -0.66 -0.39 0.00 -0.01 0.00 0.00 64.34 63.11 2wrf n VAL 395 Cb 0.53 -1.61 -0.06 0.00 -0.91 0.00 0.00 33.84 31.79 2wrf n VAL 395 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2wrf s GLY 396 N -5.71 2.28 0.49 2.92 0.00 -1.26 -4.99 107.32 101.05 2wrf s GLY 396 Ca -0.23 -0.17 0.02 0.00 0.00 0.00 0.00 44.72 44.34 2wrf s GLY 396 CO 0.75 1.10 0.02 -1.59 0.00 0.00 0.00 173.10 173.38 2wrf s LYS 397 N 1.27 2.16 0.00 2.90 0.00 -1.26 -4.24 119.74 120.56 2wrf s LYS 397 Ca 0.29 -2.33 0.05 0.00 0.00 0.00 0.00 55.97 53.98 2wrf s LYS 397 Cb -0.16 -1.57 -0.03 0.00 0.00 0.00 0.00 37.83 36.06 2wrf s LYS 397 CO 0.12 -0.31 -0.12 -1.21 0.00 0.00 0.00 175.35 173.82 2wrf s GLU 398 N -3.86 2.37 0.01 1.78 0.41 -1.26 -5.11 118.70 113.04 2wrf s GLU 398 Ca 0.12 -0.81 0.02 0.00 -0.41 0.00 0.00 54.97 53.89 2wrf s GLU 398 Cb 0.03 -2.36 -0.01 0.00 -1.78 0.00 0.00 34.13 30.01 2wrf s GLU 398 CO 0.06 0.59 -0.06 -0.06 -0.49 0.00 0.00 175.26 175.30 2wrf s PHE 399 N -0.91 0.51 1.03 1.61 0.08 -1.26 -4.93 117.98 114.10 2wrf s PHE 399 Ca 0.15 -0.20 -0.15 0.00 0.12 0.00 0.00 56.93 56.85 2wrf s PHE 399 Cb -0.11 -0.32 0.20 0.00 -0.57 0.00 0.00 43.02 42.22 2wrf s PHE 399 CO 0.05 -0.03 1.13 -1.54 -0.10 0.00 0.00 175.22 174.73 2wrf s SER 400 N -0.53 2.46 0.56 1.36 1.04 -1.26 -4.90 113.70 112.43 2wrf s SER 400 Ca -0.01 0.88 0.34 0.00 0.48 0.00 0.00 55.95 57.64 2wrf s SER 400 Cb -0.04 -1.34 1.52 0.00 0.10 0.00 0.00 66.02 66.25 2wrf s SER 400 CO -0.00 -3.20 2.04 -1.13 0.98 0.00 0.00 173.24 171.94 2wrf h ASN 401 N -1.94 0.00 -0.60 7.02 -1.24 -2.03 -2.30 115.58 114.49 2wrf h ASN 401 Ca -0.50 0.00 -0.09 0.00 0.71 0.00 0.00 56.30 56.42 2wrf h ASN 401 Cb 1.31 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 40.31 2wrf h ASN 401 CO 0.51 0.02 0.11 0.18 -1.29 0.00 0.00 177.43 176.96 2wrf n LEU 402 N -3.14 5.64 -0.78 0.34 7.99 -1.26 -4.11 117.00 121.68 2wrf n LEU 402 Ca -0.00 -3.09 0.06 0.00 -0.01 0.00 0.00 56.01 52.97 2wrf n LEU 402 Cb 0.27 -0.69 0.15 0.00 -0.11 0.00 0.00 43.42 43.04 2wrf n LEU 402 CO 0.27 0.72 0.30 -0.62 -1.51 0.00 0.00 177.39 176.55 2wrf n GLU 403 N 0.13 1.10 -0.06 3.23 1.02 -0.87 -4.86 120.64 120.34 2wrf n GLU 403 Ca 0.33 -2.83 -0.08 0.00 -0.02 0.00 0.00 57.16 54.55 2wrf n GLU 403 Cb 1.24 -1.16 -0.02 0.00 -0.02 0.00 0.00 31.44 31.48 2wrf n GLU 403 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2wrf h LYS 404 N 0.88 -0.26 -0.00 3.49 6.56 -1.71 0.53 116.57 126.05 2wrf h LYS 404 Ca -0.06 0.02 0.02 0.00 -1.06 0.00 0.00 60.65 59.57 2wrf h LYS 404 Cb 1.24 0.06 -0.03 0.00 -0.57 0.00 0.00 32.23 32.94 2wrf h LYS 404 CO 0.03 -0.18 -0.13 0.00 -2.06 0.00 0.00 179.45 177.11 2wrf h ARG 405 N -0.27 -0.21 -0.63 3.15 3.08 -1.95 0.95 114.38 118.50 2wrf h ARG 405 Ca 0.14 0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.28 2wrf h ARG 405 Cb 0.50 0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.53 2wrf h ARG 405 CO -0.42 -0.14 0.30 1.25 -1.07 0.00 0.00 179.97 179.89 2wrf h LEU 406 N -0.22 0.39 -1.13 3.04 5.85 -1.88 0.25 115.31 121.61 2wrf h LEU 406 Ca 0.05 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 2wrf h LEU 406 Cb 0.28 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 2wrf h LEU 406 CO -0.13 0.25 0.19 -0.08 -0.34 0.00 0.00 178.44 178.32 2wrf h GLU 407 N 0.54 0.80 -0.14 1.25 4.81 -0.22 -1.88 114.58 119.75 2wrf h GLU 407 Ca 0.30 -0.13 -0.22 0.00 -0.13 0.00 0.00 59.36 59.18 2wrf h GLU 407 Cb 0.28 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 29.54 2wrf h GLU 407 CO -0.24 0.68 -0.77 -0.97 -0.73 0.00 0.00 179.01 176.99 2wrf h ASN 408 N 0.78 0.92 -0.98 1.04 -1.24 0.07 -1.70 115.58 114.47 2wrf h ASN 408 Ca 0.18 -0.64 0.13 0.00 0.71 0.00 0.00 56.30 56.69 2wrf h ASN 408 Cb 0.20 -0.27 -0.09 0.00 0.73 0.00 0.00 38.32 38.89 2wrf h ASN 408 CO -0.01 1.41 0.60 0.25 -1.29 0.00 0.00 177.43 178.39 2wrf h LEU 409 N 0.49 0.86 -0.61 0.34 5.85 -0.31 0.62 115.31 122.55 2wrf h LEU 409 Ca -0.06 0.06 -0.15 0.00 0.84 0.00 0.00 57.88 58.57 2wrf h LEU 409 Cb 1.40 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 2wrf h LEU 409 CO 0.16 0.43 -0.63 -1.13 -0.34 0.00 0.00 178.44 176.93 2wrf h ASN 410 N 0.92 0.28 0.14 1.25 -1.24 -1.21 -2.24 115.58 113.47 2wrf h ASN 410 Ca 0.50 -0.17 -0.01 0.00 0.71 0.00 0.00 56.30 57.34 2wrf h ASN 410 Cb 0.55 -0.08 0.00 0.00 0.73 0.00 0.00 38.32 39.52 2wrf h ASN 410 CO -0.29 0.84 -0.06 0.50 -1.29 0.00 0.00 177.43 177.12 2wrf h LYS 411 N 0.18 -0.18 -0.24 6.67 3.64 -0.52 -2.37 116.57 123.75 2wrf h LYS 411 Ca -0.01 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.45 2wrf h LYS 411 Cb 1.15 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.00 2wrf h LYS 411 CO 0.10 0.24 0.19 -0.22 -2.27 0.00 0.00 179.45 177.49 2wrf h LYS 412 N -0.66 0.00 -0.24 1.90 3.64 -0.94 -0.12 116.57 120.15 2wrf h LYS 412 Ca -0.02 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.20 2wrf h LYS 412 Cb 0.49 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 2wrf h LYS 412 CO 0.03 0.00 -0.49 1.98 -2.27 0.00 0.00 179.45 178.70 2wrf h MET 413 N 0.00 0.76 -0.10 1.90 4.05 -1.29 -0.37 114.93 119.88 2wrf h MET 413 Ca 0.11 -0.50 -0.01 0.00 -0.28 0.00 0.00 59.70 59.02 2wrf h MET 413 Cb 0.49 0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 31.35 2wrf h MET 413 CO -0.00 1.12 0.01 0.93 0.23 0.00 0.00 176.91 179.20 2wrf h GLU 414 N 0.50 0.17 -0.47 0.39 4.39 -0.56 -2.60 114.58 116.41 2wrf h GLU 414 Ca 0.01 -0.05 0.06 0.00 0.34 0.00 0.00 59.36 59.71 2wrf h GLU 414 Cb 1.10 -0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 29.68 2wrf h GLU 414 CO 0.11 0.40 0.18 -0.44 -1.16 0.00 0.00 179.01 178.11 2wrf h ASP 415 N -0.08 0.21 -0.48 1.42 3.32 -1.13 -0.62 116.42 119.05 2wrf h ASP 415 Ca 0.03 0.05 0.10 0.00 0.02 0.00 0.00 57.03 57.23 2wrf h ASP 415 Cb 0.32 0.02 -0.10 0.00 0.22 0.00 0.00 39.33 39.79 2wrf h ASP 415 CO 0.00 0.15 -0.22 1.23 -1.72 0.00 0.00 179.24 178.69 2wrf h GLY 416 N 0.37 0.11 2.00 2.75 0.00 -0.92 0.10 103.07 107.48 2wrf h GLY 416 Ca 0.22 0.29 -0.06 0.00 0.00 0.00 0.00 47.33 47.77 2wrf h GLY 416 CO -0.21 -0.21 -0.31 0.74 0.00 0.00 0.00 176.54 176.55 2wrf h PHE 417 N -0.12 0.00 -0.24 5.60 0.04 -1.07 -2.64 116.94 118.51 2wrf h PHE 417 Ca 0.23 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.89 2wrf h PHE 417 Cb 0.47 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.62 2wrf h PHE 417 CO -0.50 0.31 -0.24 1.25 -0.60 0.00 0.00 178.31 178.53 2wrf h LEU 418 N 0.00 0.63 -1.04 1.54 5.85 0.52 -0.03 115.31 122.78 2wrf h LEU 418 Ca -0.00 -0.48 -0.06 0.00 0.84 0.00 0.00 57.88 58.18 2wrf h LEU 418 Cb 0.79 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 2wrf h LEU 418 CO 0.04 0.98 0.05 0.44 -0.34 0.00 0.00 178.44 179.61 2wrf h ASP 419 N 0.30 0.69 0.28 1.25 3.32 -0.77 -0.79 116.42 120.70 2wrf h ASP 419 Ca 0.04 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 2wrf h ASP 419 Cb 0.80 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.17 2wrf h ASP 419 CO 0.06 0.73 -0.13 0.58 -1.72 0.00 0.00 179.24 178.76 2wrf h VAL 420 N 0.70 0.61 0.00 -1.35 2.07 -1.37 -1.87 116.25 115.04 2wrf h VAL 420 Ca 0.15 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 2wrf h VAL 420 Cb 0.36 0.97 -0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2wrf h VAL 420 CO 0.01 0.14 -0.03 -0.50 0.02 0.00 0.00 177.57 177.21 2wrf h TRP 421 N -0.89 0.00 0.17 1.57 4.06 -0.97 -0.82 115.95 119.08 2wrf h TRP 421 Ca -0.04 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.90 2wrf h TRP 421 Cb 0.51 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.67 2wrf h TRP 421 CO 0.05 0.03 -0.08 1.15 -3.56 0.00 0.00 178.44 176.02 2wrf h THR 422 N 0.00 0.00 -0.44 1.49 2.02 -1.09 -2.61 112.91 112.28 2wrf h THR 422 Ca -0.00 -0.37 0.04 0.00 0.77 0.00 0.00 66.41 66.85 2wrf h THR 422 Cb 0.09 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 66.44 2wrf h THR 422 CO 0.00 0.00 -0.26 0.00 0.37 0.00 0.00 175.52 175.63 2wrf n TYR 423 N -3.66 -0.19 -0.29 3.16 9.36 -0.71 0.33 117.16 125.15 2wrf n TYR 423 Ca -0.03 0.55 -0.01 0.00 3.32 0.00 0.00 57.90 61.73 2wrf n TYR 423 Cb 0.09 -0.52 0.05 0.00 -0.63 0.00 0.00 39.34 38.33 2wrf n TYR 423 CO 0.00 0.00 0.00 -0.91 0.22 0.00 0.00 176.86 176.17 2wrf h ASN 424 N 0.00 -1.14 -0.33 2.98 4.21 -1.28 0.28 115.58 120.31 2wrf h ASN 424 Ca 0.07 0.26 -0.15 0.00 1.21 0.00 0.00 56.30 57.69 2wrf h ASN 424 Cb 0.18 0.62 -0.01 0.00 -1.12 0.00 0.00 38.32 37.99 2wrf h ASN 424 CO -0.42 -0.29 -0.37 0.00 -1.29 0.00 0.00 177.43 175.07 2wrf h ALA 425 N 1.36 0.65 -0.71 -0.83 0.00 -0.95 -1.43 119.26 117.35 2wrf h ALA 425 Ca 0.32 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 2wrf h ALA 425 Cb 0.58 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 2wrf h ALA 425 CO -0.83 0.67 0.33 1.49 0.00 0.00 0.00 179.25 180.91 2wrf h GLU 426 N 0.72 1.02 0.11 0.00 4.57 0.16 -2.54 114.58 118.62 2wrf h GLU 426 Ca 0.06 -0.14 -0.18 0.00 -1.18 0.00 0.00 59.36 57.92 2wrf h GLU 426 Cb 0.94 -0.19 0.02 0.00 -0.16 0.00 0.00 28.75 29.37 2wrf h GLU 426 CO 0.09 0.79 -0.77 -0.07 -1.18 0.00 0.00 179.01 177.87 2wrf h LEU 427 N 1.01 0.48 -1.87 1.64 3.38 -0.99 -3.04 115.31 115.92 2wrf h LEU 427 Ca 0.24 -0.92 0.19 0.00 0.09 0.00 0.00 57.88 57.49 2wrf h LEU 427 Cb 0.12 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2wrf h LEU 427 CO -0.03 1.35 0.61 0.25 0.09 0.00 0.00 178.44 180.72 2wrf h LEU 428 N -0.32 0.00 0.02 1.67 5.85 -1.15 0.29 115.31 121.67 2wrf h LEU 428 Ca -0.13 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 2wrf h LEU 428 Cb 1.57 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.60 2wrf h LEU 428 CO 0.14 0.00 -0.01 0.58 -0.34 0.00 0.00 178.44 178.82 2wrf h VAL 429 N 0.00 1.49 0.00 1.05 2.07 -1.50 -3.38 116.25 115.97 2wrf h VAL 429 Ca 0.31 -1.90 0.00 0.00 0.82 0.00 0.00 66.70 65.93 2wrf h VAL 429 Cb 1.53 2.70 0.00 0.00 -1.52 0.00 0.00 31.29 34.01 2wrf h VAL 429 CO -0.00 0.46 0.00 0.18 0.02 0.00 0.00 177.57 178.23 2wrf n LEU 430 N -4.70 0.00 -4.40 2.57 4.77 0.83 -2.51 117.00 113.56 2wrf n LEU 430 Ca -0.09 0.77 -0.34 0.00 -0.03 0.00 0.00 56.01 56.31 2wrf n LEU 430 Cb 0.38 -0.27 0.09 0.00 -2.33 0.00 0.00 43.42 41.30 2wrf n LEU 430 CO 0.30 -0.27 -0.14 0.23 -1.33 0.00 0.00 177.39 176.19 2wrf n MET 431 N -1.59 -0.04 0.00 3.23 2.81 -0.07 -1.61 117.12 119.85 2wrf n MET 431 Ca 0.00 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.92 2wrf n MET 431 Cb 0.00 -1.77 0.00 0.00 -0.71 0.00 0.00 33.22 30.74 2wrf n MET 431 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2wrf n GLU 432 N -0.95 0.00 -0.09 0.03 -0.58 -1.26 -4.55 120.64 113.24 2wrf n GLU 432 Ca 0.07 0.00 -0.23 0.00 -0.42 0.00 0.00 57.16 56.58 2wrf n GLU 432 Cb 0.52 -0.79 -0.12 0.00 -0.57 0.00 0.00 31.44 30.48 2wrf n GLU 432 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2wrf n ASN 433 N 0.25 1.97 0.33 1.62 4.13 -0.63 -1.93 115.26 120.99 2wrf n ASN 433 Ca 0.00 0.28 0.19 0.00 1.68 0.00 0.00 54.58 56.73 2wrf n ASN 433 Cb 0.00 -0.83 1.04 0.00 -1.54 0.00 0.00 39.78 38.44 2wrf n ASN 433 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 2wrf h GLU 434 N -0.61 0.00 0.00 3.52 4.57 -1.65 -1.42 114.58 118.99 2wrf h GLU 434 Ca -0.48 0.00 -0.36 0.00 -1.18 0.00 0.00 59.36 57.33 2wrf h GLU 434 Cb 1.64 0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 30.16 2wrf h GLU 434 CO -0.17 0.00 -2.36 -1.33 -1.18 0.00 0.00 179.01 173.97 2wrf n MET 435 N -3.09 0.77 -0.08 1.92 2.81 -1.25 -3.48 117.12 114.71 2wrf n MET 435 Ca -0.02 -0.00 -0.12 0.00 -1.81 0.00 0.00 57.70 55.75 2wrf n MET 435 Cb 0.21 -1.51 -0.05 0.00 -0.71 0.00 0.00 33.22 31.16 2wrf n MET 435 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 2wrf h THR 436 N 0.00 1.28 0.87 2.03 2.02 -0.98 -2.49 112.91 115.64 2wrf h THR 436 Ca -0.54 -1.07 -0.04 0.00 0.77 0.00 0.00 66.41 65.53 2wrf h THR 436 Cb 2.20 1.49 0.01 0.00 -1.74 0.00 0.00 68.15 70.10 2wrf h THR 436 CO 0.02 0.33 -0.43 -0.07 0.37 0.00 0.00 175.52 175.74 2wrf h LEU 437 N 0.21 -1.04 -1.52 2.58 4.07 -1.46 -2.35 115.31 115.81 2wrf h LEU 437 Ca 0.06 0.04 0.00 0.00 0.08 0.00 0.00 57.88 58.06 2wrf h LEU 437 Cb 0.53 0.27 0.00 0.00 1.08 0.00 0.00 40.66 42.54 2wrf h LEU 437 CO 0.02 -0.72 0.02 0.44 -1.08 0.00 0.00 178.44 177.12 2wrf h ASP 438 N -1.19 0.00 -0.04 -0.43 3.32 -1.64 -0.29 116.42 116.15 2wrf h ASP 438 Ca -0.12 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.88 2wrf h ASP 438 Cb 0.92 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.47 2wrf h ASP 438 CO 0.19 0.00 -0.17 0.15 -1.72 0.00 0.00 179.24 177.69 2wrf h PHE 439 N 0.00 0.25 0.46 4.55 3.57 -0.95 -2.21 116.94 122.60 2wrf h PHE 439 Ca 0.00 -0.10 -0.02 0.00 3.53 0.00 0.00 57.97 61.38 2wrf h PHE 439 Cb 0.03 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 38.73 2wrf h PHE 439 CO 0.00 0.80 -0.25 0.45 -2.23 0.00 0.00 178.31 177.08 2wrf h HIS 440 N -0.37 -0.65 -1.16 0.41 3.86 -0.70 0.07 115.15 116.60 2wrf h HIS 440 Ca -0.01 -0.01 0.33 0.00 -1.16 0.00 0.00 60.37 59.52 2wrf h HIS 440 Cb 0.81 0.22 -0.06 0.00 1.06 0.00 0.00 27.41 29.44 2wrf h HIS 440 CO 0.14 -0.39 0.82 0.22 0.86 0.00 0.00 177.93 179.57 2wrf h ASP 441 N -0.66 0.11 1.30 2.45 3.58 -1.43 0.61 116.42 122.38 2wrf h ASP 441 Ca -0.06 0.02 -0.08 0.00 0.42 0.00 0.00 57.03 57.34 2wrf h ASP 441 Cb 0.52 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.57 2wrf h ASP 441 CO 0.08 0.01 -0.73 -1.28 -2.88 0.00 0.00 179.24 174.44 2wrf h SER 442 N 0.09 0.00 0.24 2.28 0.87 -0.72 -2.90 113.55 113.40 2wrf h SER 442 Ca 0.58 0.00 -0.19 0.00 -1.23 0.00 0.00 61.79 60.95 2wrf h SER 442 Cb 2.11 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 64.07 2wrf h SER 442 CO -0.09 0.31 -0.77 0.78 -0.53 0.00 0.00 176.83 176.53 2wrf h ASN 443 N 0.00 0.53 0.06 6.23 2.35 0.22 -2.60 115.58 122.36 2wrf h ASN 443 Ca -0.04 -0.36 -0.00 0.00 -0.55 0.00 0.00 56.30 55.35 2wrf h ASN 443 Cb 1.27 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 39.49 2wrf h ASN 443 CO 0.03 1.11 -0.03 0.58 -1.65 0.00 0.00 177.43 177.48 2wrf h VAL 444 N 0.29 0.00 0.00 2.81 2.07 -1.27 -2.46 116.25 117.69 2wrf h VAL 444 Ca -0.04 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.44 2wrf h VAL 444 Cb 1.36 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 2wrf h VAL 444 CO 0.13 0.00 0.36 1.17 0.02 0.00 0.00 177.57 179.26 2wrf n LYS 445 N -2.30 0.07 0.06 1.57 3.00 -1.10 0.16 118.16 119.63 2wrf n LYS 445 Ca -0.01 0.54 -0.03 0.00 -0.00 0.00 0.00 58.31 58.81 2wrf n LYS 445 Cb 0.03 -2.10 -0.07 0.00 0.00 0.00 0.00 35.03 32.89 2wrf n LYS 445 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.40 176.49 2wrf h ASN 446 N 0.00 0.00 0.23 3.14 4.21 -1.40 -3.26 115.58 118.51 2wrf h ASN 446 Ca 0.00 0.00 -0.31 0.00 1.21 0.00 0.00 56.30 57.20 2wrf h ASN 446 Cb 0.72 0.00 0.03 0.00 -1.12 0.00 0.00 38.32 37.96 2wrf h ASN 446 CO 0.00 0.74 -1.39 0.25 -1.29 0.00 0.00 177.43 175.74 2wrf h LEU 447 N 0.00 0.78 -2.12 1.61 5.85 0.20 -2.45 115.31 119.18 2wrf h LEU 447 Ca -0.09 -0.93 0.04 0.00 0.84 0.00 0.00 57.88 57.74 2wrf h LEU 447 Cb 1.65 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 42.42 2wrf h LEU 447 CO 0.08 1.67 0.31 0.22 -0.34 0.00 0.00 178.44 180.38 2wrf h TYR 448 N 0.06 0.00 0.00 1.25 3.20 -1.14 -0.65 116.97 119.68 2wrf h TYR 448 Ca -0.25 0.00 -0.31 0.00 3.14 0.00 0.00 58.73 61.32 2wrf h TYR 448 Cb 2.08 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 40.29 2wrf h TYR 448 CO 0.14 0.00 -2.21 -0.25 -1.64 0.00 0.00 178.16 174.20 2wrf n ASP 449 N -3.25 0.15 0.29 -2.11 8.00 -1.20 -2.52 116.55 115.91 2wrf n ASP 449 Ca 0.01 0.07 0.15 0.00 0.71 0.00 0.00 54.79 55.73 2wrf n ASP 449 Cb 0.40 0.94 0.87 0.00 -0.02 0.00 0.00 41.12 43.31 2wrf n ASP 449 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 2wrf h LYS 450 N 0.00 0.00 0.00 -1.24 3.64 -0.64 -1.52 116.57 116.81 2wrf h LYS 450 Ca -0.44 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 2wrf h LYS 450 Cb 2.05 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.87 2wrf h LYS 450 CO 0.03 0.05 -0.21 0.28 -2.27 0.00 0.00 179.45 177.34 2wrf h VAL 451 N 0.00 0.00 -1.04 2.00 2.07 -1.52 -3.34 116.25 114.42 2wrf h VAL 451 Ca -0.00 -0.42 0.40 0.00 0.82 0.00 0.00 66.70 67.49 2wrf h VAL 451 Cb 0.18 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 29.79 2wrf h VAL 451 CO 0.01 0.00 0.59 -0.09 0.02 0.00 0.00 177.57 178.09 2wrf h ARG 452 N -0.42 0.09 0.00 1.57 2.43 -1.52 0.72 114.38 117.25 2wrf h ARG 452 Ca 0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2wrf h ARG 452 Cb 0.21 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 2wrf h ARG 452 CO 0.00 0.06 -0.03 -1.33 -1.51 0.00 0.00 179.97 177.16 2wrf n MET 453 N -5.14 0.06 -0.04 0.20 2.81 -0.57 -0.77 117.12 113.67 2wrf n MET 453 Ca 0.36 0.05 -0.21 0.00 -1.81 0.00 0.00 57.70 56.09 2wrf n MET 453 Cb 1.23 -1.57 -0.13 0.00 -0.71 0.00 0.00 33.22 32.04 2wrf n MET 453 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 2wrf h GLN 454 N 0.00 0.14 0.01 0.03 4.20 0.29 -3.42 115.11 116.37 2wrf h GLN 454 Ca 0.00 -0.24 -0.00 0.00 0.06 0.00 0.00 58.65 58.47 2wrf h GLN 454 Cb 0.56 0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.42 2wrf h GLN 454 CO 0.00 1.11 -0.01 -0.07 -0.67 0.00 0.00 178.83 179.20 2wrf h LEU 455 N -0.56 -0.02 0.00 1.46 4.07 -1.19 -3.43 115.31 115.64 2wrf h LEU 455 Ca -0.31 -0.66 0.00 0.00 0.08 0.00 0.00 57.88 57.00 2wrf h LEU 455 Cb 1.57 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.31 2wrf h LEU 455 CO -0.04 0.66 0.00 0.54 -1.08 0.00 0.00 178.44 178.52 2wrf n ARG 456 N -4.77 0.00 0.00 1.13 1.74 0.05 -1.86 116.66 112.94 2wrf n ARG 456 Ca -0.09 0.00 0.12 0.00 -0.77 0.00 0.00 57.85 57.12 2wrf n ARG 456 Cb 0.33 0.00 0.27 0.00 -1.02 0.00 0.00 32.46 32.04 2wrf n ARG 456 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2wrf n ASP 457 N 9.36 1.59 0.06 0.55 3.85 -1.26 -3.91 116.55 126.79 2wrf n ASP 457 Ca 0.00 -1.28 0.05 0.00 -0.71 0.00 0.00 54.79 52.85 2wrf n ASP 457 Cb 0.00 0.20 0.27 0.00 -1.35 0.00 0.00 41.12 40.24 2wrf n ASP 457 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 2wrf n ASN 458 N -0.13 0.24 -3.75 -1.12 4.13 -0.78 -4.71 115.26 109.14 2wrf n ASN 458 Ca 0.13 0.60 -0.10 0.00 1.68 0.00 0.00 54.58 56.89 2wrf n ASN 458 Cb 0.41 -0.63 -0.05 0.00 -1.54 0.00 0.00 39.78 37.96 2wrf n ASN 458 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 2wrf s VAL 459 N -3.20 0.08 0.05 2.41 -7.23 -1.25 -1.48 120.40 109.78 2wrf s VAL 459 Ca 0.01 -0.88 -0.05 0.00 -1.81 0.00 0.00 61.98 59.25 2wrf s VAL 459 Cb 0.04 -1.37 -0.05 0.00 0.56 0.00 0.00 36.38 35.57 2wrf s VAL 459 CO 0.13 -0.37 0.28 -1.59 -0.31 0.00 0.00 175.10 173.25 2wrf s LYS 460 N -3.85 3.56 -0.64 4.82 -2.85 0.53 -4.82 119.74 116.49 2wrf s LYS 460 Ca 0.06 -0.15 -0.15 0.00 -1.00 0.00 0.00 55.97 54.73 2wrf s LYS 460 Cb 0.02 -3.01 0.16 0.00 -2.06 0.00 0.00 37.83 32.94 2wrf s LYS 460 CO -0.09 0.59 0.60 -2.00 0.10 0.00 0.00 175.35 174.56 2wrf s GLU 461 N -2.14 3.21 0.62 1.78 2.12 -1.26 -0.74 118.70 122.29 2wrf s GLU 461 Ca 0.32 -1.97 0.34 0.00 0.36 0.00 0.00 54.97 54.03 2wrf s GLU 461 Cb -0.13 -4.35 1.98 0.00 0.26 0.00 0.00 34.13 31.90 2wrf s GLU 461 CO 0.21 -1.32 2.25 -0.07 -0.54 0.00 0.00 175.26 175.79 2wrf h LEU 462 N 8.52 0.00 0.00 2.70 4.07 -1.65 -3.46 115.31 125.50 2wrf h LEU 462 Ca -0.16 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.80 2wrf h LEU 462 Cb 1.08 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.82 2wrf h LEU 462 CO 0.94 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 178.91 2wrf n GLY 463 N -1.25 0.66 0.46 0.83 0.00 -1.26 -4.85 105.19 99.79 2wrf n GLY 463 Ca -0.02 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.04 2wrf n GLY 463 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2wrf n ASN 464 N 0.00 2.37 0.00 1.61 6.94 -1.26 -4.84 115.26 120.08 2wrf n ASN 464 Ca 0.00 -1.75 0.00 0.00 -0.02 0.00 0.00 54.58 52.81 2wrf n ASN 464 Cb 0.00 -0.11 0.00 0.00 -2.36 0.00 0.00 39.78 37.31 2wrf n ASN 464 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2wrf n GLY 465 N 0.41 2.64 3.87 4.83 0.00 -1.26 -4.40 105.19 111.28 2wrf n GLY 465 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 2wrf n GLY 465 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrf s PHE 467 N -1.75 2.68 -0.23 0.00 0.08 0.79 -1.54 117.98 118.01 2wrf s PHE 467 Ca 0.46 -0.25 -0.06 0.00 0.12 0.00 0.00 56.93 57.20 2wrf s PHE 467 Cb -0.12 -1.64 -0.02 0.00 -0.57 0.00 0.00 43.02 40.67 2wrf s PHE 467 CO 0.21 0.11 0.03 -2.00 -0.10 0.00 0.00 175.22 173.47 2wrf s GLU 468 N -0.58 3.60 0.09 0.44 2.12 0.08 -1.67 118.70 122.78 2wrf s GLU 468 Ca 0.08 -0.51 -0.31 0.00 0.36 0.00 0.00 54.97 54.59 2wrf s GLU 468 Cb -0.11 -3.18 -0.07 0.00 0.26 0.00 0.00 34.13 31.02 2wrf s GLU 468 CO 0.01 -0.11 1.36 -0.06 -0.54 0.00 0.00 175.26 175.92 2wrf s PHE 469 N 1.36 3.23 -0.10 5.30 0.08 -1.26 -0.35 117.98 126.24 2wrf s PHE 469 Ca 0.05 0.99 0.01 0.00 0.12 0.00 0.00 56.93 58.09 2wrf s PHE 469 Cb -0.15 -3.64 0.13 0.00 -0.57 0.00 0.00 43.02 38.80 2wrf s PHE 469 CO 0.02 -2.23 1.33 0.66 -0.10 0.00 0.00 175.22 174.90 2wrf n TYR 470 N 4.10 0.66 -3.25 0.36 4.01 -0.55 -4.87 117.16 117.61 2wrf n TYR 470 Ca 0.11 -0.90 0.00 0.00 -0.16 0.00 0.00 57.90 56.96 2wrf n TYR 470 Cb 0.43 -0.45 0.00 0.00 -0.31 0.00 0.00 39.34 39.01 2wrf n TYR 470 CO 0.00 0.00 0.00 -2.39 -0.46 0.00 0.00 176.86 174.01 2wrf n HIS 471 N 0.29 -0.12 -3.75 -0.72 1.44 -1.26 -4.53 115.22 106.57 2wrf n HIS 471 Ca 0.13 0.00 -0.37 0.00 -2.01 0.00 0.00 57.72 55.47 2wrf n HIS 471 Cb 0.71 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.76 2wrf n HIS 471 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 2wrf s LYS 472 N -0.48 3.75 -0.35 -1.40 -0.14 -1.26 -5.06 119.74 114.80 2wrf s LYS 472 Ca 0.00 -0.03 -0.00 0.00 -1.36 0.00 0.00 55.97 54.58 2wrf s LYS 472 Cb 0.00 -3.26 0.13 0.00 -1.68 0.00 0.00 37.83 33.01 2wrf s LYS 472 CO 0.00 0.62 0.18 0.00 -0.76 0.00 0.00 175.35 175.39 2wrf s ASP 474 N 1.18 0.51 0.00 0.00 3.84 -1.26 -4.50 116.67 116.44 2wrf s ASP 474 Ca 0.15 1.10 0.03 0.00 -0.00 0.00 0.00 52.55 53.82 2wrf s ASP 474 Cb -0.21 -1.66 0.15 0.00 -1.38 0.00 0.00 42.92 39.83 2wrf s ASP 474 CO -0.10 -4.43 0.51 0.47 -0.00 0.00 0.00 175.17 171.62 2wrf n ASP 475 N -5.03 0.00 -0.02 2.11 9.92 -1.26 -1.08 116.55 121.20 2wrf n ASP 475 Ca 0.08 -0.58 0.02 0.00 -0.53 0.00 0.00 54.79 53.78 2wrf n ASP 475 Cb 0.57 0.00 -0.08 0.00 -0.64 0.00 0.00 41.12 40.98 2wrf n ASP 475 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 2wrf n GLU 476 N -0.62 0.93 -0.00 -1.24 4.07 -1.26 -3.97 120.64 118.55 2wrf n GLU 476 Ca 0.02 -0.07 -0.19 0.00 -0.06 0.00 0.00 57.16 56.87 2wrf n GLU 476 Cb 0.01 -1.24 -0.14 0.00 -0.06 0.00 0.00 31.44 30.02 2wrf n GLU 476 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2wrf h MET 478 N -0.58 -0.69 0.00 0.00 2.86 -1.52 -0.17 114.93 114.84 2wrf h MET 478 Ca -0.14 0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2wrf h MET 478 Cb 1.46 0.16 0.00 0.00 0.06 0.00 0.00 31.60 33.28 2wrf h MET 478 CO 0.07 -0.46 0.47 -0.97 1.06 0.00 0.00 176.91 177.08 2wrf h ASN 479 N -0.72 0.00 0.89 1.22 -1.24 -1.70 0.51 115.58 114.53 2wrf h ASN 479 Ca -0.01 0.00 -0.21 0.00 0.71 0.00 0.00 56.30 56.79 2wrf h ASN 479 Cb 0.72 0.00 -0.03 0.00 0.73 0.00 0.00 38.32 39.73 2wrf h ASN 479 CO -0.27 0.00 -1.19 0.77 -1.29 0.00 0.00 177.43 175.46 2wrf h SER 480 N 0.00 0.00 0.00 1.15 4.64 -0.93 -1.28 113.55 117.13 2wrf h SER 480 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wrf h SER 480 Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 2wrf h SER 480 CO 0.00 0.86 -0.00 0.58 -0.87 0.00 0.00 176.83 177.40 2wrf h VAL 481 N 0.00 1.39 -0.87 0.95 2.07 -0.49 -1.77 116.25 117.53 2wrf h VAL 481 Ca -0.11 -1.16 0.01 0.00 0.82 0.00 0.00 66.70 66.25 2wrf h VAL 481 Cb 1.76 2.18 -0.04 0.00 -1.52 0.00 0.00 31.29 33.66 2wrf h VAL 481 CO 0.09 0.30 0.58 0.11 0.02 0.00 0.00 177.57 178.67 2wrf h LYS 482 N -0.50 1.15 0.00 1.57 1.57 -1.67 -1.65 116.57 117.05 2wrf h LYS 482 Ca -0.00 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2wrf h LYS 482 Cb 0.50 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.55 2wrf h LYS 482 CO 0.00 0.76 0.27 -0.97 -0.57 0.00 0.00 179.45 178.94 2wrf h ASN 483 N 1.18 0.00 0.00 0.86 -0.73 -0.97 -3.44 115.58 112.48 2wrf h ASN 483 Ca 0.32 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.49 2wrf h ASN 483 Cb -0.13 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.46 2wrf h ASN 483 CO -0.07 0.00 0.00 0.61 -0.37 0.00 0.00 177.43 177.60 2wrf n GLY 484 N -1.23 1.85 2.95 1.57 0.00 -0.62 -4.97 105.19 104.73 2wrf n GLY 484 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 2wrf n GLY 484 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wrf s THR 485 N -3.02 2.15 0.00 2.61 -4.23 -0.70 -5.01 115.64 107.45 2wrf s THR 485 Ca 0.00 -2.53 0.00 0.00 -1.18 0.00 0.00 61.69 57.98 2wrf s THR 485 Cb 0.00 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.28 2wrf s THR 485 CO 0.00 -0.68 0.00 0.00 -0.54 0.00 0.00 174.62 173.40 2wrf n TYR 486 N 3.96 0.00 -2.69 3.99 9.36 -1.23 -4.39 117.16 126.15 2wrf n TYR 486 Ca 0.04 0.00 -0.05 0.00 3.32 0.00 0.00 57.90 61.21 2wrf n TYR 486 Cb 0.39 0.00 0.05 0.00 -0.63 0.00 0.00 39.34 39.15 2wrf n TYR 486 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 2wrf n ASP 487 N 0.00 -1.91 0.22 2.98 4.64 -1.26 -5.02 116.55 116.20 2wrf n ASP 487 Ca 0.00 -2.06 0.06 0.00 -1.38 0.00 0.00 54.79 51.41 2wrf n ASP 487 Cb 0.00 1.07 0.49 0.00 -1.04 0.00 0.00 41.12 41.65 2wrf n ASP 487 CO 0.00 0.00 0.00 0.22 -0.82 0.00 0.00 177.20 176.60 2wrf h TYR 488 N 3.74 0.00 0.00 -0.67 3.20 -1.95 -2.63 116.97 118.66 2wrf h TYR 488 Ca -0.14 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.73 2wrf h TYR 488 Cb 1.15 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.42 2wrf h TYR 488 CO -0.06 0.25 0.00 -1.13 -1.64 0.00 0.00 178.16 175.58 2wrf n SER 489 N -4.03 1.30 0.00 -2.11 3.41 -1.26 -2.73 113.62 108.21 2wrf n SER 489 Ca -0.02 -1.93 0.00 0.00 -0.26 0.00 0.00 58.87 56.66 2wrf n SER 489 Cb 0.32 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 63.79 2wrf n SER 489 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2wrf n LYS 490 N 0.10 0.00 0.00 4.33 4.81 -0.99 -4.78 118.16 121.63 2wrf n LYS 490 Ca 0.00 0.00 0.01 0.00 -0.87 0.00 0.00 58.31 57.45 2wrf n LYS 490 Cb 0.28 0.00 0.07 0.00 0.02 0.00 0.00 35.03 35.41 2wrf n LYS 490 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2wrf n TYR 491 N -2.31 0.00 -0.37 5.64 4.01 -1.22 -2.59 117.16 120.32 2wrf n TYR 491 Ca 0.00 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.73 2wrf n TYR 491 Cb 0.00 0.00 0.12 0.00 -0.31 0.00 0.00 39.34 39.15 2wrf n TYR 491 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 2wrf h GLU 492 N 0.00 1.25 -6.26 -0.72 4.81 -1.78 -3.36 114.58 108.52 2wrf h GLU 492 Ca 0.00 -0.08 -0.56 0.00 -0.13 0.00 0.00 59.36 58.59 2wrf h GLU 492 Cb 0.00 -0.28 -0.09 0.00 0.63 0.00 0.00 28.75 29.01 2wrf h GLU 492 CO 0.00 0.83 1.20 -2.00 -0.73 0.00 0.00 179.01 178.31 2wrf s GLU 493 N -6.11 3.32 0.00 1.92 2.12 -1.07 -4.01 118.70 114.88 2wrf s GLU 493 Ca -0.13 -0.54 0.00 0.00 0.36 0.00 0.00 54.97 54.66 2wrf s GLU 493 Cb 0.18 -4.57 0.00 0.00 0.26 0.00 0.00 34.13 30.00 2wrf s GLU 493 CO 0.81 -2.17 0.00 -1.91 -0.54 0.00 0.00 175.26 171.46 2wrf n GLU 494 N 9.19 0.00 -1.42 4.30 4.07 -1.26 -5.11 120.64 130.42 2wrf n GLU 494 Ca 0.13 0.00 -0.44 0.00 -0.06 0.00 0.00 57.16 56.79 2wrf n GLU 494 Cb 0.50 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 31.86 2wrf n GLU 494 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 2wrf n SER 495 N 0.00 -1.19 0.00 4.31 7.64 -1.26 -4.73 113.62 118.40 2wrf n SER 495 Ca 0.00 1.00 0.00 0.00 1.01 0.00 0.00 58.87 60.88 2wrf n SER 495 Cb 0.00 -1.02 0.00 0.00 -1.01 0.00 0.00 64.21 62.18 2wrf n SER 495 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32