#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wrg s THR 6 N 0.00 0.03 0.04 -3.53 -4.23 -1.26 -5.15 115.64 101.54 2wrg s THR 6 Ca 0.00 -0.27 0.09 0.00 -1.18 0.00 0.00 61.69 60.32 2wrg s THR 6 Cb 0.00 -0.35 -0.03 0.00 1.34 0.00 0.00 72.50 73.46 2wrg s THR 6 CO 0.00 -0.15 -0.24 -0.51 -0.54 0.00 0.00 174.62 173.18 2wrg s ILE 7 N -0.51 2.34 0.04 2.99 2.07 -1.26 -5.15 121.20 121.72 2wrg s ILE 7 Ca -0.06 -1.31 0.06 0.00 -1.41 0.00 0.00 60.65 57.93 2wrg s ILE 7 Cb -0.04 -1.93 -0.02 0.00 0.13 0.00 0.00 42.46 40.60 2wrg s ILE 7 CO 0.01 0.37 -0.17 0.00 -1.91 0.00 0.00 174.94 173.24 2wrg s ILE 9 N -0.81 5.36 -0.02 0.00 1.09 -1.26 -5.09 121.20 120.46 2wrg s ILE 9 Ca 0.05 0.02 -0.29 0.00 -1.10 0.00 0.00 60.65 59.33 2wrg s ILE 9 Cb -0.08 -3.55 0.10 0.00 -1.06 0.00 0.00 42.46 37.86 2wrg s ILE 9 CO 0.01 0.34 1.30 -0.83 -0.10 0.00 0.00 174.94 175.66 2wrg s GLY 10 N -1.83 -0.20 0.12 6.18 0.00 -1.26 -5.19 107.32 105.15 2wrg s GLY 10 Ca 0.28 0.20 0.06 0.00 0.00 0.00 0.00 44.72 45.26 2wrg s GLY 10 CO 0.17 4.49 -0.15 -2.52 0.00 0.00 0.00 173.10 175.10 2wrg s TYR 11 N -2.09 1.43 0.53 1.90 -0.85 -1.26 -5.13 117.35 111.89 2wrg s TYR 11 Ca 0.26 -0.54 -0.21 0.00 -0.52 0.00 0.00 57.07 56.06 2wrg s TYR 11 Cb 0.01 -0.75 -0.06 0.00 0.38 0.00 0.00 41.96 41.54 2wrg s TYR 11 CO -0.02 0.15 1.12 1.58 -1.52 0.00 0.00 175.55 176.86 2wrg n HIS 12 N 0.57 1.44 -3.98 -3.49 -0.00 -1.26 -5.05 115.22 103.45 2wrg n HIS 12 Ca -0.16 0.46 -0.09 0.00 -0.00 0.00 0.00 57.72 57.94 2wrg n HIS 12 Cb 0.57 -2.24 -0.08 0.00 -0.00 0.00 0.00 29.99 28.23 2wrg n HIS 12 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2wrg s ALA 13 N -1.37 0.17 0.00 1.57 0.00 -1.26 -4.80 121.76 116.06 2wrg s ALA 13 Ca 0.71 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 51.71 2wrg s ALA 13 Cb -0.45 0.60 0.00 0.00 0.00 0.00 0.00 23.12 23.26 2wrg s ALA 13 CO 0.50 -0.51 0.00 0.27 0.00 0.00 0.00 175.76 176.03 2wrg n ASN 14 N -0.07 0.00 -0.46 0.00 0.23 -1.26 -5.02 115.26 108.68 2wrg n ASN 14 Ca -0.11 -0.92 0.04 0.00 -0.53 0.00 0.00 54.58 53.05 2wrg n ASN 14 Cb 0.62 0.00 0.11 0.00 -2.08 0.00 0.00 39.78 38.43 2wrg n ASN 14 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 2wrg n ASN 15 N -0.86 1.33 -4.77 0.53 6.94 -1.26 -4.79 115.26 112.38 2wrg n ASN 15 Ca 0.00 -2.02 -0.38 0.00 -0.02 0.00 0.00 54.58 52.17 2wrg n ASN 15 Cb 0.00 -0.18 -0.00 0.00 -2.36 0.00 0.00 39.78 37.24 2wrg n ASN 15 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 2wrg s SER 16 N -0.96 6.08 0.00 0.53 0.15 -1.26 -4.95 113.70 113.29 2wrg s SER 16 Ca 0.16 2.45 0.00 0.00 0.70 0.00 0.00 55.95 59.26 2wrg s SER 16 Cb 0.08 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 2wrg s SER 16 CO 0.10 -0.99 0.76 0.35 1.20 0.00 0.00 173.24 174.67 2wrg n THR 17 N -0.40 0.55 -1.59 6.45 -2.24 -1.26 -4.82 114.28 110.96 2wrg n THR 17 Ca 0.07 -0.57 -0.46 0.00 -2.27 0.00 0.00 64.05 60.82 2wrg n THR 17 Cb 0.47 0.75 -0.03 0.00 -2.10 0.00 0.00 70.33 69.42 2wrg n THR 17 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2wrg n ASP 18 N -0.27 1.51 -4.10 3.42 10.43 -1.26 -4.89 116.55 121.38 2wrg n ASP 18 Ca 0.00 1.16 -0.22 0.00 2.57 0.00 0.00 54.79 58.29 2wrg n ASP 18 Cb 0.34 -1.27 -0.15 0.00 1.84 0.00 0.00 41.12 41.87 2wrg n ASP 18 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 2wrg s THR 19 N -0.54 1.11 0.17 -3.53 -4.23 -1.26 -1.63 115.64 105.74 2wrg s THR 19 Ca 0.66 -0.60 0.09 0.00 -1.18 0.00 0.00 61.69 60.66 2wrg s THR 19 Cb -0.76 -0.93 -0.04 0.00 1.34 0.00 0.00 72.50 72.10 2wrg s THR 19 CO 0.55 0.32 -0.18 0.68 -0.54 0.00 0.00 174.62 175.45 2wrg s VAL 20 N -0.28 1.83 -0.14 2.29 -7.23 -0.70 -4.87 120.40 111.30 2wrg s VAL 20 Ca 0.04 -1.95 -0.10 0.00 -1.81 0.00 0.00 61.98 58.16 2wrg s VAL 20 Cb -0.06 -1.87 -0.05 0.00 0.56 0.00 0.00 36.38 34.96 2wrg s VAL 20 CO -0.00 -0.34 0.20 -1.81 -0.31 0.00 0.00 175.10 172.84 2wrg s ASP 21 N -2.73 6.40 0.47 4.85 1.01 -1.26 -0.93 116.67 124.47 2wrg s ASP 21 Ca 0.17 0.47 0.07 0.00 0.71 0.00 0.00 52.55 53.97 2wrg s ASP 21 Cb -0.05 -2.12 -0.00 0.00 1.01 0.00 0.00 42.92 41.75 2wrg s ASP 21 CO 0.07 0.27 0.35 0.42 0.21 0.00 0.00 175.17 176.49 2wrg s THR 22 N -0.32 2.21 0.22 -1.27 -4.23 0.22 -4.97 115.64 107.50 2wrg s THR 22 Ca 0.14 -1.47 0.02 0.00 -1.18 0.00 0.00 61.69 59.21 2wrg s THR 22 Cb -0.13 -2.67 -0.05 0.00 1.34 0.00 0.00 72.50 70.99 2wrg s THR 22 CO 0.03 0.00 1.54 1.62 -0.54 0.00 0.00 174.62 177.27 2wrg h VAL 23 N 1.00 1.37 0.00 2.29 3.04 -2.02 -3.19 116.25 118.74 2wrg h VAL 23 Ca -0.40 -1.97 0.00 0.00 -1.01 0.00 0.00 66.70 63.32 2wrg h VAL 23 Cb 1.28 1.98 0.00 0.00 -2.01 0.00 0.00 31.29 32.53 2wrg h VAL 23 CO 0.60 0.59 -0.98 0.18 -1.01 0.00 0.00 177.57 176.95 2wrg n LEU 24 N -3.88 0.82 -3.75 3.16 4.77 -1.26 -4.93 117.00 111.93 2wrg n LEU 24 Ca -0.03 0.30 -0.13 0.00 -0.03 0.00 0.00 56.01 56.12 2wrg n LEU 24 Cb 0.63 -0.07 -0.14 0.00 -2.33 0.00 0.00 43.42 41.50 2wrg n LEU 24 CO 0.45 -0.17 -0.20 -0.70 -1.33 0.00 0.00 177.39 175.45 2wrg s GLU 25 N -3.34 0.13 0.35 3.23 2.12 -1.20 -5.14 118.70 114.84 2wrg s GLU 25 Ca 0.00 0.39 -0.16 0.00 0.36 0.00 0.00 54.97 55.57 2wrg s GLU 25 Cb 0.10 -0.14 -0.09 0.00 0.26 0.00 0.00 34.13 34.26 2wrg s GLU 25 CO 0.79 -0.15 0.78 0.15 -0.54 0.00 0.00 175.26 176.29 2wrg s LYS 26 N 1.10 4.03 -0.71 4.30 1.02 -1.26 -0.61 119.74 127.60 2wrg s LYS 26 Ca -0.08 0.75 -0.04 0.00 0.02 0.00 0.00 55.97 56.61 2wrg s LYS 26 Cb -0.10 -2.37 0.01 0.00 -0.52 0.00 0.00 37.83 34.84 2wrg s LYS 26 CO -0.06 0.10 0.66 -1.71 -0.92 0.00 0.00 175.35 173.42 2wrg n ASN 27 N -0.50 -6.91 -4.49 2.83 2.85 -1.23 -4.91 115.26 102.90 2wrg n ASN 27 Ca 0.04 -0.24 -0.35 0.00 -0.11 0.00 0.00 54.58 53.93 2wrg n ASN 27 Cb 0.53 -4.15 -0.12 0.00 1.24 0.00 0.00 39.78 37.28 2wrg n ASN 27 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2wrg s VAL 28 N -2.86 4.12 0.10 3.44 1.01 -0.11 -4.90 120.40 121.20 2wrg s VAL 28 Ca 0.05 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 2wrg s VAL 28 Cb -0.01 -2.86 -0.06 0.00 0.00 0.00 0.00 36.38 33.45 2wrg s VAL 28 CO 0.80 0.44 1.09 -0.89 0.00 0.00 0.00 175.10 176.53 2wrg s THR 29 N 0.83 4.20 0.14 3.92 2.01 -1.26 -1.72 115.64 123.75 2wrg s THR 29 Ca 0.01 1.72 0.06 0.00 0.31 0.00 0.00 61.69 63.78 2wrg s THR 29 Cb -0.14 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.23 2wrg s THR 29 CO 0.02 0.21 -0.13 0.68 -0.69 0.00 0.00 174.62 174.72 2wrg s VAL 30 N 0.43 1.30 0.26 3.82 -7.23 -0.64 -0.84 120.40 117.49 2wrg s VAL 30 Ca 0.52 -1.87 0.03 0.00 -1.81 0.00 0.00 61.98 58.85 2wrg s VAL 30 Cb -0.27 -1.67 0.01 0.00 0.56 0.00 0.00 36.38 35.02 2wrg s VAL 30 CO 0.31 -0.54 1.64 0.71 -0.31 0.00 0.00 175.10 176.90 2wrg h THR 31 N 3.20 1.31 -3.66 5.32 1.35 -1.17 -3.38 112.91 115.87 2wrg h THR 31 Ca -0.38 -1.59 -0.11 0.00 -0.55 0.00 0.00 66.41 63.78 2wrg h THR 31 Cb 1.20 1.65 -0.17 0.00 -1.73 0.00 0.00 68.15 69.10 2wrg h THR 31 CO 0.56 0.49 -0.42 -1.00 -0.25 0.00 0.00 175.52 174.89 2wrg s HIS 32 N -4.15 0.11 0.19 4.73 3.76 -1.26 -4.77 115.29 113.89 2wrg s HIS 32 Ca -0.06 -0.39 -0.23 0.00 -0.15 0.00 0.00 55.06 54.23 2wrg s HIS 32 Cb 0.13 -0.06 0.05 0.00 1.11 0.00 0.00 32.58 33.81 2wrg s HIS 32 CO 0.80 -0.44 0.70 -1.54 -0.85 0.00 0.00 174.74 173.41 2wrg s SER 33 N -2.25 -0.40 0.19 1.40 1.04 -1.26 -1.37 113.70 111.05 2wrg s SER 33 Ca -0.03 -0.27 0.09 0.00 0.48 0.00 0.00 55.95 56.22 2wrg s SER 33 Cb 0.00 0.63 -0.04 0.00 0.10 0.00 0.00 66.02 66.70 2wrg s SER 33 CO -0.05 -1.09 -0.18 0.68 0.98 0.00 0.00 173.24 173.58 2wrg s VAL 34 N -3.73 1.91 -0.06 5.02 -7.23 -0.09 -4.85 120.40 111.37 2wrg s VAL 34 Ca 0.06 -2.04 -0.12 0.00 -1.81 0.00 0.00 61.98 58.07 2wrg s VAL 34 Cb -0.03 -1.95 -0.05 0.00 0.56 0.00 0.00 36.38 34.91 2wrg s VAL 34 CO -0.04 -0.37 0.30 0.21 -0.31 0.00 0.00 175.10 174.89 2wrg s ASN 35 N -2.90 6.63 0.00 4.85 3.04 -1.26 -0.47 114.94 124.83 2wrg s ASN 35 Ca 0.19 0.75 0.08 0.00 0.04 0.00 0.00 52.86 53.92 2wrg s ASN 35 Cb -0.05 -2.18 -0.09 0.00 -1.54 0.00 0.00 41.25 37.40 2wrg s ASN 35 CO 0.08 0.34 0.36 0.18 -3.04 0.00 0.00 177.10 175.02 2wrg n LEU 36 N 1.99 0.42 -4.37 3.21 4.77 -0.63 -4.94 117.00 117.46 2wrg n LEU 36 Ca -0.16 -0.51 -0.36 0.00 -0.03 0.00 0.00 56.01 54.95 2wrg n LEU 36 Cb 0.53 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.49 2wrg n LEU 36 CO 0.35 0.10 -0.34 -0.22 -1.33 0.00 0.00 177.39 175.95 2wrg s LEU 37 N -2.36 3.12 -0.24 2.23 2.96 -1.25 -2.87 118.68 120.27 2wrg s LEU 37 Ca 0.03 -0.31 -0.28 0.00 -0.22 0.00 0.00 54.13 53.35 2wrg s LEU 37 Cb 0.06 -1.81 0.01 0.00 0.50 0.00 0.00 46.19 44.95 2wrg s LEU 37 CO 0.34 -0.02 1.00 -0.70 -1.32 0.00 0.00 176.35 175.64 2wrg s GLU 38 N 1.51 4.24 -0.08 1.98 2.56 0.18 -4.90 118.70 124.19 2wrg s GLU 38 Ca 0.06 1.27 0.14 0.00 0.00 0.00 0.00 54.97 56.43 2wrg s GLU 38 Cb -0.15 -3.64 0.28 0.00 2.00 0.00 0.00 34.13 32.62 2wrg s GLU 38 CO -0.00 -0.62 1.13 -0.40 -0.56 0.00 0.00 175.26 174.81 2wrg n ASP 39 N 6.28 1.26 -4.00 -1.70 5.68 -1.26 -1.88 116.55 120.93 2wrg n ASP 39 Ca 0.11 -2.75 -0.23 0.00 -0.50 0.00 0.00 54.79 51.42 2wrg n ASP 39 Cb 0.46 -0.36 -0.16 0.00 -1.14 0.00 0.00 41.12 39.92 2wrg n ASP 39 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 2wrg s SER 40 N -2.27 1.51 0.53 -1.12 0.01 -1.26 -4.95 113.70 106.14 2wrg s SER 40 Ca 0.26 -0.25 0.05 0.00 1.31 0.00 0.00 55.95 57.32 2wrg s SER 40 Cb 0.26 -0.65 0.02 0.00 0.21 0.00 0.00 66.02 65.86 2wrg s SER 40 CO -0.05 0.03 0.33 -1.38 0.41 0.00 0.00 173.24 172.58 2wrg s HIS 41 N 0.60 1.76 -0.10 2.43 -3.43 -1.26 -4.69 115.29 110.60 2wrg s HIS 41 Ca -0.12 -0.83 0.15 0.00 -0.80 0.00 0.00 55.06 53.47 2wrg s HIS 41 Cb -0.14 -1.88 -0.23 0.00 -1.43 0.00 0.00 32.58 28.90 2wrg s HIS 41 CO 0.02 -0.32 0.49 -1.71 -2.00 0.00 0.00 174.74 171.23 2wrg n ASN 42 N -1.65 0.57 0.00 7.38 2.85 -0.10 -4.95 115.26 119.35 2wrg n ASN 42 Ca -0.04 0.27 0.00 0.00 -0.11 0.00 0.00 54.58 54.70 2wrg n ASN 42 Cb 0.65 0.37 0.00 0.00 1.24 0.00 0.00 39.78 42.04 2wrg n ASN 42 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2wrg n GLY 44 N 1.58 1.18 3.08 8.20 0.00 -1.26 -4.87 105.19 113.12 2wrg n GLY 44 Ca -0.20 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.63 2wrg n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wrg s LYS 45 N -0.57 0.78 -0.47 1.61 1.02 -1.26 -4.32 119.74 116.54 2wrg s LYS 45 Ca 0.00 -0.60 -0.28 0.00 0.02 0.00 0.00 55.97 55.11 2wrg s LYS 45 Cb 0.00 -0.74 0.03 0.00 -0.52 0.00 0.00 37.83 36.60 2wrg s LYS 45 CO 0.00 0.18 1.06 -0.51 -0.92 0.00 0.00 175.35 175.16 2wrg s LEU 46 N -0.89 3.78 0.58 3.17 1.43 -0.39 -1.85 118.68 124.51 2wrg s LEU 46 Ca 0.00 0.36 0.09 0.00 -1.03 0.00 0.00 54.13 53.55 2wrg s LEU 46 Cb -0.07 -3.42 0.08 0.00 0.03 0.00 0.00 46.19 42.82 2wrg s LEU 46 CO 0.01 -1.17 0.72 0.00 0.23 0.00 0.00 176.35 176.14 2wrg s LYS 48 N -4.60 4.30 -0.32 0.00 1.02 0.80 -4.59 119.74 116.35 2wrg s LYS 48 Ca 0.56 1.64 0.01 0.00 0.02 0.00 0.00 55.97 58.20 2wrg s LYS 48 Cb -0.05 -2.76 0.08 0.00 -0.52 0.00 0.00 37.83 34.58 2wrg s LYS 48 CO 0.35 -0.05 0.02 -1.17 -0.92 0.00 0.00 175.35 173.58 2wrg s LEU 49 N -2.24 4.28 -0.40 3.17 2.96 0.53 -2.28 118.68 124.69 2wrg s LEU 49 Ca 0.53 -1.72 -0.02 0.00 -0.22 0.00 0.00 54.13 52.70 2wrg s LEU 49 Cb -0.26 -1.66 0.00 0.00 0.50 0.00 0.00 46.19 44.77 2wrg s LEU 49 CO 0.33 -0.33 0.35 1.17 -1.32 0.00 0.00 176.35 176.55 2wrg n LYS 49 N 4.44 -2.35 0.00 1.98 0.00 -1.25 -3.32 118.16 117.66 2wrg n LYS 49 Ca -0.06 0.26 0.00 0.00 0.00 0.00 0.00 58.31 58.50 2wrg n LYS 49 Cb 0.42 -3.54 0.00 0.00 0.00 0.00 0.00 35.03 31.92 2wrg n LYS 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2wrg n GLY 50 N -0.98 2.66 3.94 3.14 0.00 -1.26 -4.99 105.19 107.69 2wrg n GLY 50 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 2wrg n GLY 50 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wrg s ILE 51 N -0.75 5.27 0.30 -0.61 1.01 -1.21 -5.00 121.20 120.21 2wrg s ILE 51 Ca 0.00 -0.63 -0.00 0.00 0.00 0.00 0.00 60.65 60.02 2wrg s ILE 51 Cb 0.00 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.67 2wrg s ILE 51 CO 0.00 -0.17 0.50 0.00 0.00 0.00 0.00 174.94 175.27 2wrg s ALA 52 N -1.83 3.74 0.53 9.38 0.00 -1.26 -0.34 121.76 131.97 2wrg s ALA 52 Ca 0.36 -0.88 -0.19 0.00 0.00 0.00 0.00 51.96 51.25 2wrg s ALA 52 Cb -0.11 -2.07 -0.06 0.00 0.00 0.00 0.00 23.12 20.88 2wrg s ALA 52 CO 0.29 0.13 1.09 -1.25 0.00 0.00 0.00 175.76 176.02 2wrg s PRO 53 N -3.98 3.49 -0.03 0.00 0.04 -1.26 -2.37 135.00 130.90 2wrg s PRO 53 Ca 0.40 1.46 -0.30 0.00 0.04 0.00 0.00 61.00 62.60 2wrg s PRO 53 Cb -0.10 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 2wrg s PRO 53 CO 0.33 -0.71 1.19 -1.17 0.04 0.00 0.00 177.00 176.68 2wrg s LEU 54 N -3.81 4.30 -0.05 -3.56 2.96 -0.31 -4.91 118.68 113.30 2wrg s LEU 54 Ca 0.69 1.85 -0.02 0.00 -0.22 0.00 0.00 54.13 56.43 2wrg s LEU 54 Cb -0.20 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 2wrg s LEU 54 CO 0.26 -0.55 0.07 -1.10 -1.32 0.00 0.00 176.35 173.71 2wrg s GLN 55 N 1.92 3.11 0.00 1.98 -0.21 -1.26 -1.19 119.66 124.01 2wrg s GLN 55 Ca 0.56 -0.39 0.04 0.00 0.02 0.00 0.00 55.36 55.60 2wrg s GLN 55 Cb -0.26 -2.90 -0.00 0.00 1.00 0.00 0.00 33.01 30.85 2wrg s GLN 55 CO 0.24 0.69 0.43 1.28 -2.12 0.00 0.00 175.29 175.81 2wrg n LEU 56 N 1.66 0.85 0.00 2.90 4.77 -1.24 -4.97 117.00 120.96 2wrg n LEU 56 Ca -0.16 -0.77 0.00 0.00 -0.03 0.00 0.00 56.01 55.05 2wrg n LEU 56 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 2wrg n LEU 56 CO 0.33 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 2wrg n GLY 57 N 0.65 3.83 0.38 -0.72 0.00 -1.26 -1.81 105.19 106.26 2wrg n GLY 57 Ca 0.02 0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.21 2wrg n GLY 57 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2wrg n LYS 58 N 12.89 1.30 -3.96 1.61 0.00 -1.24 -4.30 118.16 124.47 2wrg n LYS 58 Ca 0.00 -0.77 -0.28 0.00 -0.00 0.00 0.00 58.31 57.27 2wrg n LYS 58 Cb 0.00 -1.48 -0.04 0.00 -0.00 0.00 0.00 35.03 33.51 2wrg n LYS 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2wrg s ASN 60 N -2.98 5.24 0.34 0.00 2.20 -0.85 -4.66 114.94 114.22 2wrg s ASN 60 Ca 0.34 -0.67 0.13 0.00 -0.94 0.00 0.00 52.86 51.72 2wrg s ASN 60 Cb -0.12 -0.48 1.05 0.00 -2.00 0.00 0.00 41.25 39.71 2wrg s ASN 60 CO 0.27 -0.77 1.66 0.40 -2.94 0.00 0.00 177.10 175.72 2wrg h ILE 61 N 0.81 0.28 0.13 0.54 1.08 -1.94 -1.06 117.51 117.36 2wrg h ILE 61 Ca -0.40 -0.10 -0.01 0.00 -0.39 0.00 0.00 64.86 63.97 2wrg h ILE 61 Cb 1.27 -0.03 0.00 0.00 -3.07 0.00 0.00 36.82 34.99 2wrg h ILE 61 CO 0.52 0.05 -0.06 0.00 -0.69 0.00 0.00 178.15 177.97 2wrg h ALA 62 N 1.85 -0.17 -0.90 1.87 0.00 -1.94 -1.45 119.26 118.52 2wrg h ALA 62 Ca 0.72 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.48 2wrg h ALA 62 Cb 1.63 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.44 2wrg h ALA 62 CO -0.63 -0.48 0.49 0.78 0.00 0.00 0.00 179.25 179.42 2wrg h GLY 63 N -0.40 1.34 1.29 0.00 0.00 -1.37 0.23 103.07 104.16 2wrg h GLY 63 Ca -0.02 -0.61 -0.15 0.00 0.00 0.00 0.00 47.33 46.56 2wrg h GLY 63 CO 0.03 0.58 -0.38 -0.25 0.00 0.00 0.00 176.54 176.52 2wrg h TRP 64 N 1.26 0.93 -0.02 5.60 7.01 -1.31 0.67 115.95 130.09 2wrg h TRP 64 Ca 0.32 -0.27 -0.01 0.00 2.11 0.00 0.00 58.89 61.04 2wrg h TRP 64 Cb 0.02 -0.20 -0.00 0.00 -2.10 0.00 0.00 29.16 26.88 2wrg h TRP 64 CO 0.01 1.04 -0.02 -0.07 -2.79 0.00 0.00 178.44 176.61 2wrg h LEU 65 N 0.64 0.05 -1.28 0.65 3.38 -0.84 -3.28 115.31 114.63 2wrg h LEU 65 Ca 0.06 -0.52 -0.06 0.00 0.09 0.00 0.00 57.88 57.44 2wrg h LEU 65 Cb 0.93 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.66 2wrg h LEU 65 CO 0.09 0.56 -0.29 -0.07 0.09 0.00 0.00 178.44 178.81 2wrg h LEU 66 N -0.46 0.00 -0.76 1.67 3.38 -0.56 -3.46 115.31 115.12 2wrg h LEU 66 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2wrg h LEU 66 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 2wrg h LEU 66 CO 0.01 0.29 0.00 0.61 0.09 0.00 0.00 178.44 179.44 2wrg n GLY 67 N -0.17 0.87 3.54 0.83 0.00 0.01 -2.68 105.19 107.60 2wrg n GLY 67 Ca -0.01 -0.40 -0.47 0.00 0.00 0.00 0.00 46.02 45.14 2wrg n GLY 67 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wrg n ASN 68 N 0.63 0.69 0.00 1.61 2.85 0.01 0.26 115.26 121.31 2wrg n ASN 68 Ca 0.00 1.16 0.01 0.00 -0.11 0.00 0.00 54.58 55.64 2wrg n ASN 68 Cb 0.31 -1.18 0.05 0.00 1.24 0.00 0.00 39.78 40.21 2wrg n ASN 68 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 2wrg n PRO 69 N 1.07 0.02 0.00 1.20 -0.02 -1.26 -1.64 135.00 134.37 2wrg n PRO 69 Ca 0.13 0.35 0.11 0.00 -2.02 0.00 0.00 63.50 62.07 2wrg n PRO 69 Cb 0.28 -1.50 0.12 0.00 -0.02 0.00 0.00 33.50 32.38 2wrg n PRO 69 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2wrg n GLU 70 N -1.37 0.03 -1.90 -0.52 -0.58 -1.26 -4.38 120.64 110.65 2wrg n GLU 70 Ca 0.01 -0.02 -0.37 0.00 -0.42 0.00 0.00 57.16 56.36 2wrg n GLU 70 Cb 0.02 -1.50 0.04 0.00 -0.57 0.00 0.00 31.44 29.43 2wrg n GLU 70 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wrg n ASP 72 N -0.59 0.69 -0.10 0.00 8.00 -1.26 -4.18 116.55 119.10 2wrg n ASP 72 Ca 0.53 0.14 -0.21 0.00 0.71 0.00 0.00 54.79 55.96 2wrg n ASP 72 Cb 0.37 0.08 -0.12 0.00 -0.02 0.00 0.00 41.12 41.44 2wrg n ASP 72 CO 0.00 0.00 0.00 0.17 -0.39 0.00 0.00 177.20 176.98 2wrg h LEU 73 N 0.00 0.00 -0.47 0.64 -0.00 -1.96 -3.36 115.31 110.16 2wrg h LEU 73 Ca 0.00 -0.53 0.00 0.00 -0.00 0.00 0.00 57.88 57.35 2wrg h LEU 73 Cb 0.73 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.39 2wrg h LEU 73 CO 0.00 1.46 0.00 0.00 -0.00 0.00 0.00 178.44 179.90 2wrg n LEU 74 N -4.44 0.23 -2.19 0.17 -0.00 -1.26 -4.05 117.00 105.46 2wrg n LEU 74 Ca -0.31 -0.11 -0.01 0.00 -0.00 0.00 0.00 56.01 55.57 2wrg n LEU 74 Cb 0.67 -0.11 -0.02 0.00 -0.00 0.00 0.00 43.42 43.95 2wrg n LEU 74 CO 0.19 0.06 0.51 0.18 -0.00 0.00 0.00 177.39 178.33 2wrg n LEU 75 N -0.14 1.08 -3.53 1.47 4.77 -1.26 -4.51 117.00 114.89 2wrg n LEU 75 Ca 0.00 -0.81 -0.24 0.00 -0.03 0.00 0.00 56.01 54.93 2wrg n LEU 75 Cb 0.06 -0.27 -0.14 0.00 -2.33 0.00 0.00 43.42 40.74 2wrg n LEU 75 CO 0.00 0.06 -0.28 0.42 -1.33 0.00 0.00 177.39 176.26 2wrg s THR 76 N 2.17 -0.18 0.20 -5.08 -4.23 -1.26 -5.11 115.64 102.14 2wrg s THR 76 Ca 0.08 -0.39 -0.23 0.00 -1.18 0.00 0.00 61.69 59.97 2wrg s THR 76 Cb 0.04 -0.79 0.05 0.00 1.34 0.00 0.00 72.50 73.14 2wrg s THR 76 CO 0.00 -0.44 0.69 0.00 -0.54 0.00 0.00 174.62 174.33 2wrg s ALA 77 N 2.20 -1.46 0.00 3.99 0.00 -1.26 -4.94 121.76 120.29 2wrg s ALA 77 Ca 0.06 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.20 2wrg s ALA 77 Cb -0.16 0.83 0.00 0.00 0.00 0.00 0.00 23.12 23.79 2wrg s ALA 77 CO -0.22 -0.89 0.00 -1.13 0.00 0.00 0.00 175.76 173.51 2wrg n SER 78 N -0.41 0.00 0.00 0.00 3.41 -1.26 -4.97 113.62 110.38 2wrg n SER 78 Ca -0.10 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.51 2wrg n SER 78 Cb 0.62 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 2wrg n SER 78 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2wrg n SER 79 N -0.34 0.00 -3.98 4.04 2.88 -1.24 -2.81 113.62 112.16 2wrg n SER 79 Ca 0.00 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.45 2wrg n SER 79 Cb 0.00 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.36 2wrg n SER 79 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2wrg s TRP 80 N 0.00 0.28 -0.15 0.66 -2.14 -0.96 -4.67 118.94 111.96 2wrg s TRP 80 Ca 0.00 -0.61 0.19 0.00 2.66 0.00 0.00 56.10 58.34 2wrg s TRP 80 Cb 0.00 -0.21 -0.12 0.00 -3.10 0.00 0.00 33.47 30.04 2wrg s TRP 80 CO 0.00 -0.28 0.84 -1.13 -2.66 0.00 0.00 176.95 173.72 2wrg n SER 81 N 1.08 0.79 -3.71 -2.66 3.41 -1.00 -2.09 113.62 109.44 2wrg n SER 81 Ca -0.21 0.34 -0.04 0.00 -0.26 0.00 0.00 58.87 58.70 2wrg n SER 81 Cb 0.57 0.35 -0.01 0.00 -0.26 0.00 0.00 64.21 64.85 2wrg n SER 81 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2wrg s TYR 82 N -3.05 -0.16 -0.01 7.33 -0.85 -1.20 -4.50 117.35 114.92 2wrg s TYR 82 Ca -0.03 -0.11 0.02 0.00 -0.52 0.00 0.00 57.07 56.43 2wrg s TYR 82 Cb 0.09 0.62 -0.03 0.00 0.38 0.00 0.00 41.96 43.02 2wrg s TYR 82 CO 0.81 -0.76 -0.04 0.42 -1.52 0.00 0.00 175.55 174.46 2wrg s ILE 83 N -3.22 3.87 -0.12 -3.49 1.01 -1.19 -1.16 121.20 116.91 2wrg s ILE 83 Ca 0.11 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 60.11 2wrg s ILE 83 Cb -0.01 -2.69 -0.01 0.00 0.01 0.00 0.00 42.46 39.76 2wrg s ILE 83 CO 0.00 0.41 -0.16 -0.69 0.00 0.00 0.00 174.94 174.51 2wrg s VAL 84 N -1.01 2.80 0.20 2.92 1.01 -0.33 -1.37 120.40 124.62 2wrg s VAL 84 Ca 0.17 -0.75 0.11 0.00 0.00 0.00 0.00 61.98 61.51 2wrg s VAL 84 Cb -0.11 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 2wrg s VAL 84 CO 0.08 0.53 -0.19 -1.61 0.00 0.00 0.00 175.10 173.91 2wrg s GLU 85 N 0.32 1.71 0.40 2.72 2.02 -0.88 -3.72 118.70 121.26 2wrg s GLU 85 Ca -0.12 -1.49 0.04 0.00 0.02 0.00 0.00 54.97 53.42 2wrg s GLU 85 Cb -0.16 -1.93 -0.05 0.00 0.10 0.00 0.00 34.13 32.09 2wrg s GLU 85 CO 0.06 0.40 0.05 0.95 0.02 0.00 0.00 175.26 176.74 2wrg s THR 86 N -1.81 1.29 0.56 3.63 -4.23 -1.26 -1.28 115.64 112.54 2wrg s THR 86 Ca 0.23 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.99 2wrg s THR 86 Cb -0.08 -2.63 0.32 0.00 1.34 0.00 0.00 72.50 71.46 2wrg s THR 86 CO 0.12 0.00 2.19 0.28 -0.54 0.00 0.00 174.62 176.68 2wrg h SER 87 N 1.80 0.00 -2.29 3.99 0.02 -1.94 -2.97 113.55 112.15 2wrg h SER 87 Ca -0.41 0.00 -0.74 0.00 -0.84 0.00 0.00 61.79 59.80 2wrg h SER 87 Cb 1.26 0.00 -0.32 0.00 0.14 0.00 0.00 62.40 63.48 2wrg h SER 87 CO 0.71 0.00 0.47 0.59 -1.14 0.00 0.00 176.83 177.46 2wrg n ASN 88 N -4.13 6.35 -3.19 3.07 3.02 -1.26 -4.76 115.26 114.36 2wrg n ASN 88 Ca -0.02 -3.67 -0.21 0.00 -0.03 0.00 0.00 54.58 50.64 2wrg n ASN 88 Cb 0.12 -0.97 -0.05 0.00 -0.61 0.00 0.00 39.78 38.27 2wrg n ASN 88 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2wrg n SER 89 N -0.03 0.75 -0.06 6.41 2.88 -1.12 -3.58 113.62 118.86 2wrg n SER 89 Ca 0.41 -2.90 0.04 0.00 -1.33 0.00 0.00 58.87 55.09 2wrg n SER 89 Cb 0.31 -0.63 -0.04 0.00 -0.75 0.00 0.00 64.21 63.10 2wrg n SER 89 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2wrg n GLU 90 N 0.79 3.41 -2.29 -1.46 0.00 -0.76 -4.15 120.64 116.17 2wrg n GLU 90 Ca 0.24 -0.17 -0.42 0.00 0.00 0.00 0.00 57.16 56.80 2wrg n GLU 90 Cb 0.58 -0.98 -0.02 0.00 0.00 0.00 0.00 31.44 31.02 2wrg n GLU 90 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.13 176.33 2wrg s ASN 91 N -1.72 6.10 0.00 -1.84 0.02 -0.79 -4.78 114.94 111.93 2wrg s ASN 91 Ca 0.05 0.64 0.00 0.00 -1.02 0.00 0.00 52.86 52.52 2wrg s ASN 91 Cb 0.07 -2.54 0.00 0.00 0.02 0.00 0.00 41.25 38.80 2wrg s ASN 91 CO 0.34 -1.66 0.00 0.61 0.02 0.00 0.00 177.10 176.41 2wrg n GLY 92 N 5.25 2.56 3.55 0.66 0.00 -1.26 -2.01 105.19 113.95 2wrg n GLY 92 Ca 0.16 -0.28 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 2wrg n GLY 92 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wrg s THR 93 N 1.78 3.71 -0.03 2.61 2.01 -1.26 -4.13 115.64 120.33 2wrg s THR 93 Ca 0.00 0.11 -0.14 0.00 0.31 0.00 0.00 61.69 61.97 2wrg s THR 93 Cb 0.00 -4.81 -0.32 0.00 0.01 0.00 0.00 72.50 67.38 2wrg s THR 93 CO 0.00 -1.74 0.78 0.00 -0.69 0.00 0.00 174.62 172.96 2wrg s TYR 95 N -2.56 3.40 0.51 0.00 5.04 -1.26 -4.73 117.35 117.75 2wrg s TYR 95 Ca -0.14 1.51 -0.23 0.00 -2.44 0.00 0.00 57.07 55.77 2wrg s TYR 95 Cb 0.04 -3.24 -0.06 0.00 0.35 0.00 0.00 41.96 39.05 2wrg s TYR 95 CO 0.87 -0.40 1.39 -1.25 -1.34 0.00 0.00 175.55 174.82 2wrg s PRO 96 N 2.82 3.32 0.00 4.97 0.04 -1.26 -4.69 135.00 140.20 2wrg s PRO 96 Ca 0.45 2.31 0.00 0.00 0.04 0.00 0.00 61.00 63.80 2wrg s PRO 96 Cb -0.16 -2.39 0.00 0.00 0.04 0.00 0.00 34.50 31.99 2wrg s PRO 96 CO 0.10 -1.07 0.00 0.41 0.04 0.00 0.00 177.00 176.48 2wrg n GLY 97 N 0.67 -0.51 3.59 0.56 0.00 -1.26 -0.64 105.19 107.60 2wrg n GLY 97 Ca 0.09 -1.41 -0.34 0.00 0.00 0.00 0.00 46.02 44.36 2wrg n GLY 97 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wrg s ASP 98 N 0.00 5.18 -0.44 1.61 1.11 -1.22 -4.91 116.67 118.00 2wrg s ASP 98 Ca 0.00 0.01 -0.20 0.00 0.18 0.00 0.00 52.55 52.54 2wrg s ASP 98 Cb 0.00 -1.77 0.02 0.00 1.07 0.00 0.00 42.92 42.24 2wrg s ASP 98 CO 0.00 0.22 0.57 0.12 1.18 0.00 0.00 175.17 177.27 2wrg s PHE 99 N 0.05 3.10 0.13 4.23 5.99 -1.26 -1.19 117.98 129.04 2wrg s PHE 99 Ca 0.02 -0.18 -0.31 0.00 0.00 0.00 0.00 56.93 56.47 2wrg s PHE 99 Cb -0.13 -3.20 -0.08 0.00 0.00 0.00 0.00 43.02 39.61 2wrg s PHE 99 CO 0.02 -0.82 1.31 0.42 -0.00 0.00 0.00 175.22 176.15 2wrg s ILE 100 N 2.59 3.46 -1.39 3.12 1.09 -0.74 -3.30 121.20 126.03 2wrg s ILE 100 Ca 0.19 1.10 -0.07 0.00 -1.10 0.00 0.00 60.65 60.77 2wrg s ILE 100 Cb -0.15 -3.71 0.03 0.00 -1.06 0.00 0.00 42.46 37.58 2wrg s ILE 100 CO 0.17 0.12 0.96 0.47 -0.10 0.00 0.00 174.94 176.55 2wrg n ASP 101 N 3.44 -3.80 -0.03 3.58 8.00 -1.26 -4.70 116.55 121.78 2wrg n ASP 101 Ca 0.09 -0.72 -0.13 0.00 0.71 0.00 0.00 54.79 54.75 2wrg n ASP 101 Cb 0.43 -4.36 -0.08 0.00 -0.02 0.00 0.00 41.12 37.10 2wrg n ASP 101 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2wrg h TYR 102 N -2.15 0.18 -0.42 1.24 3.20 -1.97 -2.45 116.97 114.61 2wrg h TYR 102 Ca -0.59 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.23 2wrg h TYR 102 Cb 1.37 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 39.57 2wrg h TYR 102 CO 0.51 0.51 0.22 0.93 -1.64 0.00 0.00 178.16 178.69 2wrg h GLU 103 N -0.20 0.57 -0.33 1.82 3.07 -1.90 -0.69 114.58 116.92 2wrg h GLU 103 Ca 0.02 -0.05 -0.06 0.00 -0.50 0.00 0.00 59.36 58.77 2wrg h GLU 103 Cb 0.46 -0.12 -0.01 0.00 -0.84 0.00 0.00 28.75 28.24 2wrg h GLU 103 CO 0.01 0.43 -0.02 0.93 -1.40 0.00 0.00 179.01 178.96 2wrg h GLU 104 N 0.58 0.60 -0.34 2.33 4.39 -1.92 -1.22 114.58 119.00 2wrg h GLU 104 Ca 0.15 -0.20 -0.00 0.00 0.34 0.00 0.00 59.36 59.64 2wrg h GLU 104 Cb 0.03 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.62 2wrg h GLU 104 CO -0.02 0.74 0.20 1.25 -1.16 0.00 0.00 179.01 180.02 2wrg h LEU 105 N 0.40 0.42 -1.11 1.33 5.85 -0.92 -0.21 115.31 121.06 2wrg h LEU 105 Ca 0.09 -0.07 0.09 0.00 0.84 0.00 0.00 57.88 58.83 2wrg h LEU 105 Cb 0.48 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.34 2wrg h LEU 105 CO 0.02 0.36 0.61 0.03 -0.34 0.00 0.00 178.44 179.12 2wrg h ARG 106 N 0.44 0.96 -0.33 1.25 3.08 -1.06 -1.12 114.38 117.60 2wrg h ARG 106 Ca 0.12 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 60.03 2wrg h ARG 106 Cb 0.03 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 2wrg h ARG 106 CO -0.02 0.64 -0.12 1.49 -1.07 0.00 0.00 179.97 180.89 2wrg h GLU 107 N 0.99 0.67 -0.66 0.04 4.57 -0.52 -2.95 114.58 116.71 2wrg h GLU 107 Ca 0.43 -0.27 -0.07 0.00 -1.18 0.00 0.00 59.36 58.27 2wrg h GLU 107 Cb 0.34 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.88 2wrg h GLU 107 CO -0.19 0.86 0.15 1.96 -1.18 0.00 0.00 179.01 180.61 2wrg h GLN 108 N 0.44 1.07 -0.00 1.92 1.08 -0.29 -2.96 115.11 116.37 2wrg h GLN 108 Ca 0.08 -0.26 0.00 0.00 -1.45 0.00 0.00 58.65 57.02 2wrg h GLN 108 Cb 0.63 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 2wrg h GLN 108 CO 0.04 0.96 -0.01 1.28 -0.95 0.00 0.00 178.83 180.15 2wrg n LEU 109 N -4.28 0.34 0.25 1.46 4.32 -0.49 -4.28 117.00 114.32 2wrg n LEU 109 Ca 0.04 -0.08 0.14 0.00 -0.02 0.00 0.00 56.01 56.10 2wrg n LEU 109 Cb 0.26 -0.03 0.83 0.00 -1.62 0.00 0.00 43.42 42.85 2wrg n LEU 109 CO 0.42 0.06 1.12 0.77 -1.22 0.00 0.00 177.39 178.54 2wrg h SER 110 N 0.51 0.00 -4.35 -1.43 4.64 -1.34 -3.40 113.55 108.19 2wrg h SER 110 Ca 0.00 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.13 2wrg h SER 110 Cb 0.15 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 61.99 2wrg h SER 110 CO 0.00 0.00 -0.65 -0.94 -0.87 0.00 0.00 176.83 174.37 2wrg s SER 111 N -6.26 0.06 -0.08 4.97 1.04 -1.26 -3.24 113.70 108.93 2wrg s SER 111 Ca -0.05 -0.16 -0.20 0.00 0.48 0.00 0.00 55.95 56.02 2wrg s SER 111 Cb 0.16 0.11 0.04 0.00 0.10 0.00 0.00 66.02 66.44 2wrg s SER 111 CO 0.58 -0.17 0.48 -0.69 0.98 0.00 0.00 173.24 174.42 2wrg s VAL 112 N -0.69 0.02 0.00 5.02 1.01 -0.89 -0.03 120.40 124.84 2wrg s VAL 112 Ca -0.08 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 61.72 2wrg s VAL 112 Cb -0.05 -0.75 0.00 0.00 0.00 0.00 0.00 36.38 35.58 2wrg s VAL 112 CO -0.00 -0.10 0.00 -1.54 0.00 0.00 0.00 175.10 173.46 2wrg n SER 113 N 1.71 0.00 -4.46 3.32 3.41 -0.04 -2.27 113.62 115.28 2wrg n SER 113 Ca -0.18 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 57.99 2wrg n SER 113 Cb 0.56 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.45 2wrg n SER 113 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2wrg s SER 114 N -1.00 6.25 -0.30 4.04 0.01 -1.26 -3.67 113.70 117.76 2wrg s SER 114 Ca 0.00 -0.77 0.03 0.00 1.31 0.00 0.00 55.95 56.52 2wrg s SER 114 Cb 0.00 -2.30 0.08 0.00 0.21 0.00 0.00 66.02 64.01 2wrg s SER 114 CO 0.00 -0.89 -0.02 0.12 0.41 0.00 0.00 173.24 172.87 2wrg s PHE 115 N 2.74 3.41 -0.14 2.43 2.19 -1.12 -3.13 117.98 124.35 2wrg s PHE 115 Ca 0.17 -2.62 -0.02 0.00 0.33 0.00 0.00 56.93 54.80 2wrg s PHE 115 Cb -0.18 -2.41 -0.02 0.00 -1.31 0.00 0.00 43.02 39.10 2wrg s PHE 115 CO 0.14 -0.91 -0.08 -1.21 1.83 0.00 0.00 175.22 174.99 2wrg s GLU 116 N 1.04 3.53 -0.09 10.12 8.01 -0.78 -4.63 118.70 135.90 2wrg s GLU 116 Ca 0.02 -0.60 -0.23 0.00 0.01 0.00 0.00 54.97 54.18 2wrg s GLU 116 Cb -0.19 -2.78 -0.04 0.00 -4.31 0.00 0.00 34.13 26.81 2wrg s GLU 116 CO -0.07 0.24 0.68 0.21 0.01 0.00 0.00 175.26 176.32 2wrg s LYS 117 N 0.33 4.41 0.24 1.61 2.20 -1.26 0.55 119.74 127.81 2wrg s LYS 117 Ca -0.07 0.83 0.01 0.00 -0.36 0.00 0.00 55.97 56.38 2wrg s LYS 117 Cb -0.15 -3.46 -0.04 0.00 -1.51 0.00 0.00 37.83 32.67 2wrg s LYS 117 CO 0.04 0.03 0.15 -0.59 -0.36 0.00 0.00 175.35 174.62 2wrg s PHE 118 N 0.93 1.36 -0.73 4.03 -0.12 -0.12 -4.99 117.98 118.34 2wrg s PHE 118 Ca 0.36 -1.39 -0.16 0.00 -0.05 0.00 0.00 56.93 55.69 2wrg s PHE 118 Cb -0.17 -0.68 0.17 0.00 -0.63 0.00 0.00 43.02 41.71 2wrg s PHE 118 CO 0.17 -0.61 0.72 -2.00 -0.05 0.00 0.00 175.22 173.45 2wrg s GLU 119 N -3.99 3.36 -0.02 1.99 2.12 -1.26 -1.34 118.70 119.56 2wrg s GLU 119 Ca 0.39 -2.04 -0.20 0.00 0.36 0.00 0.00 54.97 53.48 2wrg s GLU 119 Cb 0.06 -4.42 -0.13 0.00 0.26 0.00 0.00 34.13 29.90 2wrg s GLU 119 CO 0.15 -1.38 0.88 0.97 -0.54 0.00 0.00 175.26 175.34 2wrg h ILE 120 N 5.34 0.34 -3.51 -3.70 2.10 -1.75 -3.39 117.51 112.93 2wrg h ILE 120 Ca -0.05 -0.68 -0.68 0.00 1.08 0.00 0.00 64.86 64.54 2wrg h ILE 120 Cb 1.06 0.53 -0.37 0.00 -1.09 0.00 0.00 36.82 36.95 2wrg h ILE 120 CO 0.91 0.07 -0.54 -0.36 -1.08 0.00 0.00 178.15 177.16 2wrg s PHE 121 N -3.83 3.47 0.24 2.19 2.99 -1.19 -5.05 117.98 116.80 2wrg s PHE 121 Ca -0.11 -2.80 -0.31 0.00 0.00 0.00 0.00 56.93 53.71 2wrg s PHE 121 Cb 0.01 -3.07 -0.14 0.00 0.00 0.00 0.00 43.02 39.82 2wrg s PHE 121 CO 0.39 -0.87 1.30 -2.30 -0.00 0.00 0.00 175.22 173.74 2wrg n PRO 122 N 3.82 1.80 0.34 0.24 -0.02 -1.26 -4.41 135.00 135.51 2wrg n PRO 122 Ca 0.04 0.64 -0.13 0.00 -2.02 0.00 0.00 63.50 62.02 2wrg n PRO 122 Cb 0.38 -2.22 -0.06 0.00 -0.02 0.00 0.00 33.50 31.57 2wrg n PRO 122 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2wrg h LYS 123 N 3.61 -0.85 -4.98 -0.52 3.64 -1.95 -2.07 116.57 113.45 2wrg h LYS 123 Ca -0.44 0.06 -0.71 0.00 -1.27 0.00 0.00 60.65 58.28 2wrg h LYS 123 Cb 1.30 0.19 -0.16 0.00 -0.41 0.00 0.00 32.23 33.14 2wrg h LYS 123 CO 0.71 -0.56 1.30 0.95 -2.27 0.00 0.00 179.45 179.58 2wrg s THR 124 N -4.67 4.82 0.00 1.00 -4.23 -1.26 -4.03 115.64 107.27 2wrg s THR 124 Ca -0.13 -2.21 0.00 0.00 -1.18 0.00 0.00 61.69 58.17 2wrg s THR 124 Cb 0.01 -4.91 0.00 0.00 1.34 0.00 0.00 72.50 68.94 2wrg s THR 124 CO 0.38 -1.64 0.00 -0.24 -0.54 0.00 0.00 174.62 172.58 2wrg n SER 125 N 6.28 0.00 0.10 3.99 2.88 -1.25 -5.00 113.62 120.61 2wrg n SER 125 Ca 0.34 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.85 2wrg n SER 125 Cb 0.45 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 64.06 2wrg n SER 125 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2wrg h SER 126 N 0.00 0.19 -2.47 -3.46 0.02 -1.51 -3.36 113.55 102.96 2wrg h SER 126 Ca 0.00 -0.11 -0.70 0.00 -0.84 0.00 0.00 61.79 60.14 2wrg h SER 126 Cb 0.00 -0.06 -0.35 0.00 0.14 0.00 0.00 62.40 62.13 2wrg h SER 126 CO 0.00 0.73 0.09 0.79 -1.14 0.00 0.00 176.83 177.30 2wrg n TRP 127 N -3.88 3.08 -1.82 3.45 7.02 -1.26 -5.03 117.44 119.02 2wrg n TRP 127 Ca -0.02 -3.38 -0.30 0.00 -1.02 0.00 0.00 57.50 52.79 2wrg n TRP 127 Cb 0.60 -0.87 0.07 0.00 -2.42 0.00 0.00 31.31 28.69 2wrg n TRP 127 CO 0.00 0.00 0.00 -1.25 -2.02 0.00 0.00 177.69 174.42 2wrg s PRO 128 N -2.93 2.35 0.00 -0.99 0.04 -1.26 -3.67 135.00 128.54 2wrg s PRO 128 Ca 0.38 0.37 0.00 0.00 0.04 0.00 0.00 61.00 61.78 2wrg s PRO 128 Cb 0.13 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.70 2wrg s PRO 128 CO 0.00 -1.37 0.00 0.09 0.04 0.00 0.00 177.00 175.76 2wrg n ASN 129 N -3.22 -1.60 -4.04 6.66 3.02 -1.26 -4.96 115.26 109.86 2wrg n ASN 129 Ca 0.07 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.54 2wrg n ASN 129 Cb 0.58 -1.32 -0.09 0.00 -0.61 0.00 0.00 39.78 38.34 2wrg n ASN 129 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 2wrg s HIS 130 N -2.30 0.53 0.30 3.10 3.76 -1.24 -4.63 115.29 114.81 2wrg s HIS 130 Ca 0.00 -0.97 0.02 0.00 -0.15 0.00 0.00 55.06 53.96 2wrg s HIS 130 Cb 0.00 -0.30 -0.03 0.00 1.11 0.00 0.00 32.58 33.36 2wrg s HIS 130 CO 0.00 -0.52 0.47 -2.00 -0.85 0.00 0.00 174.74 171.84 2wrg s GLU 131 N -3.96 3.47 0.00 1.40 -6.30 -0.83 -4.90 118.70 107.58 2wrg s GLU 131 Ca 0.14 -0.49 0.00 0.00 -2.50 0.00 0.00 54.97 52.11 2wrg s GLU 131 Cb 0.06 -2.76 0.00 0.00 0.00 0.00 0.00 34.13 31.44 2wrg s GLU 131 CO -0.05 0.27 0.00 0.25 0.02 0.00 0.00 175.26 175.75 2wrg n THR 132 N -1.58 0.00 -0.46 -1.70 -2.24 -1.26 -2.27 114.28 104.77 2wrg n THR 132 Ca -0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 2wrg n THR 132 Cb 0.56 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 2wrg n THR 132 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2wrg n LYS 133 N 0.00 0.00 -1.66 -0.78 5.02 -1.26 -4.79 118.16 114.70 2wrg n LYS 133 Ca 0.00 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.92 2wrg n LYS 133 Cb 0.00 -4.27 -0.03 0.00 -0.02 0.00 0.00 35.03 30.72 2wrg n LYS 133 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wrg n GLY 134 N -1.81 4.68 3.38 0.72 0.00 -1.26 -4.90 105.19 105.99 2wrg n GLY 134 Ca 0.00 -1.80 -0.19 0.00 0.00 0.00 0.00 46.02 44.03 2wrg n GLY 134 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2wrg s VAL 135 N -0.02 1.04 -0.04 1.61 -7.23 -1.26 -4.37 120.40 110.12 2wrg s VAL 135 Ca 0.61 -2.02 -0.22 0.00 -1.81 0.00 0.00 61.98 58.54 2wrg s VAL 135 Cb 0.21 -2.56 0.04 0.00 0.56 0.00 0.00 36.38 34.63 2wrg s VAL 135 CO -0.09 -0.15 0.47 0.28 -0.31 0.00 0.00 175.10 175.31 2wrg s THR 136 N -3.41 0.03 0.25 5.32 -1.32 -0.43 -4.90 115.64 111.17 2wrg s THR 136 Ca 0.33 -0.25 0.30 0.00 -1.21 0.00 0.00 61.69 60.87 2wrg s THR 136 Cb 0.07 -0.78 0.33 0.00 -1.51 0.00 0.00 72.50 70.61 2wrg s THR 136 CO 0.12 -0.14 2.00 0.00 -2.21 0.00 0.00 174.62 174.40 2wrg h ALA 137 N 3.60 1.07 -0.26 11.08 0.00 -1.92 -2.74 119.26 130.09 2wrg h ALA 137 Ca -0.28 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 2wrg h ALA 137 Cb 1.16 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2wrg h ALA 137 CO 0.38 0.12 0.06 0.00 0.00 0.00 0.00 179.25 179.81 2wrg h ALA 138 N 1.90 0.35 -1.51 0.00 0.00 -1.90 -3.20 119.26 114.90 2wrg h ALA 138 Ca -0.00 -0.17 -0.81 0.00 0.00 0.00 0.00 54.91 53.94 2wrg h ALA 138 Cb 0.48 -0.10 -0.27 0.00 0.00 0.00 0.00 17.79 17.91 2wrg h ALA 138 CO 0.01 0.01 1.01 0.00 0.00 0.00 0.00 179.25 180.28 2wrg s SER 140 N -1.42 7.00 -0.09 0.00 1.04 -1.21 -2.20 113.70 116.82 2wrg s SER 140 Ca 0.36 1.19 0.04 0.00 0.48 0.00 0.00 55.95 58.02 2wrg s SER 140 Cb 0.12 -2.35 0.00 0.00 0.10 0.00 0.00 66.02 63.89 2wrg s SER 140 CO -0.02 0.21 -0.23 -0.47 0.98 0.00 0.00 173.24 173.72 2wrg s TYR 141 N -0.75 2.44 -1.50 5.02 5.04 0.22 -4.71 117.35 123.11 2wrg s TYR 141 Ca 0.29 -0.96 -0.05 0.00 -2.44 0.00 0.00 57.07 53.91 2wrg s TYR 141 Cb -0.19 -1.63 0.04 0.00 0.35 0.00 0.00 41.96 40.53 2wrg s TYR 141 CO 0.18 -0.38 0.49 0.00 -1.34 0.00 0.00 175.55 174.50 2wrg n ALA 142 N 3.48 -1.80 0.00 3.97 0.00 -1.26 -0.97 120.51 123.92 2wrg n ALA 142 Ca -0.19 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.05 2wrg n ALA 142 Cb 0.53 -2.01 0.00 0.00 0.00 0.00 0.00 19.45 17.97 2wrg n ALA 142 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wrg n GLY 143 N -1.87 1.49 3.81 0.00 0.00 -1.26 -4.98 105.19 102.37 2wrg n GLY 143 Ca -0.21 -0.17 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 2wrg n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrg s ALA 144 N -0.15 2.75 0.15 4.61 0.00 -0.15 -4.98 121.76 123.99 2wrg s ALA 144 Ca 0.00 0.33 -0.30 0.00 0.00 0.00 0.00 51.96 51.99 2wrg s ALA 144 Cb 0.00 -3.22 -0.08 0.00 0.00 0.00 0.00 23.12 19.83 2wrg s ALA 144 CO 0.00 -0.84 1.27 -1.12 0.00 0.00 0.00 175.76 175.07 2wrg s SER 145 N -2.97 6.98 0.00 0.00 0.01 -1.26 0.68 113.70 117.14 2wrg s SER 145 Ca 0.62 2.25 0.00 0.00 1.31 0.00 0.00 55.95 60.14 2wrg s SER 145 Cb -0.15 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.48 2wrg s SER 145 CO 0.39 -0.49 0.00 -0.24 0.41 0.00 0.00 173.24 173.31 2wrg n SER 146 N 3.14 0.00 -2.41 2.44 2.88 -0.93 -4.65 113.62 114.09 2wrg n SER 146 Ca 0.07 -0.22 -0.11 0.00 -1.33 0.00 0.00 58.87 57.29 2wrg n SER 146 Cb 0.44 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.87 2wrg n SER 146 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 2wrg n PHE 147 N 0.00 -1.06 -2.09 0.66 7.35 -1.20 -1.32 117.46 119.81 2wrg n PHE 147 Ca 0.00 -1.68 -0.40 0.00 -0.76 0.00 0.00 57.45 54.60 2wrg n PHE 147 Cb 0.00 0.36 -0.02 0.00 0.35 0.00 0.00 39.48 40.17 2wrg n PHE 147 CO 0.00 0.00 0.00 0.71 -0.76 0.00 0.00 176.76 176.71 2wrg s TYR 148 N -3.46 2.98 0.08 -5.13 2.02 -1.26 -4.38 117.35 108.19 2wrg s TYR 148 Ca 0.21 1.40 0.18 0.00 -0.37 0.00 0.00 57.07 58.50 2wrg s TYR 148 Cb -0.00 -3.70 0.55 0.00 -0.40 0.00 0.00 41.96 38.40 2wrg s TYR 148 CO 0.15 -1.97 1.67 0.00 -1.57 0.00 0.00 175.55 173.83 2wrg h ARG 149 N 3.22 0.00 -0.01 -0.62 2.47 -0.30 -3.25 114.38 115.90 2wrg h ARG 149 Ca -0.49 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 2wrg h ARG 149 Cb 1.23 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.55 2wrg h ARG 149 CO 0.65 0.40 -0.73 0.09 0.56 0.00 0.00 179.97 180.93 2wrg n ASN 150 N -3.43 1.37 -4.34 7.04 3.02 -1.09 -4.69 115.26 113.14 2wrg n ASN 150 Ca 0.00 -1.18 -0.28 0.00 -0.03 0.00 0.00 54.58 53.09 2wrg n ASN 150 Cb 0.56 0.78 -0.14 0.00 -0.61 0.00 0.00 39.78 40.37 2wrg n ASN 150 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2wrg s LEU 151 N -2.71 2.24 -0.18 3.41 1.02 -1.23 -1.07 118.68 120.16 2wrg s LEU 151 Ca 0.12 -0.65 0.00 0.00 0.02 0.00 0.00 54.13 53.62 2wrg s LEU 151 Cb 0.16 -1.16 0.01 0.00 0.02 0.00 0.00 46.19 45.22 2wrg s LEU 151 CO 0.70 0.19 -0.17 -0.22 0.02 0.00 0.00 176.35 176.87 2wrg s LEU 152 N -1.62 2.27 -1.19 1.79 0.20 -0.17 -4.55 118.68 115.43 2wrg s LEU 152 Ca 0.11 -0.60 -0.19 0.00 0.69 0.00 0.00 54.13 54.15 2wrg s LEU 152 Cb -0.10 -1.53 0.08 0.00 -0.43 0.00 0.00 46.19 44.22 2wrg s LEU 152 CO 0.04 0.00 1.58 0.86 -0.29 0.00 0.00 176.35 178.54 2wrg s TRP 153 N 1.28 2.85 -0.07 5.38 -0.11 -1.26 -1.61 118.94 125.40 2wrg s TRP 153 Ca 0.04 -1.49 -0.30 0.00 1.22 0.00 0.00 56.10 55.58 2wrg s TRP 153 Cb -0.13 -4.64 -0.05 0.00 -1.50 0.00 0.00 33.47 27.15 2wrg s TRP 153 CO -0.10 -1.76 1.57 -0.51 -4.62 0.00 0.00 176.95 171.53 2wrg s LEU 154 N 3.90 4.29 0.47 5.86 1.43 -1.24 -4.18 118.68 129.22 2wrg s LEU 154 Ca 0.49 2.13 0.05 0.00 -1.03 0.00 0.00 54.13 55.77 2wrg s LEU 154 Cb 0.01 -3.54 -0.02 0.00 0.03 0.00 0.00 46.19 42.68 2wrg s LEU 154 CO 0.01 -0.89 0.21 0.42 0.23 0.00 0.00 176.35 176.34 2wrg s THR 155 N 3.88 1.86 0.60 5.49 -4.23 -0.96 -4.69 115.64 117.60 2wrg s THR 155 Ca 0.70 -1.69 -0.16 0.00 -1.18 0.00 0.00 61.69 59.35 2wrg s THR 155 Cb -0.31 -2.56 -0.03 0.00 1.34 0.00 0.00 72.50 70.95 2wrg s THR 155 CO 0.27 0.00 1.08 -1.59 -0.54 0.00 0.00 174.62 173.84 2wrg s LYS 156 N -4.02 3.18 -0.31 3.99 -2.85 -0.05 -1.96 119.74 117.73 2wrg s LYS 156 Ca 0.31 1.32 -0.01 0.00 -1.00 0.00 0.00 55.97 56.60 2wrg s LYS 156 Cb 0.01 -2.01 0.06 0.00 -2.06 0.00 0.00 37.83 33.84 2wrg s LYS 156 CO 0.18 -0.94 0.01 0.21 0.10 0.00 0.00 175.35 174.90 2wrg s LYS 157 N -3.94 2.27 -0.94 1.78 2.20 -1.08 -4.36 119.74 115.67 2wrg s LYS 157 Ca 0.66 -1.39 -0.10 0.00 -0.36 0.00 0.00 55.97 54.78 2wrg s LYS 157 Cb -0.18 -3.17 -0.00 0.00 -1.51 0.00 0.00 37.83 32.96 2wrg s LYS 157 CO 0.36 -0.69 0.70 0.41 -0.36 0.00 0.00 175.35 175.78 2wrg n GLY 158 N 4.56 -1.16 4.08 5.54 0.00 -1.26 -2.79 105.19 114.16 2wrg n GLY 158 Ca -0.11 0.50 -0.36 0.00 0.00 0.00 0.00 46.02 46.06 2wrg n GLY 158 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wrg n SER 159 N -2.41 -2.01 -3.16 1.61 3.41 -1.26 -4.96 113.62 104.84 2wrg n SER 159 Ca -0.15 -1.21 0.05 0.00 -0.26 0.00 0.00 58.87 57.30 2wrg n SER 159 Cb 0.60 -2.12 -0.01 0.00 -0.26 0.00 0.00 64.21 62.42 2wrg n SER 159 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2wrg s SER 160 N -3.94 -0.84 -0.63 4.04 0.15 -1.12 -5.05 113.70 106.32 2wrg s SER 160 Ca 0.25 0.55 0.03 0.00 0.70 0.00 0.00 55.95 57.47 2wrg s SER 160 Cb -0.12 1.71 0.16 0.00 -1.71 0.00 0.00 66.02 66.05 2wrg s SER 160 CO 0.95 -0.16 0.41 -0.47 1.20 0.00 0.00 173.24 175.17 2wrg s TYR 161 N 2.90 3.40 -0.01 3.44 5.04 -1.26 -2.63 117.35 128.22 2wrg s TYR 161 Ca 0.08 -3.13 -0.30 0.00 -2.44 0.00 0.00 57.07 51.27 2wrg s TYR 161 Cb -0.12 -2.90 -0.05 0.00 0.35 0.00 0.00 41.96 39.24 2wrg s TYR 161 CO -0.15 -0.70 1.43 -1.25 -1.34 0.00 0.00 175.55 173.53 2wrg s PRO 162 N -0.68 4.27 -0.32 4.97 0.04 -1.26 -4.85 135.00 137.16 2wrg s PRO 162 Ca 0.20 1.99 -0.29 0.00 0.04 0.00 0.00 61.00 62.94 2wrg s PRO 162 Cb -0.17 -3.62 -0.13 0.00 0.04 0.00 0.00 34.50 30.63 2wrg s PRO 162 CO -0.06 -0.61 1.26 1.17 0.04 0.00 0.00 177.00 178.80 2wrg n LYS 163 N 5.59 0.00 -3.55 4.56 4.81 -1.26 -4.90 118.16 123.41 2wrg n LYS 163 Ca 0.14 0.00 -0.36 0.00 -0.87 0.00 0.00 58.31 57.21 2wrg n LYS 163 Cb 0.43 -0.97 -0.06 0.00 0.02 0.00 0.00 35.03 34.46 2wrg n LYS 163 CO 0.00 0.00 0.00 -0.48 1.17 0.00 0.00 177.40 178.09 2wrg s LEU 164 N 3.20 4.41 -0.42 3.14 0.05 0.36 -4.92 118.68 124.50 2wrg s LEU 164 Ca 0.74 0.87 0.06 0.00 0.05 0.00 0.00 54.13 55.85 2wrg s LEU 164 Cb -0.97 -2.78 0.21 0.00 -2.05 0.00 0.00 46.19 40.60 2wrg s LEU 164 CO 0.46 0.25 0.45 -0.24 -0.55 0.00 0.00 176.35 176.72 2wrg n SER 165 N 1.36 0.15 -4.82 1.48 2.88 -1.25 -1.77 113.62 111.65 2wrg n SER 165 Ca -0.11 -2.60 -0.36 0.00 -1.33 0.00 0.00 58.87 54.46 2wrg n SER 165 Cb 0.52 -0.61 -0.07 0.00 -0.75 0.00 0.00 64.21 63.31 2wrg n SER 165 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 2wrg s LYS 166 N -0.69 3.71 0.07 -1.46 2.47 -0.56 -4.93 119.74 118.34 2wrg s LYS 166 Ca 0.34 -0.17 0.04 0.00 -1.56 0.00 0.00 55.97 54.62 2wrg s LYS 166 Cb 0.10 -3.27 -0.03 0.00 -1.46 0.00 0.00 37.83 33.17 2wrg s LYS 166 CO -0.15 0.60 -0.11 -1.12 0.16 0.00 0.00 175.35 174.73 2wrg s SER 167 N -0.51 1.38 -0.01 1.43 0.01 -1.26 -0.45 113.70 114.29 2wrg s SER 167 Ca 0.12 -0.66 0.03 0.00 1.31 0.00 0.00 55.95 56.76 2wrg s SER 167 Cb -0.12 -0.01 -0.01 0.00 0.21 0.00 0.00 66.02 66.10 2wrg s SER 167 CO 0.02 -0.17 -0.10 -0.47 0.41 0.00 0.00 173.24 172.93 2wrg s TYR 168 N -1.66 0.91 -0.09 2.43 5.04 -0.35 -4.99 117.35 118.64 2wrg s TYR 168 Ca -0.02 -0.18 -0.01 0.00 -2.44 0.00 0.00 57.07 54.42 2wrg s TYR 168 Cb -0.08 -0.59 -0.03 0.00 0.35 0.00 0.00 41.96 41.61 2wrg s TYR 168 CO 0.01 -0.02 -0.03 0.08 -1.34 0.00 0.00 175.55 174.25 2wrg s VAL 169 N -0.21 3.99 -0.91 3.14 1.01 -1.26 -1.62 120.40 124.55 2wrg s VAL 169 Ca 0.03 -0.36 -0.19 0.00 0.00 0.00 0.00 61.98 61.46 2wrg s VAL 169 Cb -0.04 -2.67 0.13 0.00 0.00 0.00 0.00 36.38 33.79 2wrg s VAL 169 CO -0.00 0.58 1.11 0.21 0.00 0.00 0.00 175.10 177.00 2wrg s ASN 170 N -0.65 6.59 -0.34 3.32 3.84 -0.61 -4.83 114.94 122.27 2wrg s ASN 170 Ca 0.10 -1.97 0.09 0.00 0.21 0.00 0.00 52.86 51.29 2wrg s ASN 170 Cb -0.12 -2.40 0.73 0.00 -0.55 0.00 0.00 41.25 38.92 2wrg s ASN 170 CO 0.02 -1.09 1.82 0.59 -2.79 0.00 0.00 177.10 175.65 2wrg n ASN 171 N 6.61 4.63 0.11 -4.21 3.02 -1.26 -1.22 115.26 122.93 2wrg n ASN 171 Ca 0.21 -3.29 0.12 0.00 -0.03 0.00 0.00 54.58 51.59 2wrg n ASN 171 Cb 0.49 -0.76 0.13 0.00 -0.61 0.00 0.00 39.78 39.03 2wrg n ASN 171 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 2wrg h LYS 172 N 2.39 0.00 -1.59 3.52 1.79 -1.98 -3.48 116.57 117.23 2wrg h LYS 172 Ca 0.32 0.00 -0.29 0.00 -2.18 0.00 0.00 60.65 58.50 2wrg h LYS 172 Cb 2.39 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 32.99 2wrg h LYS 172 CO 0.78 0.00 -0.33 0.41 -1.08 0.00 0.00 179.45 179.23 2wrg n GLY 173 N 1.24 0.36 3.80 3.86 0.00 -1.26 -4.98 105.19 108.20 2wrg n GLY 173 Ca 0.02 -0.30 -0.08 0.00 0.00 0.00 0.00 46.02 45.66 2wrg n GLY 173 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wrg s LYS 174 N -4.21 1.82 0.57 1.61 -2.85 -1.26 -4.98 119.74 110.44 2wrg s LYS 174 Ca 0.00 -1.12 -0.19 0.00 -1.00 0.00 0.00 55.97 53.66 2wrg s LYS 174 Cb 0.00 0.59 -0.05 0.00 -2.06 0.00 0.00 37.83 36.31 2wrg s LYS 174 CO 0.00 -0.83 1.15 -1.21 0.10 0.00 0.00 175.35 174.57 2wrg s GLU 175 N -3.66 3.20 -0.21 1.78 2.02 -0.91 -3.98 118.70 116.93 2wrg s GLU 175 Ca 0.14 1.66 0.01 0.00 0.02 0.00 0.00 54.97 56.81 2wrg s GLU 175 Cb -0.05 -1.98 0.04 0.00 0.10 0.00 0.00 34.13 32.25 2wrg s GLU 175 CO 0.08 -0.99 -0.12 0.08 0.02 0.00 0.00 175.26 174.34 2wrg s VAL 176 N -1.76 1.85 -0.31 2.63 1.01 -0.36 0.11 120.40 123.57 2wrg s VAL 176 Ca 0.74 -1.19 -0.29 0.00 0.00 0.00 0.00 61.98 61.24 2wrg s VAL 176 Cb -0.26 -1.90 0.01 0.00 0.00 0.00 0.00 36.38 34.24 2wrg s VAL 176 CO 0.30 0.15 1.14 -0.22 0.00 0.00 0.00 175.10 176.47 2wrg s LEU 177 N 1.30 3.93 -0.19 3.92 2.96 0.10 -1.24 118.68 129.46 2wrg s LEU 177 Ca -0.03 1.11 -0.02 0.00 -0.22 0.00 0.00 54.13 54.97 2wrg s LEU 177 Cb -0.17 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 42.98 2wrg s LEU 177 CO -0.08 -0.93 -0.10 -0.69 -1.32 0.00 0.00 176.35 173.23 2wrg s VAL 178 N 3.82 2.98 0.19 1.68 1.01 -0.75 -1.59 120.40 127.75 2wrg s VAL 178 Ca 0.48 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.89 2wrg s VAL 178 Cb -0.14 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.89 2wrg s VAL 178 CO 0.17 0.47 0.08 -0.76 0.00 0.00 0.00 175.10 175.07 2wrg s LEU 179 N 1.18 3.58 0.27 3.92 1.02 -1.26 -1.98 118.68 125.41 2wrg s LEU 179 Ca 0.02 -0.28 -0.21 0.00 0.02 0.00 0.00 54.13 53.68 2wrg s LEU 179 Cb -0.14 -2.19 0.04 0.00 0.02 0.00 0.00 46.19 43.92 2wrg s LEU 179 CO -0.04 0.06 0.80 -1.66 0.02 0.00 0.00 176.35 175.54 2wrg s TRP 180 N -1.84 -0.09 0.19 0.29 -2.14 -0.39 -4.13 118.94 110.83 2wrg s TRP 180 Ca 0.30 -0.38 0.02 0.00 2.66 0.00 0.00 56.10 58.70 2wrg s TRP 180 Cb -0.09 0.72 -0.05 0.00 -3.10 0.00 0.00 33.47 30.95 2wrg s TRP 180 CO 0.22 -1.21 0.01 0.20 -2.66 0.00 0.00 176.95 173.50 2wrg s GLY 181 N -2.99 1.32 -0.08 3.67 0.00 -0.63 0.25 107.32 108.86 2wrg s GLY 181 Ca 0.13 -1.64 0.02 0.00 0.00 0.00 0.00 44.72 43.23 2wrg s GLY 181 CO 0.07 -1.56 -0.13 0.14 0.00 0.00 0.00 173.10 171.62 2wrg s VAL 182 N -3.61 1.24 -0.14 1.40 1.01 0.21 -0.71 120.40 119.80 2wrg s VAL 182 Ca 0.26 -0.52 -0.17 0.00 0.00 0.00 0.00 61.98 61.55 2wrg s VAL 182 Cb 0.06 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 2wrg s VAL 182 CO 0.05 0.38 0.43 -2.28 0.00 0.00 0.00 175.10 173.69 2wrg s HIS 183 N 0.81 3.49 -0.46 5.22 2.46 0.45 -1.90 115.29 125.36 2wrg s HIS 183 Ca -0.11 0.80 -0.03 0.00 0.47 0.00 0.00 55.06 56.19 2wrg s HIS 183 Cb -0.15 -2.51 0.12 0.00 -0.13 0.00 0.00 32.58 29.91 2wrg s HIS 183 CO 0.02 0.16 0.27 -1.01 -2.47 0.00 0.00 174.74 171.71 2wrg s HIS 184 N 0.67 3.54 1.01 3.88 3.76 0.62 -4.73 115.29 124.04 2wrg s HIS 184 Ca 0.23 -2.44 -0.12 0.00 -0.15 0.00 0.00 55.06 52.59 2wrg s HIS 184 Cb -0.15 -3.25 0.15 0.00 1.11 0.00 0.00 32.58 30.45 2wrg s HIS 184 CO 0.09 -0.95 0.82 -2.30 -0.85 0.00 0.00 174.74 171.55 2wrg n PRO 185 N 4.38 -1.00 0.04 8.40 -0.02 -1.26 -1.59 135.00 143.94 2wrg n PRO 185 Ca -0.00 -0.25 -0.09 0.00 -2.02 0.00 0.00 63.50 61.14 2wrg n PRO 185 Cb 0.40 -2.14 -0.13 0.00 -0.02 0.00 0.00 33.50 31.62 2wrg n PRO 185 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2wrg h PRO 186 N -2.02 0.04 -3.58 0.52 0.11 -1.79 -3.32 132.00 121.96 2wrg h PRO 186 Ca -0.48 -0.08 -0.11 0.00 0.11 0.00 0.00 66.00 65.44 2wrg h PRO 186 Cb 1.30 0.03 -0.17 0.00 0.11 0.00 0.00 31.00 32.27 2wrg h PRO 186 CO 0.41 0.87 -0.39 0.95 -0.21 0.00 0.00 178.00 179.63 2wrg s THR 187 N -2.66 0.11 0.65 -1.15 -4.23 -1.26 -2.86 115.64 104.24 2wrg s THR 187 Ca -0.02 -0.91 0.33 0.00 -1.18 0.00 0.00 61.69 59.90 2wrg s THR 187 Cb 0.09 -0.95 0.35 0.00 1.34 0.00 0.00 72.50 73.33 2wrg s THR 187 CO 0.83 -0.50 2.06 1.23 -0.54 0.00 0.00 174.62 177.69 2wrg h GLY 188 N 3.38 0.00 1.02 3.99 0.00 -1.94 -1.83 103.07 107.69 2wrg h GLY 188 Ca -0.32 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 46.90 2wrg h GLY 188 CO 0.49 0.00 -0.18 -0.84 0.00 0.00 0.00 176.54 176.01 2wrg h THR 189 N 0.00 1.28 -0.00 4.70 2.02 -2.00 -3.14 112.91 115.77 2wrg h THR 189 Ca 0.03 -1.31 -0.18 0.00 0.77 0.00 0.00 66.41 65.73 2wrg h THR 189 Cb 0.52 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 2wrg h THR 189 CO -0.00 0.44 -0.80 0.44 0.37 0.00 0.00 175.52 175.96 2wrg h ASP 190 N 0.64 0.12 -0.51 4.18 3.32 -1.76 -3.11 116.42 119.30 2wrg h ASP 190 Ca 0.09 -0.09 0.15 0.00 0.02 0.00 0.00 57.03 57.20 2wrg h ASP 190 Cb 0.73 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.22 2wrg h ASP 190 CO 0.06 0.87 0.40 -0.61 -1.72 0.00 0.00 179.24 178.24 2wrg h GLN 191 N 0.05 0.00 0.05 3.56 5.75 -1.46 -1.20 115.11 121.86 2wrg h GLN 191 Ca -0.02 0.00 -0.26 0.00 -0.15 0.00 0.00 58.65 58.22 2wrg h GLN 191 Cb 1.41 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.93 2wrg h GLN 191 CO 0.11 0.00 -1.38 1.96 -2.65 0.00 0.00 178.83 176.88 2wrg h GLN 192 N 0.00 0.10 0.00 1.69 4.20 -1.56 -2.03 115.11 117.51 2wrg h GLN 192 Ca 0.24 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.78 2wrg h GLN 192 Cb 1.04 0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.89 2wrg h GLN 192 CO -0.00 1.08 0.00 0.66 -0.67 0.00 0.00 178.83 179.90 2wrg h SER 193 N -0.65 0.00 0.00 1.46 4.64 -1.48 -0.94 113.55 116.58 2wrg h SER 193 Ca -0.34 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 60.76 2wrg h SER 193 Cb 1.53 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.58 2wrg h SER 193 CO -0.09 0.00 -1.70 0.18 -0.87 0.00 0.00 176.83 174.35 2wrg n LEU 194 N -2.46 1.86 0.00 5.97 4.77 -0.47 -4.82 117.00 121.85 2wrg n LEU 194 Ca -0.00 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 2wrg n LEU 194 Cb 0.14 -0.74 0.00 0.00 -2.33 0.00 0.00 43.42 40.49 2wrg n LEU 194 CO 0.16 0.12 0.43 -1.22 -1.33 0.00 0.00 177.39 175.56 2wrg n TYR 195 N -4.28 0.00 0.00 -1.77 4.02 -0.78 -0.87 117.16 113.49 2wrg n TYR 195 Ca -0.32 -0.38 0.00 0.00 -0.01 0.00 0.00 57.90 57.19 2wrg n TYR 195 Cb 0.68 -0.04 0.00 0.00 -0.02 0.00 0.00 39.34 39.96 2wrg n TYR 195 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 2wrg n GLN 196 N -0.38 0.00 -1.43 -0.72 1.13 -0.36 -4.60 117.38 111.02 2wrg n GLN 196 Ca 0.00 0.00 -0.50 0.00 -1.94 0.00 0.00 57.00 54.56 2wrg n GLN 196 Cb 0.24 0.00 -0.08 0.00 0.11 0.00 0.00 30.24 30.51 2wrg n GLN 196 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 2wrg n ASN 197 N 0.81 1.79 0.04 1.08 4.13 -1.26 -4.54 115.26 117.31 2wrg n ASN 197 Ca 0.00 0.34 0.11 0.00 1.68 0.00 0.00 54.58 56.72 2wrg n ASN 197 Cb 0.00 -1.21 0.57 0.00 -1.54 0.00 0.00 39.78 37.60 2wrg n ASN 197 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2wrg h ALA 198 N 12.53 2.06 -3.03 5.41 0.00 -1.87 -3.27 119.26 131.08 2wrg h ALA 198 Ca -0.22 -0.01 -0.63 0.00 0.00 0.00 0.00 54.91 54.04 2wrg h ALA 198 Cb 1.33 -0.05 -0.41 0.00 0.00 0.00 0.00 17.79 18.66 2wrg h ALA 198 CO 1.08 -0.14 -0.49 -0.25 0.00 0.00 0.00 179.25 179.44 2wrg n ASP 199 N -4.47 3.25 -4.93 0.00 8.00 -1.26 -5.04 116.55 112.09 2wrg n ASP 199 Ca 0.05 -3.21 -0.20 0.00 0.71 0.00 0.00 54.79 52.14 2wrg n ASP 199 Cb 0.29 -0.81 0.05 0.00 -0.02 0.00 0.00 41.12 40.63 2wrg n ASP 199 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wrg s ALA 200 N -1.49 4.16 -0.09 2.24 0.00 -1.24 -5.05 121.76 120.29 2wrg s ALA 200 Ca 0.26 -1.64 -0.29 0.00 0.00 0.00 0.00 51.96 50.28 2wrg s ALA 200 Cb -0.04 -1.84 0.07 0.00 0.00 0.00 0.00 23.12 21.31 2wrg s ALA 200 CO -0.16 -0.80 0.67 1.52 0.00 0.00 0.00 175.76 176.99 2wrg s TYR 201 N -2.72 -0.67 -0.08 0.00 -0.85 -1.26 -4.50 117.35 107.28 2wrg s TYR 201 Ca 0.59 1.26 0.03 0.00 -0.52 0.00 0.00 57.07 58.43 2wrg s TYR 201 Cb -0.08 0.37 -0.02 0.00 0.38 0.00 0.00 41.96 42.60 2wrg s TYR 201 CO 0.38 -0.55 -0.15 0.08 -1.52 0.00 0.00 175.55 173.79 2wrg s VAL 202 N -0.86 2.94 -0.06 -3.49 1.01 -1.00 -1.70 120.40 117.24 2wrg s VAL 202 Ca -0.09 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.16 2wrg s VAL 202 Cb -0.01 -2.17 0.02 0.00 0.00 0.00 0.00 36.38 34.22 2wrg s VAL 202 CO 0.08 0.56 -0.05 -0.55 0.00 0.00 0.00 175.10 175.14 2wrg s SER 203 N -0.28 1.38 -0.09 3.32 0.15 0.16 -1.22 113.70 117.14 2wrg s SER 203 Ca 0.02 -0.18 0.03 0.00 0.70 0.00 0.00 55.95 56.52 2wrg s SER 203 Cb -0.13 -0.57 -0.01 0.00 -1.71 0.00 0.00 66.02 63.60 2wrg s SER 203 CO 0.03 -0.07 -0.20 -0.69 1.20 0.00 0.00 173.24 173.51 2wrg s VAL 204 N 1.17 2.51 -0.05 4.45 1.01 -1.10 -0.89 120.40 127.49 2wrg s VAL 204 Ca -0.07 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 61.01 2wrg s VAL 204 Cb -0.14 -1.98 0.03 0.00 0.00 0.00 0.00 36.38 34.29 2wrg s VAL 204 CO -0.01 0.56 0.10 -0.83 0.00 0.00 0.00 175.10 174.92 2wrg s GLY 205 N 0.02 0.01 0.00 4.51 0.00 -0.98 -2.89 107.32 107.98 2wrg s GLY 205 Ca -0.07 0.51 0.00 0.00 0.00 0.00 0.00 44.72 45.16 2wrg s GLY 205 CO 0.05 0.81 0.00 -1.14 0.00 0.00 0.00 173.10 172.82 2wrg n SER 206 N 4.05 0.33 -0.03 1.64 3.41 0.76 -0.58 113.62 123.20 2wrg n SER 206 Ca -0.25 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.23 2wrg n SER 206 Cb 0.52 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.38 2wrg n SER 206 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2wrg h SER 207 N 0.00 0.17 -0.36 4.04 0.02 -2.00 -3.34 113.55 112.09 2wrg h SER 207 Ca 0.00 -0.54 0.00 0.00 -0.84 0.00 0.00 61.79 60.41 2wrg h SER 207 Cb 0.00 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2wrg h SER 207 CO 0.00 0.68 0.00 2.29 -1.14 0.00 0.00 176.83 178.66 2wrg n LYS 208 N -4.69 3.02 -3.70 3.45 2.85 -1.26 -4.91 118.16 112.92 2wrg n LYS 208 Ca -0.08 -2.46 -0.26 0.00 -1.05 0.00 0.00 58.31 54.46 2wrg n LYS 208 Cb 0.33 -1.56 -0.17 0.00 -0.65 0.00 0.00 35.03 32.98 2wrg n LYS 208 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 177.40 176.88 2wrg s TYR 209 N -1.77 0.69 -0.34 5.58 5.04 -1.25 -5.07 117.35 120.22 2wrg s TYR 209 Ca 0.34 -0.57 -0.01 0.00 -2.44 0.00 0.00 57.07 54.39 2wrg s TYR 209 Cb 0.23 -0.88 0.12 0.00 0.35 0.00 0.00 41.96 41.78 2wrg s TYR 209 CO 0.15 -0.54 0.16 1.21 -1.34 0.00 0.00 175.55 175.20 2wrg s ASN 210 N 1.97 3.52 0.11 4.32 2.47 -1.26 -0.17 114.94 125.90 2wrg s ASN 210 Ca 0.01 -1.89 0.09 0.00 0.42 0.00 0.00 52.86 51.49 2wrg s ASN 210 Cb -0.16 -0.62 -0.04 0.00 -1.45 0.00 0.00 41.25 38.98 2wrg s ASN 210 CO -0.08 -0.36 -0.23 -0.60 -3.72 0.00 0.00 177.10 172.10 2wrg s ARG 211 N 1.35 1.25 0.04 0.43 3.52 -1.14 -5.06 118.95 119.34 2wrg s ARG 211 Ca 0.13 -1.23 0.09 0.00 -0.13 0.00 0.00 55.73 54.60 2wrg s ARG 211 Cb -0.20 -1.60 -0.03 0.00 -1.56 0.00 0.00 34.95 31.56 2wrg s ARG 211 CO -0.16 0.38 -0.26 0.50 -0.81 0.00 0.00 175.30 174.95 2wrg s ARG 212 N -1.94 1.85 0.13 5.12 3.52 -1.26 -2.72 118.95 123.64 2wrg s ARG 212 Ca 0.09 -1.09 0.10 0.00 -0.13 0.00 0.00 55.73 54.71 2wrg s ARG 212 Cb -0.10 -2.00 -0.04 0.00 -1.56 0.00 0.00 34.95 31.25 2wrg s ARG 212 CO 0.05 0.52 -0.25 -0.06 -0.81 0.00 0.00 175.30 174.74 2wrg s PHE 213 N -0.80 2.19 -0.05 5.12 0.40 -0.35 -5.03 117.98 119.46 2wrg s PHE 213 Ca 0.12 -0.39 -0.04 0.00 -0.60 0.00 0.00 56.93 56.02 2wrg s PHE 213 Cb -0.10 -1.18 0.02 0.00 0.51 0.00 0.00 43.02 42.27 2wrg s PHE 213 CO 0.02 0.32 0.13 -0.08 0.70 0.00 0.00 175.22 176.31 2wrg s THR 214 N -1.14 -0.02 -0.40 0.64 -1.32 -1.26 -2.36 115.64 109.78 2wrg s THR 214 Ca 0.13 0.07 -0.38 0.00 -1.21 0.00 0.00 61.69 60.30 2wrg s THR 214 Cb -0.10 -0.20 -0.14 0.00 -1.51 0.00 0.00 72.50 70.55 2wrg s THR 214 CO 0.06 0.03 2.19 -2.65 -2.21 0.00 0.00 174.62 172.03 2wrg n PRO 215 N 3.46 0.76 -3.03 7.08 -0.02 -1.26 -4.91 135.00 137.08 2wrg n PRO 215 Ca -0.18 0.20 -0.44 0.00 -2.02 0.00 0.00 63.50 61.07 2wrg n PRO 215 Cb 0.56 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 2wrg n PRO 215 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2wrg n GLU 216 N 8.02 3.72 -2.29 -0.52 1.02 -1.26 -5.01 120.64 124.31 2wrg n GLU 216 Ca 0.45 -4.19 -0.42 0.00 -0.02 0.00 0.00 57.16 52.98 2wrg n GLU 216 Cb 0.15 -2.72 -0.03 0.00 -0.02 0.00 0.00 31.44 28.83 2wrg n GLU 216 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2wrg s ILE 217 N -0.65 3.91 0.14 -3.67 1.01 -1.26 -4.77 121.20 115.91 2wrg s ILE 217 Ca 0.35 1.24 -0.25 0.00 0.00 0.00 0.00 60.65 61.99 2wrg s ILE 217 Cb -0.02 -3.80 0.06 0.00 0.01 0.00 0.00 42.46 38.71 2wrg s ILE 217 CO -0.01 -0.03 0.87 0.00 0.00 0.00 0.00 174.94 175.77 2wrg s ALA 218 N 2.69 -1.61 -0.18 9.38 0.00 -1.14 -4.96 121.76 125.94 2wrg s ALA 218 Ca 0.61 0.26 -0.19 0.00 0.00 0.00 0.00 51.96 52.65 2wrg s ALA 218 Cb -0.28 0.66 -0.03 0.00 0.00 0.00 0.00 23.12 23.46 2wrg s ALA 218 CO 0.24 -0.94 0.52 0.00 0.00 0.00 0.00 175.76 175.57 2wrg s ALA 219 N -3.41 3.53 0.05 0.00 0.00 -1.24 -4.35 121.76 116.34 2wrg s ALA 219 Ca 0.09 -0.34 -0.04 0.00 0.00 0.00 0.00 51.96 51.67 2wrg s ALA 219 Cb -0.02 -2.79 -0.02 0.00 0.00 0.00 0.00 23.12 20.29 2wrg s ALA 219 CO -0.01 -0.35 0.07 -0.98 0.00 0.00 0.00 175.76 174.49 2wrg s ARG 220 N 1.43 0.64 0.85 0.00 1.70 -1.26 -5.16 118.95 117.16 2wrg s ARG 220 Ca 0.25 -0.95 -0.13 0.00 -0.47 0.00 0.00 55.73 54.42 2wrg s ARG 220 Cb -0.15 0.24 0.05 0.00 -0.57 0.00 0.00 34.95 34.53 2wrg s ARG 220 CO 0.10 -0.16 0.83 -2.30 -1.08 0.00 0.00 175.30 172.69 2wrg n PRO 221 N 0.39 -0.03 -3.16 3.89 -0.02 -1.26 -4.76 135.00 130.05 2wrg n PRO 221 Ca -0.17 0.05 -0.40 0.00 -2.02 0.00 0.00 63.50 60.97 2wrg n PRO 221 Cb 0.60 -2.14 -0.06 0.00 -0.02 0.00 0.00 33.50 31.88 2wrg n PRO 221 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2wrg s LYS 222 N -3.78 4.21 -0.20 -0.52 1.02 -1.26 -4.59 119.74 114.61 2wrg s LYS 222 Ca 0.66 0.55 -0.06 0.00 0.02 0.00 0.00 55.97 57.14 2wrg s LYS 222 Cb -0.27 -3.57 -0.03 0.00 -0.52 0.00 0.00 37.83 33.44 2wrg s LYS 222 CO 0.58 -0.21 0.03 0.08 -0.92 0.00 0.00 175.35 174.91 2wrg s VAL 223 N 1.81 4.20 -1.53 3.17 1.01 -0.26 -4.35 120.40 124.45 2wrg s VAL 223 Ca 0.27 -0.23 -0.12 0.00 0.00 0.00 0.00 61.98 61.90 2wrg s VAL 223 Cb -0.16 -2.91 0.08 0.00 0.00 0.00 0.00 36.38 33.40 2wrg s VAL 223 CO 0.10 0.42 0.88 0.54 0.00 0.00 0.00 175.10 177.04 2wrg n ARG 224 N 4.20 -4.89 -3.57 2.72 1.74 -1.26 -2.05 116.66 113.55 2wrg n ARG 224 Ca -0.17 0.55 -0.22 0.00 -0.77 0.00 0.00 57.85 57.24 2wrg n ARG 224 Cb 0.52 -5.32 0.05 0.00 -1.02 0.00 0.00 32.46 26.68 2wrg n ARG 224 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2wrg n ASP 225 N -2.84 -3.72 -3.70 0.55 2.03 -1.26 -4.64 116.55 102.98 2wrg n ASP 225 Ca -0.01 -0.84 -0.11 0.00 0.52 0.00 0.00 54.79 54.35 2wrg n ASP 225 Cb 0.55 -4.22 -0.12 0.00 -0.72 0.00 0.00 41.12 36.61 2wrg n ASP 225 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 2wrg s GLN 226 N -5.55 0.30 0.04 -0.67 -1.52 -0.87 -4.90 119.66 106.49 2wrg s GLN 226 Ca 0.25 0.72 0.22 0.00 -1.95 0.00 0.00 55.36 54.59 2wrg s GLN 226 Cb -0.06 -0.03 -0.20 0.00 -0.22 0.00 0.00 33.01 32.49 2wrg s GLN 226 CO 0.80 -0.18 0.70 0.00 -0.25 0.00 0.00 175.29 176.37 2wrg n ALA 227 N 4.45 2.85 -1.72 6.09 0.00 -1.26 -1.10 120.51 129.81 2wrg n ALA 227 Ca -0.21 -0.43 -0.29 0.00 0.00 0.00 0.00 53.44 52.51 2wrg n ALA 227 Cb 0.53 -0.87 0.11 0.00 0.00 0.00 0.00 19.45 19.22 2wrg n ALA 227 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2wrg s GLY 228 N -4.34 1.59 0.06 0.00 0.00 -1.26 -4.52 107.32 98.84 2wrg s GLY 228 Ca -0.04 -0.55 0.01 0.00 0.00 0.00 0.00 44.72 44.14 2wrg s GLY 228 CO 0.86 -0.04 -0.05 0.50 0.00 0.00 0.00 173.10 174.37 2wrg s ARG 229 N -5.41 0.63 -0.16 2.90 1.81 -0.62 -4.75 118.95 113.34 2wrg s ARG 229 Ca 0.62 -1.09 -0.04 0.00 -1.72 0.00 0.00 55.73 53.50 2wrg s ARG 229 Cb -0.13 -0.03 0.05 0.00 -0.45 0.00 0.00 34.95 34.40 2wrg s ARG 229 CO 0.51 -0.04 0.06 1.41 -0.68 0.00 0.00 175.30 176.56 2wrg s MET 230 N -3.15 0.34 -0.08 3.54 1.75 0.18 -0.27 119.30 121.61 2wrg s MET 230 Ca 0.02 -0.15 -0.19 0.00 -1.25 0.00 0.00 55.69 54.12 2wrg s MET 230 Cb 0.01 -1.74 -0.04 0.00 2.84 0.00 0.00 34.83 35.90 2wrg s MET 230 CO -0.05 -0.59 0.52 -0.80 -0.65 0.00 0.00 175.02 173.45 2wrg s ASN 231 N 2.02 6.79 -0.08 1.11 0.01 -0.80 -3.40 114.94 120.59 2wrg s ASN 231 Ca 0.01 0.94 -0.04 0.00 -0.71 0.00 0.00 52.86 53.07 2wrg s ASN 231 Cb -0.16 -2.31 -0.04 0.00 0.41 0.00 0.00 41.25 39.15 2wrg s ASN 231 CO -0.08 0.03 0.09 -0.31 -1.51 0.00 0.00 177.10 175.33 2wrg s TYR 232 N 0.35 3.40 0.05 2.20 1.51 -0.33 -0.62 117.35 123.90 2wrg s TYR 232 Ca 0.28 0.35 0.04 0.00 -1.01 0.00 0.00 57.07 56.73 2wrg s TYR 232 Cb -0.16 -1.84 -0.02 0.00 -0.11 0.00 0.00 41.96 39.82 2wrg s TYR 232 CO 0.13 0.61 -0.11 0.71 -1.11 0.00 0.00 175.55 175.78 2wrg s TYR 233 N -1.05 0.98 0.36 2.71 1.51 0.14 -1.79 117.35 120.21 2wrg s TYR 233 Ca 0.17 -0.42 0.03 0.00 -1.01 0.00 0.00 57.07 55.85 2wrg s TYR 233 Cb -0.12 -0.57 -0.04 0.00 -0.11 0.00 0.00 41.96 41.12 2wrg s TYR 233 CO 0.07 -0.00 0.09 1.67 -1.11 0.00 0.00 175.55 176.27 2wrg s TRP 234 N -1.12 1.84 -0.11 2.71 1.48 -1.26 -1.26 118.94 121.21 2wrg s TRP 234 Ca -0.04 -1.13 -0.30 0.00 -1.06 0.00 0.00 56.10 53.58 2wrg s TRP 234 Cb -0.09 -1.19 0.11 0.00 -1.16 0.00 0.00 33.47 31.14 2wrg s TRP 234 CO 0.01 -0.16 0.90 -0.08 -4.06 0.00 0.00 176.95 173.56 2wrg s THR 235 N -3.30 0.00 -0.33 0.66 -1.32 -0.84 -4.99 115.64 105.52 2wrg s THR 235 Ca 0.30 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.67 2wrg s THR 235 Cb 0.06 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 70.04 2wrg s THR 235 CO 0.15 0.00 0.19 -0.76 -2.21 0.00 0.00 174.62 171.99 2wrg s LEU 236 N -1.29 4.36 -0.12 9.08 1.43 -1.26 -1.81 118.68 129.07 2wrg s LEU 236 Ca -0.03 -0.56 -0.22 0.00 -1.03 0.00 0.00 54.13 52.29 2wrg s LEU 236 Cb -0.00 -2.06 -0.03 0.00 0.03 0.00 0.00 46.19 44.13 2wrg s LEU 236 CO 0.02 -0.24 0.64 -0.22 0.23 0.00 0.00 176.35 176.78 2wrg s LEU 237 N 1.64 4.25 0.38 1.79 2.96 -0.37 -4.89 118.68 124.44 2wrg s LEU 237 Ca 0.05 1.01 -0.19 0.00 -0.22 0.00 0.00 54.13 54.78 2wrg s LEU 237 Cb -0.17 -2.95 -0.10 0.00 0.50 0.00 0.00 46.19 43.46 2wrg s LEU 237 CO 0.08 -0.15 0.86 -1.61 -1.32 0.00 0.00 176.35 174.21 2wrg s GLU 238 N 1.13 4.18 0.01 1.98 2.02 -1.26 -1.22 118.70 125.54 2wrg s GLU 238 Ca 0.33 0.96 -0.36 0.00 0.02 0.00 0.00 54.97 55.92 2wrg s GLU 238 Cb -0.17 -2.34 -0.15 0.00 0.10 0.00 0.00 34.13 31.57 2wrg s GLU 238 CO 0.14 0.08 1.53 -2.30 0.02 0.00 0.00 175.26 174.73 2wrg n PRO 239 N -0.40 1.49 0.00 0.39 -0.02 -1.26 -0.84 135.00 134.37 2wrg n PRO 239 Ca 0.05 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 2wrg n PRO 239 Cb 0.53 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 2wrg n PRO 239 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wrg n GLY 240 N 3.26 3.29 3.82 -1.23 0.00 -0.36 -5.03 105.19 108.94 2wrg n GLY 240 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 2wrg n GLY 240 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wrg s ASP 241 N -1.06 3.91 -0.05 1.61 3.68 -0.02 -4.63 116.67 120.11 2wrg s ASP 241 Ca 0.00 0.96 0.03 0.00 2.13 0.00 0.00 52.55 55.68 2wrg s ASP 241 Cb 0.00 -1.55 0.00 0.00 -1.45 0.00 0.00 42.92 39.93 2wrg s ASP 241 CO 0.00 -2.30 -0.14 -0.89 0.13 0.00 0.00 175.17 171.97 2wrg s THR 242 N -3.34 1.25 -0.09 1.71 2.01 -1.26 -1.57 115.64 114.35 2wrg s THR 242 Ca 0.63 -0.58 0.01 0.00 0.31 0.00 0.00 61.69 62.05 2wrg s THR 242 Cb -0.14 -1.10 -0.02 0.00 0.01 0.00 0.00 72.50 71.25 2wrg s THR 242 CO 0.52 0.37 -0.11 -0.51 -0.69 0.00 0.00 174.62 174.21 2wrg s ILE 243 N 0.31 3.33 -0.21 1.82 2.07 -0.64 -4.20 121.20 123.68 2wrg s ILE 243 Ca -0.09 -0.60 0.00 0.00 -1.41 0.00 0.00 60.65 58.56 2wrg s ILE 243 Cb -0.13 -2.37 0.05 0.00 0.13 0.00 0.00 42.46 40.14 2wrg s ILE 243 CO 0.03 0.56 -0.06 -0.89 -1.91 0.00 0.00 174.94 172.67 2wrg s THR 244 N -0.26 1.44 -0.20 4.00 2.01 0.25 -1.22 115.64 121.65 2wrg s THR 244 Ca 0.02 -1.03 -0.19 0.00 0.31 0.00 0.00 61.69 60.80 2wrg s THR 244 Cb -0.13 -1.65 -0.03 0.00 0.01 0.00 0.00 72.50 70.70 2wrg s THR 244 CO 0.03 0.00 0.56 -0.36 -0.69 0.00 0.00 174.62 174.16 2wrg s PHE 245 N 1.46 3.36 -0.14 4.92 0.40 0.40 -2.33 117.98 126.05 2wrg s PHE 245 Ca -0.03 0.82 -0.01 0.00 -0.60 0.00 0.00 56.93 57.10 2wrg s PHE 245 Cb -0.17 -2.72 0.04 0.00 0.51 0.00 0.00 43.02 40.67 2wrg s PHE 245 CO -0.07 -0.14 -0.03 -2.00 0.70 0.00 0.00 175.22 173.68 2wrg s GLU 246 N 1.79 1.11 0.05 0.44 2.12 -0.07 -1.50 118.70 122.63 2wrg s GLU 246 Ca 0.25 -0.33 -0.10 0.00 0.36 0.00 0.00 54.97 55.16 2wrg s GLU 246 Cb -0.16 -1.74 0.00 0.00 0.26 0.00 0.00 34.13 32.49 2wrg s GLU 246 CO 0.10 -0.42 0.20 0.00 -0.54 0.00 0.00 175.26 174.60 2wrg s ALA 247 N 1.76 -0.37 -0.09 6.30 0.00 -0.73 0.40 121.76 129.04 2wrg s ALA 247 Ca 0.02 -0.31 0.13 0.00 0.00 0.00 0.00 51.96 51.80 2wrg s ALA 247 Cb -0.15 0.31 0.20 0.00 0.00 0.00 0.00 23.12 23.48 2wrg s ALA 247 CO -0.07 -0.38 1.09 0.25 0.00 0.00 0.00 175.76 176.64 2wrg n THR 248 N 0.58 1.46 0.00 0.00 -2.24 -0.69 -0.48 114.28 112.91 2wrg n THR 248 Ca -0.18 -1.72 0.00 0.00 -2.27 0.00 0.00 64.05 59.87 2wrg n THR 248 Cb 0.59 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 2wrg n THR 248 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wrg n GLY 249 N -1.07 3.56 2.86 3.38 0.00 -1.26 -4.62 105.19 108.04 2wrg n GLY 249 Ca 0.11 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.72 2wrg n GLY 249 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2wrg n ASN 250 N 0.00 -2.40 -4.66 1.61 3.02 -1.26 -4.42 115.26 107.14 2wrg n ASN 250 Ca 0.00 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.15 2wrg n ASN 250 Cb 0.00 -1.45 -0.06 0.00 -0.61 0.00 0.00 39.78 37.66 2wrg n ASN 250 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2wrg s LEU 251 N 0.00 4.16 -1.10 3.41 2.96 -1.26 -0.41 118.68 126.44 2wrg s LEU 251 Ca 0.00 0.89 -0.09 0.00 -0.22 0.00 0.00 54.13 54.71 2wrg s LEU 251 Cb 0.00 -2.94 0.28 0.00 0.50 0.00 0.00 46.19 44.03 2wrg s LEU 251 CO 0.00 -0.28 1.10 -0.63 -1.32 0.00 0.00 176.35 175.22 2wrg s ILE 252 N 1.87 5.99 0.80 6.68 -1.09 0.11 -3.62 121.20 131.94 2wrg s ILE 252 Ca 0.30 -3.38 -0.14 0.00 -2.23 0.00 0.00 60.65 55.20 2wrg s ILE 252 Cb -0.16 -4.60 0.08 0.00 -1.58 0.00 0.00 42.46 36.20 2wrg s ILE 252 CO 0.11 -1.18 1.21 0.00 -1.23 0.00 0.00 174.94 173.85 2wrg s ALA 253 N -1.20 1.87 0.47 9.38 0.00 -0.64 -1.61 121.76 130.03 2wrg s ALA 253 Ca 0.30 0.87 -0.24 0.00 0.00 0.00 0.00 51.96 52.90 2wrg s ALA 253 Cb -0.10 -3.50 -0.07 0.00 0.00 0.00 0.00 23.12 19.45 2wrg s ALA 253 CO -0.08 -2.25 1.28 -2.14 0.00 0.00 0.00 175.76 172.58 2wrg s PRO 254 N -4.08 3.64 0.00 0.00 0.02 -1.26 -0.99 135.00 132.32 2wrg s PRO 254 Ca 0.74 2.08 0.00 0.00 0.02 0.00 0.00 61.00 63.84 2wrg s PRO 254 Cb -0.29 -2.49 0.00 0.00 0.02 0.00 0.00 34.50 31.73 2wrg s PRO 254 CO 0.50 -0.74 0.00 1.87 -0.33 0.00 0.00 177.00 178.30 2wrg n TRP 255 N -0.43 0.00 -4.85 6.54 -0.00 -0.25 -4.34 117.44 114.11 2wrg n TRP 255 Ca 0.07 0.00 -0.30 0.00 -0.00 0.00 0.00 57.50 57.27 2wrg n TRP 255 Cb 0.45 0.05 -0.14 0.00 -0.00 0.00 0.00 31.31 31.67 2wrg n TRP 255 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 177.69 178.40 2wrg s TYR 256 N -1.83 2.39 0.39 5.87 1.51 -0.24 -2.13 117.35 123.31 2wrg s TYR 256 Ca 0.00 -0.37 0.04 0.00 -1.01 0.00 0.00 57.07 55.73 2wrg s TYR 256 Cb 0.00 -1.41 -0.03 0.00 -0.11 0.00 0.00 41.96 40.40 2wrg s TYR 256 CO 0.00 0.16 0.10 0.00 -1.11 0.00 0.00 175.55 174.70 2wrg s ALA 257 N -0.83 2.82 0.08 3.71 0.00 -0.45 -4.70 121.76 122.38 2wrg s ALA 257 Ca 0.12 -1.42 0.09 0.00 0.00 0.00 0.00 51.96 50.75 2wrg s ALA 257 Cb -0.10 0.69 -0.03 0.00 0.00 0.00 0.00 23.12 23.67 2wrg s ALA 257 CO 0.03 -0.31 -0.23 -0.06 0.00 0.00 0.00 175.76 175.19 2wrg s PHE 258 N -3.23 1.99 -0.04 0.00 0.40 -0.62 -0.95 117.98 115.54 2wrg s PHE 258 Ca 0.26 -0.39 0.01 0.00 -0.60 0.00 0.00 56.93 56.21 2wrg s PHE 258 Cb 0.04 -1.14 -0.03 0.00 0.51 0.00 0.00 43.02 42.40 2wrg s PHE 258 CO 0.14 0.18 -0.04 0.00 0.70 0.00 0.00 175.22 176.20 2wrg s ALA 259 N -0.95 3.13 0.01 5.36 0.00 0.19 0.01 121.76 129.51 2wrg s ALA 259 Ca 0.09 -0.91 -0.00 0.00 0.00 0.00 0.00 51.96 51.13 2wrg s ALA 259 Cb -0.10 -1.29 -0.01 0.00 0.00 0.00 0.00 23.12 21.73 2wrg s ALA 259 CO 0.03 0.60 -0.00 -0.51 0.00 0.00 0.00 175.76 175.88 2wrg s LEU 260 N -1.13 2.08 -0.27 0.00 1.43 0.12 -1.87 118.68 119.04 2wrg s LEU 260 Ca 0.15 -0.23 0.01 0.00 -1.03 0.00 0.00 54.13 53.03 2wrg s LEU 260 Cb -0.11 0.09 0.08 0.00 0.03 0.00 0.00 46.19 46.27 2wrg s LEU 260 CO 0.05 -0.15 0.00 0.20 0.23 0.00 0.00 176.35 176.68 2wrg s ASN 261 N -0.73 4.06 0.56 2.29 0.01 -1.18 -2.14 114.94 117.81 2wrg s ASN 261 Ca -0.08 -1.47 -0.20 0.00 -0.71 0.00 0.00 52.86 50.40 2wrg s ASN 261 Cb -0.05 -1.19 -0.05 0.00 0.41 0.00 0.00 41.25 40.37 2wrg s ASN 261 CO -0.00 -0.30 1.21 -0.13 -1.51 0.00 0.00 177.10 176.36 2wrg s ARG 262 N 1.35 3.15 0.62 -0.60 0.52 -1.26 -0.86 118.95 121.87 2wrg s ARG 262 Ca 0.01 1.84 -0.06 0.00 -0.52 0.00 0.00 55.73 57.00 2wrg s ARG 262 Cb -0.19 -2.04 0.03 0.00 0.52 0.00 0.00 34.95 33.27 2wrg s ARG 262 CO -0.11 -1.07 0.93 0.20 0.02 0.00 0.00 175.30 175.28 2wrg s GLY 263 N -1.51 1.64 0.08 -3.53 0.00 0.96 -4.72 107.32 100.25 2wrg s GLY 263 Ca 0.74 -0.81 -0.30 0.00 0.00 0.00 0.00 44.72 44.35 2wrg s GLY 263 CO 0.34 -0.49 1.47 1.48 0.00 0.00 0.00 173.10 175.91 2wrg h SER 264 N -0.30 -1.32 0.00 1.64 4.64 -1.95 -3.46 113.55 112.80 2wrg h SER 264 Ca -0.45 0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2wrg h SER 264 Cb 1.28 0.48 0.00 0.00 -0.31 0.00 0.00 62.40 63.84 2wrg h SER 264 CO 0.60 -0.50 0.00 0.61 -0.87 0.00 0.00 176.83 176.67 2wrg n GLY 265 N -1.43 -1.27 0.00 -0.77 0.00 -1.26 -5.10 105.19 95.36 2wrg n GLY 265 Ca -0.08 0.87 0.00 0.00 0.00 0.00 0.00 46.02 46.81 2wrg n GLY 265 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2wrg n SER 266 N 0.00 0.00 -3.14 1.61 2.88 -1.26 -5.05 113.62 108.66 2wrg n SER 266 Ca 0.00 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.52 2wrg n SER 266 Cb 0.00 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.48 2wrg n SER 266 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2wrg n GLY 267 N 5.00 0.62 3.58 0.46 0.00 -1.26 -4.92 105.19 108.67 2wrg n GLY 267 Ca 0.00 -1.12 -0.34 0.00 0.00 0.00 0.00 46.02 44.56 2wrg n GLY 267 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wrg s ILE 268 N -2.10 3.74 -0.04 -0.61 1.01 -1.26 -3.16 121.20 118.77 2wrg s ILE 268 Ca 0.21 -0.46 0.05 0.00 0.00 0.00 0.00 60.65 60.46 2wrg s ILE 268 Cb -0.02 -2.54 -0.01 0.00 0.01 0.00 0.00 42.46 39.90 2wrg s ILE 268 CO 0.04 0.59 -0.21 0.27 0.00 0.00 0.00 174.94 175.64 2wrg s ILE 269 N -0.74 1.70 -0.36 2.92 -4.36 -0.47 -4.98 121.20 114.90 2wrg s ILE 269 Ca 0.11 -0.88 -0.07 0.00 -0.26 0.00 0.00 60.65 59.55 2wrg s ILE 269 Cb -0.11 -1.44 0.05 0.00 1.25 0.00 0.00 42.46 42.21 2wrg s ILE 269 CO 0.02 0.48 0.15 -0.89 0.24 0.00 0.00 174.94 174.94 2wrg s THR 270 N -0.15 3.89 0.06 8.37 2.01 -1.26 -2.08 115.64 126.49 2wrg s THR 270 Ca -0.01 -1.24 -0.18 0.00 0.31 0.00 0.00 61.69 60.56 2wrg s THR 270 Cb -0.12 -3.27 0.04 0.00 0.01 0.00 0.00 72.50 69.16 2wrg s THR 270 CO 0.02 -0.29 0.42 -0.55 -0.69 0.00 0.00 174.62 173.53 2wrg s SER 271 N 1.61 -0.29 0.00 3.53 0.15 -0.40 -4.95 113.70 113.35 2wrg s SER 271 Ca 0.00 -0.05 0.24 0.00 0.70 0.00 0.00 55.95 56.84 2wrg s SER 271 Cb -0.21 0.44 0.20 0.00 -1.71 0.00 0.00 66.02 64.74 2wrg s SER 271 CO 0.02 -0.71 1.24 0.47 1.20 0.00 0.00 173.24 175.46 2wrg n ASP 272 N 0.33 2.50 -4.75 5.45 8.00 -1.26 -4.31 116.55 122.51 2wrg n ASP 272 Ca -0.18 -1.76 -0.37 0.00 0.71 0.00 0.00 54.79 53.19 2wrg n ASP 272 Cb 0.61 0.17 0.04 0.00 -0.02 0.00 0.00 41.12 41.92 2wrg n ASP 272 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wrg s ALA 273 N -2.19 2.69 0.16 2.24 0.00 -1.26 -4.95 121.76 118.45 2wrg s ALA 273 Ca 0.25 1.18 -0.30 0.00 0.00 0.00 0.00 51.96 53.09 2wrg s ALA 273 Cb 0.19 -3.51 -0.07 0.00 0.00 0.00 0.00 23.12 19.73 2wrg s ALA 273 CO 0.41 -1.27 1.18 -1.25 0.00 0.00 0.00 175.76 174.82 2wrg s PRO 274 N -3.07 4.50 0.28 0.00 0.04 -1.26 -4.58 135.00 130.90 2wrg s PRO 274 Ca 0.74 1.82 -0.29 0.00 0.04 0.00 0.00 61.00 63.31 2wrg s PRO 274 Cb -0.36 -3.27 -0.09 0.00 0.04 0.00 0.00 34.50 30.82 2wrg s PRO 274 CO 0.41 -0.09 1.11 0.08 0.04 0.00 0.00 177.00 178.55 2wrg s VAL 275 N 0.13 3.47 0.35 -0.36 1.01 -1.26 -1.27 120.40 122.47 2wrg s VAL 275 Ca 0.53 1.47 0.04 0.00 0.00 0.00 0.00 61.98 64.02 2wrg s VAL 275 Cb -0.31 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 2wrg s VAL 275 CO 0.35 0.35 0.14 -1.00 0.00 0.00 0.00 175.10 174.93 2wrg s HIS 276 N -1.11 1.73 -2.06 5.22 3.76 -0.78 -4.89 115.29 117.17 2wrg s HIS 276 Ca 0.45 -1.28 0.12 0.00 -0.15 0.00 0.00 55.06 54.19 2wrg s HIS 276 Cb -0.32 -1.03 0.45 0.00 1.11 0.00 0.00 32.58 32.79 2wrg s HIS 276 CO 0.41 -0.37 1.33 -0.40 -0.85 0.00 0.00 174.74 174.86 2wrg n ASP 277 N -1.05 1.11 -4.90 1.40 3.85 -1.26 -4.29 116.55 111.41 2wrg n ASP 277 Ca -0.02 -1.85 -0.29 0.00 -0.71 0.00 0.00 54.79 51.92 2wrg n ASP 277 Cb 0.65 -0.12 0.06 0.00 -1.35 0.00 0.00 41.12 40.37 2wrg n ASP 277 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2wrg s ASN 279 N -4.45 4.41 -0.12 0.00 -0.87 -1.26 -0.14 114.94 112.50 2wrg s ASN 279 Ca 0.59 -0.65 -0.30 0.00 -1.57 0.00 0.00 52.86 50.93 2wrg s ASN 279 Cb -0.11 -0.78 0.12 0.00 -0.02 0.00 0.00 41.25 40.46 2wrg s ASN 279 CO 0.50 0.03 0.95 0.28 -2.57 0.00 0.00 177.10 176.29 2wrg s THR 280 N -2.17 0.00 -0.15 1.60 -1.32 -0.97 -4.82 115.64 107.81 2wrg s THR 280 Ca 0.30 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.99 2wrg s THR 280 Cb -0.07 -1.00 -0.32 0.00 -1.51 0.00 0.00 72.50 69.60 2wrg s THR 280 CO 0.18 0.00 0.53 0.29 -2.21 0.00 0.00 174.62 173.41 2wrg n LYS 281 N 0.57 0.58 -4.13 7.08 5.02 -1.26 -3.97 118.16 122.04 2wrg n LYS 281 Ca -0.11 -0.17 -0.26 0.00 -2.02 0.00 0.00 58.31 55.75 2wrg n LYS 281 Cb 0.58 -1.51 -0.17 0.00 -0.02 0.00 0.00 35.03 33.92 2wrg n LYS 281 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wrg s GLN 283 N 1.35 3.25 0.40 0.00 2.00 -0.42 -1.00 119.66 125.24 2wrg s GLN 283 Ca -0.01 -0.75 0.08 0.00 -2.00 0.00 0.00 55.36 52.67 2wrg s GLN 283 Cb -0.14 -2.54 -0.06 0.00 0.80 0.00 0.00 33.01 31.07 2wrg s GLN 283 CO -0.05 0.15 0.07 0.95 -0.50 0.00 0.00 175.29 175.92 2wrg s THR 284 N 0.47 2.22 0.38 -0.34 -4.23 -0.96 -0.87 115.64 112.31 2wrg s THR 284 Ca -0.12 -1.88 0.07 0.00 -1.18 0.00 0.00 61.69 58.58 2wrg s THR 284 Cb -0.16 -2.96 0.19 0.00 1.34 0.00 0.00 72.50 70.91 2wrg s THR 284 CO 0.05 -0.04 1.95 -0.65 -0.54 0.00 0.00 174.62 175.39 2wrg h PRO 285 N 1.65 0.40 0.00 3.99 0.11 -1.93 -3.03 132.00 133.19 2wrg h PRO 285 Ca -0.43 -0.07 -0.22 0.00 0.11 0.00 0.00 66.00 65.39 2wrg h PRO 285 Cb 1.25 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2wrg h PRO 285 CO 0.74 0.42 -1.20 0.45 -0.21 0.00 0.00 178.00 178.19 2wrg h HIS 286 N 0.39 0.00 0.00 0.65 3.86 -1.94 -3.43 115.15 114.68 2wrg h HIS 286 Ca 0.09 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 2wrg h HIS 286 Cb 0.24 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.71 2wrg h HIS 286 CO 0.01 0.92 0.00 0.41 0.86 0.00 0.00 177.93 180.13 2wrg n GLY 287 N 1.40 1.19 3.74 2.45 0.00 -1.15 -4.13 105.19 108.70 2wrg n GLY 287 Ca -0.06 -0.82 -0.33 0.00 0.00 0.00 0.00 46.02 44.81 2wrg n GLY 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wrg s ALA 288 N -2.00 2.23 -0.29 4.61 0.00 -0.77 -2.27 121.76 123.27 2wrg s ALA 288 Ca 0.00 0.65 0.02 0.00 0.00 0.00 0.00 51.96 52.63 2wrg s ALA 288 Cb 0.00 -3.38 0.08 0.00 0.00 0.00 0.00 23.12 19.82 2wrg s ALA 288 CO 0.00 -1.68 0.01 0.42 0.00 0.00 0.00 175.76 174.52 2wrg s ILE 289 N -2.28 1.69 -0.76 0.00 1.01 -0.17 -0.93 121.20 119.76 2wrg s ILE 289 Ca 0.69 -1.69 -0.25 0.00 0.00 0.00 0.00 60.65 59.39 2wrg s ILE 289 Cb -0.24 -2.12 -0.05 0.00 0.01 0.00 0.00 42.46 40.07 2wrg s ILE 289 CO 0.46 -0.41 2.01 0.21 0.00 0.00 0.00 174.94 177.20 2wrg s ASN 290 N 1.25 4.99 -0.04 3.58 2.47 -1.26 -4.03 114.94 121.90 2wrg s ASN 290 Ca 0.04 -0.12 -0.00 0.00 0.42 0.00 0.00 52.86 53.19 2wrg s ASN 290 Cb -0.19 -2.54 0.03 0.00 -1.45 0.00 0.00 41.25 37.10 2wrg s ASN 290 CO -0.11 -2.76 0.02 -0.44 -3.72 0.00 0.00 177.10 170.09 2wrg s SER 291 N 8.70 0.68 0.00 -4.21 0.01 -1.26 -4.87 113.70 112.75 2wrg s SER 291 Ca 0.74 0.01 0.00 0.00 1.31 0.00 0.00 55.95 58.00 2wrg s SER 291 Cb -0.10 -0.20 0.00 0.00 0.21 0.00 0.00 66.02 65.93 2wrg s SER 291 CO 0.09 -0.15 0.00 -1.54 0.41 0.00 0.00 173.24 172.05 2wrg n SER 292 N 4.56 1.44 -4.77 2.44 3.41 -1.26 -4.80 113.62 114.64 2wrg n SER 292 Ca -0.19 -0.03 -0.36 0.00 -0.26 0.00 0.00 58.87 58.04 2wrg n SER 292 Cb 0.50 0.34 0.01 0.00 -0.26 0.00 0.00 64.21 64.80 2wrg n SER 292 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2wrg s LEU 293 N -0.97 3.78 0.49 1.04 1.43 -1.26 -4.97 118.68 118.23 2wrg s LEU 293 Ca 0.00 2.24 0.27 0.00 -1.03 0.00 0.00 54.13 55.61 2wrg s LEU 293 Cb 0.00 -4.52 1.27 0.00 0.03 0.00 0.00 46.19 42.97 2wrg s LEU 293 CO 0.00 -1.23 1.98 1.55 0.23 0.00 0.00 176.35 178.88 2wrg h PRO 294 N 1.30 0.00 -5.10 1.29 0.13 -1.96 -3.41 132.00 124.25 2wrg h PRO 294 Ca -0.50 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.23 2wrg h PRO 294 Cb 1.27 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.16 2wrg h PRO 294 CO 0.57 0.16 -0.78 -0.06 -0.23 0.00 0.00 178.00 177.66 2wrg s PHE 295 N -3.97 1.06 0.06 1.56 0.40 -1.14 -1.16 117.98 114.80 2wrg s PHE 295 Ca -0.01 -0.37 0.04 0.00 -0.60 0.00 0.00 56.93 55.99 2wrg s PHE 295 Cb 0.12 -0.63 -0.03 0.00 0.51 0.00 0.00 43.02 42.99 2wrg s PHE 295 CO 0.60 0.01 -0.12 1.14 0.70 0.00 0.00 175.22 177.55 2wrg s GLN 296 N -1.20 0.71 -0.22 0.44 1.03 -0.93 0.51 119.66 119.99 2wrg s GLN 296 Ca -0.01 -0.89 0.11 0.00 0.04 0.00 0.00 55.36 54.61 2wrg s GLN 296 Cb -0.08 -0.63 0.43 0.00 0.03 0.00 0.00 33.01 32.76 2wrg s GLN 296 CO 0.01 0.13 1.21 0.27 -2.54 0.00 0.00 175.29 174.37 2wrg n ASN 297 N 1.33 2.44 -0.03 12.60 0.23 -0.79 -1.45 115.26 129.59 2wrg n ASN 297 Ca -0.22 -3.78 -0.21 0.00 -0.53 0.00 0.00 54.58 49.85 2wrg n ASN 297 Cb 0.54 -0.48 -0.13 0.00 -2.08 0.00 0.00 39.78 37.63 2wrg n ASN 297 CO 0.00 0.00 0.00 -0.38 -0.93 0.00 0.00 177.26 175.95 2wrg n ILE 298 N -0.96 1.70 -3.64 1.53 5.41 -1.26 -4.96 119.36 117.18 2wrg n ILE 298 Ca 0.24 -0.63 -0.03 0.00 1.00 0.00 0.00 62.75 63.34 2wrg n ILE 298 Cb 0.77 -1.65 -0.07 0.00 -0.71 0.00 0.00 39.64 37.98 2wrg n ILE 298 CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 2wrg s HIS 299 N -2.55 -0.44 0.13 1.39 2.46 -1.26 -4.99 115.29 110.03 2wrg s HIS 299 Ca -0.26 0.92 -0.17 0.00 0.47 0.00 0.00 55.06 56.02 2wrg s HIS 299 Cb 0.07 0.31 -0.02 0.00 -0.13 0.00 0.00 32.58 32.81 2wrg s HIS 299 CO 0.72 -0.22 1.68 -1.00 -2.47 0.00 0.00 174.74 173.46 2wrg h PRO 300 N 5.43 0.52 -6.71 2.88 0.13 -1.95 -3.43 132.00 128.87 2wrg h PRO 300 Ca -0.28 -0.09 -0.51 0.00 -0.87 0.00 0.00 66.00 64.26 2wrg h PRO 300 Cb 1.18 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2wrg h PRO 300 CO 0.19 0.50 0.44 0.08 -0.23 0.00 0.00 178.00 178.98 2wrg s VAL 301 N -5.61 3.84 0.10 1.56 1.01 -1.26 -4.93 120.40 115.11 2wrg s VAL 301 Ca -0.13 1.71 -0.26 0.00 0.00 0.00 0.00 61.98 63.30 2wrg s VAL 301 Cb 0.09 -4.09 0.08 0.00 0.00 0.00 0.00 36.38 32.47 2wrg s VAL 301 CO 0.74 0.35 0.76 -0.89 0.00 0.00 0.00 175.10 176.06 2wrg s THR 302 N -0.67 0.00 -0.03 3.92 2.01 -1.26 -4.45 115.64 115.15 2wrg s THR 302 Ca 0.46 -0.12 -0.01 0.00 0.31 0.00 0.00 61.69 62.33 2wrg s THR 302 Cb -0.29 -1.15 0.03 0.00 0.01 0.00 0.00 72.50 71.10 2wrg s THR 302 CO 0.36 0.00 0.05 -0.63 -0.69 0.00 0.00 174.62 173.71 2wrg s ILE 303 N -3.45 -0.09 -0.26 1.82 1.01 -0.05 -4.98 121.20 115.19 2wrg s ILE 303 Ca 0.04 0.34 0.00 0.00 0.00 0.00 0.00 60.65 61.03 2wrg s ILE 303 Cb -0.01 -0.12 0.00 0.00 0.01 0.00 0.00 42.46 42.33 2wrg s ILE 303 CO -0.09 0.14 0.00 0.61 0.00 0.00 0.00 174.94 175.60 2wrg n GLY 304 N 4.82 0.35 3.52 6.18 0.00 -1.26 -1.31 105.19 117.49 2wrg n GLY 304 Ca -0.14 -2.28 -0.42 0.00 0.00 0.00 0.00 46.02 43.18 2wrg n GLY 304 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wrg s GLU 305 N -0.10 3.53 0.00 1.61 2.02 0.17 -4.92 118.70 121.02 2wrg s GLU 305 Ca 0.00 -1.22 0.06 0.00 0.02 0.00 0.00 54.97 53.83 2wrg s GLU 305 Cb 0.00 -5.07 -0.03 0.00 0.10 0.00 0.00 34.13 29.13 2wrg s GLU 305 CO 0.00 -2.05 -0.16 0.00 0.02 0.00 0.00 175.26 173.06 2wrg n PRO 307 N 1.87 0.11 -2.12 0.00 -0.02 -1.26 -4.90 135.00 128.68 2wrg n PRO 307 Ca -0.16 0.10 -0.42 0.00 -2.02 0.00 0.00 63.50 61.00 2wrg n PRO 307 Cb 0.52 -2.17 -0.03 0.00 -0.02 0.00 0.00 33.50 31.80 2wrg n PRO 307 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2wrg s LYS 308 N -3.68 4.26 0.39 -0.52 3.01 -0.31 -4.51 119.74 118.39 2wrg s LYS 308 Ca 0.68 2.10 -0.26 0.00 -1.01 0.00 0.00 55.97 57.48 2wrg s LYS 308 Cb -0.29 -3.54 -0.09 0.00 -1.01 0.00 0.00 37.83 32.90 2wrg s LYS 308 CO 0.56 -0.61 1.20 -0.47 0.51 0.00 0.00 175.35 176.53 2wrg s TYR 309 N 2.33 3.04 0.05 3.18 5.04 -1.26 -2.20 117.35 127.53 2wrg s TYR 309 Ca 0.67 1.53 -0.08 0.00 -2.44 0.00 0.00 57.07 56.75 2wrg s TYR 309 Cb -0.35 -3.46 -0.00 0.00 0.35 0.00 0.00 41.96 38.50 2wrg s TYR 309 CO 0.29 -1.46 0.15 0.08 -1.34 0.00 0.00 175.55 173.27 2wrg s VAL 310 N -1.36 0.13 -1.10 3.14 1.01 -0.53 -4.91 120.40 116.78 2wrg s VAL 310 Ca 0.56 -1.07 0.18 0.00 0.00 0.00 0.00 61.98 61.65 2wrg s VAL 310 Cb -0.33 -1.05 0.67 0.00 0.00 0.00 0.00 36.38 35.68 2wrg s VAL 310 CO 0.41 -0.59 1.59 0.54 0.00 0.00 0.00 175.10 177.05 2wrg n ARG 311 N 0.49 3.57 -1.47 2.72 1.74 -1.26 -4.41 116.66 118.04 2wrg n ARG 311 Ca -0.18 -2.81 -0.31 0.00 -0.77 0.00 0.00 57.85 53.78 2wrg n ARG 311 Cb 0.60 -1.82 0.07 0.00 -1.02 0.00 0.00 32.46 30.29 2wrg n ARG 311 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2wrg s SER 312 N -1.00 4.87 -0.14 0.55 0.01 -1.26 -4.98 113.70 111.76 2wrg s SER 312 Ca 0.48 1.60 0.08 0.00 1.31 0.00 0.00 55.95 59.42 2wrg s SER 312 Cb 0.31 -2.39 -0.14 0.00 0.21 0.00 0.00 66.02 64.01 2wrg s SER 312 CO 0.23 -1.77 -0.02 0.41 0.41 0.00 0.00 173.24 172.50 2wrg n THR 313 N -3.33 0.89 -3.67 1.44 -1.04 -1.26 -4.82 114.28 102.49 2wrg n THR 313 Ca 0.08 -0.47 -0.19 0.00 -2.04 0.00 0.00 64.05 61.42 2wrg n THR 313 Cb 0.54 -0.81 -0.17 0.00 -1.82 0.00 0.00 70.33 68.07 2wrg n THR 313 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 2wrg s LYS 314 N -2.31 -0.04 -0.51 -2.82 2.20 -1.26 -5.05 119.74 109.95 2wrg s LYS 314 Ca -0.12 0.44 0.07 0.00 -0.36 0.00 0.00 55.97 56.01 2wrg s LYS 314 Cb 0.04 -0.44 0.31 0.00 -1.51 0.00 0.00 37.83 36.24 2wrg s LYS 314 CO 0.47 -0.33 0.79 1.28 -0.36 0.00 0.00 175.35 177.21 2wrg n LEU 315 N 5.31 2.78 -4.66 5.43 4.77 -1.26 -5.06 117.00 124.30 2wrg n LEU 315 Ca -0.04 -5.32 -0.39 0.00 -0.03 0.00 0.00 56.01 50.23 2wrg n LEU 315 Cb 0.50 -0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 41.44 2wrg n LEU 315 CO 0.05 2.24 0.17 -0.60 -1.33 0.00 0.00 177.39 177.93 2wrg s ARG 316 N -2.69 4.16 -0.26 3.23 3.52 -1.26 -1.60 118.95 124.05 2wrg s ARG 316 Ca 0.43 0.30 -0.07 0.00 -0.13 0.00 0.00 55.73 56.26 2wrg s ARG 316 Cb 0.26 -3.56 -0.02 0.00 -1.56 0.00 0.00 34.95 30.07 2wrg s ARG 316 CO -0.09 -0.13 0.07 1.41 -0.81 0.00 0.00 175.30 175.75 2wrg s MET 317 N 1.58 3.49 0.24 5.12 -2.45 0.38 -4.52 119.30 123.14 2wrg s MET 317 Ca 0.21 -0.59 -0.31 0.00 -1.25 0.00 0.00 55.69 53.75 2wrg s MET 317 Cb -0.15 -3.33 -0.12 0.00 1.25 0.00 0.00 34.83 32.48 2wrg s MET 317 CO 0.09 -0.26 1.68 0.00 1.05 0.00 0.00 175.02 177.57 2wrg s ALA 318 N 1.58 3.87 -0.02 4.11 0.00 -1.26 -0.91 121.76 129.13 2wrg s ALA 318 Ca 0.05 1.59 0.01 0.00 0.00 0.00 0.00 51.96 53.61 2wrg s ALA 318 Cb -0.16 -3.68 -0.01 0.00 0.00 0.00 0.00 23.12 19.27 2wrg s ALA 318 CO 0.03 -0.95 -0.01 0.25 0.00 0.00 0.00 175.76 175.08 2wrg n THR 319 N 3.32 0.11 -0.80 0.00 -2.24 -0.84 -4.87 114.28 108.96 2wrg n THR 319 Ca 0.13 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 2wrg n THR 319 Cb 0.36 -0.69 0.00 0.00 -2.10 0.00 0.00 70.33 67.90 2wrg n THR 319 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wrg n GLY 320 N 3.25 -0.50 3.93 3.38 0.00 -0.47 -4.91 105.19 109.87 2wrg n GLY 320 Ca -0.03 -1.72 -0.23 0.00 0.00 0.00 0.00 46.02 44.05 2wrg n GLY 320 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2wrg s LEU 321 N 0.00 3.05 0.06 0.99 2.34 -1.26 -4.74 118.68 119.11 2wrg s LEU 321 Ca 0.00 -0.97 -0.33 0.00 0.06 0.00 0.00 54.13 52.90 2wrg s LEU 321 Cb 0.00 -1.62 -0.12 0.00 -0.56 0.00 0.00 46.19 43.89 2wrg s LEU 321 CO 0.00 -1.00 1.80 -1.14 -1.06 0.00 0.00 176.35 174.94 2wrg n ARG 322 N -1.81 2.43 -2.91 1.48 0.63 -1.26 -0.65 116.66 114.58 2wrg n ARG 322 Ca 0.04 0.89 -0.44 0.00 -0.92 0.00 0.00 57.85 57.42 2wrg n ARG 322 Cb 0.63 -2.74 -0.03 0.00 0.45 0.00 0.00 32.46 30.77 2wrg n ARG 322 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 2wrg s ASN 323 N 2.83 6.40 -0.61 6.15 2.47 -0.02 -4.73 114.94 127.43 2wrg s ASN 323 Ca 0.85 -1.56 -0.04 0.00 0.42 0.00 0.00 52.86 52.54 2wrg s ASN 323 Cb -0.60 -2.40 0.16 0.00 -1.45 0.00 0.00 41.25 36.96 2wrg s ASN 323 CO 0.42 -1.23 0.44 -0.63 -3.72 0.00 0.00 177.10 172.38 2wrg s ILE 324 N 3.29 3.83 0.28 -5.21 1.01 -1.26 -4.80 121.20 118.35 2wrg s ILE 324 Ca 0.27 -2.78 0.16 0.00 0.00 0.00 0.00 60.65 58.30 2wrg s ILE 324 Cb -0.11 -3.50 0.10 0.00 0.01 0.00 0.00 42.46 38.96 2wrg s ILE 324 CO -0.00 -0.86 1.77 -0.65 0.00 0.00 0.00 174.94 175.19 2wrg h PRO 325 N 7.25 0.00 -6.39 2.79 0.11 -1.93 -3.47 132.00 130.36 2wrg h PRO 325 Ca -0.03 0.00 -0.47 0.00 0.11 0.00 0.00 66.00 65.62 2wrg h PRO 325 Cb 0.97 0.00 0.06 0.00 0.11 0.00 0.00 31.00 32.15 2wrg h PRO 325 CO 0.72 0.40 -0.95 0.43 -0.21 0.00 0.00 178.00 178.39 2wrg n SER 326 N -3.79 -5.10 -4.82 -2.05 7.64 -1.26 -4.92 113.62 99.32 2wrg n SER 326 Ca -0.01 -1.07 -0.32 0.00 1.01 0.00 0.00 58.87 58.48 2wrg n SER 326 Cb 0.47 -2.97 0.03 0.00 -1.01 0.00 0.00 64.21 60.73 2wrg n SER 326 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wrg s ARG 327 N -6.27 3.19 0.00 1.43 1.04 -1.26 -5.24 118.95 111.84 2wrg s ARG 327 Ca 0.47 1.01 0.00 0.00 -1.04 0.00 0.00 55.73 56.17 2wrg s ARG 327 Cb -0.19 -2.02 0.00 0.00 -2.04 0.00 0.00 34.95 30.70 2wrg s ARG 327 CO 0.89 -0.90 0.00 1.04 -0.04 0.00 0.00 175.30 176.28