#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wgi s ILE 22 N 0.00 3.32 0.03 2.46 1.01 -1.26 -1.37 121.20 125.39 2wgi s ILE 22 Ca 0.00 -0.55 0.07 0.00 0.00 0.00 0.00 60.65 60.17 2wgi s ILE 22 Cb 0.00 -2.43 -0.02 0.00 0.01 0.00 0.00 42.46 40.01 2wgi s ILE 22 CO 0.00 0.50 -0.21 0.28 0.00 0.00 0.00 174.94 175.51 2wgi s THR 23 N 0.55 1.65 -0.09 2.92 -1.32 -0.54 -5.00 115.64 113.81 2wgi s THR 23 Ca -0.06 -1.10 -0.20 0.00 -1.21 0.00 0.00 61.69 59.11 2wgi s THR 23 Cb -0.15 -1.41 -0.04 0.00 -1.51 0.00 0.00 72.50 69.38 2wgi s THR 23 CO 0.03 0.27 0.56 -0.70 -2.21 0.00 0.00 174.62 172.57 2wgi s GLU 24 N -0.98 4.36 -0.30 7.08 2.12 -1.26 -1.33 118.70 128.39 2wgi s GLU 24 Ca 0.08 0.61 0.02 0.00 0.36 0.00 0.00 54.97 56.03 2wgi s GLU 24 Cb -0.09 -3.43 0.09 0.00 0.26 0.00 0.00 34.13 30.97 2wgi s GLU 24 CO 0.01 0.16 0.03 1.21 -0.54 0.00 0.00 175.26 176.13 2wgi s ASN 25 N 0.55 4.37 0.00 -1.70 2.47 0.14 -4.93 114.94 115.85 2wgi s ASN 25 Ca 0.30 -1.77 0.31 0.00 0.42 0.00 0.00 52.86 52.12 2wgi s ASN 25 Cb -0.16 -1.33 1.61 0.00 -1.45 0.00 0.00 41.25 39.91 2wgi s ASN 25 CO 0.13 -0.35 2.09 0.35 -3.72 0.00 0.00 177.10 175.61 2wgi n THR 26 N 4.50 0.00 0.49 -5.21 -2.24 -1.26 -4.05 114.28 106.51 2wgi n THR 26 Ca -0.02 -0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.84 2wgi n THR 26 Cb 0.42 -0.50 0.35 0.00 -2.10 0.00 0.00 70.33 68.50 2wgi n THR 26 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2wgi n SER 27 N -1.23 0.13 -0.51 3.42 3.41 -1.26 -2.37 113.62 115.22 2wgi n SER 27 Ca 0.16 0.53 0.06 0.00 -0.26 0.00 0.00 58.87 59.36 2wgi n SER 27 Cb 0.21 -0.56 0.07 0.00 -0.26 0.00 0.00 64.21 63.68 2wgi n SER 27 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2wgi n TRP 28 N -1.65 0.11 0.32 7.33 7.02 -1.26 -4.55 117.44 124.77 2wgi n TRP 28 Ca 0.03 -0.11 0.03 0.00 -1.02 0.00 0.00 57.50 56.44 2wgi n TRP 28 Cb 0.18 -0.01 0.17 0.00 -2.42 0.00 0.00 31.31 29.24 2wgi n TRP 28 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 2wgi n ASN 29 N 0.63 0.00 0.06 -0.99 3.02 -1.00 -2.01 115.26 114.96 2wgi n ASN 29 Ca 0.08 0.19 -0.08 0.00 -0.03 0.00 0.00 54.58 54.74 2wgi n ASN 29 Cb 0.32 -0.29 0.06 0.00 -0.61 0.00 0.00 39.78 39.27 2wgi n ASN 29 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 2wgi h LYS 30 N 0.00 0.36 -0.20 3.52 3.11 -1.81 -2.67 116.57 118.88 2wgi h LYS 30 Ca 0.00 -0.27 -0.12 0.00 -2.81 0.00 0.00 60.65 57.46 2wgi h LYS 30 Cb 0.07 0.05 -0.00 0.00 -1.00 0.00 0.00 32.23 31.34 2wgi h LYS 30 CO 0.00 0.90 -0.33 0.93 -2.81 0.00 0.00 179.45 178.14 2wgi h GLU 31 N 0.26 0.57 -0.40 1.90 4.39 -1.77 -1.73 114.58 117.80 2wgi h GLU 31 Ca -0.02 -0.35 -0.13 0.00 0.34 0.00 0.00 59.36 59.21 2wgi h GLU 31 Cb 1.21 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.88 2wgi h GLU 31 CO 0.11 0.96 -0.26 0.74 -1.16 0.00 0.00 179.01 179.40 2wgi h PHE 32 N 0.24 0.95 -0.15 4.33 0.04 -1.66 -2.30 116.94 118.38 2wgi h PHE 32 Ca 0.02 -0.23 -0.05 0.00 2.80 0.00 0.00 57.97 60.50 2wgi h PHE 32 Cb 0.91 -0.22 -0.00 0.00 2.20 0.00 0.00 35.95 38.84 2wgi h PHE 32 CO 0.09 0.99 -0.11 0.77 -0.60 0.00 0.00 178.31 179.45 2wgi h SER 33 N 0.71 0.36 -0.16 2.17 0.02 -1.52 -1.72 113.55 113.42 2wgi h SER 33 Ca 0.09 -0.45 -0.04 0.00 -0.84 0.00 0.00 61.79 60.55 2wgi h SER 33 Cb 0.79 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 63.22 2wgi h SER 33 CO 0.07 0.73 -0.01 0.00 -1.14 0.00 0.00 176.83 176.48 2wgi h ALA 34 N 0.64 1.49 -0.13 3.77 0.00 -1.32 -2.72 119.26 121.00 2wgi h ALA 34 Ca 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2wgi h ALA 34 Cb 0.61 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2wgi h ALA 34 CO 0.03 0.37 0.00 0.39 0.00 0.00 0.00 179.25 180.04 2wgi n GLU 35 N -4.32 1.90 -3.92 0.00 -0.58 -0.87 -4.96 120.64 107.90 2wgi n GLU 35 Ca 0.01 -1.33 -0.28 0.00 -0.42 0.00 0.00 57.16 55.13 2wgi n GLU 35 Cb 0.22 -1.45 0.01 0.00 -0.57 0.00 0.00 31.44 29.65 2wgi n GLU 35 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wgi n ALA 36 N 0.58 -1.60 -2.66 0.62 0.00 -0.99 -4.97 120.51 111.48 2wgi n ALA 36 Ca 0.17 -0.01 -0.33 0.00 0.00 0.00 0.00 53.44 53.27 2wgi n ALA 36 Cb 0.41 -3.13 -0.13 0.00 0.00 0.00 0.00 19.45 16.60 2wgi n ALA 36 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2wgi s VAL 37 N -3.52 3.24 -0.45 0.00 1.01 -0.68 -5.06 120.40 114.94 2wgi s VAL 37 Ca 0.39 -0.64 -0.12 0.00 0.00 0.00 0.00 61.98 61.60 2wgi s VAL 37 Cb -0.20 -2.31 0.08 0.00 0.00 0.00 0.00 36.38 33.95 2wgi s VAL 37 CO 0.85 0.57 0.33 0.20 0.00 0.00 0.00 175.10 177.06 2wgi s ASN 38 N -0.44 5.90 0.19 3.32 0.01 -1.26 -4.70 114.94 117.96 2wgi s ASN 38 Ca 0.06 -1.43 -0.05 0.00 -0.71 0.00 0.00 52.86 50.73 2wgi s ASN 38 Cb -0.12 -2.09 0.02 0.00 0.41 0.00 0.00 41.25 39.47 2wgi s ASN 38 CO 0.02 -0.60 0.34 0.61 -1.51 0.00 0.00 177.10 175.96 2wgi n GLY 39 N 5.06 1.93 3.10 0.66 0.00 -1.26 -1.10 105.19 113.59 2wgi n GLY 39 Ca -0.11 -1.28 -0.13 0.00 0.00 0.00 0.00 46.02 44.50 2wgi n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wgi s VAL 40 N -2.58 0.01 -0.06 1.61 0.11 0.04 -4.84 120.40 114.69 2wgi s VAL 40 Ca 0.11 -0.04 0.06 0.00 -2.93 0.00 0.00 61.98 59.17 2wgi s VAL 40 Cb -0.02 -0.32 -0.01 0.00 -1.53 0.00 0.00 36.38 34.51 2wgi s VAL 40 CO 0.08 -0.02 -0.24 0.12 -3.33 0.00 0.00 175.10 171.71 2wgi s PHE 41 N 0.02 2.34 -0.11 1.54 5.36 -1.26 -1.88 117.98 123.98 2wgi s PHE 41 Ca -0.01 -0.69 0.01 0.00 -0.96 0.00 0.00 56.93 55.28 2wgi s PHE 41 Cb -0.02 -1.54 0.02 0.00 -0.34 0.00 0.00 43.02 41.14 2wgi s PHE 41 CO 0.00 -0.21 -0.13 0.08 -1.46 0.00 0.00 175.22 173.51 2wgi s VAL 42 N -0.13 1.34 -0.06 3.12 1.01 -0.39 -3.66 120.40 121.62 2wgi s VAL 42 Ca -0.04 -0.53 0.01 0.00 0.00 0.00 0.00 61.98 61.43 2wgi s VAL 42 Cb -0.13 -1.26 0.02 0.00 0.00 0.00 0.00 36.38 35.01 2wgi s VAL 42 CO 0.03 0.41 -0.07 -0.22 0.00 0.00 0.00 175.10 175.26 2wgi s LEU 43 N 1.21 1.36 -0.01 3.92 2.96 -0.77 -1.46 118.68 125.89 2wgi s LEU 43 Ca -0.03 -0.20 0.05 0.00 -0.22 0.00 0.00 54.13 53.74 2wgi s LEU 43 Cb -0.14 -0.61 -0.01 0.00 0.50 0.00 0.00 46.19 45.93 2wgi s LEU 43 CO -0.04 -0.04 -0.17 0.00 -1.32 0.00 0.00 176.35 174.78 2wgi s LYS 45 N -0.43 3.44 0.00 0.00 2.20 -1.25 -0.99 119.74 122.71 2wgi s LYS 45 Ca 0.06 -0.22 0.00 0.00 -0.36 0.00 0.00 55.97 55.45 2wgi s LYS 45 Cb -0.06 -3.14 0.00 0.00 -1.51 0.00 0.00 37.83 33.11 2wgi s LYS 45 CO -0.01 0.72 0.00 0.45 -0.36 0.00 0.00 175.35 176.16 2wgi n SER 46 N 1.44 0.00 -3.92 1.43 2.88 0.42 -4.58 113.62 111.29 2wgi n SER 46 Ca -0.15 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.27 2wgi n SER 46 Cb 0.54 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.87 2wgi n SER 46 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2wgi s SER 47 N 0.00 0.16 0.00 -3.46 0.15 -1.26 -4.84 113.70 104.45 2wgi s SER 47 Ca 0.00 -0.18 0.00 0.00 0.70 0.00 0.00 55.95 56.47 2wgi s SER 47 Cb 0.00 0.03 0.00 0.00 -1.71 0.00 0.00 66.02 64.34 2wgi s SER 47 CO 0.00 -0.09 0.42 -1.54 1.20 0.00 0.00 173.24 173.23 2wgi n SER 48 N 2.55 1.05 0.03 5.45 3.41 -1.26 -3.02 113.62 121.83 2wgi n SER 48 Ca -0.16 -1.27 0.12 0.00 -0.26 0.00 0.00 58.87 57.30 2wgi n SER 48 Cb 0.58 -0.32 0.17 0.00 -0.26 0.00 0.00 64.21 64.39 2wgi n SER 48 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 2wgi n LYS 49 N 0.35 0.15 -3.51 4.33 2.85 -1.26 -4.50 118.16 116.58 2wgi n LYS 49 Ca 0.00 0.03 -0.25 0.00 -1.05 0.00 0.00 58.31 57.04 2wgi n LYS 49 Cb 0.21 -1.58 -0.14 0.00 -0.65 0.00 0.00 35.03 32.87 2wgi n LYS 49 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2wgi s SER 50 N -3.60 2.86 0.28 -5.58 0.15 -1.17 -2.18 113.70 104.46 2wgi s SER 50 Ca 0.08 -1.04 0.11 0.00 0.70 0.00 0.00 55.95 55.79 2wgi s SER 50 Cb 0.15 -0.09 -0.05 0.00 -1.71 0.00 0.00 66.02 64.33 2wgi s SER 50 CO 0.73 -0.41 -0.11 0.00 1.20 0.00 0.00 173.24 174.65 2wgi s ALA 52 N -2.43 2.52 0.16 0.00 0.00 -0.32 -1.47 121.76 120.21 2wgi s ALA 52 Ca 0.31 -1.45 -0.16 0.00 0.00 0.00 0.00 51.96 50.66 2wgi s ALA 52 Cb -0.05 -0.48 0.03 0.00 0.00 0.00 0.00 23.12 22.62 2wgi s ALA 52 CO 0.17 0.54 0.44 -0.08 0.00 0.00 0.00 175.76 176.84 2wgi s THR 53 N -1.18 0.05 -0.07 0.00 -1.32 -0.44 -1.85 115.64 110.82 2wgi s THR 53 Ca 0.16 -0.74 0.14 0.00 -1.21 0.00 0.00 61.69 60.05 2wgi s THR 53 Cb -0.10 -1.41 -0.15 0.00 -1.51 0.00 0.00 72.50 69.33 2wgi s THR 53 CO 0.08 -0.22 0.89 -0.55 -2.21 0.00 0.00 174.62 172.61 2wgi h ASN 54 N 2.31 0.00 -2.93 8.08 -1.07 -1.76 0.41 115.58 120.62 2wgi h ASN 54 Ca -0.31 0.00 -0.51 0.00 0.07 0.00 0.00 56.30 55.55 2wgi h ASN 54 Cb 1.26 0.00 -0.40 0.00 -2.07 0.00 0.00 38.32 37.10 2wgi h ASN 54 CO 0.43 0.75 -0.77 -0.62 0.07 0.00 0.00 177.43 177.29 2wgi s ASP 55 N -6.05 3.08 0.17 6.14 2.15 -1.26 -4.68 116.67 116.22 2wgi s ASP 55 Ca -0.02 -1.03 -0.15 0.00 0.43 0.00 0.00 52.55 51.78 2wgi s ASP 55 Cb 0.08 -0.34 0.13 0.00 -0.30 0.00 0.00 42.92 42.49 2wgi s ASP 55 CO 0.81 -0.40 1.71 -0.07 -0.17 0.00 0.00 175.17 177.05 2wgi h LEU 56 N 8.39 -0.10 -0.19 -1.34 3.38 -1.95 -0.77 115.31 122.73 2wgi h LEU 56 Ca -0.18 0.09 0.02 0.00 0.09 0.00 0.00 57.88 57.91 2wgi h LEU 56 Cb 1.07 0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 2wgi h LEU 56 CO 0.38 -0.01 0.04 0.00 0.09 0.00 0.00 178.44 178.94 2wgi h ALA 57 N 1.36 0.20 -0.04 1.53 0.00 -2.01 -2.91 119.26 117.38 2wgi h ALA 57 Ca 0.21 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.01 2wgi h ALA 57 Cb 0.29 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2wgi h ALA 57 CO -0.32 -0.39 -0.62 -0.09 0.00 0.00 0.00 179.25 177.83 2wgi h ARG 58 N 0.12 0.13 -0.88 0.00 2.43 -1.89 -3.18 114.38 111.11 2wgi h ARG 58 Ca 0.09 -0.09 0.21 0.00 -0.81 0.00 0.00 59.98 59.38 2wgi h ARG 58 Cb 0.08 0.02 -0.06 0.00 -0.42 0.00 0.00 29.97 29.58 2wgi h ARG 58 CO -0.11 0.71 0.60 0.00 -1.51 0.00 0.00 179.97 179.66 2wgi h ALA 59 N 1.27 2.37 -0.01 2.80 0.00 -0.94 -1.13 119.26 123.62 2wgi h ALA 59 Ca -0.01 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2wgi h ALA 59 Cb 1.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2wgi h ALA 59 CO 0.09 -0.64 -0.40 0.43 0.00 0.00 0.00 179.25 178.73 2wgi n SER 60 N -4.45 1.92 -4.76 0.00 7.64 -1.21 -2.23 113.62 110.53 2wgi n SER 60 Ca 0.19 -1.46 -0.40 0.00 1.01 0.00 0.00 58.87 58.21 2wgi n SER 60 Cb 0.76 0.45 -0.05 0.00 -1.01 0.00 0.00 64.21 64.36 2wgi n SER 60 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2wgi s LYS 61 N -2.22 4.65 -0.23 1.43 2.20 -0.43 -4.73 119.74 120.41 2wgi s LYS 61 Ca 0.17 1.73 -0.11 0.00 -0.36 0.00 0.00 55.97 57.39 2wgi s LYS 61 Cb 0.16 -3.16 -0.05 0.00 -1.51 0.00 0.00 37.83 33.27 2wgi s LYS 61 CO 0.49 0.24 0.19 -1.21 -0.36 0.00 0.00 175.35 174.70 2wgi s GLU 62 N -1.48 4.10 0.24 4.03 2.02 -1.26 -4.26 118.70 122.09 2wgi s GLU 62 Ca 0.45 -0.20 0.11 0.00 0.02 0.00 0.00 54.97 55.35 2wgi s GLU 62 Cb -0.30 -3.52 -0.05 0.00 0.10 0.00 0.00 34.13 30.36 2wgi s GLU 62 CO 0.38 0.08 -0.20 0.71 0.02 0.00 0.00 175.26 176.25 2wgi s TYR 63 N 1.00 2.16 0.18 1.61 2.02 -0.54 -4.68 117.35 119.10 2wgi s TYR 63 Ca 0.09 -0.38 -0.33 0.00 -0.37 0.00 0.00 57.07 56.08 2wgi s TYR 63 Cb -0.13 -0.98 -0.15 0.00 -0.40 0.00 0.00 41.96 40.29 2wgi s TYR 63 CO 0.04 0.59 1.20 1.28 -1.57 0.00 0.00 175.55 177.09 2wgi n LEU 64 N -0.35 1.74 0.21 -1.29 4.32 -1.26 -0.06 117.00 120.32 2wgi n LEU 64 Ca -0.08 1.14 0.09 0.00 -0.02 0.00 0.00 56.01 57.14 2wgi n LEU 64 Cb 0.59 -1.24 0.42 0.00 -1.62 0.00 0.00 43.42 41.56 2wgi n LEU 64 CO 0.35 -1.19 0.76 -0.65 -1.22 0.00 0.00 177.39 175.45 2wgi h PRO 65 N 3.51 0.00 0.00 3.23 0.11 -1.77 -3.46 132.00 133.62 2wgi h PRO 65 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2wgi h PRO 65 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2wgi h PRO 65 CO 0.71 0.27 0.00 0.00 -0.21 0.00 0.00 178.00 178.77 2wgi n ALA 66 N -2.24 0.00 0.80 -0.75 0.00 -1.24 -2.61 120.51 114.46 2wgi n ALA 66 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.53 2wgi n ALA 66 Cb 0.46 0.00 0.43 0.00 0.00 0.00 0.00 19.45 20.33 2wgi n ALA 66 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2wgi n SER 67 N 0.23 0.00 0.02 0.00 7.64 -1.26 -2.08 113.62 118.17 2wgi n SER 67 Ca 0.00 0.06 0.09 0.00 1.01 0.00 0.00 58.87 60.04 2wgi n SER 67 Cb 0.00 -0.30 0.40 0.00 -1.01 0.00 0.00 64.21 63.30 2wgi n SER 67 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2wgi n THR 68 N -1.30 0.75 0.52 0.44 -2.24 -1.07 -2.14 114.28 109.24 2wgi n THR 68 Ca 0.08 0.18 0.10 0.00 -2.27 0.00 0.00 64.05 62.14 2wgi n THR 68 Cb 0.14 -0.89 0.43 0.00 -2.10 0.00 0.00 70.33 67.90 2wgi n THR 68 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2wgi n PHE 69 N -1.60 0.44 0.24 4.78 7.35 -0.88 -2.89 117.46 124.90 2wgi n PHE 69 Ca 0.04 0.16 0.08 0.00 -0.76 0.00 0.00 57.45 56.97 2wgi n PHE 69 Cb 0.22 -0.76 0.60 0.00 0.35 0.00 0.00 39.48 39.89 2wgi n PHE 69 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 2wgi h LYS 70 N 0.00 0.00 0.62 -4.13 1.57 -1.67 -1.87 116.57 111.09 2wgi h LYS 70 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2wgi h LYS 70 Cb 0.37 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.69 2wgi h LYS 70 CO 0.00 0.14 -0.30 0.82 -0.57 0.00 0.00 179.45 179.54 2wgi h ILE 71 N 0.00 0.24 -0.76 1.86 2.04 -1.77 -0.10 117.51 119.02 2wgi h ILE 71 Ca -0.00 -0.31 -0.05 0.00 1.00 0.00 0.00 64.86 65.50 2wgi h ILE 71 Cb 0.27 0.31 -0.03 0.00 -0.74 0.00 0.00 36.82 36.63 2wgi h ILE 71 CO 0.02 0.03 0.27 1.55 0.00 0.00 0.00 178.15 180.01 2wgi h PRO 72 N -1.07 1.16 -0.48 2.37 0.13 -1.75 -2.73 132.00 129.63 2wgi h PRO 72 Ca -0.08 -0.23 0.10 0.00 -0.87 0.00 0.00 66.00 64.91 2wgi h PRO 72 Cb 0.69 -0.18 -0.09 0.00 0.13 0.00 0.00 31.00 31.55 2wgi h PRO 72 CO 0.14 0.97 -0.07 -0.97 -0.23 0.00 0.00 178.00 177.84 2wgi h ASN 73 N 1.12 -0.34 -0.68 1.44 -0.73 -1.33 -0.87 115.58 114.19 2wgi h ASN 73 Ca 0.25 0.13 0.01 0.00 1.87 0.00 0.00 56.30 58.56 2wgi h ASN 73 Cb 0.27 0.25 -0.04 0.00 0.27 0.00 0.00 38.32 39.08 2wgi h ASN 73 CO -0.01 -0.12 0.44 0.00 -0.37 0.00 0.00 177.43 177.37 2wgi h ALA 74 N 1.46 0.87 -0.58 1.57 0.00 -0.80 0.25 119.26 122.03 2wgi h ALA 74 Ca 0.24 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 2wgi h ALA 74 Cb 0.36 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2wgi h ALA 74 CO -0.45 0.26 0.25 0.82 0.00 0.00 0.00 179.25 180.12 2wgi h ILE 75 N 0.89 1.22 -0.25 0.00 2.04 -1.12 -2.28 117.51 118.02 2wgi h ILE 75 Ca 0.26 -0.66 -0.09 0.00 1.00 0.00 0.00 64.86 65.37 2wgi h ILE 75 Cb -0.07 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 2wgi h ILE 75 CO -0.07 0.26 -0.18 0.40 0.00 0.00 0.00 178.15 178.56 2wgi h ILE 76 N 0.79 1.31 -0.71 -0.67 2.04 -0.72 -0.90 117.51 118.64 2wgi h ILE 76 Ca 0.19 -1.31 0.15 0.00 1.00 0.00 0.00 64.86 64.89 2wgi h ILE 76 Cb 0.17 1.61 -0.10 0.00 -0.74 0.00 0.00 36.82 37.75 2wgi h ILE 76 CO -0.02 0.41 0.17 1.23 0.00 0.00 0.00 178.15 179.94 2wgi h GLY 77 N 0.29 0.98 1.00 5.37 0.00 -0.41 -0.27 103.07 110.02 2wgi h GLY 77 Ca 0.05 -0.04 -0.14 0.00 0.00 0.00 0.00 47.33 47.20 2wgi h GLY 77 CO 0.05 -0.18 -0.40 1.41 0.00 0.00 0.00 176.54 177.42 2wgi h LEU 78 N 0.28 0.78 -0.60 3.11 3.38 -1.34 -0.42 115.31 120.51 2wgi h LEU 78 Ca 0.39 -0.52 0.03 0.00 0.09 0.00 0.00 57.88 57.87 2wgi h LEU 78 Cb 0.65 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 2wgi h LEU 78 CO -0.48 1.15 0.36 -0.33 0.09 0.00 0.00 178.44 179.23 2wgi h GLU 79 N 0.43 0.69 0.00 1.13 4.39 -0.57 -2.01 114.58 118.65 2wgi h GLU 79 Ca 0.02 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2wgi h GLU 79 Cb 0.99 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.49 2wgi h GLU 79 CO 0.09 0.46 0.00 0.25 -1.16 0.00 0.00 179.01 178.65 2wgi n THR 80 N -4.75 0.12 -1.10 1.13 -2.24 -0.17 -4.90 114.28 102.37 2wgi n THR 80 Ca 0.05 0.03 -0.03 0.00 -2.27 0.00 0.00 64.05 61.83 2wgi n THR 80 Cb 0.08 -0.56 -0.01 0.00 -2.10 0.00 0.00 70.33 67.74 2wgi n THR 80 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wgi n GLY 81 N 1.31 0.64 0.26 3.38 0.00 -0.75 -4.89 105.19 105.12 2wgi n GLY 81 Ca 0.07 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.55 2wgi n GLY 81 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wgi h VAL 82 N 0.00 1.27 -3.65 1.61 2.07 -1.45 -3.38 116.25 112.73 2wgi h VAL 82 Ca -0.07 -1.29 -0.64 0.00 0.82 0.00 0.00 66.70 65.51 2wgi h VAL 82 Cb 0.36 1.17 -0.15 0.00 -1.52 0.00 0.00 31.29 31.15 2wgi h VAL 82 CO 0.10 0.44 -0.15 -0.63 0.02 0.00 0.00 177.57 177.35 2wgi s ILE 83 N -4.72 5.10 0.08 4.57 1.01 -0.30 -5.01 121.20 121.93 2wgi s ILE 83 Ca -0.12 0.37 -0.19 0.00 0.00 0.00 0.00 60.65 60.71 2wgi s ILE 83 Cb 0.11 -3.85 -0.10 0.00 0.01 0.00 0.00 42.46 38.64 2wgi s ILE 83 CO 0.85 -0.07 1.52 0.50 0.00 0.00 0.00 174.94 177.74 2wgi h LYS 84 N 8.35 0.37 0.00 2.79 3.64 -1.88 -3.39 116.57 126.45 2wgi h LYS 84 Ca -0.29 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 2wgi h LYS 84 Cb 1.14 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 2wgi h LYS 84 CO 0.72 0.55 0.08 0.27 -2.27 0.00 0.00 179.45 178.79 2wgi n ASN 85 N -4.69 -0.47 0.29 4.20 0.23 -1.26 -4.99 115.26 108.57 2wgi n ASN 85 Ca -0.04 -1.31 0.16 0.00 -0.53 0.00 0.00 54.58 52.86 2wgi n ASN 85 Cb 0.22 0.78 0.90 0.00 -2.08 0.00 0.00 39.78 39.61 2wgi n ASN 85 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 2wgi h GLU 86 N 0.00 0.00 -0.35 -3.83 4.11 -1.99 -2.81 114.58 109.71 2wgi h GLU 86 Ca -0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.36 2wgi h GLU 86 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2wgi h GLU 86 CO 0.09 0.04 0.00 0.72 0.07 0.00 0.00 179.01 179.93 2wgi n HIS 87 N -3.55 0.44 -1.62 2.06 8.25 -1.26 -4.58 115.22 114.97 2wgi n HIS 87 Ca -0.02 -0.22 -0.49 0.00 -0.26 0.00 0.00 57.72 56.72 2wgi n HIS 87 Cb 0.15 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.21 2wgi n HIS 87 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 2wgi n GLN 88 N 1.18 1.52 -3.89 -0.41 -0.06 -1.06 -5.00 117.38 109.65 2wgi n GLN 88 Ca 0.18 0.55 -0.35 0.00 -2.00 0.00 0.00 57.00 55.38 2wgi n GLN 88 Cb 0.53 -2.21 -0.14 0.00 -4.06 0.00 0.00 30.24 24.36 2wgi n GLN 88 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 2wgi s VAL 89 N 0.49 3.41 -0.60 1.69 1.01 -1.26 -4.00 120.40 121.14 2wgi s VAL 89 Ca 0.80 -0.56 -0.24 0.00 0.00 0.00 0.00 61.98 61.98 2wgi s VAL 89 Cb -0.84 -2.59 0.05 0.00 0.00 0.00 0.00 36.38 33.00 2wgi s VAL 89 CO 0.45 0.36 0.99 -0.36 0.00 0.00 0.00 175.10 176.54 2wgi s PHE 90 N 1.47 2.71 0.20 5.22 0.08 0.18 -4.93 117.98 122.90 2wgi s PHE 90 Ca 0.05 -0.14 -0.30 0.00 0.12 0.00 0.00 56.93 56.66 2wgi s PHE 90 Cb -0.15 -4.20 -0.09 0.00 -0.57 0.00 0.00 43.02 38.01 2wgi s PHE 90 CO -0.03 -1.51 1.35 0.15 -0.10 0.00 0.00 175.22 175.09 2wgi s LYS 91 N 4.19 4.35 0.06 0.44 -0.14 -1.26 -2.15 119.74 125.22 2wgi s LYS 91 Ca 0.29 2.12 -0.30 0.00 -1.36 0.00 0.00 55.97 56.72 2wgi s LYS 91 Cb -0.13 -3.18 -0.05 0.00 -1.68 0.00 0.00 37.83 32.79 2wgi s LYS 91 CO 0.17 -0.32 1.14 -0.46 -0.76 0.00 0.00 175.35 175.11 2wgi s TRP 92 N 0.25 3.50 -1.17 3.18 -0.00 -1.26 -4.94 118.94 118.50 2wgi s TRP 92 Ca 0.59 1.42 0.26 0.00 -0.00 0.00 0.00 56.10 58.36 2wgi s TRP 92 Cb -0.38 -3.34 1.18 0.00 -0.00 0.00 0.00 33.47 30.93 2wgi s TRP 92 CO 0.38 -0.92 1.84 -0.40 -0.00 0.00 0.00 176.95 177.85 2wgi n ASP 93 N 3.79 0.00 0.00 5.86 5.75 -1.26 -4.89 116.55 125.80 2wgi n ASP 93 Ca 0.08 0.26 0.00 0.00 -0.01 0.00 0.00 54.79 55.12 2wgi n ASP 93 Cb 0.47 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 40.15 2wgi n ASP 93 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wgi n GLY 94 N 1.05 0.73 3.80 6.12 0.00 -1.26 -5.06 105.19 110.57 2wgi n GLY 94 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 2wgi n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wgi s LYS 95 N -0.73 4.37 0.31 1.61 -0.14 -1.26 -5.01 119.74 118.89 2wgi s LYS 95 Ca 0.00 1.03 -0.29 0.00 -1.36 0.00 0.00 55.97 55.35 2wgi s LYS 95 Cb 0.00 -2.84 -0.12 0.00 -1.68 0.00 0.00 37.83 33.19 2wgi s LYS 95 CO 0.00 0.35 1.49 -2.30 -0.76 0.00 0.00 175.35 174.12 2wgi n PRO 96 N 0.64 2.49 -4.37 -1.68 -0.02 -1.26 -5.00 135.00 125.80 2wgi n PRO 96 Ca -0.01 0.88 -0.29 0.00 -2.02 0.00 0.00 63.50 62.06 2wgi n PRO 96 Cb 0.51 -2.60 -0.06 0.00 -0.02 0.00 0.00 33.50 31.33 2wgi n PRO 96 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2wgi s ARG 97 N -1.12 2.20 0.32 -0.52 0.52 -1.26 -5.06 118.95 114.02 2wgi s ARG 97 Ca 0.61 -2.15 0.05 0.00 -0.52 0.00 0.00 55.73 53.71 2wgi s ARG 97 Cb -0.53 -1.79 0.54 0.00 0.52 0.00 0.00 34.95 33.69 2wgi s ARG 97 CO 0.55 -0.35 1.79 0.00 0.02 0.00 0.00 175.30 177.31 2wgi h ALA 98 N 1.24 1.25 -3.43 2.13 0.00 -1.98 -3.44 119.26 115.03 2wgi h ALA 98 Ca -0.42 -0.29 -0.49 0.00 0.00 0.00 0.00 54.91 53.71 2wgi h ALA 98 Cb 1.29 -0.12 -0.21 0.00 0.00 0.00 0.00 17.79 18.76 2wgi h ALA 98 CO 0.69 0.49 -0.80 -1.64 0.00 0.00 0.00 179.25 178.00 2wgi s MET 99 N -4.60 1.02 0.17 0.00 -1.94 -1.26 -5.07 119.30 107.62 2wgi s MET 99 Ca -0.06 -1.12 -0.11 0.00 -1.71 0.00 0.00 55.69 52.68 2wgi s MET 99 Cb 0.14 -1.13 0.07 0.00 2.01 0.00 0.00 34.83 35.92 2wgi s MET 99 CO 0.77 0.25 1.70 0.87 -0.01 0.00 0.00 175.02 178.60 2wgi h LYS 100 N 4.01 0.93 0.00 2.03 1.57 -1.99 -2.97 116.57 120.14 2wgi h LYS 100 Ca -0.43 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.15 2wgi h LYS 100 Cb 1.19 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.37 2wgi h LYS 100 CO 0.42 0.83 0.08 -0.56 -0.57 0.00 0.00 179.45 179.65 2wgi h GLN 101 N 0.84 0.00 0.00 3.15 -0.00 -1.97 0.17 115.11 117.30 2wgi h GLN 101 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.84 2wgi h GLN 101 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.77 2wgi h GLN 101 CO -0.01 0.00 -0.30 0.91 -0.00 0.00 0.00 178.83 179.43 2wgi n TRP 102 N -2.80 0.09 -1.93 0.06 8.01 -1.12 -4.47 117.44 115.28 2wgi n TRP 102 Ca -0.02 0.03 -0.40 0.00 -1.31 0.00 0.00 57.50 55.79 2wgi n TRP 102 Cb 0.13 -0.41 -0.01 0.00 -2.01 0.00 0.00 31.31 29.01 2wgi n TRP 102 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.69 177.07 2wgi n GLU 103 N -1.59 4.36 -3.60 -0.99 1.02 0.59 -4.84 120.64 115.58 2wgi n GLU 103 Ca 0.06 -3.29 -0.06 0.00 -0.02 0.00 0.00 57.16 53.85 2wgi n GLU 103 Cb 0.35 -2.69 -0.02 0.00 -0.02 0.00 0.00 31.44 29.06 2wgi n GLU 103 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2wgi s ARG 104 N -0.49 0.88 0.38 3.49 1.70 -1.26 -5.09 118.95 118.55 2wgi s ARG 104 Ca 0.55 -0.40 -0.27 0.00 -0.47 0.00 0.00 55.73 55.13 2wgi s ARG 104 Cb 0.17 0.35 -0.10 0.00 -0.57 0.00 0.00 34.95 34.81 2wgi s ARG 104 CO -0.08 -0.39 1.35 -0.51 -1.08 0.00 0.00 175.30 174.59 2wgi s ASP 105 N -2.65 6.45 0.03 -2.89 1.01 -1.26 -4.30 116.67 113.06 2wgi s ASP 105 Ca 0.08 2.77 0.02 0.00 0.71 0.00 0.00 52.55 56.14 2wgi s ASP 105 Cb -0.01 -2.65 -0.02 0.00 1.01 0.00 0.00 42.92 41.26 2wgi s ASP 105 CO -0.05 -0.76 -0.07 -0.76 0.21 0.00 0.00 175.17 173.74 2wgi s LEU 106 N -2.15 2.18 0.78 1.23 1.43 -0.91 -4.98 118.68 116.26 2wgi s LEU 106 Ca 0.53 -0.40 -0.07 0.00 -1.03 0.00 0.00 54.13 53.16 2wgi s LEU 106 Cb -0.41 -0.20 0.13 0.00 0.03 0.00 0.00 46.19 45.74 2wgi s LEU 106 CO 0.54 -0.12 1.09 0.42 0.23 0.00 0.00 176.35 178.52 2wgi s THR 107 N -0.98 2.15 0.09 5.49 -4.23 -1.26 -0.65 115.64 116.25 2wgi s THR 107 Ca -0.06 -0.33 -0.23 0.00 -1.18 0.00 0.00 61.69 59.90 2wgi s THR 107 Cb -0.07 -2.82 -0.14 0.00 1.34 0.00 0.00 72.50 70.81 2wgi s THR 107 CO 0.00 0.00 1.74 0.25 -0.54 0.00 0.00 174.62 176.07 2wgi h LEU 108 N -0.87 0.01 -0.38 4.79 5.85 -1.81 0.32 115.31 123.22 2wgi h LEU 108 Ca -0.41 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 2wgi h LEU 108 Cb 1.27 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.28 2wgi h LEU 108 CO 0.45 0.01 0.18 -0.09 -0.34 0.00 0.00 178.44 178.66 2wgi h ARG 109 N 0.03 0.55 -0.22 1.25 2.43 -1.91 -1.15 114.38 115.36 2wgi h ARG 109 Ca 0.01 -0.08 0.06 0.00 -0.81 0.00 0.00 59.98 59.16 2wgi h ARG 109 Cb 0.00 -0.10 -0.07 0.00 -0.42 0.00 0.00 29.97 29.39 2wgi h ARG 109 CO -0.01 0.49 -0.22 0.78 -1.51 0.00 0.00 179.97 179.50 2wgi h GLY 110 N 0.48 -0.13 1.48 2.80 0.00 -1.87 0.17 103.07 105.99 2wgi h GLY 110 Ca 0.13 0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.71 2wgi h GLY 110 CO -0.02 -0.19 0.17 0.00 0.00 0.00 0.00 176.54 176.50 2wgi h ALA 111 N 0.83 1.42 -0.28 3.60 0.00 -0.73 -1.29 119.26 122.81 2wgi h ALA 111 Ca 0.13 -0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.75 2wgi h ALA 111 Cb 0.43 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2wgi h ALA 111 CO -0.36 0.43 -0.43 0.82 0.00 0.00 0.00 179.25 179.71 2wgi h ILE 112 N 0.67 1.29 -0.22 0.00 2.04 -0.65 -1.44 117.51 119.21 2wgi h ILE 112 Ca 0.16 -1.62 -0.14 0.00 1.00 0.00 0.00 64.86 64.26 2wgi h ILE 112 Cb 0.16 1.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 2wgi h ILE 112 CO -0.01 0.52 -0.41 1.56 0.00 0.00 0.00 178.15 179.81 2wgi h GLN 113 N 0.53 0.66 -0.00 2.37 1.08 -0.33 -2.97 115.11 116.45 2wgi h GLN 113 Ca 0.02 -0.42 0.00 0.00 -1.45 0.00 0.00 58.65 56.80 2wgi h GLN 113 Cb 1.03 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.51 2wgi h GLN 113 CO 0.10 1.04 -0.25 1.33 -0.95 0.00 0.00 178.83 180.10 2wgi n VAL 114 N -4.22 0.00 -3.16 -0.54 0.24 -0.52 -4.97 118.33 105.17 2wgi n VAL 114 Ca -0.06 -0.01 -0.15 0.00 -2.04 0.00 0.00 64.34 62.09 2wgi n VAL 114 Cb 0.54 -0.09 0.06 0.00 -1.47 0.00 0.00 33.84 32.88 2wgi n VAL 114 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 2wgi n SER 115 N -1.41 -3.84 -4.55 -1.34 2.88 -0.64 -4.90 113.62 99.82 2wgi n SER 115 Ca 0.07 -0.40 -0.38 0.00 -1.33 0.00 0.00 58.87 56.83 2wgi n SER 115 Cb 0.33 -3.69 -0.03 0.00 -0.75 0.00 0.00 64.21 60.07 2wgi n SER 115 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wgi s ALA 116 N -3.23 2.16 0.14 -1.46 0.00 -0.64 -4.89 121.76 113.85 2wgi s ALA 116 Ca 0.24 -0.56 -0.17 0.00 0.00 0.00 0.00 51.96 51.47 2wgi s ALA 116 Cb -0.11 -4.29 -0.00 0.00 0.00 0.00 0.00 23.12 18.72 2wgi s ALA 116 CO 0.51 -3.88 1.78 0.28 0.00 0.00 0.00 175.76 174.45 2wgi h VAL 117 N 6.94 1.02 -0.63 0.00 2.07 -1.90 -2.80 116.25 120.94 2wgi h VAL 117 Ca -0.26 -0.12 0.05 0.00 0.82 0.00 0.00 66.70 67.19 2wgi h VAL 117 Cb 1.17 0.63 -0.04 0.00 -1.52 0.00 0.00 31.29 31.53 2wgi h VAL 117 CO 1.21 0.07 0.42 1.55 0.02 0.00 0.00 177.57 180.83 2wgi h PRO 118 N 0.36 0.65 -0.25 1.57 0.13 -1.99 0.36 132.00 132.84 2wgi h PRO 118 Ca 0.13 -0.04 0.03 0.00 -0.87 0.00 0.00 66.00 65.25 2wgi h PRO 118 Cb 0.01 -0.15 -0.03 0.00 0.13 0.00 0.00 31.00 30.97 2wgi h PRO 118 CO -0.07 0.43 0.07 0.28 -0.23 0.00 0.00 178.00 178.48 2wgi h VAL 119 N 0.67 0.91 0.00 1.56 2.07 -1.91 -1.43 116.25 118.12 2wgi h VAL 119 Ca 0.27 -0.06 -0.09 0.00 0.82 0.00 0.00 66.70 67.64 2wgi h VAL 119 Cb 0.21 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 2wgi h VAL 119 CO -0.08 0.03 -0.41 -0.26 0.02 0.00 0.00 177.57 176.87 2wgi h PHE 120 N 0.17 0.00 -0.49 1.57 0.04 -1.30 -2.53 116.94 114.40 2wgi h PHE 120 Ca 0.11 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.87 2wgi h PHE 120 Cb 0.09 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.22 2wgi h PHE 120 CO -0.14 0.41 0.28 1.96 -0.60 0.00 0.00 178.31 180.22 2wgi h GLN 121 N 0.00 0.68 -0.53 1.51 4.20 -0.09 -2.27 115.11 118.61 2wgi h GLN 121 Ca -0.00 -0.07 -0.08 0.00 0.06 0.00 0.00 58.65 58.55 2wgi h GLN 121 Cb 1.24 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.86 2wgi h GLN 121 CO 0.05 0.52 -0.00 0.37 -0.67 0.00 0.00 178.83 179.10 2wgi h GLN 122 N 0.66 0.90 -0.25 1.46 5.75 -1.14 -1.08 115.11 121.40 2wgi h GLN 122 Ca 0.17 -0.26 -0.01 0.00 -0.15 0.00 0.00 58.65 58.40 2wgi h GLN 122 Cb 0.03 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 28.47 2wgi h GLN 122 CO -0.03 0.90 0.12 0.82 -2.65 0.00 0.00 178.83 177.99 2wgi h ILE 123 N 0.84 1.14 -0.05 2.39 2.04 -1.38 -2.84 117.51 119.66 2wgi h ILE 123 Ca 0.16 -0.41 -0.09 0.00 1.00 0.00 0.00 64.86 65.52 2wgi h ILE 123 Cb 0.50 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 2wgi h ILE 123 CO 0.02 0.14 -0.41 0.00 0.00 0.00 0.00 178.15 177.91 2wgi h ALA 124 N 0.99 1.23 -0.32 1.87 0.00 -1.23 -1.58 119.26 120.22 2wgi h ALA 124 Ca 0.09 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2wgi h ALA 124 Cb 0.11 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2wgi h ALA 124 CO -0.01 0.55 0.20 -0.09 0.00 0.00 0.00 179.25 179.90 2wgi h ARG 125 N 0.09 0.43 -0.52 0.00 2.43 -1.09 -2.06 114.38 113.66 2wgi h ARG 125 Ca 0.01 -0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.02 2wgi h ARG 125 Cb 0.76 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.20 2wgi h ARG 125 CO 0.06 0.30 -0.16 0.93 -1.51 0.00 0.00 179.97 179.59 2wgi h GLU 126 N 0.42 1.02 -0.90 0.20 3.07 -1.27 -3.06 114.58 114.08 2wgi h GLU 126 Ca 0.12 -0.41 0.06 0.00 -0.50 0.00 0.00 59.36 58.63 2wgi h GLU 126 Cb -0.03 -0.05 -0.06 0.00 -0.84 0.00 0.00 28.75 27.77 2wgi h GLU 126 CO -0.02 1.09 0.56 0.28 -1.40 0.00 0.00 179.01 179.52 2wgi h VAL 127 N 0.90 1.06 0.00 3.13 2.07 -1.16 -3.49 116.25 118.75 2wgi h VAL 127 Ca 0.13 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.29 2wgi h VAL 127 Cb 0.73 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 2wgi h VAL 127 CO 0.06 0.19 0.00 0.61 0.02 0.00 0.00 177.57 178.45 2wgi n GLY 128 N -1.34 -0.28 0.32 2.17 0.00 -0.79 -4.34 105.19 100.94 2wgi n GLY 128 Ca 0.13 -1.50 -0.07 0.00 0.00 0.00 0.00 46.02 44.58 2wgi n GLY 128 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2wgi h GLU 129 N 0.00 1.14 -0.35 1.61 5.08 -1.87 -2.51 114.58 117.68 2wgi h GLU 129 Ca 0.00 -0.27 -0.05 0.00 -1.00 0.00 0.00 59.36 58.04 2wgi h GLU 129 Cb 0.00 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 2wgi h GLU 129 CO 0.00 1.00 0.04 0.28 -1.00 0.00 0.00 179.01 179.33 2wgi h VAL 130 N 1.08 1.25 -0.50 3.13 2.07 -1.98 -1.44 116.25 119.85 2wgi h VAL 130 Ca 0.23 -0.88 -0.03 0.00 0.82 0.00 0.00 66.70 66.83 2wgi h VAL 130 Cb 0.37 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 2wgi h VAL 130 CO 0.00 0.30 0.19 0.03 0.02 0.00 0.00 177.57 178.11 2wgi h ARG 131 N 0.42 0.76 -0.29 1.57 3.08 -1.74 -2.45 114.38 115.73 2wgi h ARG 131 Ca 0.10 -0.15 -0.00 0.00 0.07 0.00 0.00 59.98 60.01 2wgi h ARG 131 Cb 0.39 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 2wgi h ARG 131 CO 0.01 0.68 0.17 1.98 -1.07 0.00 0.00 179.97 181.75 2wgi h MET 132 N 0.67 0.39 -0.61 0.04 4.05 -1.42 -2.59 114.93 115.48 2wgi h MET 132 Ca 0.17 -0.04 0.12 0.00 -0.28 0.00 0.00 59.70 59.67 2wgi h MET 132 Cb 0.22 -0.08 -0.12 0.00 -0.80 0.00 0.00 31.60 30.82 2wgi h MET 132 CO -0.01 0.30 -0.18 0.37 0.23 0.00 0.00 176.91 177.62 2wgi h GLN 133 N 0.37 -0.03 0.37 0.39 5.75 -1.14 -2.02 115.11 118.81 2wgi h GLN 133 Ca 0.10 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.59 2wgi h GLN 133 Cb 0.01 0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.57 2wgi h GLN 133 CO -0.02 -0.02 -0.18 -0.22 -2.65 0.00 0.00 178.83 175.74 2wgi h LYS 134 N -0.03 -0.48 -0.98 1.69 3.64 -1.13 -2.36 116.57 116.92 2wgi h LYS 134 Ca 0.29 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.73 2wgi h LYS 134 Cb 0.47 0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.35 2wgi h LYS 134 CO -0.64 -0.25 0.65 1.88 -2.27 0.00 0.00 179.45 178.82 2wgi h TYR 135 N -0.63 1.22 -0.18 1.91 0.05 -1.34 -0.69 116.97 117.31 2wgi h TYR 135 Ca -0.05 0.03 0.02 0.00 0.05 0.00 0.00 58.73 58.77 2wgi h TYR 135 Cb 0.46 -0.41 -0.02 0.00 1.01 0.00 0.00 36.73 37.77 2wgi h TYR 135 CO -0.02 0.73 0.07 -0.07 -1.05 0.00 0.00 178.16 177.81 2wgi h LEU 136 N 1.28 0.08 -0.55 3.88 3.38 -1.30 0.27 115.31 122.35 2wgi h LEU 136 Ca 0.38 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.46 2wgi h LEU 136 Cb -0.05 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.62 2wgi h LEU 136 CO -0.11 0.07 0.12 0.50 0.09 0.00 0.00 178.44 179.12 2wgi h LYS 137 N 0.15 0.26 -0.59 1.13 3.64 -0.88 -1.05 116.57 119.23 2wgi h LYS 137 Ca 0.08 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2wgi h LYS 137 Cb 0.04 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 2wgi h LYS 137 CO -0.07 0.17 0.39 -0.22 -2.27 0.00 0.00 179.45 177.45 2wgi h LYS 138 N 0.26 0.76 -0.00 1.90 3.64 -0.19 -1.52 116.57 121.42 2wgi h LYS 138 Ca 0.28 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.62 2wgi h LYS 138 Cb 0.39 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 2wgi h LYS 138 CO -0.35 0.50 -0.22 1.19 -2.27 0.00 0.00 179.45 178.30 2wgi n PHE 139 N -4.45 0.00 -3.77 1.91 3.72 0.86 -4.76 117.46 110.98 2wgi n PHE 139 Ca 0.06 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.19 2wgi n PHE 139 Cb 0.06 -0.27 0.05 0.00 -0.94 0.00 0.00 39.48 38.38 2wgi n PHE 139 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2wgi n SER 140 N -1.22 -5.32 -4.47 4.37 7.64 -0.49 -4.92 113.62 109.21 2wgi n SER 140 Ca 0.10 -0.68 -0.43 0.00 1.01 0.00 0.00 58.87 58.87 2wgi n SER 140 Cb 0.32 -4.40 -0.05 0.00 -1.01 0.00 0.00 64.21 59.06 2wgi n SER 140 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2wgi s TYR 141 N -3.32 2.91 0.00 1.43 5.04 -0.63 -4.97 117.35 117.81 2wgi s TYR 141 Ca 0.60 -0.36 0.00 0.00 -2.44 0.00 0.00 57.07 54.88 2wgi s TYR 141 Cb -0.29 -3.85 0.00 0.00 0.35 0.00 0.00 41.96 38.17 2wgi s TYR 141 CO 0.79 -1.23 0.00 0.41 -1.34 0.00 0.00 175.55 174.17 2wgi n GLY 142 N 5.17 -2.54 0.06 8.97 0.00 -1.26 -4.76 105.19 110.82 2wgi n GLY 142 Ca -0.03 -1.64 -0.01 0.00 0.00 0.00 0.00 46.02 44.34 2wgi n GLY 142 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2wgi n ASN 143 N -0.38 -0.14 -1.39 1.61 6.94 0.14 -4.98 115.26 117.06 2wgi n ASN 143 Ca 0.00 0.27 0.17 0.00 -0.02 0.00 0.00 54.58 55.00 2wgi n ASN 143 Cb 0.00 -0.04 -0.08 0.00 -2.36 0.00 0.00 39.78 37.30 2wgi n ASN 143 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2wgi n ALA 154 N -3.90 -3.67 1.52 -2.53 0.00 -1.26 -5.06 120.51 105.61 2wgi n ALA 154 Ca 0.01 0.78 0.14 0.00 0.00 0.00 0.00 53.44 54.37 2wgi n ALA 154 Cb 0.05 -1.47 0.56 0.00 0.00 0.00 0.00 19.45 18.59 2wgi n ALA 154 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2wgi n LEU 155 N -4.22 1.17 -3.15 0.00 -0.00 -1.26 -3.73 117.00 105.81 2wgi n LEU 155 Ca -0.06 -0.37 0.04 0.00 -0.00 0.00 0.00 56.01 55.62 2wgi n LEU 155 Cb 0.66 -0.03 -0.01 0.00 -0.00 0.00 0.00 43.42 44.04 2wgi n LEU 155 CO 0.03 0.20 0.30 -1.83 -0.00 0.00 0.00 177.39 176.09 2wgi s GLU 156 N -2.11 0.43 0.00 1.47 4.04 -1.26 -4.74 118.70 116.53 2wgi s GLU 156 Ca 0.37 0.68 0.00 0.00 0.04 0.00 0.00 54.97 56.05 2wgi s GLU 156 Cb 0.21 0.37 0.00 0.00 0.02 0.00 0.00 34.13 34.72 2wgi s GLU 156 CO 0.38 -0.55 0.00 0.41 -1.84 0.00 0.00 175.26 173.66 2wgi n GLY 157 N 5.42 3.52 0.00 -3.83 0.00 -1.26 -5.06 105.19 103.97 2wgi n GLY 157 Ca -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2wgi n GLY 157 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2wgi n GLN 158 N 0.00 0.49 -3.61 1.61 1.13 -1.26 -5.06 117.38 110.67 2wgi n GLN 158 Ca 0.00 -0.07 -0.36 0.00 -1.94 0.00 0.00 57.00 54.62 2wgi n GLN 158 Cb 0.00 -0.43 -0.08 0.00 0.11 0.00 0.00 30.24 29.84 2wgi n GLN 158 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 2wgi s LEU 159 N -0.18 4.16 0.16 1.08 2.96 -1.26 -5.00 118.68 120.60 2wgi s LEU 159 Ca 0.00 0.27 0.06 0.00 -0.22 0.00 0.00 54.13 54.24 2wgi s LEU 159 Cb 0.00 -2.21 -0.04 0.00 0.50 0.00 0.00 46.19 44.44 2wgi s LEU 159 CO 0.00 0.07 -0.14 -0.13 -1.32 0.00 0.00 176.35 174.84 2wgi s ARG 160 N 0.84 1.16 -0.02 1.98 0.52 -1.26 -4.20 118.95 117.96 2wgi s ARG 160 Ca 0.11 -1.41 -0.06 0.00 -0.52 0.00 0.00 55.73 53.85 2wgi s ARG 160 Cb -0.13 -0.97 0.01 0.00 0.52 0.00 0.00 34.95 34.38 2wgi s ARG 160 CO 0.03 0.17 0.13 -1.50 0.02 0.00 0.00 175.30 174.15 2wgi s ILE 161 N -2.61 0.04 0.49 1.52 2.07 0.92 0.28 121.20 123.91 2wgi s ILE 161 Ca 0.15 -0.36 -0.01 0.00 -1.41 0.00 0.00 60.65 59.02 2wgi s ILE 161 Cb -0.02 -0.31 0.00 0.00 0.13 0.00 0.00 42.46 42.26 2wgi s ILE 161 CO 0.04 -0.20 0.73 -0.94 -1.91 0.00 0.00 174.94 172.66 2wgi s SER 162 N -0.65 5.75 0.31 4.50 1.04 -1.26 -1.47 113.70 121.92 2wgi s SER 162 Ca -0.07 0.37 0.08 0.00 0.48 0.00 0.00 55.95 56.81 2wgi s SER 162 Cb -0.04 -1.54 0.52 0.00 0.10 0.00 0.00 66.02 65.06 2wgi s SER 162 CO 0.01 -0.81 1.74 0.00 0.98 0.00 0.00 173.24 175.16 2wgi h ALA 163 N 0.25 1.19 -0.21 5.32 0.00 -1.72 -0.75 119.26 123.33 2wgi h ALA 163 Ca -0.46 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.03 2wgi h ALA 163 Cb 1.26 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2wgi h ALA 163 CO 0.58 0.55 -0.02 0.28 0.00 0.00 0.00 179.25 180.64 2wgi h VAL 164 N 0.17 1.27 -0.71 0.00 2.07 -1.82 -2.78 116.25 114.45 2wgi h VAL 164 Ca 0.02 -0.94 0.08 0.00 0.82 0.00 0.00 66.70 66.67 2wgi h VAL 164 Cb 0.75 1.47 -0.06 0.00 -1.52 0.00 0.00 31.29 31.93 2wgi h VAL 164 CO 0.06 0.29 0.39 -1.13 0.02 0.00 0.00 177.57 177.19 2wgi h ASN 165 N 0.13 0.55 -0.46 0.57 -0.00 -1.79 -2.31 115.58 112.27 2wgi h ASN 165 Ca 0.06 0.04 -0.00 0.00 -0.00 0.00 0.00 56.30 56.39 2wgi h ASN 165 Cb 0.44 -0.06 -0.02 0.00 -0.00 0.00 0.00 38.32 38.67 2wgi h ASN 165 CO 0.01 0.34 0.27 1.56 -0.00 0.00 0.00 177.43 179.61 2wgi h GLN 166 N 0.69 0.63 -0.54 6.67 1.08 -1.09 -2.07 115.11 120.47 2wgi h GLN 166 Ca 0.33 -0.06 -0.07 0.00 -1.45 0.00 0.00 58.65 57.40 2wgi h GLN 166 Cb 0.27 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.55 2wgi h GLN 166 CO -0.22 0.47 0.04 0.28 -0.95 0.00 0.00 178.83 178.45 2wgi h VAL 167 N 0.61 1.25 -0.45 -0.54 2.07 -1.22 -0.80 116.25 117.16 2wgi h VAL 167 Ca 0.16 -1.00 -0.10 0.00 0.82 0.00 0.00 66.70 66.58 2wgi h VAL 167 Cb 0.01 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2wgi h VAL 167 CO -0.03 0.36 -0.14 -0.33 0.02 0.00 0.00 177.57 177.45 2wgi h GLU 168 N 0.84 0.84 -0.30 1.57 5.08 -1.20 -2.16 114.58 119.25 2wgi h GLU 168 Ca 0.17 -0.30 -0.07 0.00 -1.00 0.00 0.00 59.36 58.15 2wgi h GLU 168 Cb 0.44 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 2wgi h GLU 168 CO 0.02 0.93 -0.10 0.35 -1.00 0.00 0.00 179.01 179.20 2wgi h PHE 169 N 0.75 0.67 -0.12 4.33 3.57 -1.08 -2.89 116.94 122.17 2wgi h PHE 169 Ca 0.12 -0.15 -0.08 0.00 3.53 0.00 0.00 57.97 61.38 2wgi h PHE 169 Cb 0.65 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 2wgi h PHE 169 CO 0.04 0.80 -0.29 -0.07 -2.23 0.00 0.00 178.31 176.56 2wgi h LEU 170 N 0.35 0.22 0.44 0.59 3.38 -1.07 -2.29 115.31 116.93 2wgi h LEU 170 Ca 0.07 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2wgi h LEU 170 Cb 0.60 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2wgi h LEU 170 CO 0.03 0.51 -0.21 -0.08 0.09 0.00 0.00 178.44 178.78 2wgi h GLU 171 N 0.20 -0.57 -0.75 1.13 4.81 -1.37 -2.02 114.58 116.01 2wgi h GLU 171 Ca 0.03 0.04 0.15 0.00 -0.13 0.00 0.00 59.36 59.45 2wgi h GLU 171 Cb 0.61 0.13 -0.10 0.00 0.63 0.00 0.00 28.75 30.02 2wgi h GLU 171 CO 0.04 -0.34 0.26 0.77 -0.73 0.00 0.00 179.01 179.01 2wgi h SER 172 N -0.66 0.20 -0.56 1.04 0.02 -1.29 0.73 113.55 113.04 2wgi h SER 172 Ca -0.06 0.12 0.03 0.00 -0.84 0.00 0.00 61.79 61.05 2wgi h SER 172 Cb 0.49 0.12 -0.04 0.00 0.14 0.00 0.00 62.40 63.11 2wgi h SER 172 CO 0.10 0.05 0.32 0.25 -1.14 0.00 0.00 176.83 176.41 2wgi h LEU 173 N 0.38 0.50 -0.75 5.07 5.85 -1.35 0.17 115.31 125.19 2wgi h LEU 173 Ca 0.42 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 59.07 2wgi h LEU 173 Cb 0.67 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 2wgi h LEU 173 CO -0.44 0.34 0.05 0.22 -0.34 0.00 0.00 178.44 178.28 2wgi h TYR 174 N 0.62 1.08 -0.00 1.25 3.20 -0.16 -2.74 116.97 120.21 2wgi h TYR 174 Ca 0.23 -0.16 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2wgi h TYR 174 Cb 0.07 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.05 2wgi h TYR 174 CO -0.07 0.93 -0.06 1.28 -1.64 0.00 0.00 178.16 178.60 2wgi n LEU 175 N -4.20 0.50 -1.24 2.82 4.77 -0.23 -4.92 117.00 114.50 2wgi n LEU 175 Ca 0.04 -0.07 -0.11 0.00 -0.03 0.00 0.00 56.01 55.83 2wgi n LEU 175 Cb 0.31 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.28 2wgi n LEU 175 CO 0.43 0.09 -0.14 0.59 -1.33 0.00 0.00 177.39 177.03 2wgi n ASN 176 N -0.79 -3.78 -0.19 -1.43 3.02 -0.65 -4.96 115.26 106.48 2wgi n ASN 176 Ca 0.18 0.03 0.12 0.00 -0.03 0.00 0.00 54.58 54.88 2wgi n ASN 176 Cb 0.24 -2.90 0.21 0.00 -0.61 0.00 0.00 39.78 36.72 2wgi n ASN 176 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2wgi n LYS 177 N -2.18 0.56 -1.58 3.52 5.02 0.51 -4.87 118.16 119.14 2wgi n LYS 177 Ca -0.13 -0.38 -0.33 0.00 -2.02 0.00 0.00 58.31 55.45 2wgi n LYS 177 Cb 0.57 -1.49 0.07 0.00 -0.02 0.00 0.00 35.03 34.15 2wgi n LYS 177 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2wgi s LEU 178 N -2.70 3.31 -1.09 -0.35 1.43 -1.25 -4.88 118.68 113.15 2wgi s LEU 178 Ca 0.17 2.06 -0.20 0.00 -1.03 0.00 0.00 54.13 55.13 2wgi s LEU 178 Cb 0.18 -4.56 -0.07 0.00 0.03 0.00 0.00 46.19 41.78 2wgi s LEU 178 CO 0.63 -1.88 1.95 -1.20 0.23 0.00 0.00 176.35 176.09 2wgi n SER 179 N -2.69 3.27 -3.51 2.29 7.64 -1.26 -4.76 113.62 114.60 2wgi n SER 179 Ca 0.11 -2.75 -0.14 0.00 1.01 0.00 0.00 58.87 57.10 2wgi n SER 179 Cb 0.52 -1.48 -0.04 0.00 -1.01 0.00 0.00 64.21 62.20 2wgi n SER 179 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wgi s ALA 180 N 6.20 -1.78 0.49 -0.43 0.00 -1.26 -5.05 121.76 119.93 2wgi s ALA 180 Ca 0.58 1.18 -0.23 0.00 0.00 0.00 0.00 51.96 53.49 2wgi s ALA 180 Cb 0.09 0.07 -0.07 0.00 0.00 0.00 0.00 23.12 23.20 2wgi s ALA 180 CO 0.08 -0.48 1.25 -1.13 0.00 0.00 0.00 175.76 175.48 2wgi n SER 181 N 0.44 2.31 -0.22 0.00 3.41 -1.26 -4.91 113.62 113.38 2wgi n SER 181 Ca -0.15 1.01 -0.02 0.00 -0.26 0.00 0.00 58.87 59.45 2wgi n SER 181 Cb 0.59 -1.51 0.09 0.00 -0.26 0.00 0.00 64.21 63.12 2wgi n SER 181 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2wgi h LYS 182 N 1.60 0.67 -0.73 4.33 3.64 -1.94 -2.57 116.57 121.56 2wgi h LYS 182 Ca -0.49 -0.04 0.16 0.00 -1.27 0.00 0.00 60.65 59.01 2wgi h LYS 182 Cb 1.31 -0.15 -0.12 0.00 -0.41 0.00 0.00 32.23 32.86 2wgi h LYS 182 CO 0.57 0.44 0.11 1.49 -2.27 0.00 0.00 179.45 179.79 2wgi h GLU 183 N 0.69 0.19 -0.24 1.90 4.81 -2.00 -1.81 114.58 118.11 2wgi h GLU 183 Ca 0.29 -0.01 -0.17 0.00 -0.13 0.00 0.00 59.36 59.34 2wgi h GLU 183 Cb 0.15 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 2wgi h GLU 183 CO -0.17 0.12 -0.53 -0.91 -0.73 0.00 0.00 179.01 176.80 2wgi h ASN 184 N 0.19 0.76 -0.17 1.04 2.35 -1.84 -2.48 115.58 115.45 2wgi h ASN 184 Ca 0.41 -0.40 -0.07 0.00 -0.55 0.00 0.00 56.30 55.69 2wgi h ASN 184 Cb 0.71 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.85 2wgi h ASN 184 CO -0.56 1.14 -0.11 1.56 -1.65 0.00 0.00 177.43 177.81 2wgi h GLN 185 N 0.53 0.53 -0.49 0.81 4.20 -1.33 -2.63 115.11 116.72 2wgi h GLN 185 Ca 0.02 -0.15 -0.06 0.00 0.06 0.00 0.00 58.65 58.51 2wgi h GLN 185 Cb 1.09 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.80 2wgi h GLN 185 CO 0.11 0.64 0.07 -0.07 -0.67 0.00 0.00 178.83 178.90 2wgi h LEU 186 N 0.49 0.79 -0.34 1.46 3.38 -1.20 -0.59 115.31 119.29 2wgi h LEU 186 Ca 0.09 -0.27 0.04 0.00 0.09 0.00 0.00 57.88 57.84 2wgi h LEU 186 Cb 0.49 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 2wgi h LEU 186 CO 0.03 0.86 0.10 0.40 0.09 0.00 0.00 178.44 179.92 2wgi h ILE 187 N 0.70 0.88 -0.29 1.22 2.04 -1.19 -1.14 117.51 119.72 2wgi h ILE 187 Ca 0.15 -0.08 -0.14 0.00 1.00 0.00 0.00 64.86 65.79 2wgi h ILE 187 Cb 0.41 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 2wgi h ILE 187 CO 0.01 0.04 -0.39 0.58 0.00 0.00 0.00 178.15 178.39 2wgi h VAL 188 N 0.24 1.29 -0.20 1.67 2.07 -1.45 -2.15 116.25 117.72 2wgi h VAL 188 Ca 0.16 -1.56 0.04 0.00 0.82 0.00 0.00 66.70 66.16 2wgi h VAL 188 Cb 0.15 1.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 2wgi h VAL 188 CO -0.18 0.50 -0.06 0.11 0.02 0.00 0.00 177.57 177.96 2wgi h LYS 189 N 0.56 -0.02 -0.79 1.57 1.57 -0.66 -1.48 116.57 117.33 2wgi h LYS 189 Ca 0.05 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 2wgi h LYS 189 Cb 0.92 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.20 2wgi h LYS 189 CO 0.08 -0.01 0.39 1.49 -0.57 0.00 0.00 179.45 180.82 2wgi h GLU 190 N -0.02 1.14 -0.10 3.15 4.81 -1.20 -2.61 114.58 119.75 2wgi h GLU 190 Ca 0.10 -0.16 0.03 0.00 -0.13 0.00 0.00 59.36 59.19 2wgi h GLU 190 Cb 0.17 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.34 2wgi h GLU 190 CO -0.22 0.88 0.09 0.00 -0.73 0.00 0.00 179.01 179.03 2wgi h ALA 191 N 1.20 1.81 -0.01 2.92 0.00 -0.82 -2.39 119.26 121.96 2wgi h ALA 191 Ca 0.27 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2wgi h ALA 191 Cb 0.11 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2wgi h ALA 191 CO -0.04 -0.14 0.00 1.28 0.00 0.00 0.00 179.25 180.36 2wgi n LEU 192 N -4.06 1.47 -4.67 0.00 4.77 -0.61 -4.78 117.00 109.12 2wgi n LEU 192 Ca -0.01 -0.49 -0.42 0.00 -0.03 0.00 0.00 56.01 55.06 2wgi n LEU 192 Cb 0.20 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.26 2wgi n LEU 192 CO 0.30 0.24 1.44 -0.69 -1.33 0.00 0.00 177.39 177.35 2wgi s VAL 193 N -2.00 3.15 -0.01 4.08 1.01 -0.90 -1.83 120.40 123.89 2wgi s VAL 193 Ca 0.38 0.36 0.02 0.00 0.00 0.00 0.00 61.98 62.74 2wgi s VAL 193 Cb 0.21 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 33.33 2wgi s VAL 193 CO 0.34 -0.02 0.02 0.35 0.00 0.00 0.00 175.10 175.78 2wgi n THR 194 N 5.22 0.09 -3.77 3.92 -2.24 0.30 -4.95 114.28 112.86 2wgi n THR 194 Ca 0.18 -0.07 -0.13 0.00 -2.27 0.00 0.00 64.05 61.75 2wgi n THR 194 Cb 0.41 -0.56 -0.14 0.00 -2.10 0.00 0.00 70.33 67.94 2wgi n THR 194 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2wgi s GLU 195 N -2.07 0.12 -0.05 -0.78 2.12 -1.18 -5.02 118.70 111.83 2wgi s GLU 195 Ca -0.01 0.34 0.04 0.00 0.36 0.00 0.00 54.97 55.70 2wgi s GLU 195 Cb 0.01 -0.11 0.00 0.00 0.26 0.00 0.00 34.13 34.28 2wgi s GLU 195 CO 0.08 -0.13 -0.17 0.00 -0.54 0.00 0.00 175.26 174.50 2wgi s ALA 196 N 0.91 1.56 0.10 6.30 0.00 -1.26 -0.92 121.76 128.45 2wgi s ALA 196 Ca -0.07 -0.67 -0.02 0.00 0.00 0.00 0.00 51.96 51.19 2wgi s ALA 196 Cb -0.09 -0.56 -0.03 0.00 0.00 0.00 0.00 23.12 22.44 2wgi s ALA 196 CO -0.05 0.25 0.06 0.00 0.00 0.00 0.00 175.76 176.02 2wgi s ALA 197 N 0.20 0.58 0.55 0.00 0.00 -0.29 -5.03 121.76 117.77 2wgi s ALA 197 Ca -0.08 -1.26 0.28 0.00 0.00 0.00 0.00 51.96 50.90 2wgi s ALA 197 Cb -0.13 0.64 1.70 0.00 0.00 0.00 0.00 23.12 25.33 2wgi s ALA 197 CO 0.03 -0.47 2.21 -1.00 0.00 0.00 0.00 175.76 176.54 2wgi h PRO 198 N 2.92 0.00 -0.00 0.00 0.13 -2.03 -3.13 132.00 129.89 2wgi h PRO 198 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2wgi h PRO 198 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2wgi h PRO 198 CO 0.60 0.02 0.00 -0.85 -0.23 0.00 0.00 178.00 177.54 2wgi n GLU 199 N -3.88 -0.74 -3.71 0.86 -0.00 -1.26 -5.06 120.64 106.86 2wgi n GLU 199 Ca -0.03 -0.59 -0.13 0.00 -0.00 0.00 0.00 57.16 56.41 2wgi n GLU 199 Cb 0.11 -1.02 -0.07 0.00 -0.00 0.00 0.00 31.44 30.46 2wgi n GLU 199 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.13 178.65 2wgi s TYR 200 N -0.11 -0.23 -0.03 -1.84 -0.85 -1.18 -3.44 117.35 109.67 2wgi s TYR 200 Ca 0.01 0.24 0.01 0.00 -0.52 0.00 0.00 57.07 56.81 2wgi s TYR 200 Cb 0.01 0.16 0.02 0.00 0.38 0.00 0.00 41.96 42.53 2wgi s TYR 200 CO 0.01 -0.50 -0.03 -1.17 -1.52 0.00 0.00 175.55 172.34 2wgi s LEU 201 N -1.76 1.36 -0.21 -3.49 2.96 -0.74 -1.14 118.68 115.66 2wgi s LEU 201 Ca -0.08 -0.08 -0.01 0.00 -0.22 0.00 0.00 54.13 53.74 2wgi s LEU 201 Cb -0.02 -0.32 0.02 0.00 0.50 0.00 0.00 46.19 46.37 2wgi s LEU 201 CO 0.00 -0.06 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.17 2wgi s VAL 202 N 0.81 2.63 -0.20 1.68 1.01 -0.10 -1.81 120.40 124.42 2wgi s VAL 202 Ca -0.09 -0.87 -0.10 0.00 0.00 0.00 0.00 61.98 60.92 2wgi s VAL 202 Cb -0.12 -2.21 -0.05 0.00 0.00 0.00 0.00 36.38 33.99 2wgi s VAL 202 CO -0.01 0.40 0.13 -1.00 0.00 0.00 0.00 175.10 174.62 2wgi s HIS 203 N 1.34 3.40 0.19 5.22 3.76 -0.75 -0.54 115.29 127.91 2wgi s HIS 203 Ca 0.03 0.32 -0.23 0.00 -0.15 0.00 0.00 55.06 55.03 2wgi s HIS 203 Cb -0.15 -2.17 0.06 0.00 1.11 0.00 0.00 32.58 31.43 2wgi s HIS 203 CO -0.08 0.27 0.68 -1.54 -0.85 0.00 0.00 174.74 173.21 2wgi s SER 204 N 0.42 -0.44 -0.15 1.40 1.04 -0.76 -0.55 113.70 114.66 2wgi s SER 204 Ca 0.08 -0.21 -0.10 0.00 0.48 0.00 0.00 55.95 56.20 2wgi s SER 204 Cb -0.11 0.62 0.05 0.00 0.10 0.00 0.00 66.02 66.68 2wgi s SER 204 CO -0.01 -1.06 0.37 -0.75 0.98 0.00 0.00 173.24 172.77 2wgi s LYS 205 N -3.74 0.37 0.52 4.02 2.47 0.15 -4.84 119.74 118.70 2wgi s LYS 205 Ca 0.05 0.66 -0.06 0.00 -1.56 0.00 0.00 55.97 55.06 2wgi s LYS 205 Cb -0.03 0.03 -0.03 0.00 -1.46 0.00 0.00 37.83 36.35 2wgi s LYS 205 CO -0.06 -0.13 0.84 0.95 0.16 0.00 0.00 175.35 177.11 2wgi s THR 206 N 1.02 4.60 -0.03 3.43 -4.23 -1.26 -1.61 115.64 117.56 2wgi s THR 206 Ca -0.07 0.23 -0.11 0.00 -1.18 0.00 0.00 61.69 60.56 2wgi s THR 206 Cb -0.07 -3.77 0.02 0.00 1.34 0.00 0.00 72.50 70.02 2wgi s THR 206 CO -0.08 -0.79 0.25 -0.83 -0.54 0.00 0.00 174.62 172.62 2wgi s GLY 207 N -4.16 -0.10 -0.29 3.99 0.00 -0.43 -4.02 107.32 102.31 2wgi s GLY 207 Ca 0.50 0.27 -0.06 0.00 0.00 0.00 0.00 44.72 45.42 2wgi s GLY 207 CO 0.46 0.10 0.62 -0.12 0.00 0.00 0.00 173.10 174.16 2wgi s PHE 208 N -1.06 -1.42 -0.71 1.90 5.36 -1.26 0.16 117.98 120.96 2wgi s PHE 208 Ca -0.11 2.03 0.26 0.00 -0.96 0.00 0.00 56.93 58.15 2wgi s PHE 208 Cb -0.05 0.68 0.71 0.00 -0.34 0.00 0.00 43.02 44.01 2wgi s PHE 208 CO 0.03 -0.75 1.68 -1.13 -1.46 0.00 0.00 175.22 173.59 2wgi n SER 209 N 5.44 0.81 0.00 6.13 3.41 -0.55 -4.82 113.62 124.04 2wgi n SER 209 Ca -0.07 0.48 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 2wgi n SER 209 Cb 0.50 -0.61 0.00 0.00 -0.26 0.00 0.00 64.21 63.84 2wgi n SER 209 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wgi n GLY 210 N 1.31 3.11 3.75 5.00 0.00 -1.26 -4.93 105.19 112.17 2wgi n GLY 210 Ca 0.05 -1.98 -0.41 0.00 0.00 0.00 0.00 46.02 43.68 2wgi n GLY 210 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wgi s VAL 211 N -2.97 2.62 0.02 1.61 1.01 -1.26 -3.86 120.40 117.56 2wgi s VAL 211 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.53 2wgi s VAL 211 Cb 0.00 -3.35 -0.00 0.00 0.00 0.00 0.00 36.38 33.03 2wgi s VAL 211 CO 0.00 0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.81 2wgi n GLY 212 N 1.82 4.15 3.90 4.51 0.00 -1.08 -4.75 105.19 113.74 2wgi n GLY 212 Ca 0.05 -2.14 -0.28 0.00 0.00 0.00 0.00 46.02 43.65 2wgi n GLY 212 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wgi s THR 213 N -1.20 4.67 0.29 2.61 2.01 -0.76 -4.57 115.64 118.70 2wgi s THR 213 Ca 0.00 0.34 0.04 0.00 0.31 0.00 0.00 61.69 62.38 2wgi s THR 213 Cb 0.00 -3.81 0.28 0.00 0.01 0.00 0.00 72.50 68.99 2wgi s THR 213 CO 0.00 -0.87 1.75 -0.33 -0.69 0.00 0.00 174.62 174.48 2wgi h GLU 214 N 0.03 0.61 0.00 4.92 3.07 -1.96 -1.85 114.58 119.39 2wgi h GLU 214 Ca -0.46 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.36 2wgi h GLU 214 Cb 1.21 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 28.98 2wgi h GLU 214 CO 0.62 0.40 -0.97 0.66 -1.40 0.00 0.00 179.01 178.32 2wgi h SER 215 N 0.63 0.00 -2.15 1.42 4.64 -2.02 -3.40 113.55 112.66 2wgi h SER 215 Ca 0.56 -0.01 -0.57 0.00 -0.47 0.00 0.00 61.79 61.30 2wgi h SER 215 Cb 0.92 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.60 2wgi h SER 215 CO -0.42 0.00 -0.82 0.59 -0.87 0.00 0.00 176.83 175.32 2wgi n ASN 216 N -2.67 2.79 -4.81 4.97 3.02 -0.92 -5.12 115.26 112.52 2wgi n ASN 216 Ca 0.00 -3.30 -0.33 0.00 -0.03 0.00 0.00 54.58 50.92 2wgi n ASN 216 Cb 0.55 -0.62 0.00 0.00 -0.61 0.00 0.00 39.78 39.10 2wgi n ASN 216 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2wgi s PRO 217 N -2.54 3.40 0.82 3.52 0.04 -0.74 -1.82 135.00 137.67 2wgi s PRO 217 Ca 0.42 1.18 -0.12 0.00 0.04 0.00 0.00 61.00 62.52 2wgi s PRO 217 Cb 0.23 -2.05 0.09 0.00 0.04 0.00 0.00 34.50 32.81 2wgi s PRO 217 CO -0.08 -0.74 1.18 0.20 0.04 0.00 0.00 177.00 177.59 2wgi s GLY 218 N -2.81 1.59 -0.01 0.56 0.00 -0.89 -4.79 107.32 100.98 2wgi s GLY 218 Ca 0.63 -0.64 0.08 0.00 0.00 0.00 0.00 44.72 44.79 2wgi s GLY 218 CO 0.36 -0.14 -0.25 0.54 0.00 0.00 0.00 173.10 173.61 2wgi s VAL 219 N -3.55 2.17 -0.06 1.40 0.11 -1.26 -0.02 120.40 119.20 2wgi s VAL 219 Ca 0.62 -1.13 0.05 0.00 -2.93 0.00 0.00 61.98 58.60 2wgi s VAL 219 Cb -0.11 -1.78 -0.02 0.00 -1.53 0.00 0.00 36.38 32.94 2wgi s VAL 219 CO 0.50 0.54 -0.22 0.00 -3.33 0.00 0.00 175.10 172.58 2wgi s ALA 220 N -0.66 2.29 0.12 1.54 0.00 -0.41 -1.48 121.76 123.16 2wgi s ALA 220 Ca 0.11 -1.04 0.10 0.00 0.00 0.00 0.00 51.96 51.13 2wgi s ALA 220 Cb -0.10 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.23 2wgi s ALA 220 CO -0.00 0.45 -0.26 -1.58 0.00 0.00 0.00 175.76 174.37 2wgi s TRP 221 N -0.30 2.35 -0.11 0.00 0.52 0.12 -1.91 118.94 119.62 2wgi s TRP 221 Ca 0.01 -0.37 -0.04 0.00 0.02 0.00 0.00 56.10 55.73 2wgi s TRP 221 Cb -0.13 -1.28 0.05 0.00 -1.15 0.00 0.00 33.47 30.96 2wgi s TRP 221 CO 0.02 0.32 0.16 -0.46 0.02 0.00 0.00 176.95 177.01 2wgi s TRP 222 N -1.04 -0.16 0.23 -1.98 -0.00 -0.41 -1.31 118.94 114.28 2wgi s TRP 222 Ca 0.14 0.48 0.09 0.00 -0.00 0.00 0.00 56.10 56.82 2wgi s TRP 222 Cb -0.10 -0.31 -0.05 0.00 -0.00 0.00 0.00 33.47 33.01 2wgi s TRP 222 CO 0.06 -0.33 -0.17 0.14 -0.00 0.00 0.00 176.95 176.65 2wgi s VAL 223 N 2.28 2.03 -3.63 5.86 -7.23 -0.63 -0.71 120.40 118.37 2wgi s VAL 223 Ca 0.04 -2.26 0.00 0.00 -1.81 0.00 0.00 61.98 57.94 2wgi s VAL 223 Cb -0.13 -2.13 0.00 0.00 0.56 0.00 0.00 36.38 34.69 2wgi s VAL 223 CO -0.07 -0.50 0.00 0.61 -0.31 0.00 0.00 175.10 174.84 2wgi n GLY 224 N -0.41 -1.00 3.18 2.32 0.00 -0.53 -0.67 105.19 108.07 2wgi n GLY 224 Ca -0.07 -1.06 -0.10 0.00 0.00 0.00 0.00 46.02 44.79 2wgi n GLY 224 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2wgi s TRP 225 N -3.00 0.06 -0.10 1.61 -2.14 0.29 -1.50 118.94 114.16 2wgi s TRP 225 Ca 0.00 -0.28 0.03 0.00 2.66 0.00 0.00 56.10 58.51 2wgi s TRP 225 Cb 0.00 -0.03 -0.01 0.00 -3.10 0.00 0.00 33.47 30.33 2wgi s TRP 225 CO 0.00 -0.42 -0.19 0.08 -2.66 0.00 0.00 176.95 173.76 2wgi s VAL 226 N -2.53 2.58 -0.28 -0.66 1.01 0.60 -1.81 120.40 119.31 2wgi s VAL 226 Ca -0.05 -0.85 -0.10 0.00 0.00 0.00 0.00 61.98 60.98 2wgi s VAL 226 Cb -0.01 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 2wgi s VAL 226 CO -0.04 0.55 0.16 -1.61 0.00 0.00 0.00 175.10 174.17 2wgi s GLU 227 N 0.11 3.75 -0.03 2.72 2.02 -0.75 0.09 118.70 126.61 2wgi s GLU 227 Ca -0.09 -0.44 0.00 0.00 0.02 0.00 0.00 54.97 54.46 2wgi s GLU 227 Cb -0.15 -3.59 0.03 0.00 0.10 0.00 0.00 34.13 30.52 2wgi s GLU 227 CO 0.06 -0.24 0.01 0.21 0.02 0.00 0.00 175.26 175.31 2wgi s LYS 228 N 1.70 0.19 6.95 1.61 2.20 -0.38 -1.79 119.74 130.23 2wgi s LYS 228 Ca 0.06 0.12 0.00 0.00 -0.36 0.00 0.00 55.97 55.79 2wgi s LYS 228 Cb -0.16 -0.42 0.00 0.00 -1.51 0.00 0.00 37.83 35.74 2wgi s LYS 228 CO 0.09 -0.15 0.00 0.39 -0.36 0.00 0.00 175.35 175.31 2wgi n GLU 229 N 4.19 0.00 -1.34 4.03 -0.58 -1.22 -0.94 120.64 124.78 2wgi n GLU 229 Ca -0.26 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.19 2wgi n GLU 229 Cb 0.50 0.00 0.11 0.00 -0.57 0.00 0.00 31.44 31.48 2wgi n GLU 229 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2wgi n THR 230 N 0.00 3.32 -4.27 2.62 -2.24 -1.26 -4.98 114.28 107.47 2wgi n THR 230 Ca 0.00 -2.82 -0.19 0.00 -2.27 0.00 0.00 64.05 58.77 2wgi n THR 230 Cb 0.00 -0.92 -0.11 0.00 -2.10 0.00 0.00 70.33 67.20 2wgi n THR 230 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2wgi s GLU 231 N -3.63 1.10 -0.03 -0.78 2.56 -0.11 -5.11 118.70 112.70 2wgi s GLU 231 Ca 0.60 -1.31 0.01 0.00 0.00 0.00 0.00 54.97 54.26 2wgi s GLU 231 Cb 0.48 -1.00 0.02 0.00 2.00 0.00 0.00 34.13 35.64 2wgi s GLU 231 CO 0.02 0.19 -0.02 0.54 -0.56 0.00 0.00 175.26 175.44 2wgi s VAL 232 N -2.25 0.28 -0.19 3.70 0.11 -1.26 -1.25 120.40 119.54 2wgi s VAL 232 Ca 0.12 -0.00 0.01 0.00 -2.93 0.00 0.00 61.98 59.18 2wgi s VAL 232 Cb -0.04 -0.34 0.03 0.00 -1.53 0.00 0.00 36.38 34.50 2wgi s VAL 232 CO 0.04 0.15 -0.14 -0.31 -3.33 0.00 0.00 175.10 171.51 2wgi s TYR 233 N 0.83 2.63 -0.06 1.54 2.02 0.11 -0.43 117.35 123.99 2wgi s TYR 233 Ca -0.09 -1.66 -0.15 0.00 -0.37 0.00 0.00 57.07 54.80 2wgi s TYR 233 Cb -0.12 -1.77 -0.05 0.00 -0.40 0.00 0.00 41.96 39.62 2wgi s TYR 233 CO -0.01 -0.77 0.39 -0.06 -1.57 0.00 0.00 175.55 173.53 2wgi s PHE 234 N 1.33 3.63 0.02 2.71 0.08 -0.16 -0.29 117.98 125.29 2wgi s PHE 234 Ca 0.01 0.88 -0.00 0.00 0.12 0.00 0.00 56.93 57.94 2wgi s PHE 234 Cb -0.15 -2.34 -0.02 0.00 -0.57 0.00 0.00 43.02 39.94 2wgi s PHE 234 CO -0.10 0.47 -0.03 -0.59 -0.10 0.00 0.00 175.22 174.88 2wgi s PHE 235 N -0.43 0.24 -0.19 0.36 -0.71 -0.56 -0.35 117.98 116.33 2wgi s PHE 235 Ca 0.22 -0.48 -0.09 0.00 -1.04 0.00 0.00 56.93 55.54 2wgi s PHE 235 Cb -0.15 -0.17 0.07 0.00 -1.21 0.00 0.00 43.02 41.56 2wgi s PHE 235 CO 0.11 -0.17 0.45 0.00 -1.34 0.00 0.00 175.22 174.26 2wgi s ALA 236 N -1.33 -1.21 -0.03 1.99 0.00 -0.54 -1.45 121.76 119.19 2wgi s ALA 236 Ca -0.15 1.65 0.03 0.00 0.00 0.00 0.00 51.96 53.49 2wgi s ALA 236 Cb -0.09 -1.13 0.00 0.00 0.00 0.00 0.00 23.12 21.90 2wgi s ALA 236 CO -0.01 -0.45 -0.12 0.12 0.00 0.00 0.00 175.76 175.30 2wgi s PHE 237 N 1.84 1.27 0.09 0.00 2.19 0.12 -1.26 117.98 122.23 2wgi s PHE 237 Ca -0.07 -0.34 0.01 0.00 0.33 0.00 0.00 56.93 56.85 2wgi s PHE 237 Cb -0.09 -0.88 -0.04 0.00 -1.31 0.00 0.00 43.02 40.70 2wgi s PHE 237 CO -0.14 -0.13 -0.05 0.54 1.83 0.00 0.00 175.22 177.27 2wgi s ASN 238 N 0.15 0.99 0.01 6.13 2.20 -0.79 -1.28 114.94 122.36 2wgi s ASN 238 Ca -0.04 -1.02 -0.25 0.00 -0.94 0.00 0.00 52.86 50.62 2wgi s ASN 238 Cb -0.10 0.12 0.06 0.00 -2.00 0.00 0.00 41.25 39.33 2wgi s ASN 238 CO 0.01 -0.50 0.56 0.00 -2.94 0.00 0.00 177.10 174.23 2wgi s MET 239 N -3.86 1.02 0.41 3.55 0.23 -0.80 -0.78 119.30 119.07 2wgi s MET 239 Ca 0.12 -0.06 -0.22 0.00 -1.03 0.00 0.00 55.69 54.49 2wgi s MET 239 Cb 0.06 0.47 -0.10 0.00 -1.53 0.00 0.00 34.83 33.73 2wgi s MET 239 CO -0.05 -0.35 0.98 -0.51 -2.03 0.00 0.00 175.02 173.06 2wgi s ASP 240 N -1.67 6.91 -0.21 -1.18 1.01 -0.26 -1.28 116.67 119.99 2wgi s ASP 240 Ca -0.08 1.82 -0.04 0.00 0.71 0.00 0.00 52.55 54.96 2wgi s ASP 240 Cb -0.01 -2.56 0.08 0.00 1.01 0.00 0.00 42.92 41.44 2wgi s ASP 240 CO 0.03 -0.38 0.15 -0.51 0.21 0.00 0.00 175.17 174.66 2wgi s ILE 241 N -1.94 -0.18 -1.09 0.77 2.07 0.96 -4.72 121.20 117.08 2wgi s ILE 241 Ca 0.60 -0.28 0.09 0.00 -1.41 0.00 0.00 60.65 59.65 2wgi s ILE 241 Cb -0.14 -0.71 0.10 0.00 0.13 0.00 0.00 42.46 41.84 2wgi s ILE 241 CO 0.19 -0.35 0.86 -0.90 -1.91 0.00 0.00 174.94 172.82 2wgi n ASP 242 N 5.29 1.93 -3.70 4.50 5.68 -1.26 -2.09 116.55 126.90 2wgi n ASP 242 Ca -0.06 -1.48 -0.22 0.00 -0.50 0.00 0.00 54.79 52.53 2wgi n ASP 242 Cb 0.48 -0.03 -0.18 0.00 -1.14 0.00 0.00 41.12 40.25 2wgi n ASP 242 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 2wgi s ASN 243 N -0.80 1.42 0.52 -1.12 2.47 -1.26 -4.64 114.94 111.52 2wgi s ASN 243 Ca 0.12 -0.05 0.20 0.00 0.42 0.00 0.00 52.86 53.55 2wgi s ASN 243 Cb 0.08 -0.25 1.35 0.00 -1.45 0.00 0.00 41.25 40.98 2wgi s ASN 243 CO 0.12 -0.24 2.13 -0.08 -3.72 0.00 0.00 177.10 175.31 2wgi h GLU 244 N 8.40 0.00 0.00 0.43 4.81 -1.98 -2.23 114.58 124.01 2wgi h GLU 244 Ca -0.15 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 2wgi h GLU 244 Cb 1.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.50 2wgi h GLU 244 CO 0.20 0.05 0.00 -1.13 -0.73 0.00 0.00 179.01 177.40 2wgi n SER 245 N -4.25 0.23 -0.19 1.04 3.41 -1.26 -2.65 113.62 109.94 2wgi n SER 245 Ca -0.03 0.54 0.07 0.00 -0.26 0.00 0.00 58.87 59.18 2wgi n SER 245 Cb 0.14 -0.59 0.33 0.00 -0.26 0.00 0.00 64.21 63.82 2wgi n SER 245 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2wgi n LYS 246 N -1.73 1.25 -0.18 4.33 4.76 -0.84 -4.36 118.16 121.39 2wgi n LYS 246 Ca 0.05 -0.37 -0.09 0.00 -2.87 0.00 0.00 58.31 55.02 2wgi n LYS 246 Cb 0.28 -1.24 0.01 0.00 -1.84 0.00 0.00 35.03 32.25 2wgi n LYS 246 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 2wgi h LEU 247 N 0.70 0.87 -1.71 -0.35 5.85 -1.71 -3.07 115.31 115.89 2wgi h LEU 247 Ca 0.00 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 58.43 2wgi h LEU 247 Cb 0.15 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.95 2wgi h LEU 247 CO 0.00 0.94 0.20 -0.65 -0.34 0.00 0.00 178.44 178.59 2wgi h PRO 248 N 0.77 0.00 0.00 5.25 0.11 -1.87 -1.93 132.00 134.33 2wgi h PRO 248 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2wgi h PRO 248 Cb 0.47 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.58 2wgi h PRO 248 CO 0.02 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.09 2wgi n LEU 249 N -2.54 0.05 0.11 2.35 4.77 -1.16 -1.98 117.00 118.59 2wgi n LEU 249 Ca -0.02 0.51 0.12 0.00 -0.03 0.00 0.00 56.01 56.59 2wgi n LEU 249 Cb 0.24 -0.50 0.46 0.00 -2.33 0.00 0.00 43.42 41.29 2wgi n LEU 249 CO 0.11 -0.17 0.85 -2.11 -1.33 0.00 0.00 177.39 174.74 2wgi n ARG 250 N -1.55 0.18 -0.04 3.23 1.85 -0.72 -3.11 116.66 116.49 2wgi n ARG 250 Ca 0.05 0.35 -0.07 0.00 -1.00 0.00 0.00 57.85 57.18 2wgi n ARG 250 Cb 0.24 -1.80 -0.03 0.00 -1.05 0.00 0.00 32.46 29.81 2wgi n ARG 250 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2wgi n LYS 251 N -2.12 0.19 -0.19 2.89 5.02 -0.84 -4.60 118.16 118.51 2wgi n LYS 251 Ca 0.03 0.06 -0.03 0.00 -2.02 0.00 0.00 58.31 56.35 2wgi n LYS 251 Cb 0.26 -1.01 0.17 0.00 -0.02 0.00 0.00 35.03 34.43 2wgi n LYS 251 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2wgi h SER 252 N -0.13 0.88 0.06 4.39 4.64 -1.55 -1.88 113.55 119.97 2wgi h SER 252 Ca -0.20 -0.12 -0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2wgi h SER 252 Cb 1.24 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 2wgi h SER 252 CO -0.07 0.79 -0.03 0.40 -0.87 0.00 0.00 176.83 177.05 2wgi h ILE 253 N 0.94 1.21 -0.40 0.95 2.04 -1.82 -0.80 117.51 119.64 2wgi h ILE 253 Ca 0.22 -1.02 0.01 0.00 1.00 0.00 0.00 64.86 65.07 2wgi h ILE 253 Cb 0.19 1.87 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 2wgi h ILE 253 CO -0.02 0.25 0.27 -0.65 0.00 0.00 0.00 178.15 178.00 2wgi h PRO 254 N -0.55 0.52 -0.13 2.37 0.11 -1.79 -2.61 132.00 129.92 2wgi h PRO 254 Ca -0.01 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 2wgi h PRO 254 Cb 0.48 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 31.47 2wgi h PRO 254 CO 0.01 0.34 -0.14 1.15 -0.21 0.00 0.00 178.00 179.16 2wgi h THR 255 N 0.53 1.36 -0.77 -1.15 2.02 -1.30 -0.56 112.91 113.03 2wgi h THR 255 Ca 0.15 -1.32 0.17 0.00 0.77 0.00 0.00 66.41 66.18 2wgi h THR 255 Cb -0.05 1.94 -0.11 0.00 -1.74 0.00 0.00 68.15 68.19 2wgi h THR 255 CO -0.03 0.38 0.21 0.11 0.37 0.00 0.00 175.52 176.56 2wgi h LYS 256 N -0.08 0.28 0.46 6.66 1.57 -1.01 -0.72 116.57 123.74 2wgi h LYS 256 Ca 0.02 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2wgi h LYS 256 Cb 0.68 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.93 2wgi h LYS 256 CO 0.03 0.19 -0.22 0.82 -0.57 0.00 0.00 179.45 179.70 2wgi h ILE 257 N 0.29 0.37 -0.60 1.86 2.04 -1.33 -2.71 117.51 117.43 2wgi h ILE 257 Ca 0.45 -0.51 0.01 0.00 1.00 0.00 0.00 64.86 65.81 2wgi h ILE 257 Cb 0.78 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 2wgi h ILE 257 CO -0.52 0.06 0.39 0.24 0.00 0.00 0.00 178.15 178.32 2wgi h MET 258 N -0.99 0.78 -0.58 2.37 2.86 -0.85 -0.45 114.93 118.07 2wgi h MET 258 Ca -0.06 -0.05 -0.08 0.00 -2.06 0.00 0.00 59.70 57.45 2wgi h MET 258 Cb 0.58 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 2wgi h MET 258 CO 0.10 0.52 0.06 0.93 1.06 0.00 0.00 176.91 179.59 2wgi h GLU 259 N 0.81 0.96 0.00 1.72 5.08 -1.22 -0.84 114.58 121.08 2wgi h GLU 259 Ca 0.22 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 2wgi h GLU 259 Cb -0.09 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 2wgi h GLU 259 CO -0.05 0.91 -0.17 0.66 -1.00 0.00 0.00 179.01 179.36 2wgi h SER 260 N 0.90 0.00 0.59 1.42 4.64 -0.76 -1.59 113.55 118.74 2wgi h SER 260 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 2wgi h SER 260 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2wgi h SER 260 CO 0.02 0.17 -0.27 -0.62 -0.87 0.00 0.00 176.83 175.25 2wgi n GLU 261 N -3.68 0.19 -0.81 4.77 -0.58 -0.84 -4.94 120.64 114.75 2wgi n GLU 261 Ca -0.02 -0.08 0.00 0.00 -0.42 0.00 0.00 57.16 56.64 2wgi n GLU 261 Cb 0.29 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.66 2wgi n GLU 261 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wgi n GLY 262 N 1.45 0.55 0.14 0.62 0.00 -0.60 -4.97 105.19 102.38 2wgi n GLY 262 Ca 0.08 -0.44 -0.17 0.00 0.00 0.00 0.00 46.02 45.49 2wgi n GLY 262 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2wgi h ILE 263 N 0.00 1.43 0.00 -0.61 2.04 -1.36 -3.49 117.51 115.51 2wgi h ILE 263 Ca 0.00 -1.98 0.00 0.00 1.00 0.00 0.00 64.86 63.88 2wgi h ILE 263 Cb 0.00 2.51 0.00 0.00 -0.74 0.00 0.00 36.82 38.59 2wgi h ILE 263 CO 0.00 0.58 0.00 2.30 0.00 0.00 0.00 178.15 181.03