#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g4x n PHE 6 N 0.00 1.80 0.08 2.03 0.99 -1.26 -4.54 117.46 116.56 1g4x n PHE 6 Ca 0.00 -0.79 -0.09 0.00 -0.00 0.00 0.00 57.45 56.57 1g4x n PHE 6 Cb 0.00 -0.47 -0.08 0.00 -1.00 0.00 0.00 39.48 37.93 1g4x n PHE 6 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.76 177.69 1g4x h GLU 7 N 3.36 0.12 -0.02 -1.08 5.08 -2.12 -3.08 114.58 116.84 1g4x h GLU 7 Ca 0.01 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 1g4x h GLU 7 Cb 1.86 0.06 -0.00 0.00 0.50 0.00 0.00 28.75 31.16 1g4x h GLU 7 CO 0.43 1.01 -0.44 0.09 -1.00 0.00 0.00 179.01 179.11 1g4x n ASN 8 N -3.51 1.81 -4.71 1.42 3.02 -1.26 -5.01 115.26 107.02 1g4x n ASN 8 Ca -0.03 -3.83 -0.42 0.00 -0.03 0.00 0.00 54.58 50.27 1g4x n ASN 8 Cb 0.90 -0.53 -0.03 0.00 -0.61 0.00 0.00 39.78 39.52 1g4x n ASN 8 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1g4x s ILE 9 N -3.21 4.77 0.39 2.41 1.01 -1.17 -5.01 121.20 120.40 1g4x s ILE 9 Ca 0.38 1.99 -0.15 0.00 0.00 0.00 0.00 60.65 62.87 1g4x s ILE 9 Cb 0.36 -4.28 -0.08 0.00 0.01 0.00 0.00 42.46 38.47 1g4x s ILE 9 CO -0.06 0.16 0.82 0.28 0.00 0.00 0.00 174.94 176.14 1g4x s THR 10 N 1.00 4.63 0.35 2.92 -1.32 -1.26 -5.04 115.64 116.92 1g4x s THR 10 Ca 0.53 1.00 -0.25 0.00 -1.21 0.00 0.00 61.69 61.75 1g4x s THR 10 Cb -0.22 -3.66 -0.10 0.00 -1.51 0.00 0.00 72.50 67.02 1g4x s THR 10 CO 0.28 -0.37 0.99 0.00 -2.21 0.00 0.00 174.62 173.31 1g4x s ALA 11 N -2.22 3.17 0.28 11.08 0.00 -1.26 -5.04 121.76 127.77 1g4x s ALA 11 Ca 0.55 0.60 -0.28 0.00 0.00 0.00 0.00 51.96 52.83 1g4x s ALA 11 Cb -0.10 -3.22 -0.09 0.00 0.00 0.00 0.00 23.12 19.71 1g4x s ALA 11 CO 0.22 0.02 0.97 0.00 0.00 0.00 0.00 175.76 176.97 1g4x s ALA 12 N -1.63 3.30 0.89 0.00 0.00 -1.26 -5.04 121.76 118.02 1g4x s ALA 12 Ca 0.53 0.63 -0.10 0.00 0.00 0.00 0.00 51.96 53.02 1g4x s ALA 12 Cb -0.20 -3.22 0.13 0.00 0.00 0.00 0.00 23.12 19.83 1g4x s ALA 12 CO 0.25 0.13 1.15 -1.25 0.00 0.00 0.00 175.76 176.05 1g4x s PRO 13 N -1.53 1.18 0.08 0.00 0.04 -1.26 -4.97 135.00 128.54 1g4x s PRO 13 Ca 0.45 1.55 -0.30 0.00 0.04 0.00 0.00 61.00 62.73 1g4x s PRO 13 Cb -0.24 -1.75 -0.06 0.00 0.04 0.00 0.00 34.50 32.49 1g4x s PRO 13 CO 0.30 -2.51 1.19 0.00 0.04 0.00 0.00 177.00 176.02 1g4x s ALA 14 N -2.61 3.39 -0.35 8.56 0.00 -1.26 -4.97 121.76 124.52 1g4x s ALA 14 Ca 0.67 0.85 -0.29 0.00 0.00 0.00 0.00 51.96 53.19 1g4x s ALA 14 Cb -0.23 -3.43 0.01 0.00 0.00 0.00 0.00 23.12 19.46 1g4x s ALA 14 CO 0.57 -0.41 1.26 0.34 0.00 0.00 0.00 175.76 177.52 1g4x s ASP 15 N 0.89 6.65 0.11 0.00 -1.08 -1.26 -4.95 116.67 117.04 1g4x s ASP 15 Ca 0.57 1.02 -0.08 0.00 -0.52 0.00 0.00 52.55 53.55 1g4x s ASP 15 Cb -0.30 -2.54 0.13 0.00 -1.46 0.00 0.00 42.92 38.75 1g4x s ASP 15 CO 0.30 -1.13 0.74 -0.81 0.52 0.00 0.00 175.17 174.79 1g4x n PRO 16 N 7.45 -0.10 -0.24 4.34 -0.04 -1.26 -0.59 135.00 144.56 1g4x n PRO 16 Ca 0.14 0.74 -0.08 0.00 -0.04 0.00 0.00 63.50 64.26 1g4x n PRO 16 Cb 0.47 -1.09 0.04 0.00 -0.04 0.00 0.00 33.50 32.88 1g4x n PRO 16 CO 0.00 0.00 0.00 -0.84 -0.04 0.00 0.00 175.50 174.62 1g4x h ILE 17 N 0.00 1.25 -3.09 0.52 3.07 -1.92 -1.38 117.51 115.97 1g4x h ILE 17 Ca 0.18 -0.90 -0.79 0.00 1.55 0.00 0.00 64.86 64.89 1g4x h ILE 17 Cb 0.30 0.59 -0.29 0.00 -0.27 0.00 0.00 36.82 37.14 1g4x h ILE 17 CO -0.48 0.35 0.58 0.00 -1.05 0.00 0.00 178.15 177.55 1g4x n LEU 18 N -4.32 5.93 0.15 0.16 -0.00 0.24 -1.88 117.00 117.28 1g4x n LEU 18 Ca 0.04 -5.17 0.00 0.00 -0.00 0.00 0.00 56.01 50.88 1g4x n LEU 18 Cb 0.23 -1.29 0.00 0.00 -0.00 0.00 0.00 43.42 42.36 1g4x n LEU 18 CO 0.41 1.61 0.00 0.61 -0.00 0.00 0.00 177.39 180.02 1g4x n GLY 19 N 1.73 -1.21 0.14 1.47 0.00 -0.88 -4.08 105.19 102.37 1g4x n GLY 19 Ca 0.25 0.21 -0.09 0.00 0.00 0.00 0.00 46.02 46.40 1g4x n GLY 19 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1g4x h LEU 20 N 0.00 0.34 -1.29 0.99 3.38 -0.95 -2.61 115.31 115.17 1g4x h LEU 20 Ca 0.00 -0.01 0.25 0.00 0.09 0.00 0.00 57.88 58.21 1g4x h LEU 20 Cb 0.00 -0.08 -0.10 0.00 0.09 0.00 0.00 40.66 40.57 1g4x h LEU 20 CO 0.00 0.25 0.65 0.00 0.09 0.00 0.00 178.44 179.43 1g4x h ALA 21 N 1.12 2.11 -0.07 1.53 0.00 -1.65 0.29 119.26 122.60 1g4x h ALA 21 Ca 0.11 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 1g4x h ALA 21 Cb -0.04 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1g4x h ALA 21 CO -0.03 -0.51 -0.19 -0.44 0.00 0.00 0.00 179.25 178.08 1g4x h ASP 22 N 0.46 0.28 -0.51 0.00 3.32 -1.77 -0.60 116.42 117.61 1g4x h ASP 22 Ca 0.59 -0.60 0.04 0.00 0.02 0.00 0.00 57.03 57.09 1g4x h ASP 22 Cb 1.37 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 40.81 1g4x h ASP 22 CO -0.32 0.83 0.34 -0.07 -1.72 0.00 0.00 179.24 178.30 1g4x h LEU 23 N -0.25 0.45 -0.01 1.55 3.38 -0.87 -0.50 115.31 119.06 1g4x h LEU 23 Ca -0.00 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1g4x h LEU 23 Cb 0.80 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1g4x h LEU 23 CO 0.04 0.31 -0.06 0.15 0.09 0.00 0.00 178.44 178.97 1g4x h PHE 24 N 0.52 0.08 -0.04 1.13 3.57 -0.28 -3.23 116.94 118.68 1g4x h PHE 24 Ca 0.21 -0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.62 1g4x h PHE 24 Cb 0.19 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 1g4x h PHE 24 CO -0.00 0.73 -0.23 0.07 -2.23 0.00 0.00 178.31 176.64 1g4x h ARG 25 N -0.59 0.07 -0.97 1.11 -0.00 -0.84 -2.08 114.38 111.09 1g4x h ARG 25 Ca -0.00 -0.02 -0.03 0.00 -0.00 0.00 0.00 59.98 59.93 1g4x h ARG 25 Cb 0.73 -0.01 -0.02 0.00 -0.00 0.00 0.00 29.97 30.68 1g4x h ARG 25 CO 0.01 0.30 0.03 0.00 -0.00 0.00 0.00 179.97 180.32 1g4x n ALA 26 N -2.49 2.77 -3.42 0.08 0.00 -0.22 -4.79 120.51 112.44 1g4x n ALA 26 Ca -0.02 -0.30 -0.34 0.00 0.00 0.00 0.00 53.44 52.78 1g4x n ALA 26 Cb 0.31 -1.03 -0.14 0.00 0.00 0.00 0.00 19.45 18.58 1g4x n ALA 26 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1g4x s ASP 27 N 0.21 4.17 0.28 0.00 -1.08 -0.78 -4.99 116.67 114.47 1g4x s ASP 27 Ca 0.07 -0.38 0.25 0.00 -0.52 0.00 0.00 52.55 51.97 1g4x s ASP 27 Cb 0.06 -1.69 0.59 0.00 -1.46 0.00 0.00 42.92 40.42 1g4x s ASP 27 CO 0.02 0.04 1.66 -0.08 0.52 0.00 0.00 175.17 177.33 1g4x h GLU 28 N 7.67 0.00 -6.77 4.34 4.22 -1.88 -3.47 114.58 118.69 1g4x h GLU 28 Ca -0.37 0.00 -0.56 0.00 0.08 0.00 0.00 59.36 58.51 1g4x h GLU 28 Cb 1.17 0.00 0.10 0.00 0.50 0.00 0.00 28.75 30.52 1g4x h GLU 28 CO 0.60 0.00 0.70 0.54 -2.18 0.00 0.00 179.01 178.66 1g4x n ARG 29 N -2.54 2.40 0.04 1.92 3.00 -1.26 -4.96 116.66 115.26 1g4x n ARG 29 Ca 0.05 0.85 -0.12 0.00 -0.01 0.00 0.00 57.85 58.61 1g4x n ARG 29 Cb 0.47 -2.53 -0.08 0.00 0.00 0.00 0.00 32.46 30.31 1g4x n ARG 29 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 1g4x h PRO 30 N 3.60 -0.04 -1.42 5.56 0.13 -1.98 -3.28 132.00 134.57 1g4x h PRO 30 Ca -0.47 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 63.99 1g4x h PRO 30 Cb 1.26 0.01 -0.26 0.00 0.13 0.00 0.00 31.00 32.13 1g4x h PRO 30 CO 0.70 0.11 0.88 0.41 -0.23 0.00 0.00 178.00 179.87 1g4x n GLY 31 N -0.72 5.53 3.77 1.56 0.00 -1.26 -4.97 105.19 109.10 1g4x n GLY 31 Ca -0.08 -2.24 -0.38 0.00 0.00 0.00 0.00 46.02 43.32 1g4x n GLY 31 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1g4x s LYS 32 N -3.63 4.49 -0.05 1.61 -2.85 -1.24 -4.84 119.74 113.23 1g4x s LYS 32 Ca 0.58 1.58 0.03 0.00 -1.00 0.00 0.00 55.97 57.16 1g4x s LYS 32 Cb 0.46 -2.90 0.00 0.00 -2.06 0.00 0.00 37.83 33.33 1g4x s LYS 32 CO -0.15 0.13 -0.15 0.42 0.10 0.00 0.00 175.35 175.70 1g4x s ILE 33 N -1.42 1.29 -0.31 3.79 1.01 -0.18 -4.99 121.20 120.39 1g4x s ILE 33 Ca 0.50 -0.62 -0.03 0.00 0.00 0.00 0.00 60.65 60.50 1g4x s ILE 33 Cb -0.25 -1.13 0.05 0.00 0.01 0.00 0.00 42.46 41.13 1g4x s ILE 33 CO 0.32 0.38 0.02 0.21 0.00 0.00 0.00 174.94 175.87 1g4x s ASN 34 N 0.25 4.98 0.00 3.58 3.84 -1.26 -0.24 114.94 126.08 1g4x s ASN 34 Ca -0.07 -1.23 0.24 0.00 0.21 0.00 0.00 52.86 52.00 1g4x s ASN 34 Cb -0.13 -1.75 0.15 0.00 -0.55 0.00 0.00 41.25 38.98 1g4x s ASN 34 CO 0.03 -0.27 1.22 0.18 -2.79 0.00 0.00 177.10 175.47 1g4x n LEU 35 N 4.67 2.74 -2.29 3.21 4.77 0.80 -4.48 117.00 126.41 1g4x n LEU 35 Ca -0.13 -0.93 -0.33 0.00 -0.03 0.00 0.00 56.01 54.59 1g4x n LEU 35 Cb 0.44 -0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.61 1g4x n LEU 35 CO 0.27 0.47 1.43 0.61 -1.33 0.00 0.00 177.39 178.84 1g4x n GLY 36 N 1.37 5.67 0.13 -0.72 0.00 -1.19 -1.35 105.19 109.09 1g4x n GLY 36 Ca 0.13 -2.15 0.02 0.00 0.00 0.00 0.00 46.02 44.01 1g4x n GLY 36 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1g4x h ILE 37 N 1.00 0.86 0.00 -0.61 3.07 -1.92 -3.46 117.51 116.44 1g4x h ILE 37 Ca 0.59 -2.25 0.00 0.00 1.55 0.00 0.00 64.86 64.75 1g4x h ILE 37 Cb 0.93 2.40 0.00 0.00 -0.27 0.00 0.00 36.82 39.88 1g4x h ILE 37 CO 1.51 0.49 0.00 0.61 -1.05 0.00 0.00 178.15 179.71 1g4x n GLY 38 N 1.25 0.57 3.40 0.16 0.00 -1.26 -4.94 105.19 104.36 1g4x n GLY 38 Ca 0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1g4x n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g4x s VAL 39 N -1.80 1.64 0.22 1.61 1.01 -1.26 -5.13 120.40 116.69 1g4x s VAL 39 Ca 0.00 -2.15 -0.20 0.00 0.00 0.00 0.00 61.98 59.63 1g4x s VAL 39 Cb 0.00 -2.34 -0.08 0.00 0.00 0.00 0.00 36.38 33.96 1g4x s VAL 39 CO 0.00 -0.37 0.73 -0.47 0.00 0.00 0.00 175.10 174.98 1g4x s TYR 40 N -3.02 3.67 0.07 5.22 6.14 -1.26 -4.86 117.35 123.31 1g4x s TYR 40 Ca 0.28 1.41 0.06 0.00 0.64 0.00 0.00 57.07 59.45 1g4x s TYR 40 Cb 0.03 -2.63 -0.03 0.00 0.42 0.00 0.00 41.96 39.75 1g4x s TYR 40 CO 0.10 0.35 -0.15 0.15 0.64 0.00 0.00 175.55 176.64 1g4x s LYS 41 N -1.91 0.91 0.11 4.97 -0.14 -1.26 -4.39 119.74 118.03 1g4x s LYS 41 Ca 0.42 -0.95 -0.00 0.00 -1.36 0.00 0.00 55.97 54.08 1g4x s LYS 41 Cb -0.17 -0.96 0.02 0.00 -1.68 0.00 0.00 37.83 35.04 1g4x s LYS 41 CO 0.21 0.22 0.15 -0.40 -0.76 0.00 0.00 175.35 174.78 1g4x n ASP 42 N 1.39 0.18 0.12 2.83 5.68 -0.10 -4.86 116.55 121.80 1g4x n ASP 42 Ca -0.20 -1.16 0.20 0.00 -0.50 0.00 0.00 54.79 53.12 1g4x n ASP 42 Cb 0.54 -0.10 0.76 0.00 -1.14 0.00 0.00 41.12 41.18 1g4x n ASP 42 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1g4x h GLU 43 N 0.00 0.00 -0.30 0.11 5.08 -1.92 -0.08 114.58 117.47 1g4x h GLU 43 Ca -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1g4x h GLU 43 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1g4x h GLU 43 CO 0.05 0.00 0.00 0.25 -1.00 0.00 0.00 179.01 178.31 1g4x n THR 44 N -3.73 0.38 -2.45 1.13 -2.24 -1.26 -4.88 114.28 101.23 1g4x n THR 44 Ca 0.06 -0.56 -0.10 0.00 -2.27 0.00 0.00 64.05 61.18 1g4x n THR 44 Cb 0.55 0.67 0.01 0.00 -2.10 0.00 0.00 70.33 69.46 1g4x n THR 44 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1g4x n GLY 45 N 1.32 0.09 3.50 3.38 0.00 -0.04 -5.04 105.19 108.39 1g4x n GLY 45 Ca 0.18 -0.42 -0.26 0.00 0.00 0.00 0.00 46.02 45.51 1g4x n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g4x s LYS 46 N -4.84 1.79 -0.71 1.61 3.01 -1.26 -4.86 119.74 114.48 1g4x s LYS 46 Ca 0.09 -1.48 0.01 0.00 -1.01 0.00 0.00 55.97 53.59 1g4x s LYS 46 Cb -0.04 -1.96 0.18 0.00 -1.01 0.00 0.00 37.83 35.00 1g4x s LYS 46 CO 0.11 0.40 0.52 0.99 0.51 0.00 0.00 175.35 177.88 1g4x s THR 47 N -1.88 3.41 0.83 2.17 2.01 -1.26 -0.92 115.64 120.00 1g4x s THR 47 Ca 0.25 -3.76 -0.12 0.00 0.31 0.00 0.00 61.69 58.36 1g4x s THR 47 Cb -0.08 -3.21 0.09 0.00 0.01 0.00 0.00 72.50 69.32 1g4x s THR 47 CO 0.13 -0.97 1.10 -2.16 -0.69 0.00 0.00 174.62 172.04 1g4x s PRO 48 N -0.98 1.77 -0.10 4.92 0.05 -1.26 -5.02 135.00 134.38 1g4x s PRO 48 Ca 0.23 0.59 -0.16 0.00 0.05 0.00 0.00 61.00 61.71 1g4x s PRO 48 Cb -0.12 -1.89 -0.05 0.00 0.05 0.00 0.00 34.50 32.50 1g4x s PRO 48 CO -0.10 -1.83 0.40 0.54 0.05 0.00 0.00 177.00 176.07 1g4x s VAL 49 N -3.15 5.18 0.53 -0.36 0.11 -1.26 -4.93 120.40 116.51 1g4x s VAL 49 Ca 0.62 0.80 -0.22 0.00 -2.93 0.00 0.00 61.98 60.25 1g4x s VAL 49 Cb -0.15 -3.73 -0.05 0.00 -1.53 0.00 0.00 36.38 30.91 1g4x s VAL 49 CO 0.54 0.42 1.27 -0.76 -3.33 0.00 0.00 175.10 173.24 1g4x s LEU 50 N 0.10 3.87 0.25 2.54 1.43 -1.26 -4.87 118.68 120.74 1g4x s LEU 50 Ca 0.23 2.55 -0.04 0.00 -1.03 0.00 0.00 54.13 55.84 1g4x s LEU 50 Cb -0.15 -4.32 0.38 0.00 0.03 0.00 0.00 46.19 42.13 1g4x s LEU 50 CO 0.09 -1.36 1.86 0.74 0.23 0.00 0.00 176.35 177.91 1g4x h THR 51 N 1.48 1.05 -0.29 5.49 2.02 -1.98 -1.11 112.91 119.57 1g4x h THR 51 Ca -0.50 -0.36 -0.06 0.00 0.77 0.00 0.00 66.41 66.25 1g4x h THR 51 Cb 1.28 -0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.57 1g4x h THR 51 CO 0.58 0.19 -0.08 0.77 0.37 0.00 0.00 175.52 177.35 1g4x h SER 52 N 1.06 0.45 0.67 4.18 4.64 -1.92 -0.40 113.55 122.23 1g4x h SER 52 Ca 0.41 -0.10 -0.22 0.00 -0.47 0.00 0.00 61.79 61.41 1g4x h SER 52 Cb 0.19 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 1g4x h SER 52 CO -0.18 0.57 -1.01 -0.37 -0.87 0.00 0.00 176.83 174.98 1g4x h VAL 53 N 0.44 1.54 -0.76 0.95 -1.51 -1.73 -0.54 116.25 114.63 1g4x h VAL 53 Ca 0.09 -2.90 -0.01 0.00 -1.23 0.00 0.00 66.70 62.65 1g4x h VAL 53 Cb 0.42 2.68 -0.04 0.00 -2.13 0.00 0.00 31.29 32.22 1g4x h VAL 53 CO 0.02 0.84 0.46 0.11 -1.23 0.00 0.00 177.57 177.77 1g4x h LYS 54 N 0.08 1.04 -0.54 5.19 1.79 -0.66 0.84 116.57 124.31 1g4x h LYS 54 Ca -0.06 -0.10 -0.07 0.00 -2.18 0.00 0.00 60.65 58.24 1g4x h LYS 54 Cb 1.70 -0.22 -0.02 0.00 -1.58 0.00 0.00 32.23 32.11 1g4x h LYS 54 CO 0.15 0.74 0.07 0.87 -1.08 0.00 0.00 179.45 180.20 1g4x h LYS 55 N 1.04 0.91 -0.52 3.15 1.57 -0.97 -1.58 116.57 120.17 1g4x h LYS 55 Ca 0.27 -0.26 -0.06 0.00 -1.87 0.00 0.00 60.65 58.74 1g4x h LYS 55 Cb -0.03 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 1g4x h LYS 55 CO -0.05 0.89 0.09 0.00 -0.57 0.00 0.00 179.45 179.81 1g4x h ALA 56 N 0.98 1.17 -0.28 3.86 0.00 -0.52 -2.50 119.26 121.98 1g4x h ALA 56 Ca 0.16 -0.22 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 1g4x h ALA 56 Cb 0.44 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1g4x h ALA 56 CO 0.01 0.55 -0.34 0.93 0.00 0.00 0.00 179.25 180.41 1g4x h GLU 57 N 0.79 0.60 -0.71 0.00 5.08 -0.53 -0.99 114.58 118.81 1g4x h GLU 57 Ca 0.17 -0.28 -0.06 0.00 -1.00 0.00 0.00 59.36 58.19 1g4x h GLU 57 Cb 0.35 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 1g4x h GLU 57 CO 0.01 0.86 0.21 0.37 -1.00 0.00 0.00 179.01 179.46 1g4x h GLN 58 N 0.51 1.11 0.03 2.33 5.75 -1.07 -1.23 115.11 122.54 1g4x h GLN 58 Ca 0.06 -0.24 -0.00 0.00 -0.15 0.00 0.00 58.65 58.31 1g4x h GLN 58 Cb 0.83 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 29.22 1g4x h GLN 58 CO 0.07 0.96 -0.01 -0.92 -2.65 0.00 0.00 178.83 176.27 1g4x h TYR 59 N 1.05 -0.04 -0.86 3.99 3.20 -1.13 -2.01 116.97 121.17 1g4x h TYR 59 Ca 0.23 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.10 1g4x h TYR 59 Cb 0.32 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.56 1g4x h TYR 59 CO 0.03 0.00 0.56 -0.07 -1.64 0.00 0.00 178.16 177.03 1g4x h LEU 60 N -0.06 1.01 -0.97 2.82 3.38 -0.94 0.19 115.31 120.74 1g4x h LEU 60 Ca -0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1g4x h LEU 60 Cb 0.05 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.50 1g4x h LEU 60 CO 0.01 0.75 0.60 0.25 0.09 0.00 0.00 178.44 180.14 1g4x h LEU 61 N 1.18 1.14 -0.33 1.67 5.85 -1.05 0.78 115.31 124.54 1g4x h LEU 61 Ca 0.31 -0.05 -0.19 0.00 0.84 0.00 0.00 57.88 58.79 1g4x h LEU 61 Cb -0.11 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 40.62 1g4x h LEU 61 CO -0.07 0.86 -0.85 -0.33 -0.34 0.00 0.00 178.44 177.72 1g4x h GLU 62 N 1.32 0.12 0.00 1.25 5.08 -0.78 -3.37 114.58 118.21 1g4x h GLU 62 Ca 0.35 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1g4x h GLU 62 Cb -0.09 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1g4x h GLU 62 CO -0.07 0.89 -1.82 0.09 -1.00 0.00 0.00 179.01 177.11 1g4x n ASN 63 N -3.63 0.30 -4.70 1.42 4.13 0.00 -4.97 115.26 107.80 1g4x n ASN 63 Ca -0.02 -0.14 -0.42 0.00 1.68 0.00 0.00 54.58 55.67 1g4x n ASN 63 Cb 0.79 1.82 -0.03 0.00 -1.54 0.00 0.00 39.78 40.82 1g4x n ASN 63 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1g4x s GLU 64 N -3.39 4.31 0.00 3.52 2.02 0.23 -4.92 118.70 120.47 1g4x s GLU 64 Ca -0.05 2.00 0.14 0.00 0.02 0.00 0.00 54.97 57.08 1g4x s GLU 64 Cb 0.14 -3.43 -0.07 0.00 0.10 0.00 0.00 34.13 30.87 1g4x s GLU 64 CO 0.87 -0.50 0.71 0.25 0.02 0.00 0.00 175.26 176.61 1g4x n THR 66 N 4.32 0.00 -3.59 3.63 -2.24 -1.26 -5.01 114.28 110.12 1g4x n THR 66 Ca 0.12 -0.26 -0.15 0.00 -2.27 0.00 0.00 64.05 61.49 1g4x n THR 66 Cb 0.43 1.09 -0.06 0.00 -2.10 0.00 0.00 70.33 69.70 1g4x n THR 66 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1g4x s THR 67 N -2.04 0.03 -0.22 4.28 -1.32 -1.26 -5.02 115.64 110.09 1g4x s THR 67 Ca 0.09 -0.23 0.12 0.00 -1.21 0.00 0.00 61.69 60.46 1g4x s THR 67 Cb 0.11 -0.93 0.43 0.00 -1.51 0.00 0.00 72.50 70.61 1g4x s THR 67 CO 0.47 -0.13 1.30 0.29 -2.21 0.00 0.00 174.62 174.34 1g4x n LYS 68 N 0.66 1.72 -2.00 7.08 4.76 -1.26 -5.06 118.16 124.07 1g4x n LYS 68 Ca -0.19 -3.09 -0.37 0.00 -2.87 0.00 0.00 58.31 51.79 1g4x n LYS 68 Cb 0.59 -1.68 0.03 0.00 -1.84 0.00 0.00 35.03 32.13 1g4x n LYS 68 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1g4x s ASN 69 N -2.84 5.43 0.32 4.39 3.04 -1.26 -4.90 114.94 119.11 1g4x s ASN 69 Ca 0.39 2.49 -0.27 0.00 0.04 0.00 0.00 52.86 55.51 1g4x s ASN 69 Cb 0.36 -2.61 -0.14 0.00 -1.54 0.00 0.00 41.25 37.32 1g4x s ASN 69 CO -0.02 -1.44 0.90 -1.22 -3.04 0.00 0.00 177.10 172.28 1g4x n TYR 70 N -1.17 0.84 -2.08 0.43 4.01 -1.26 -5.00 117.16 112.93 1g4x n TYR 70 Ca 0.11 0.69 -0.28 0.00 -0.16 0.00 0.00 57.90 58.27 1g4x n TYR 70 Cb 0.48 -2.18 0.06 0.00 -0.31 0.00 0.00 39.34 37.38 1g4x n TYR 70 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1g4x s LEU 71 N 0.73 2.86 0.98 7.72 1.43 -1.26 -5.05 118.68 126.07 1g4x s LEU 71 Ca 0.60 0.79 -0.12 0.00 -1.03 0.00 0.00 54.13 54.37 1g4x s LEU 71 Cb -0.69 -3.48 0.18 0.00 0.03 0.00 0.00 46.19 42.22 1g4x s LEU 71 CO 0.59 -1.48 1.09 -0.83 0.23 0.00 0.00 176.35 175.95 1g4x s GLY 72 N -4.44 1.58 0.27 -3.19 0.00 -1.26 -4.83 107.32 95.46 1g4x s GLY 72 Ca 0.59 -0.27 0.01 0.00 0.00 0.00 0.00 44.72 45.04 1g4x s GLY 72 CO 0.48 0.31 1.71 -2.22 0.00 0.00 0.00 173.10 173.38 1g4x h ILE 73 N -1.83 0.56 -0.43 0.90 1.08 -1.97 0.45 117.51 116.26 1g4x h ILE 73 Ca -0.53 -0.15 0.00 0.00 -0.39 0.00 0.00 64.86 63.79 1g4x h ILE 73 Cb 1.32 0.08 0.00 0.00 -3.07 0.00 0.00 36.82 35.15 1g4x h ILE 73 CO 0.56 0.08 0.00 -0.90 -0.69 0.00 0.00 178.15 177.21 1g4x n ASP 74 N -5.02 2.74 0.00 1.72 5.75 -1.26 -4.33 116.55 116.15 1g4x n ASP 74 Ca 0.19 -2.12 0.00 0.00 -0.01 0.00 0.00 54.79 52.85 1g4x n ASP 74 Cb 0.55 -0.37 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 1g4x n ASP 74 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1g4x n GLY 75 N 1.04 -1.10 3.74 6.12 0.00 0.15 -1.37 105.19 113.77 1g4x n GLY 75 Ca 0.16 -1.23 -0.38 0.00 0.00 0.00 0.00 46.02 44.56 1g4x n GLY 75 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1g4x s ILE 76 N 0.00 5.08 0.19 -0.61 -5.25 -1.26 -4.23 121.20 115.12 1g4x s ILE 76 Ca 0.00 1.10 -0.13 0.00 -0.99 0.00 0.00 60.65 60.64 1g4x s ILE 76 Cb 0.00 -3.88 0.11 0.00 2.95 0.00 0.00 42.46 41.65 1g4x s ILE 76 CO 0.00 0.35 1.71 -0.65 -1.79 0.00 0.00 174.94 174.56 1g4x h PRO 77 N 6.33 0.22 -0.93 0.37 0.11 -1.98 -1.99 132.00 134.13 1g4x h PRO 77 Ca -0.43 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.71 1g4x h PRO 77 Cb 1.19 -0.05 -0.06 0.00 0.11 0.00 0.00 31.00 32.19 1g4x h PRO 77 CO 0.73 0.15 0.61 0.93 -0.21 0.00 0.00 178.00 180.21 1g4x h GLU 78 N 0.23 1.10 -0.05 1.05 4.39 -1.99 -1.02 114.58 118.30 1g4x h GLU 78 Ca 0.26 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.89 1g4x h GLU 78 Cb 0.35 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 28.74 1g4x h GLU 78 CO -0.34 0.73 0.02 0.35 -1.16 0.00 0.00 179.01 178.61 1g4x h PHE 79 N 1.14 0.03 -0.27 4.33 3.04 -1.71 -0.57 116.94 122.94 1g4x h PHE 79 Ca 0.38 0.00 0.06 0.00 3.98 0.00 0.00 57.97 62.39 1g4x h PHE 79 Cb 0.07 -0.01 -0.05 0.00 2.56 0.00 0.00 35.95 38.52 1g4x h PHE 79 CO -0.00 0.02 -0.09 0.78 -2.02 0.00 0.00 178.31 177.00 1g4x h GLY 80 N 0.04 0.16 0.44 2.40 0.00 -1.17 -0.90 103.07 104.04 1g4x h GLY 80 Ca 0.02 0.12 0.05 0.00 0.00 0.00 0.00 47.33 47.52 1g4x h GLY 80 CO -0.02 -0.12 -0.10 -0.09 0.00 0.00 0.00 176.54 176.21 1g4x h ARG 81 N -0.03 -0.06 -0.66 4.80 1.12 -0.90 -2.04 114.38 116.60 1g4x h ARG 81 Ca 0.13 0.00 -0.07 0.00 -1.11 0.00 0.00 59.98 58.94 1g4x h ARG 81 Cb 0.24 0.01 -0.03 0.00 -0.01 0.00 0.00 29.97 30.18 1g4x h ARG 81 CO -0.29 -0.04 0.15 0.00 -3.11 0.00 0.00 179.97 176.67 1g4x h THR 83 N 1.00 1.39 -0.55 0.00 1.35 -0.98 -1.44 112.91 113.69 1g4x h THR 83 Ca 0.21 -2.23 0.00 0.00 -0.55 0.00 0.00 66.41 63.84 1g4x h THR 83 Cb 0.39 2.19 -0.03 0.00 -1.73 0.00 0.00 68.15 68.97 1g4x h THR 83 CO 0.01 0.67 0.34 1.56 -0.25 0.00 0.00 175.52 177.85 1g4x h GLN 84 N 0.25 0.73 -0.62 4.72 4.20 -1.20 0.11 115.11 123.30 1g4x h GLN 84 Ca -0.04 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.54 1g4x h GLN 84 Cb 1.36 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.96 1g4x h GLN 84 CO 0.13 0.51 0.08 0.93 -0.67 0.00 0.00 178.83 179.81 1g4x h GLU 85 N 0.74 1.02 -0.61 1.46 5.08 -1.21 0.57 114.58 121.63 1g4x h GLU 85 Ca 0.20 -0.27 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 1g4x h GLU 85 Cb -0.05 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 1g4x h GLU 85 CO -0.04 0.95 0.26 -0.07 -1.00 0.00 0.00 179.01 179.11 1g4x h LEU 86 N 0.95 0.83 -0.09 1.33 3.38 -0.78 -0.77 115.31 120.15 1g4x h LEU 86 Ca 0.19 -0.16 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1g4x h LEU 86 Cb 0.44 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1g4x h LEU 86 CO 0.01 0.76 -0.17 -0.07 0.09 0.00 0.00 178.44 179.06 1g4x h LEU 87 N 0.84 0.31 -0.84 1.67 4.07 -0.53 -3.37 115.31 117.46 1g4x h LEU 87 Ca 0.20 -0.56 0.00 0.00 0.08 0.00 0.00 57.88 57.61 1g4x h LEU 87 Cb 0.18 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 41.83 1g4x h LEU 87 CO -0.02 0.81 -0.28 0.49 -1.08 0.00 0.00 178.44 178.35 1g4x n PHE 88 N -4.56 0.00 0.00 1.13 3.72 0.17 -4.74 117.46 113.18 1g4x n PHE 88 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 1g4x n PHE 88 Cb 0.39 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.93 1g4x n PHE 88 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1g4x n GLY 89 N 1.05 -0.13 0.37 1.37 0.00 -0.30 -4.47 105.19 103.08 1g4x n GLY 89 Ca 0.06 -1.47 0.13 0.00 0.00 0.00 0.00 46.02 44.73 1g4x n GLY 89 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1g4x h LYS 90 N 0.00 0.49 -0.99 1.61 3.64 -1.91 -2.64 116.57 116.76 1g4x h LYS 90 Ca 0.00 -0.03 -0.60 0.00 -1.27 0.00 0.00 60.65 58.75 1g4x h LYS 90 Cb 0.00 -0.11 -0.38 0.00 -0.41 0.00 0.00 32.23 31.33 1g4x h LYS 90 CO 0.00 0.32 -0.25 0.41 -2.27 0.00 0.00 179.45 177.66 1g4x n GLY 91 N -1.50 6.17 3.75 5.01 0.00 -1.26 -5.03 105.19 112.33 1g4x n GLY 91 Ca 0.13 -2.58 -0.40 0.00 0.00 0.00 0.00 46.02 43.17 1g4x n GLY 91 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1g4x s SER 92 N -2.98 7.27 0.30 1.61 0.15 -1.00 -4.93 113.70 114.12 1g4x s SER 92 Ca 0.54 2.24 -0.01 0.00 0.70 0.00 0.00 55.95 59.42 1g4x s SER 92 Cb 0.44 -2.62 0.45 0.00 -1.71 0.00 0.00 66.02 62.57 1g4x s SER 92 CO -0.03 -0.16 1.88 0.00 1.20 0.00 0.00 173.24 176.13 1g4x h ALA 93 N 4.07 1.30 -0.99 5.45 0.00 -1.91 -0.99 119.26 126.18 1g4x h ALA 93 Ca -0.46 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 54.37 1g4x h ALA 93 Cb 1.21 -0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.69 1g4x h ALA 93 CO 0.68 0.52 0.64 -0.07 0.00 0.00 0.00 179.25 181.02 1g4x h LEU 94 N 0.85 0.99 -0.01 0.00 3.38 -1.95 0.83 115.31 119.40 1g4x h LEU 94 Ca 0.20 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 1g4x h LEU 94 Cb 0.17 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1g4x h LEU 94 CO -0.02 0.61 -0.11 0.40 0.09 0.00 0.00 178.44 179.41 1g4x h ILE 95 N 1.11 1.54 0.00 1.22 2.04 -1.70 -0.87 117.51 120.85 1g4x h ILE 95 Ca 0.44 -1.73 -0.07 0.00 1.00 0.00 0.00 64.86 64.51 1g4x h ILE 95 Cb 0.25 2.64 -0.01 0.00 -0.74 0.00 0.00 36.82 38.97 1g4x h ILE 95 CO -0.19 0.46 -0.34 0.78 0.00 0.00 0.00 178.15 178.87 1g4x h ASN 96 N -0.57 0.00 -0.04 1.72 -0.26 -0.73 -1.12 115.58 114.59 1g4x h ASN 96 Ca -0.01 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.73 1g4x h ASN 96 Cb 0.81 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.07 1g4x h ASN 96 CO 0.02 0.34 0.00 0.47 -1.06 0.00 0.00 177.43 177.20 1g4x n ASP 97 N -3.66 1.44 -3.75 5.81 8.00 0.24 -4.96 116.55 119.68 1g4x n ASP 97 Ca -0.01 -1.51 -0.31 0.00 0.71 0.00 0.00 54.79 53.68 1g4x n ASP 97 Cb 0.45 -0.02 0.03 0.00 -0.02 0.00 0.00 41.12 41.56 1g4x n ASP 97 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1g4x n LYS 98 N 0.13 -1.70 0.00 -1.24 4.01 -0.42 -4.24 118.16 114.70 1g4x n LYS 98 Ca 0.19 0.43 0.12 0.00 -0.51 0.00 0.00 58.31 58.54 1g4x n LYS 98 Cb 0.34 -4.16 0.12 0.00 -0.51 0.00 0.00 35.03 30.82 1g4x n LYS 98 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1g4x n ARG 99 N -4.27 2.11 -4.69 1.97 1.74 -0.36 -3.41 116.66 109.75 1g4x n ARG 99 Ca -0.14 -1.71 -0.24 0.00 -0.77 0.00 0.00 57.85 54.99 1g4x n ARG 99 Cb 0.61 -1.46 -0.15 0.00 -1.02 0.00 0.00 32.46 30.44 1g4x n ARG 99 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1g4x s ALA 100 N -2.07 1.39 -0.00 7.54 0.00 -1.25 -2.79 121.76 124.57 1g4x s ALA 100 Ca 0.27 -0.78 0.03 0.00 0.00 0.00 0.00 51.96 51.49 1g4x s ALA 100 Cb 0.20 -0.32 -0.01 0.00 0.00 0.00 0.00 23.12 22.99 1g4x s ALA 100 CO 0.34 0.33 -0.11 1.03 0.00 0.00 0.00 175.76 177.35 1g4x s ARG 101 N -0.63 0.85 -0.09 0.00 1.81 -0.65 -4.97 118.95 115.26 1g4x s ARG 101 Ca 0.06 -0.41 0.04 0.00 -1.72 0.00 0.00 55.73 53.70 1g4x s ARG 101 Cb -0.07 -0.82 0.00 0.00 -0.45 0.00 0.00 34.95 33.62 1g4x s ARG 101 CO 0.00 0.22 -0.22 0.99 -0.68 0.00 0.00 175.30 175.61 1g4x s THR 102 N -0.31 1.91 -0.16 0.02 2.01 -1.26 -0.85 115.64 117.00 1g4x s THR 102 Ca 0.04 -0.94 -0.04 0.00 0.31 0.00 0.00 61.69 61.06 1g4x s THR 102 Cb -0.04 -1.65 -0.02 0.00 0.01 0.00 0.00 72.50 70.79 1g4x s THR 102 CO -0.00 0.53 -0.04 0.00 -0.69 0.00 0.00 174.62 174.41 1g4x s ALA 103 N 0.31 2.95 0.09 7.40 0.00 -0.52 -4.87 121.76 127.12 1g4x s ALA 103 Ca -0.16 -0.87 -0.31 0.00 0.00 0.00 0.00 51.96 50.62 1g4x s ALA 103 Cb -0.17 -1.56 -0.07 0.00 0.00 0.00 0.00 23.12 21.32 1g4x s ALA 103 CO 0.07 0.12 1.36 -1.14 0.00 0.00 0.00 175.76 176.17 1g4x s GLN 104 N 0.53 4.34 0.30 0.00 0.74 -0.47 -0.72 119.66 124.37 1g4x s GLN 104 Ca -0.03 2.00 0.06 0.00 0.05 0.00 0.00 55.36 57.44 1g4x s GLN 104 Cb -0.14 -3.31 -0.06 0.00 1.10 0.00 0.00 33.01 30.59 1g4x s GLN 104 CO 0.03 -0.42 -0.03 0.95 -0.55 0.00 0.00 175.29 175.26 1g4x s THR 105 N 1.28 1.60 -1.18 -0.34 -4.23 -0.34 -4.56 115.64 107.87 1g4x s THR 105 Ca 0.63 -2.09 -0.23 0.00 -1.18 0.00 0.00 61.69 58.82 1g4x s THR 105 Cb -0.35 -2.56 -0.10 0.00 1.34 0.00 0.00 72.50 70.84 1g4x s THR 105 CO 0.30 -0.22 1.95 -2.16 -0.54 0.00 0.00 174.62 173.94 1g4x s PRO 106 N -3.75 2.42 0.07 3.99 0.04 -1.25 -2.08 135.00 134.43 1g4x s PRO 106 Ca 0.31 -1.12 0.00 0.00 0.04 0.00 0.00 61.00 60.24 1g4x s PRO 106 Cb 0.05 -5.23 0.00 0.00 0.04 0.00 0.00 34.50 29.36 1g4x s PRO 106 CO 0.13 -4.07 0.00 0.41 0.04 0.00 0.00 177.00 173.51 1g4x n GLY 107 N 5.84 -1.80 0.36 0.56 0.00 -1.03 -2.70 105.19 106.43 1g4x n GLY 107 Ca 0.45 -1.45 -0.03 0.00 0.00 0.00 0.00 46.02 44.98 1g4x n GLY 107 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1g4x h GLY 108 N -0.21 1.36 1.01 -0.02 0.00 -1.78 -1.42 103.07 102.01 1g4x h GLY 108 Ca -0.01 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 46.73 1g4x h GLY 108 CO 0.01 0.54 0.29 -0.84 0.00 0.00 0.00 176.54 176.54 1g4x h THR 109 N 1.30 1.23 -0.75 4.70 2.02 -1.93 -1.16 112.91 118.32 1g4x h THR 109 Ca 0.34 -0.70 -0.02 0.00 0.77 0.00 0.00 66.41 66.80 1g4x h THR 109 Cb -0.07 0.45 -0.04 0.00 -1.74 0.00 0.00 68.15 66.75 1g4x h THR 109 CO -0.07 0.28 0.40 1.23 0.37 0.00 0.00 175.52 177.74 1g4x h GLY 110 N 0.94 1.13 0.91 2.16 0.00 -1.25 -0.84 103.07 106.12 1g4x h GLY 110 Ca 0.23 -0.52 0.02 0.00 0.00 0.00 0.00 47.33 47.06 1g4x h GLY 110 CO -0.02 0.50 0.37 0.00 0.00 0.00 0.00 176.54 177.38 1g4x h ALA 111 N 1.21 0.75 -0.72 3.60 0.00 -0.78 -1.03 119.26 122.28 1g4x h ALA 111 Ca 0.26 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 1g4x h ALA 111 Cb 0.05 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1g4x h ALA 111 CO -0.04 0.12 0.31 -0.07 0.00 0.00 0.00 179.25 179.57 1g4x h LEU 112 N 0.73 0.98 -0.42 0.00 3.38 -0.58 -1.89 115.31 117.51 1g4x h LEU 112 Ca 0.23 -0.16 -0.16 0.00 0.09 0.00 0.00 57.88 57.88 1g4x h LEU 112 Cb -0.01 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1g4x h LEU 112 CO -0.08 0.86 -0.42 -0.09 0.09 0.00 0.00 178.44 178.80 1g4x h ARG 113 N 1.03 0.87 -0.15 1.13 1.12 -0.79 -0.66 114.38 116.92 1g4x h ARG 113 Ca 0.24 -0.47 -0.12 0.00 -1.11 0.00 0.00 59.98 58.52 1g4x h ARG 113 Cb 0.17 0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 30.14 1g4x h ARG 113 CO -0.02 1.11 -0.44 -0.39 -3.11 0.00 0.00 179.97 177.12 1g4x h VAL 114 N 0.70 1.32 -0.21 0.20 -1.51 -1.04 -0.87 116.25 114.85 1g4x h VAL 114 Ca 0.05 -1.60 -0.00 0.00 -1.23 0.00 0.00 66.70 63.91 1g4x h VAL 114 Cb 1.00 1.68 -0.01 0.00 -2.13 0.00 0.00 31.29 31.83 1g4x h VAL 114 CO 0.10 0.49 0.11 0.00 -1.23 0.00 0.00 177.57 177.04 1g4x h ALA 115 N 1.25 0.27 -0.35 5.19 0.00 -1.19 0.06 119.26 124.48 1g4x h ALA 115 Ca 0.02 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1g4x h ALA 115 Cb 0.89 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 1g4x h ALA 115 CO 0.07 -0.20 0.18 0.00 0.00 0.00 0.00 179.25 179.30 1g4x h ALA 116 N 1.00 0.43 -0.26 0.00 0.00 -0.79 -0.31 119.26 119.34 1g4x h ALA 116 Ca 0.07 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1g4x h ALA 116 Cb 0.06 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1g4x h ALA 116 CO -0.01 -0.19 0.07 -0.44 0.00 0.00 0.00 179.25 178.68 1g4x h ASP 117 N 0.37 0.38 -0.24 0.00 3.32 -1.01 -1.10 116.42 118.14 1g4x h ASP 117 Ca 0.15 -0.21 0.05 0.00 0.02 0.00 0.00 57.03 57.03 1g4x h ASP 117 Cb 0.05 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.46 1g4x h ASP 117 CO -0.10 0.49 -0.04 0.15 -1.72 0.00 0.00 179.24 178.02 1g4x h PHE 118 N 0.25 -0.09 0.23 4.55 3.04 -0.74 -0.42 116.94 123.75 1g4x h PHE 118 Ca 0.08 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 62.04 1g4x h PHE 118 Cb 0.25 0.08 0.00 0.00 2.56 0.00 0.00 35.95 38.84 1g4x h PHE 118 CO 0.01 -0.08 -0.11 -0.07 -2.02 0.00 0.00 178.31 176.03 1g4x h LEU 119 N 0.02 -0.26 -1.37 0.59 4.07 -0.98 0.82 115.31 118.20 1g4x h LEU 119 Ca 0.12 -0.01 -0.06 0.00 0.08 0.00 0.00 57.88 58.00 1g4x h LEU 119 Cb 0.17 0.07 -0.01 0.00 1.08 0.00 0.00 40.66 41.96 1g4x h LEU 119 CO -0.23 -0.16 -0.18 0.00 -1.08 0.00 0.00 178.44 176.79 1g4x h ALA 120 N 0.43 1.48 0.16 1.53 0.00 -1.02 -0.51 119.26 121.33 1g4x h ALA 120 Ca -0.03 -0.23 -0.31 0.00 0.00 0.00 0.00 54.91 54.34 1g4x h ALA 120 Cb 0.26 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1g4x h ALA 120 CO 0.05 0.37 -1.49 0.87 0.00 0.00 0.00 179.25 179.05 1g4x h LYS 121 N 0.18 0.33 -0.00 0.00 1.57 -0.93 -3.41 116.57 114.30 1g4x h LYS 121 Ca 0.03 -0.56 0.00 0.00 -1.87 0.00 0.00 60.65 58.25 1g4x h LYS 121 Cb 0.43 0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.95 1g4x h LYS 121 CO 0.03 1.23 -0.30 0.09 -0.57 0.00 0.00 179.45 179.93 1g4x n ASN 122 N -3.54 0.88 -1.29 0.86 3.02 0.27 -5.04 115.26 110.42 1g4x n ASN 122 Ca -0.16 -0.94 0.00 0.00 -0.03 0.00 0.00 54.58 53.45 1g4x n ASN 122 Cb 1.06 0.69 0.00 0.00 -0.61 0.00 0.00 39.78 40.91 1g4x n ASN 122 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1g4x n THR 123 N -0.65 0.00 -1.17 3.41 -2.24 -0.22 -5.02 114.28 108.39 1g4x n THR 123 Ca 0.03 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.76 1g4x n THR 123 Cb 0.18 0.00 0.25 0.00 -2.10 0.00 0.00 70.33 68.66 1g4x n THR 123 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1g4x n SER 124 N -1.86 3.91 -4.74 3.42 3.41 -1.26 -4.80 113.62 111.70 1g4x n SER 124 Ca 0.00 -3.38 -0.41 0.00 -0.26 0.00 0.00 58.87 54.82 1g4x n SER 124 Cb 0.00 -0.69 -0.05 0.00 -0.26 0.00 0.00 64.21 63.21 1g4x n SER 124 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1g4x s VAL 125 N -3.07 4.41 0.00 -3.33 -7.23 -1.26 -4.89 120.40 105.03 1g4x s VAL 125 Ca 0.50 1.99 0.00 0.00 -1.81 0.00 0.00 61.98 62.67 1g4x s VAL 125 Cb 0.42 -4.29 0.00 0.00 0.56 0.00 0.00 36.38 33.07 1g4x s VAL 125 CO 0.09 0.38 0.00 0.29 -0.31 0.00 0.00 175.10 175.55 1g4x n LYS 126 N 2.38 2.10 -4.29 4.82 4.76 -1.26 -4.67 118.16 122.00 1g4x n LYS 126 Ca 0.00 0.00 -0.20 0.00 -2.87 0.00 0.00 58.31 55.25 1g4x n LYS 126 Cb 0.49 -0.96 -0.13 0.00 -1.84 0.00 0.00 35.03 32.59 1g4x n LYS 126 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1g4x s ARG 129 N -1.87 0.90 -0.10 1.97 1.81 -1.26 -0.63 118.95 119.77 1g4x s ARG 129 Ca 0.00 -0.84 0.03 0.00 -1.72 0.00 0.00 55.73 53.20 1g4x s ARG 129 Cb 0.00 -0.91 0.01 0.00 -0.45 0.00 0.00 34.95 33.59 1g4x s ARG 129 CO 0.00 0.22 -0.19 0.08 -0.68 0.00 0.00 175.30 174.72 1g4x s VAL 133 N -1.01 1.73 -0.18 3.52 1.01 0.11 -2.40 120.40 123.18 1g4x s VAL 133 Ca 0.00 -0.81 -0.14 0.00 0.00 0.00 0.00 61.98 61.03 1g4x s VAL 133 Cb -0.09 -1.52 -0.05 0.00 0.00 0.00 0.00 36.38 34.72 1g4x s VAL 133 CO 0.02 0.49 0.30 0.26 0.00 0.00 0.00 175.10 176.16 1g4x s TRP 134 N 0.57 3.42 0.13 5.22 0.52 0.26 -0.62 118.94 128.44 1g4x s TRP 134 Ca -0.15 0.56 0.09 0.00 0.02 0.00 0.00 56.10 56.62 1g4x s TRP 134 Cb -0.17 -2.37 -0.04 0.00 -1.15 0.00 0.00 33.47 29.74 1g4x s TRP 134 CO 0.05 0.16 -0.21 0.08 0.02 0.00 0.00 176.95 177.05 1g4x s VAL 135 N 0.72 1.85 0.63 4.03 1.01 0.56 -0.75 120.40 128.46 1g4x s VAL 135 Ca 0.16 -1.71 -0.14 0.00 0.00 0.00 0.00 61.98 60.29 1g4x s VAL 135 Cb -0.13 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.50 1g4x s VAL 135 CO 0.05 -0.12 1.06 -0.94 0.00 0.00 0.00 175.10 175.15 1g4x s SER 136 N -2.20 5.61 -0.25 3.32 1.04 -1.26 -1.49 113.70 118.46 1g4x s SER 136 Ca 0.11 1.76 -0.04 0.00 0.48 0.00 0.00 55.95 58.26 1g4x s SER 136 Cb -0.09 -2.52 0.01 0.00 0.10 0.00 0.00 66.02 63.52 1g4x s SER 136 CO 0.06 -1.29 -0.01 0.21 0.98 0.00 0.00 173.24 173.19 1g4x s ASN 137 N -3.12 4.56 0.78 7.02 3.84 0.36 -3.05 114.94 125.34 1g4x s ASN 137 Ca 0.62 -0.69 -0.10 0.00 0.21 0.00 0.00 52.86 52.90 1g4x s ASN 137 Cb -0.15 -1.75 0.09 0.00 -0.55 0.00 0.00 41.25 38.88 1g4x s ASN 137 CO 0.43 -0.12 1.12 -2.16 -2.79 0.00 0.00 177.10 173.59 1g4x s PRO 138 N 1.42 1.92 0.06 0.43 0.04 -1.26 -3.02 135.00 134.59 1g4x s PRO 138 Ca 0.02 -0.11 -0.12 0.00 0.04 0.00 0.00 61.00 60.83 1g4x s PRO 138 Cb -0.16 -2.04 0.01 0.00 0.04 0.00 0.00 34.50 32.36 1g4x s PRO 138 CO -0.02 -1.53 0.26 0.45 0.04 0.00 0.00 177.00 176.20 1g4x s SER 139 N -4.59 -0.04 0.18 6.66 0.15 -1.17 -4.63 113.70 110.26 1g4x s SER 139 Ca 0.63 -0.35 -0.03 0.00 0.70 0.00 0.00 55.95 56.90 1g4x s SER 139 Cb -0.10 0.35 -0.05 0.00 -1.71 0.00 0.00 66.02 64.51 1g4x s SER 139 CO 0.48 -0.65 0.39 0.86 1.20 0.00 0.00 173.24 175.52 1g4x s TRP 140 N -2.99 3.48 -0.21 3.44 -0.00 -1.16 -4.71 118.94 116.79 1g4x s TRP 140 Ca -0.02 0.46 -0.16 0.00 -0.00 0.00 0.00 56.10 56.39 1g4x s TRP 140 Cb 0.01 -1.94 -0.09 0.00 -0.00 0.00 0.00 33.47 31.44 1g4x s TRP 140 CO -0.06 0.39 -0.25 -0.35 -0.00 0.00 0.00 176.95 176.68 1g4x n PRO 141 N -0.32 0.54 0.00 5.86 -0.05 -1.26 -4.10 135.00 135.67 1g4x n PRO 141 Ca -0.03 0.33 0.00 0.00 -0.05 0.00 0.00 63.50 63.75 1g4x n PRO 141 Cb 0.53 -1.54 0.00 0.00 -0.05 0.00 0.00 33.50 32.44 1g4x n PRO 141 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 175.50 175.72 1g4x n ASN 142 N -4.41 1.56 -0.05 3.54 6.94 -1.26 -3.51 115.26 118.07 1g4x n ASN 142 Ca -0.30 -1.17 -0.10 0.00 -0.02 0.00 0.00 54.58 53.00 1g4x n ASN 142 Cb 0.63 -0.29 -0.03 0.00 -2.36 0.00 0.00 39.78 37.73 1g4x n ASN 142 CO 0.00 0.00 0.00 0.45 -1.03 0.00 0.00 177.26 176.68 1g4x h HIS 143 N 0.76 0.27 0.21 -2.53 3.86 -1.96 -3.01 115.15 112.75 1g4x h HIS 143 Ca 0.00 0.01 0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1g4x h HIS 143 Cb 0.54 -0.09 -0.04 0.00 1.06 0.00 0.00 27.41 28.88 1g4x h HIS 143 CO 0.00 0.17 -0.49 0.87 0.86 0.00 0.00 177.93 179.34 1g4x h LYS 144 N 0.29 -0.76 0.00 2.45 1.79 -1.92 -2.70 116.57 115.71 1g4x h LYS 144 Ca 0.08 0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.58 1g4x h LYS 144 Cb -0.03 0.17 -0.00 0.00 -1.58 0.00 0.00 32.23 30.79 1g4x h LYS 144 CO -0.02 -0.50 -0.12 0.66 -1.08 0.00 0.00 179.45 178.39 1g4x h SER 145 N -0.79 0.00 -0.04 0.86 4.64 -1.85 0.48 113.55 116.85 1g4x h SER 145 Ca -0.01 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1g4x h SER 145 Cb 0.76 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.85 1g4x h SER 145 CO -0.22 0.12 0.01 0.58 -0.87 0.00 0.00 176.83 176.45 1g4x h VAL 146 N 0.00 1.17 -0.05 0.95 2.07 -1.36 -0.03 116.25 119.00 1g4x h VAL 146 Ca -0.00 -0.50 -0.24 0.00 0.82 0.00 0.00 66.70 66.78 1g4x h VAL 146 Cb 0.21 1.43 0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1g4x h VAL 146 CO 0.02 0.14 -0.93 -0.26 0.02 0.00 0.00 177.57 176.55 1g4x h PHE 147 N -0.13 0.95 -0.07 1.57 -1.00 -1.10 -3.07 116.94 114.09 1g4x h PHE 147 Ca 0.01 -0.48 -0.06 0.00 2.81 0.00 0.00 57.97 60.25 1g4x h PHE 147 Cb 0.21 -0.12 -0.01 0.00 3.61 0.00 0.00 35.95 39.64 1g4x h PHE 147 CO -0.01 1.31 -0.25 -0.91 -1.61 0.00 0.00 178.31 176.85 1g4x h ASN 148 N 0.40 0.12 0.18 2.17 -0.26 -0.92 -0.95 115.58 116.33 1g4x h ASN 148 Ca -0.09 -0.03 -0.11 0.00 -0.56 0.00 0.00 56.30 55.50 1g4x h ASN 148 Cb 1.57 -0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 38.78 1g4x h ASN 148 CO 0.18 0.38 -0.40 0.77 -1.06 0.00 0.00 177.43 177.30 1g4x h SER 149 N 0.12 0.31 0.72 5.81 4.64 -0.92 -1.58 113.55 122.64 1g4x h SER 149 Ca 0.02 -0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 1g4x h SER 149 Cb 0.51 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 1g4x h SER 149 CO 0.04 0.69 0.00 0.00 -0.87 0.00 0.00 176.83 176.68 1g4x n ALA 150 N -2.48 2.03 -0.33 5.18 0.00 -0.85 -4.89 120.51 119.17 1g4x n ALA 150 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1g4x n ALA 150 Cb 0.48 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.57 1g4x n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1g4x n GLY 151 N 0.76 0.80 3.83 0.00 0.00 -0.59 -4.83 105.19 105.15 1g4x n GLY 151 Ca 0.06 -0.34 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 1g4x n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1g4x s LEU 152 N 0.00 4.14 0.24 0.99 1.02 -0.42 -4.99 118.68 119.66 1g4x s LEU 152 Ca 0.00 0.32 -0.22 0.00 0.02 0.00 0.00 54.13 54.25 1g4x s LEU 152 Cb 0.00 -2.17 -0.09 0.00 0.02 0.00 0.00 46.19 43.96 1g4x s LEU 152 CO 0.00 0.35 0.80 -0.70 0.02 0.00 0.00 176.35 176.82 1g4x s GLU 154 N -1.32 4.40 -0.07 1.70 2.12 0.19 -3.41 118.70 122.31 1g4x s GLU 154 Ca 0.19 1.05 0.05 0.00 0.36 0.00 0.00 54.97 56.61 1g4x s GLU 154 Cb -0.12 -2.91 -0.01 0.00 0.26 0.00 0.00 34.13 31.35 1g4x s GLU 154 CO 0.08 0.39 -0.22 0.08 -0.54 0.00 0.00 175.26 175.06 1g4x s VAL 155 N -1.50 2.36 0.15 3.70 1.01 -1.26 0.09 120.40 124.95 1g4x s VAL 155 Ca 0.44 -0.95 0.07 0.00 0.00 0.00 0.00 61.98 61.54 1g4x s VAL 155 Cb -0.18 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 1g4x s VAL 155 CO 0.23 0.57 -0.16 -0.13 0.00 0.00 0.00 175.10 175.60 1g4x s ARG 156 N -0.12 1.16 0.02 2.72 1.81 0.20 -4.92 118.95 119.82 1g4x s ARG 156 Ca -0.04 -1.35 0.05 0.00 -1.72 0.00 0.00 55.73 52.68 1g4x s ARG 156 Cb -0.14 -1.10 -0.03 0.00 -0.45 0.00 0.00 34.95 33.22 1g4x s ARG 156 CO 0.04 0.21 -0.14 -1.21 -0.68 0.00 0.00 175.30 173.52 1g4x s GLU 157 N -2.82 2.27 0.17 3.54 2.02 -1.26 -0.32 118.70 122.30 1g4x s GLU 157 Ca 0.13 -0.86 0.08 0.00 0.02 0.00 0.00 54.97 54.33 1g4x s GLU 157 Cb -0.05 -2.30 -0.04 0.00 0.10 0.00 0.00 34.13 31.84 1g4x s GLU 157 CO 0.05 0.57 -0.03 1.52 0.02 0.00 0.00 175.26 177.39 1g4x s TYR 158 N -0.91 2.79 0.55 1.61 -0.85 -0.56 -4.91 117.35 115.07 1g4x s TYR 158 Ca 0.15 -0.16 -0.18 0.00 -0.52 0.00 0.00 57.07 56.36 1g4x s TYR 158 Cb -0.11 -1.36 -0.06 0.00 0.38 0.00 0.00 41.96 40.81 1g4x s TYR 158 CO 0.05 0.51 1.06 0.00 -1.52 0.00 0.00 175.55 175.65 1g4x s ALA 159 N -1.67 2.78 0.24 9.51 0.00 -1.26 -0.49 121.76 130.87 1g4x s ALA 159 Ca 0.26 0.54 0.00 0.00 0.00 0.00 0.00 51.96 52.76 1g4x s ALA 159 Cb -0.09 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.77 1g4x s ALA 159 CO 0.17 -0.62 0.00 0.98 0.00 0.00 0.00 175.76 176.30 1g4x n TYR 160 N -1.51 -2.52 -3.60 0.00 4.19 -1.17 -3.92 117.16 108.64 1g4x n TYR 160 Ca 0.09 0.58 -0.30 0.00 3.31 0.00 0.00 57.90 61.58 1g4x n TYR 160 Cb 0.52 1.35 -0.04 0.00 0.49 0.00 0.00 39.34 41.66 1g4x n TYR 160 CO 0.00 0.00 0.00 -0.47 0.91 0.00 0.00 176.86 177.30 1g4x s TYR 161 N -2.00 3.47 -0.33 2.98 5.04 -1.24 -0.53 117.35 124.74 1g4x s TYR 161 Ca 0.00 0.57 -0.00 0.00 -2.44 0.00 0.00 57.07 55.19 1g4x s TYR 161 Cb 0.00 -2.02 0.08 0.00 0.35 0.00 0.00 41.96 40.37 1g4x s TYR 161 CO 0.00 0.36 0.06 0.34 -1.34 0.00 0.00 175.55 174.97 1g4x s ASP 162 N -2.68 4.92 0.20 4.32 3.68 0.48 -4.64 116.67 122.97 1g4x s ASP 162 Ca 0.42 -1.68 -0.10 0.00 2.13 0.00 0.00 52.55 53.32 1g4x s ASP 162 Cb -0.12 -1.71 0.26 0.00 -1.45 0.00 0.00 42.92 39.90 1g4x s ASP 162 CO 0.26 -0.36 1.74 0.00 0.13 0.00 0.00 175.17 176.94 1g4x h ALA 163 N 7.91 0.74 0.88 3.66 0.00 -1.97 0.23 119.26 130.71 1g4x h ALA 163 Ca -0.15 0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1g4x h ALA 163 Cb 1.05 0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.92 1g4x h ALA 163 CO 0.57 -0.22 -0.42 0.93 0.00 0.00 0.00 179.25 180.11 1g4x h GLU 164 N 0.37 -1.14 0.00 0.00 5.08 -1.97 -3.20 114.58 113.72 1g4x h GLU 164 Ca 0.30 0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 1g4x h GLU 164 Cb 0.38 0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1g4x h GLU 164 CO -0.31 -0.75 0.00 -0.91 -1.00 0.00 0.00 179.01 176.03 1g4x h ASN 165 N -1.26 0.00 -5.24 1.42 4.21 -1.99 -3.47 115.58 109.25 1g4x h ASN 165 Ca -0.12 0.00 -0.09 0.00 1.21 0.00 0.00 56.30 57.30 1g4x h ASN 165 Cb 0.91 0.00 0.07 0.00 -1.12 0.00 0.00 38.32 38.18 1g4x h ASN 165 CO 0.20 0.00 -0.32 1.41 -1.29 0.00 0.00 177.43 177.43 1g4x n HIS 166 N -2.81 -2.60 -3.89 1.19 8.25 0.79 -5.04 115.22 111.13 1g4x n HIS 166 Ca 0.04 0.96 -0.09 0.00 -0.26 0.00 0.00 57.72 58.37 1g4x n HIS 166 Cb 0.48 -3.97 -0.04 0.00 1.12 0.00 0.00 29.99 27.57 1g4x n HIS 166 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1g4x s THR 167 N -3.14 0.02 -0.37 1.59 2.01 -1.09 -4.98 115.64 109.68 1g4x s THR 167 Ca 0.17 -1.13 -0.28 0.00 0.31 0.00 0.00 61.69 60.76 1g4x s THR 167 Cb -0.02 -1.92 0.02 0.00 0.01 0.00 0.00 72.50 70.59 1g4x s THR 167 CO 0.70 -0.07 1.02 -0.22 -0.69 0.00 0.00 174.62 175.35 1g4x s LEU 168 N -2.95 3.91 -1.09 4.42 0.20 -1.26 -0.38 118.68 121.52 1g4x s LEU 168 Ca 0.16 0.75 -0.17 0.00 0.69 0.00 0.00 54.13 55.55 1g4x s LEU 168 Cb -0.01 -3.42 0.13 0.00 -0.43 0.00 0.00 46.19 42.45 1g4x s LEU 168 CO 0.04 -0.93 1.37 -0.62 -0.29 0.00 0.00 176.35 175.91 1g4x s ASP 169 N 1.88 6.80 0.29 3.68 -1.08 0.31 -4.83 116.67 123.72 1g4x s ASP 169 Ca 0.43 -2.36 -0.03 0.00 -0.52 0.00 0.00 52.55 50.07 1g4x s ASP 169 Cb -0.11 -2.45 0.40 0.00 -1.46 0.00 0.00 42.92 39.30 1g4x s ASP 169 CO 0.19 -1.03 1.92 0.15 0.52 0.00 0.00 175.17 176.93 1g4x h PHE 170 N 8.19 1.03 -0.02 -5.34 -0.00 -1.93 -0.98 116.94 117.90 1g4x h PHE 170 Ca 0.26 -0.01 -0.00 0.00 -0.00 0.00 0.00 57.97 58.22 1g4x h PHE 170 Cb 0.95 -0.34 -0.00 0.00 -0.00 0.00 0.00 35.95 36.56 1g4x h PHE 170 CO 1.20 0.70 0.01 -0.44 -0.00 0.00 0.00 178.31 179.77 1g4x h ASP 171 N 1.08 0.02 -0.03 0.41 3.32 -1.98 -1.28 116.42 117.95 1g4x h ASP 171 Ca 0.28 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 57.11 1g4x h ASP 171 Cb -0.02 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1g4x h ASP 171 CO -0.05 0.20 -0.05 0.00 -1.72 0.00 0.00 179.24 177.62 1g4x h ALA 172 N 0.82 1.64 0.57 3.45 0.00 -1.86 -0.11 119.26 123.76 1g4x h ALA 172 Ca 0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1g4x h ALA 172 Cb 0.19 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.91 1g4x h ALA 172 CO -0.00 0.27 -0.27 1.25 0.00 0.00 0.00 179.25 180.50 1g4x h LEU 173 N 0.22 -0.65 -1.00 0.00 6.46 -0.63 -0.47 115.31 119.24 1g4x h LEU 173 Ca 0.05 0.02 -0.05 0.00 -0.12 0.00 0.00 57.88 57.78 1g4x h LEU 173 Cb 0.24 0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 40.31 1g4x h LEU 173 CO 0.01 -0.43 0.12 0.16 -0.62 0.00 0.00 178.44 177.68 1g4x h ILE 174 N -0.83 1.23 -0.51 4.05 3.07 -1.07 -0.68 117.51 122.77 1g4x h ILE 174 Ca -0.08 -0.84 0.06 0.00 1.55 0.00 0.00 64.86 65.55 1g4x h ILE 174 Cb 0.58 0.69 -0.05 0.00 -0.27 0.00 0.00 36.82 37.77 1g4x h ILE 174 CO 0.13 0.31 0.23 0.78 -1.05 0.00 0.00 178.15 178.55 1g4x h ASN 175 N 0.81 0.30 0.12 2.16 4.21 -1.03 -0.82 115.58 121.32 1g4x h ASN 175 Ca 0.17 0.04 -0.22 0.00 1.21 0.00 0.00 56.30 57.51 1g4x h ASN 175 Cb 0.32 -0.01 0.01 0.00 -1.12 0.00 0.00 38.32 37.52 1g4x h ASN 175 CO 0.00 0.20 -0.85 0.77 -1.29 0.00 0.00 177.43 176.27 1g4x h SER 176 N 0.45 0.69 0.55 5.81 4.64 -0.33 -3.09 113.55 122.27 1g4x h SER 176 Ca 0.24 -0.49 -0.02 0.00 -0.47 0.00 0.00 61.79 61.04 1g4x h SER 176 Cb 0.20 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1g4x h SER 176 CO -0.20 1.28 -0.08 0.25 -0.87 0.00 0.00 176.83 177.21 1g4x h LEU 177 N 0.36 0.00 0.00 5.97 5.85 -0.66 -2.20 115.31 124.63 1g4x h LEU 177 Ca -0.06 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1g4x h LEU 177 Cb 1.47 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.50 1g4x h LEU 177 CO 0.16 0.08 0.00 0.59 -0.34 0.00 0.00 178.44 178.93 1g4x n ASN 178 N -3.37 0.00 -0.06 1.25 4.13 -0.36 -1.23 115.26 115.62 1g4x n ASN 178 Ca -0.01 -0.35 0.12 0.00 1.68 0.00 0.00 54.58 56.02 1g4x n ASN 178 Cb 0.25 -0.03 0.26 0.00 -1.54 0.00 0.00 39.78 38.72 1g4x n ASN 178 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 1g4x n GLU 179 N -1.03 0.19 -2.49 3.52 0.00 -0.83 -4.90 120.64 115.12 1g4x n GLU 179 Ca 0.09 -0.12 -0.39 0.00 0.00 0.00 0.00 57.16 56.74 1g4x n GLU 179 Cb 0.05 -1.50 -0.04 0.00 0.00 0.00 0.00 31.44 29.95 1g4x n GLU 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1g4x s ALA 180 N -2.89 3.31 0.46 4.31 0.00 -0.37 -5.03 121.76 121.56 1g4x s ALA 180 Ca 0.14 0.85 0.01 0.00 0.00 0.00 0.00 51.96 52.96 1g4x s ALA 180 Cb 0.18 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.99 1g4x s ALA 180 CO 0.67 -0.18 0.67 -0.65 0.00 0.00 0.00 175.76 176.27 1g4x s GLN 181 N -1.74 2.95 0.17 0.00 -0.21 -1.26 -5.02 119.66 114.56 1g4x s GLN 181 Ca 0.48 -0.63 -0.31 0.00 0.02 0.00 0.00 55.36 54.92 1g4x s GLN 181 Cb -0.29 -2.58 -0.10 0.00 1.00 0.00 0.00 33.01 31.04 1g4x s GLN 181 CO 0.37 -0.33 1.55 0.00 -2.12 0.00 0.00 175.29 174.76 1g4x s ALA 182 N -2.56 3.76 0.00 6.09 0.00 -1.25 -1.88 121.76 125.93 1g4x s ALA 182 Ca 0.50 1.37 0.00 0.00 0.00 0.00 0.00 51.96 53.83 1g4x s ALA 182 Cb -0.10 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.41 1g4x s ALA 182 CO 0.37 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 175.76 1g4x n GLY 183 N 3.56 0.47 3.87 0.00 0.00 -0.11 -5.02 105.19 107.96 1g4x n GLY 183 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 1g4x n GLY 183 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1g4x s ASP 184 N -2.94 6.64 0.00 1.61 1.01 -0.79 -4.52 116.67 117.69 1g4x s ASP 184 Ca 0.00 1.05 -0.16 0.00 0.71 0.00 0.00 52.55 54.15 1g4x s ASP 184 Cb 0.00 -2.28 -0.06 0.00 1.01 0.00 0.00 42.92 41.59 1g4x s ASP 184 CO 0.00 -0.18 0.45 -0.69 0.21 0.00 0.00 175.17 174.97 1g4x s VAL 185 N -1.98 4.98 -0.14 -1.27 1.01 -1.01 -0.89 120.40 121.11 1g4x s VAL 185 Ca 0.50 0.94 0.01 0.00 0.00 0.00 0.00 61.98 63.43 1g4x s VAL 185 Cb -0.11 -3.77 0.02 0.00 0.00 0.00 0.00 36.38 32.52 1g4x s VAL 185 CO 0.22 0.54 -0.18 0.54 0.00 0.00 0.00 175.10 176.22 1g4x s VAL 186 N -0.85 1.77 -0.15 2.92 0.11 -0.35 -0.58 120.40 123.27 1g4x s VAL 186 Ca 0.25 -0.79 -0.22 0.00 -2.93 0.00 0.00 61.98 58.30 1g4x s VAL 186 Cb -0.17 -1.61 -0.03 0.00 -1.53 0.00 0.00 36.38 33.04 1g4x s VAL 186 CO 0.14 0.49 0.65 -0.22 -3.33 0.00 0.00 175.10 172.84 1g4x s LEU 187 N 1.11 4.21 0.04 2.54 1.98 0.07 -0.85 118.68 127.78 1g4x s LEU 187 Ca -0.02 0.97 0.09 0.00 -2.89 0.00 0.00 54.13 52.28 1g4x s LEU 187 Cb -0.14 -2.96 -0.03 0.00 0.66 0.00 0.00 46.19 43.72 1g4x s LEU 187 CO -0.06 -0.21 -0.24 -0.36 -1.89 0.00 0.00 176.35 173.59 1g4x s PHE 188 N 1.47 2.14 -0.06 5.38 0.08 0.18 -4.52 117.98 122.64 1g4x s PHE 188 Ca 0.32 -0.40 -0.23 0.00 0.12 0.00 0.00 56.93 56.74 1g4x s PHE 188 Cb -0.16 -1.29 -0.04 0.00 -0.57 0.00 0.00 43.02 40.96 1g4x s PHE 188 CO 0.13 0.10 0.70 -1.01 -0.10 0.00 0.00 175.22 175.04 1g4x s HIS 189 N -0.79 3.58 0.25 0.36 3.76 -1.26 -0.57 115.29 120.62 1g4x s HIS 189 Ca 0.10 1.25 -0.02 0.00 -0.15 0.00 0.00 55.06 56.25 1g4x s HIS 189 Cb -0.10 -2.80 0.31 0.00 1.11 0.00 0.00 32.58 31.10 1g4x s HIS 189 CO 0.02 0.09 1.72 0.78 -0.85 0.00 0.00 174.74 176.50 1g4x h GLY 190 N 6.73 0.81 -2.90 -2.22 0.00 -1.48 -3.47 103.07 100.54 1g4x h GLY 190 Ca -0.41 -0.59 0.18 0.00 0.00 0.00 0.00 47.33 46.51 1g4x h GLY 190 CO 0.75 0.54 0.57 0.00 0.00 0.00 0.00 176.54 178.40 1g4x n HIS 193 N -4.51 2.15 -3.42 0.00 -0.00 -1.26 -4.80 115.22 103.38 1g4x n HIS 193 Ca -0.10 0.31 -0.37 0.00 0.46 0.00 0.00 57.72 58.02 1g4x n HIS 193 Cb 0.58 -2.54 -0.06 0.00 -0.12 0.00 0.00 29.99 27.84 1g4x n HIS 193 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1g4x s ALA 194 N 3.54 3.53 -2.11 1.57 0.00 -1.26 -0.07 121.76 126.96 1g4x s ALA 194 Ca 0.95 -0.32 0.22 0.00 0.00 0.00 0.00 51.96 52.81 1g4x s ALA 194 Cb -0.90 -2.52 0.59 0.00 0.00 0.00 0.00 23.12 20.29 1g4x s ALA 194 CO 0.58 0.05 1.50 -0.35 0.00 0.00 0.00 175.76 177.54 1g4x n PRO 195 N 3.60 2.61 0.00 0.00 -0.04 -1.26 -2.96 135.00 136.95 1g4x n PRO 195 Ca -0.09 -2.48 -0.04 0.00 -0.04 0.00 0.00 63.50 60.84 1g4x n PRO 195 Cb 0.52 -1.54 -0.11 0.00 -0.04 0.00 0.00 33.50 32.32 1g4x n PRO 195 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1g4x n THR 196 N 1.55 1.38 -1.02 0.52 -2.24 -0.89 -2.95 114.28 110.63 1g4x n THR 196 Ca 0.23 -0.74 -0.01 0.00 -2.27 0.00 0.00 64.05 61.26 1g4x n THR 196 Cb 0.60 -0.86 -0.00 0.00 -2.10 0.00 0.00 70.33 67.96 1g4x n THR 196 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1g4x n GLY 197 N 1.48 0.42 3.73 3.38 0.00 0.90 -4.53 105.19 110.57 1g4x n GLY 197 Ca -0.14 -0.09 -0.36 0.00 0.00 0.00 0.00 46.02 45.43 1g4x n GLY 197 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1g4x s ILE 198 N -1.81 5.32 0.11 -0.61 -1.09 -1.26 -0.77 121.20 121.09 1g4x s ILE 198 Ca 0.00 0.51 0.10 0.00 -2.23 0.00 0.00 60.65 59.03 1g4x s ILE 198 Cb 0.00 -3.61 -0.04 0.00 -1.58 0.00 0.00 42.46 37.23 1g4x s ILE 198 CO 0.00 0.39 -0.26 -1.81 -1.23 0.00 0.00 174.94 172.04 1g4x s ASP 199 N 0.48 3.13 0.47 3.58 1.01 -1.26 -4.33 116.67 119.75 1g4x s ASP 199 Ca 0.15 -0.72 -0.25 0.00 0.71 0.00 0.00 52.55 52.45 1g4x s ASP 199 Cb -0.13 -0.21 -0.08 0.00 1.01 0.00 0.00 42.92 43.52 1g4x s ASP 199 CO 0.03 0.16 1.43 -2.84 0.21 0.00 0.00 175.17 174.16 1g4x s PRO 200 N -1.93 3.57 0.72 8.23 0.02 -1.26 -5.00 135.00 139.35 1g4x s PRO 200 Ca 0.12 2.41 -0.12 0.00 0.02 0.00 0.00 61.00 63.43 1g4x s PRO 200 Cb -0.10 -2.58 0.03 0.00 0.02 0.00 0.00 34.50 31.86 1g4x s PRO 200 CO 0.05 -0.91 1.09 0.99 -0.33 0.00 0.00 177.00 177.89 1g4x s THR 201 N -1.21 3.46 0.34 0.99 2.01 -1.26 -4.79 115.64 115.18 1g4x s THR 201 Ca 0.63 0.54 0.05 0.00 0.31 0.00 0.00 61.69 63.22 1g4x s THR 201 Cb -0.44 -3.08 0.30 0.00 0.01 0.00 0.00 72.50 69.29 1g4x s THR 201 CO 0.56 -0.55 1.92 0.25 -0.69 0.00 0.00 174.62 176.10 1g4x h LEU 202 N -0.65 0.74 -0.65 4.42 5.85 -1.99 0.16 115.31 123.20 1g4x h LEU 202 Ca -0.45 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.20 1g4x h LEU 202 Cb 1.23 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.09 1g4x h LEU 202 CO 0.53 0.46 0.06 -0.33 -0.34 0.00 0.00 178.44 178.82 1g4x h GLU 203 N 0.83 1.10 -0.43 1.25 5.08 -1.99 -0.75 114.58 119.67 1g4x h GLU 203 Ca 0.37 -0.32 -0.09 0.00 -1.00 0.00 0.00 59.36 58.31 1g4x h GLU 203 Cb 0.35 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1g4x h GLU 203 CO -0.14 1.03 -0.12 1.96 -1.00 0.00 0.00 179.01 180.75 1g4x h GLN 204 N 1.02 0.78 -0.65 2.33 4.20 -1.55 0.46 115.11 121.70 1g4x h GLN 204 Ca 0.19 -0.26 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 1g4x h GLN 204 Cb 0.49 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.18 1g4x h GLN 204 CO 0.02 0.87 0.28 -1.49 -0.67 0.00 0.00 178.83 177.83 1g4x h TRP 205 N 0.71 0.97 -0.61 2.96 -0.00 -0.73 -1.26 115.95 117.99 1g4x h TRP 205 Ca 0.12 -0.06 -0.09 0.00 -0.00 0.00 0.00 58.89 58.85 1g4x h TRP 205 Cb 0.60 -0.29 -0.02 0.00 -0.00 0.00 0.00 29.16 29.44 1g4x h TRP 205 CO 0.03 0.75 0.01 1.96 -0.00 0.00 0.00 178.44 181.19 1g4x h GLN 206 N 0.91 1.07 -0.24 0.49 4.20 -0.43 0.13 115.11 121.23 1g4x h GLN 206 Ca 0.22 -0.34 -0.14 0.00 0.06 0.00 0.00 58.65 58.46 1g4x h GLN 206 Cb 0.18 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 1g4x h GLN 206 CO -0.02 1.04 -0.42 1.79 -0.67 0.00 0.00 178.83 180.55 1g4x h THR 207 N 0.97 1.30 -0.70 -0.54 1.35 -0.78 -1.40 112.91 113.11 1g4x h THR 207 Ca 0.17 -1.59 -0.02 0.00 -0.55 0.00 0.00 66.41 64.42 1g4x h THR 207 Cb 0.55 1.56 -0.03 0.00 -1.73 0.00 0.00 68.15 68.50 1g4x h THR 207 CO 0.03 0.50 0.35 -0.07 -0.25 0.00 0.00 175.52 176.08 1g4x h LEU 208 N 0.48 0.90 -0.32 3.87 4.07 -0.97 -0.09 115.31 123.25 1g4x h LEU 208 Ca 0.04 -0.12 -0.02 0.00 0.08 0.00 0.00 57.88 57.86 1g4x h LEU 208 Cb 0.93 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 42.42 1g4x h LEU 208 CO 0.08 0.76 0.13 0.00 -1.08 0.00 0.00 178.44 178.34 1g4x h ALA 209 N 1.17 0.41 -0.46 1.53 0.00 -0.28 -0.46 119.26 121.18 1g4x h ALA 209 Ca 0.24 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1g4x h ALA 209 Cb 0.09 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1g4x h ALA 209 CO -0.03 0.01 0.24 1.96 0.00 0.00 0.00 179.25 181.43 1g4x h GLN 210 N 0.37 0.65 -0.49 0.00 4.20 -1.04 -2.52 115.11 116.27 1g4x h GLN 210 Ca 0.11 -0.08 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 1g4x h GLN 210 Cb 0.17 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 1g4x h GLN 210 CO -0.01 0.53 0.20 1.25 -0.67 0.00 0.00 178.83 180.13 1g4x h LEU 211 N 0.61 0.68 -0.63 1.46 5.85 -0.88 -3.01 115.31 119.39 1g4x h LEU 211 Ca 0.16 -0.16 0.09 0.00 0.84 0.00 0.00 57.88 58.81 1g4x h LEU 211 Cb 0.07 -0.18 -0.07 0.00 0.37 0.00 0.00 40.66 40.86 1g4x h LEU 211 CO -0.02 0.66 0.26 -1.28 -0.34 0.00 0.00 178.44 177.72 1g4x h SER 212 N 0.66 0.30 0.12 1.25 0.87 -0.79 -1.09 113.55 114.86 1g4x h SER 212 Ca 0.17 0.07 -0.14 0.00 -1.23 0.00 0.00 61.79 60.66 1g4x h SER 212 Cb 0.19 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.17 1g4x h SER 212 CO -0.01 0.17 -0.50 -0.37 -0.53 0.00 0.00 176.83 175.59 1g4x h VAL 213 N 0.46 1.33 -0.21 2.23 -1.51 -1.37 -1.17 116.25 116.00 1g4x h VAL 213 Ca 0.31 -1.73 -0.12 0.00 -1.23 0.00 0.00 66.70 63.94 1g4x h VAL 213 Cb 0.36 1.75 -0.01 0.00 -2.13 0.00 0.00 31.29 31.26 1g4x h VAL 213 CO -0.29 0.53 -0.36 -0.08 -1.23 0.00 0.00 177.57 176.14 1g4x h GLU 214 N 0.34 0.47 0.00 5.19 4.81 -1.27 -3.00 114.58 121.11 1g4x h GLU 214 Ca 0.02 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 59.03 1g4x h GLU 214 Cb 1.00 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.37 1g4x h GLU 214 CO 0.09 0.77 -0.86 0.87 -0.73 0.00 0.00 179.01 179.15 1g4x h LYS 215 N 0.40 0.00 -1.50 1.92 1.79 -1.13 -3.49 116.57 114.56 1g4x h LYS 215 Ca 0.04 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.48 1g4x h LYS 215 Cb 0.82 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.48 1g4x h LYS 215 CO 0.07 0.00 -0.06 0.41 -1.08 0.00 0.00 179.45 178.79 1g4x n GLY 216 N 1.24 0.78 3.80 3.86 0.00 -0.50 -3.75 105.19 110.62 1g4x n GLY 216 Ca 0.01 -0.58 -0.36 0.00 0.00 0.00 0.00 46.02 45.09 1g4x n GLY 216 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1g4x s TRP 217 N -3.03 3.66 -0.30 1.61 0.23 -0.86 -0.94 118.94 119.31 1g4x s TRP 217 Ca 0.04 1.54 -0.14 0.00 -2.03 0.00 0.00 56.10 55.51 1g4x s TRP 217 Cb -0.02 -2.74 -0.03 0.00 0.03 0.00 0.00 33.47 30.72 1g4x s TRP 217 CO 0.06 0.28 0.33 -1.17 0.96 0.00 0.00 176.95 177.40 1g4x s LEU 218 N -2.04 4.20 0.09 2.99 0.20 -0.06 -4.83 118.68 119.23 1g4x s LEU 218 Ca 0.46 0.00 -0.30 0.00 0.69 0.00 0.00 54.13 54.98 1g4x s LEU 218 Cb -0.17 -2.32 -0.06 0.00 -0.43 0.00 0.00 46.19 43.22 1g4x s LEU 218 CO 0.22 -0.22 1.05 -2.84 -0.29 0.00 0.00 176.35 174.28 1g4x s PRO 219 N 1.97 4.58 -0.21 0.98 0.02 -1.26 -1.22 135.00 139.87 1g4x s PRO 219 Ca 0.12 1.58 0.01 0.00 0.02 0.00 0.00 61.00 62.73 1g4x s PRO 219 Cb -0.16 -3.37 0.04 0.00 0.02 0.00 0.00 34.50 31.03 1g4x s PRO 219 CO 0.11 0.01 -0.12 -1.17 -0.33 0.00 0.00 177.00 175.49 1g4x s LEU 220 N 0.39 2.46 -0.15 -5.54 0.20 -0.03 -1.69 118.68 114.32 1g4x s LEU 220 Ca 0.51 -0.93 -0.11 0.00 0.69 0.00 0.00 54.13 54.29 1g4x s LEU 220 Cb -0.26 -1.33 -0.05 0.00 -0.43 0.00 0.00 46.19 44.12 1g4x s LEU 220 CO 0.31 -0.13 0.21 -0.36 -0.29 0.00 0.00 176.35 176.09 1g4x s PHE 221 N 1.32 3.49 -0.29 5.38 0.08 0.05 -0.64 117.98 127.37 1g4x s PHE 221 Ca -0.01 0.52 -0.08 0.00 0.12 0.00 0.00 56.93 57.48 1g4x s PHE 221 Cb -0.16 -2.20 0.00 0.00 -0.57 0.00 0.00 43.02 40.09 1g4x s PHE 221 CO -0.08 0.38 0.10 0.34 -0.10 0.00 0.00 175.22 175.86 1g4x s ASP 222 N 0.03 5.25 -0.44 1.36 3.68 0.26 -0.58 116.67 126.23 1g4x s ASP 222 Ca 0.14 -0.60 0.03 0.00 2.13 0.00 0.00 52.55 54.25 1g4x s ASP 222 Cb -0.12 -1.92 0.12 0.00 -1.45 0.00 0.00 42.92 39.55 1g4x s ASP 222 CO 0.03 -0.18 0.19 0.12 0.13 0.00 0.00 175.17 175.46 1g4x s PHE 223 N 1.55 2.83 -0.43 -5.34 2.19 -0.02 -1.10 117.98 117.65 1g4x s PHE 223 Ca 0.04 -2.79 0.05 0.00 0.33 0.00 0.00 56.93 54.56 1g4x s PHE 223 Cb -0.17 -2.48 -0.00 0.00 -1.31 0.00 0.00 43.02 39.06 1g4x s PHE 223 CO 0.04 -0.81 0.43 0.00 1.83 0.00 0.00 175.22 176.71 1g4x n ALA 224 N 3.66 2.54 -2.40 11.12 0.00 -1.26 -1.39 120.51 132.78 1g4x n ALA 224 Ca 0.05 -0.34 -0.14 0.00 0.00 0.00 0.00 53.44 53.01 1g4x n ALA 224 Cb 0.36 -0.17 0.03 0.00 0.00 0.00 0.00 19.45 19.67 1g4x n ALA 224 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1g4x n TYR 225 N -0.39 2.13 -2.25 0.00 4.02 -1.26 -4.53 117.16 114.87 1g4x n TYR 225 Ca 0.02 -2.26 -0.42 0.00 -0.01 0.00 0.00 57.90 55.22 1g4x n TYR 225 Cb 0.10 -0.28 -0.03 0.00 -0.02 0.00 0.00 39.34 39.11 1g4x n TYR 225 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 176.86 174.71 1g4x s GLN 226 N -3.66 4.35 0.00 -0.72 0.74 -1.26 -1.78 119.66 117.33 1g4x s GLN 226 Ca 0.40 1.97 0.00 0.00 0.05 0.00 0.00 55.36 57.78 1g4x s GLN 226 Cb 0.38 -3.31 0.00 0.00 1.10 0.00 0.00 33.01 31.18 1g4x s GLN 226 CO -0.00 -0.39 0.00 0.41 -0.55 0.00 0.00 175.29 174.75 1g4x n GLY 227 N 3.42 3.43 0.12 2.59 0.00 -1.26 -4.80 105.19 108.70 1g4x n GLY 227 Ca 0.11 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.25 1g4x n GLY 227 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1g4x h PHE 228 N 0.00 0.00 0.00 1.61 0.04 -1.67 -3.37 116.94 113.55 1g4x h PHE 228 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1g4x h PHE 228 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 1g4x h PHE 228 CO 0.00 0.00 -0.61 0.00 -0.60 0.00 0.00 178.31 177.10 1g4x n ALA 229 N -1.92 0.54 0.00 2.45 0.00 -1.26 -4.29 120.51 116.02 1g4x n ALA 229 Ca 0.04 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1g4x n ALA 229 Cb 0.47 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.94 1g4x n ALA 229 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1g4x n ARG 230 N -4.57 0.09 0.00 0.00 1.74 -1.26 -4.93 116.66 107.73 1g4x n ARG 230 Ca -0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.99 1g4x n ARG 230 Cb 0.32 -0.74 0.00 0.00 -1.02 0.00 0.00 32.46 31.02 1g4x n ARG 230 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1g4x n GLY 231 N 2.42 1.14 0.34 -0.13 0.00 -1.26 -4.98 105.19 102.73 1g4x n GLY 231 Ca 0.00 -0.98 -0.15 0.00 0.00 0.00 0.00 46.02 44.88 1g4x n GLY 231 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1g4x h LEU 233 N 0.00 -0.81 -0.57 0.99 3.38 -1.91 -1.75 115.31 114.65 1g4x h LEU 233 Ca 0.00 0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 1g4x h LEU 233 Cb 0.00 0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1g4x h LEU 233 CO 0.00 -0.46 -0.14 -0.33 0.09 0.00 0.00 178.44 177.61 1g4x h GLU 234 N -0.69 1.00 -0.73 1.13 4.39 -1.97 -2.88 114.58 114.84 1g4x h GLU 234 Ca -0.03 -0.38 -0.02 0.00 0.34 0.00 0.00 59.36 59.26 1g4x h GLU 234 Cb 0.60 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.16 1g4x h GLU 234 CO -0.02 1.07 0.38 0.93 -1.16 0.00 0.00 179.01 180.21 1g4x h GLU 235 N 0.89 1.03 0.00 2.33 3.07 -1.92 -1.95 114.58 118.03 1g4x h GLU 235 Ca 0.13 -0.13 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 1g4x h GLU 235 Cb 0.71 -0.20 -0.00 0.00 -0.84 0.00 0.00 28.75 28.41 1g4x h GLU 235 CO 0.05 0.77 -0.11 -0.44 -1.40 0.00 0.00 179.01 177.89 1g4x h ASP 236 N 1.03 0.00 1.48 1.42 3.45 -1.10 -2.96 116.42 119.73 1g4x h ASP 236 Ca 0.26 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.72 1g4x h ASP 236 Cb 0.06 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.83 1g4x h ASP 236 CO -0.04 0.11 -0.25 0.00 -1.57 0.00 0.00 179.24 177.48 1g4x h ALA 237 N 1.89 0.85 -0.92 3.45 0.00 -1.23 -3.40 119.26 119.90 1g4x h ALA 237 Ca -0.00 0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.08 1g4x h ALA 237 Cb 0.88 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.50 1g4x h ALA 237 CO 0.01 0.00 -0.26 -1.91 0.00 0.00 0.00 179.25 177.09 1g4x n GLU 238 N -2.58 -0.12 -0.24 0.00 2.13 -1.03 -1.41 120.64 117.40 1g4x n GLU 238 Ca 0.04 1.44 -0.08 0.00 0.66 0.00 0.00 57.16 59.21 1g4x n GLU 238 Cb 0.48 -2.14 0.04 0.00 0.27 0.00 0.00 31.44 30.09 1g4x n GLU 238 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1g4x h GLY 239 N 0.00 1.17 0.99 8.31 0.00 -1.82 -0.03 103.07 111.70 1g4x h GLY 239 Ca 0.41 -0.78 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 1g4x h GLY 239 CO -0.94 0.72 0.25 -2.00 0.00 0.00 0.00 176.54 174.56 1g4x h LEU 240 N 1.01 0.81 -1.19 3.11 5.85 -1.56 -1.83 115.31 121.51 1g4x h LEU 240 Ca 0.20 -0.16 -0.08 0.00 0.84 0.00 0.00 57.88 58.68 1g4x h LEU 240 Cb 0.43 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1g4x h LEU 240 CO 0.01 0.75 -0.36 0.03 -0.34 0.00 0.00 178.44 178.53 1g4x h ARG 241 N 0.82 0.08 -0.54 1.25 3.08 -0.81 0.12 114.38 118.38 1g4x h ARG 241 Ca 0.20 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 1g4x h ARG 241 Cb 0.19 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1g4x h ARG 241 CO -0.02 0.43 0.25 0.00 -1.07 0.00 0.00 179.97 179.56 1g4x h ALA 242 N 1.57 0.70 -0.39 0.04 0.00 -0.23 -2.15 119.26 118.79 1g4x h ALA 242 Ca 0.01 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.65 1g4x h ALA 242 Cb 0.67 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1g4x h ALA 242 CO 0.05 0.28 -0.26 0.74 0.00 0.00 0.00 179.25 180.06 1g4x h PHE 243 N 0.73 1.02 -0.01 0.00 0.04 -0.61 -3.18 116.94 114.94 1g4x h PHE 243 Ca 0.18 -0.28 -0.08 0.00 2.80 0.00 0.00 57.97 60.60 1g4x h PHE 243 Cb 0.15 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.06 1g4x h PHE 243 CO 0.00 1.07 -0.36 0.00 -0.60 0.00 0.00 178.31 178.42 1g4x h ALA 244 N 0.79 1.38 0.00 2.45 0.00 -0.69 0.92 119.26 124.11 1g4x h ALA 244 Ca 0.08 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1g4x h ALA 244 Cb 0.84 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 1g4x h ALA 244 CO 0.07 0.46 -0.08 0.00 0.00 0.00 0.00 179.25 179.70 1g4x h ALA 245 N 1.62 1.01 0.02 0.00 0.00 -1.41 -3.27 119.26 117.23 1g4x h ALA 245 Ca 0.00 -0.07 -0.36 0.00 0.00 0.00 0.00 54.91 54.47 1g4x h ALA 245 Cb 0.65 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.36 1g4x h ALA 245 CO 0.05 0.10 -2.26 -0.12 0.00 0.00 0.00 179.25 177.02 1g4x n MET 246 N -3.20 0.68 -3.93 0.00 0.00 -0.79 -5.00 117.12 104.88 1g4x n MET 246 Ca 0.01 0.12 -0.37 0.00 0.00 0.00 0.00 57.70 57.47 1g4x n MET 246 Cb 0.37 -1.59 -0.07 0.00 0.00 0.00 0.00 33.22 31.93 1g4x n MET 246 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 175.97 174.96 1g4x s HIS 247 N -2.53 3.54 0.20 1.12 4.02 0.25 -4.97 115.29 116.92 1g4x s HIS 247 Ca -0.18 0.47 0.02 0.00 1.02 0.00 0.00 55.06 56.39 1g4x s HIS 247 Cb 0.07 -1.94 0.14 0.00 -1.02 0.00 0.00 32.58 29.84 1g4x s HIS 247 CO 0.75 0.68 1.49 0.87 1.02 0.00 0.00 174.74 179.54 1g4x h LYS 248 N 5.12 0.28 -4.29 1.40 1.79 -1.89 -3.46 116.57 115.52 1g4x h LYS 248 Ca -0.53 -0.22 -0.28 0.00 -2.18 0.00 0.00 60.65 57.43 1g4x h LYS 248 Cb 1.22 0.04 -0.25 0.00 -1.58 0.00 0.00 32.23 31.66 1g4x h LYS 248 CO 0.59 0.86 -0.74 -1.21 -1.08 0.00 0.00 179.45 177.88 1g4x s GLU 249 N -3.61 0.39 0.02 3.15 2.02 -1.26 -2.65 118.70 116.76 1g4x s GLU 249 Ca -0.04 -0.40 -0.28 0.00 0.02 0.00 0.00 54.97 54.26 1g4x s GLU 249 Cb 0.11 -0.26 0.10 0.00 0.10 0.00 0.00 34.13 34.17 1g4x s GLU 249 CO 0.82 0.06 0.99 -0.48 0.02 0.00 0.00 175.26 176.67 1g4x s LEU 250 N -0.75 -0.24 -0.01 1.80 2.34 -0.91 -4.52 118.68 116.38 1g4x s LEU 250 Ca -0.04 -0.15 0.04 0.00 0.06 0.00 0.00 54.13 54.04 1g4x s LEU 250 Cb -0.05 1.92 -0.01 0.00 -0.56 0.00 0.00 46.19 47.49 1g4x s LEU 250 CO -0.00 -0.63 -0.14 -0.63 -1.06 0.00 0.00 176.35 173.88 1g4x s ILE 251 N -3.02 1.12 -0.07 1.48 1.01 -0.68 -0.96 121.20 120.08 1g4x s ILE 251 Ca 0.09 -0.60 0.01 0.00 0.00 0.00 0.00 60.65 60.14 1g4x s ILE 251 Cb -0.00 -0.94 0.02 0.00 0.01 0.00 0.00 42.46 41.55 1g4x s ILE 251 CO -0.04 0.32 -0.06 0.54 0.00 0.00 0.00 174.94 175.70 1g4x s VAL 252 N -0.29 0.74 -0.34 2.92 0.11 -0.41 -0.77 120.40 122.35 1g4x s VAL 252 Ca 0.05 -0.19 -0.11 0.00 -2.93 0.00 0.00 61.98 58.80 1g4x s VAL 252 Cb -0.06 -0.76 0.01 0.00 -1.53 0.00 0.00 36.38 34.04 1g4x s VAL 252 CO -0.00 0.29 0.19 0.00 -3.33 0.00 0.00 175.10 172.24 1g4x s ALA 253 N 1.20 3.31 0.24 1.54 0.00 0.25 -0.73 121.76 127.58 1g4x s ALA 253 Ca -0.06 -1.54 0.10 0.00 0.00 0.00 0.00 51.96 50.46 1g4x s ALA 253 Cb -0.14 -2.52 -0.05 0.00 0.00 0.00 0.00 23.12 20.42 1g4x s ALA 253 CO -0.02 -1.14 -0.11 -1.54 0.00 0.00 0.00 175.76 172.95 1g4x s SER 254 N 1.60 4.06 0.08 0.00 1.04 -0.24 -0.84 113.70 119.39 1g4x s SER 254 Ca 0.04 -0.77 0.08 0.00 0.48 0.00 0.00 55.95 55.77 1g4x s SER 254 Cb -0.18 -0.58 -0.03 0.00 0.10 0.00 0.00 66.02 65.32 1g4x s SER 254 CO 0.07 0.05 -0.20 -0.55 0.98 0.00 0.00 173.24 173.59 1g4x s SER 255 N -3.32 2.40 0.00 7.02 0.15 -0.49 -1.45 113.70 118.02 1g4x s SER 255 Ca 0.28 -0.62 0.09 0.00 0.70 0.00 0.00 55.95 56.41 1g4x s SER 255 Cb -0.07 -0.15 0.24 0.00 -1.71 0.00 0.00 66.02 64.34 1g4x s SER 255 CO 0.16 0.08 1.18 -1.22 1.20 0.00 0.00 173.24 174.63 1g4x n TYR 256 N 1.38 0.36 -0.23 3.44 4.01 -0.75 -4.73 117.16 120.64 1g4x n TYR 256 Ca -0.19 -0.45 -0.06 0.00 -0.16 0.00 0.00 57.90 57.04 1g4x n TYR 256 Cb 0.54 -0.03 0.04 0.00 -0.31 0.00 0.00 39.34 39.58 1g4x n TYR 256 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 1g4x h SER 257 N 1.74 0.77 0.03 7.72 0.02 -1.84 -2.69 113.55 119.29 1g4x h SER 257 Ca 0.00 -0.05 -0.28 0.00 -0.84 0.00 0.00 61.79 60.62 1g4x h SER 257 Cb 0.67 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.98 1g4x h SER 257 CO 0.00 0.59 -1.51 0.29 -1.14 0.00 0.00 176.83 175.07 1g4x n LYS 258 N -4.60 0.61 0.02 3.45 4.01 -1.26 -1.54 118.16 118.85 1g4x n LYS 258 Ca 0.05 0.49 0.12 0.00 -0.51 0.00 0.00 58.31 58.45 1g4x n LYS 258 Cb 0.05 -1.72 0.49 0.00 -0.51 0.00 0.00 35.03 33.33 1g4x n LYS 258 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1g4x n ASN 259 N -4.21 0.15 -0.21 4.39 2.04 -1.25 -2.45 115.26 113.72 1g4x n ASN 259 Ca -0.34 0.52 0.02 0.00 -0.44 0.00 0.00 54.58 54.35 1g4x n ASN 259 Cb 0.77 -0.56 0.03 0.00 -2.53 0.00 0.00 39.78 37.49 1g4x n ASN 259 CO 0.00 0.00 0.00 0.49 -0.44 0.00 0.00 177.26 177.31 1g4x n PHE 260 N -1.65 0.03 -2.40 -2.53 3.72 -1.02 -4.85 117.46 108.76 1g4x n PHE 260 Ca 0.05 -0.07 -0.21 0.00 -0.05 0.00 0.00 57.45 57.18 1g4x n PHE 260 Cb 0.29 -0.01 -0.01 0.00 -0.94 0.00 0.00 39.48 38.81 1g4x n PHE 260 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1g4x n GLY 261 N 0.23 -0.50 1.90 1.37 0.00 -1.03 -4.68 105.19 102.48 1g4x n GLY 261 Ca 0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 1g4x n GLY 261 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1g4x n LEU 262 N -3.01 5.97 -0.36 0.99 4.77 -0.59 -4.83 117.00 119.94 1g4x n LEU 262 Ca -0.25 -3.87 -0.04 0.00 -0.03 0.00 0.00 56.01 51.83 1g4x n LEU 262 Cb 0.69 -0.77 -0.01 0.00 -2.33 0.00 0.00 43.42 41.00 1g4x n LEU 262 CO 0.29 1.27 0.50 -1.22 -1.33 0.00 0.00 177.39 176.90 1g4x n TYR 263 N -1.07 -0.12 1.49 -1.77 4.02 -1.16 -1.01 117.16 117.53 1g4x n TYR 263 Ca 0.51 1.13 0.10 0.00 -0.01 0.00 0.00 57.90 59.63 1g4x n TYR 263 Cb 1.25 -0.75 0.43 0.00 -0.02 0.00 0.00 39.34 40.24 1g4x n TYR 263 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 1g4x n ASN 264 N -5.27 1.10 -0.19 7.72 0.23 -1.26 -3.51 115.26 114.07 1g4x n ASN 264 Ca 0.07 -1.62 0.12 0.00 -0.53 0.00 0.00 54.58 52.62 1g4x n ASN 264 Cb 0.32 -0.07 0.27 0.00 -2.08 0.00 0.00 39.78 38.23 1g4x n ASN 264 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1g4x n GLU 265 N -0.05 0.61 -3.25 -3.83 -0.58 -0.18 -5.00 120.64 108.37 1g4x n GLU 265 Ca 0.15 -0.39 -0.10 0.00 -0.42 0.00 0.00 57.16 56.40 1g4x n GLU 265 Cb 0.24 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.62 1g4x n GLU 265 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1g4x n ARG 266 N -0.85 -1.57 -4.02 3.49 5.12 -1.23 -4.39 116.66 113.21 1g4x n ARG 266 Ca 0.10 1.39 -0.30 0.00 -1.93 0.00 0.00 57.85 57.10 1g4x n ARG 266 Cb 0.36 -4.62 -0.16 0.00 -1.16 0.00 0.00 32.46 26.88 1g4x n ARG 266 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1g4x s VAL 267 N -2.84 1.63 0.31 1.55 0.11 -1.26 -2.47 120.40 117.43 1g4x s VAL 267 Ca 0.06 -0.74 -0.07 0.00 -2.93 0.00 0.00 61.98 58.30 1g4x s VAL 267 Cb -0.01 -1.56 0.03 0.00 -1.53 0.00 0.00 36.38 33.31 1g4x s VAL 267 CO 0.80 0.41 0.54 0.61 -3.33 0.00 0.00 175.10 174.13 1g4x n GLY 268 N 4.74 1.68 3.32 6.54 0.00 -0.88 -1.81 105.19 118.77 1g4x n GLY 268 Ca -0.17 -1.39 -0.14 0.00 0.00 0.00 0.00 46.02 44.32 1g4x n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g4x s ALA 269 N -2.24 -1.05 -0.25 4.61 0.00 -0.53 -1.20 121.76 121.11 1g4x s ALA 269 Ca 0.19 0.87 0.01 0.00 0.00 0.00 0.00 51.96 53.03 1g4x s ALA 269 Cb -0.03 -0.30 0.04 0.00 0.00 0.00 0.00 23.12 22.84 1g4x s ALA 269 CO 0.14 -0.25 -0.10 0.00 0.00 0.00 0.00 175.76 175.55 1g4x s THR 271 N 1.20 4.36 -0.14 0.00 2.01 0.09 -1.44 115.64 121.73 1g4x s THR 271 Ca -0.04 -0.19 -0.06 0.00 0.31 0.00 0.00 61.69 61.71 1g4x s THR 271 Cb -0.18 -2.95 -0.04 0.00 0.01 0.00 0.00 72.50 69.34 1g4x s THR 271 CO -0.05 0.47 0.09 -0.76 -0.69 0.00 0.00 174.62 173.67 1g4x s LEU 272 N 0.43 4.03 -0.01 4.42 1.43 -0.03 -1.29 118.68 127.66 1g4x s LEU 272 Ca -0.00 0.26 0.04 0.00 -1.03 0.00 0.00 54.13 53.40 1g4x s LEU 272 Cb -0.13 -1.99 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 1g4x s LEU 272 CO 0.02 0.31 -0.14 -0.69 0.23 0.00 0.00 176.35 176.08 1g4x s VAL 273 N -0.44 1.09 0.35 -1.59 1.01 -0.14 -1.64 120.40 119.04 1g4x s VAL 273 Ca 0.10 -0.59 -0.05 0.00 0.00 0.00 0.00 61.98 61.44 1g4x s VAL 273 Cb -0.12 -0.91 0.01 0.00 0.00 0.00 0.00 36.38 35.37 1g4x s VAL 273 CO 0.02 0.31 0.52 0.00 0.00 0.00 0.00 175.10 175.95 1g4x s ALA 274 N -0.32 0.48 0.56 5.51 0.00 -1.12 -2.14 121.76 124.74 1g4x s ALA 274 Ca 0.05 -1.37 0.28 0.00 0.00 0.00 0.00 51.96 50.93 1g4x s ALA 274 Cb -0.05 1.08 1.48 0.00 0.00 0.00 0.00 23.12 25.62 1g4x s ALA 274 CO -0.01 -0.82 1.96 0.00 0.00 0.00 0.00 175.76 176.89 1g4x h ALA 275 N 2.10 2.33 -2.96 0.00 0.00 -1.83 -3.45 119.26 115.44 1g4x h ALA 275 Ca -0.29 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.68 1g4x h ALA 275 Cb 1.24 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 19.02 1g4x h ALA 275 CO 0.39 -0.69 0.25 0.16 0.00 0.00 0.00 179.25 179.35 1g4x s ASP 276 N -5.68 -0.24 0.26 0.00 -4.77 -1.26 -5.01 116.67 99.97 1g4x s ASP 276 Ca -0.05 -0.63 -0.03 0.00 -3.30 0.00 0.00 52.55 48.55 1g4x s ASP 276 Cb 0.18 0.72 0.34 0.00 -1.09 0.00 0.00 42.92 43.07 1g4x s ASP 276 CO 0.64 -1.34 1.81 0.28 0.70 0.00 0.00 175.17 177.26 1g4x h SER 277 N 2.00 0.84 -0.77 2.11 0.02 -1.73 -2.13 113.55 113.89 1g4x h SER 277 Ca -0.20 -0.15 0.02 0.00 -0.84 0.00 0.00 61.79 60.62 1g4x h SER 277 Cb 1.25 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 63.53 1g4x h SER 277 CO 0.24 0.81 0.51 -0.08 -1.14 0.00 0.00 176.83 177.17 1g4x h GLU 278 N 0.87 0.99 0.00 3.45 4.22 -1.95 -0.82 114.58 121.34 1g4x h GLU 278 Ca 0.19 -0.06 -0.20 0.00 0.08 0.00 0.00 59.36 59.37 1g4x h GLU 278 Cb 0.29 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 1g4x h GLU 278 CO -0.00 0.65 -0.99 0.00 -2.18 0.00 0.00 179.01 176.49 1g4x h THR 279 N 1.02 1.64 -0.65 0.32 1.03 -1.91 -3.04 112.91 111.31 1g4x h THR 279 Ca 0.29 -3.33 -0.05 0.00 -0.01 0.00 0.00 66.41 63.32 1g4x h THR 279 Cb -0.07 2.81 -0.03 0.00 -1.07 0.00 0.00 68.15 69.79 1g4x h THR 279 CO -0.08 0.93 0.21 1.62 -0.01 0.00 0.00 175.52 178.19 1g4x h VAL 280 N 0.00 1.25 -0.44 0.00 3.04 -0.66 -0.33 116.25 119.11 1g4x h VAL 280 Ca -0.02 -0.84 -0.08 0.00 -1.01 0.00 0.00 66.70 64.75 1g4x h VAL 280 Cb 1.75 0.57 -0.01 0.00 -2.01 0.00 0.00 31.29 31.58 1g4x h VAL 280 CO 0.12 0.32 -0.05 0.44 -1.01 0.00 0.00 177.57 177.39 1g4x h ASP 281 N 0.93 0.81 -0.36 3.17 3.32 -1.24 0.13 116.42 123.19 1g4x h ASP 281 Ca 0.21 -0.34 -0.06 0.00 0.02 0.00 0.00 57.03 56.87 1g4x h ASP 281 Cb 0.28 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 1g4x h ASP 281 CO -0.01 0.95 0.00 0.03 -1.72 0.00 0.00 179.24 178.50 1g4x h ARG 282 N 0.65 0.63 -0.66 3.56 3.08 -1.40 -0.88 114.38 119.35 1g4x h ARG 282 Ca 0.12 -0.20 -0.06 0.00 0.07 0.00 0.00 59.98 59.91 1g4x h ARG 282 Cb 0.57 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.54 1g4x h ARG 282 CO 0.03 0.74 0.16 0.00 -1.07 0.00 0.00 179.97 179.83 1g4x h ALA 283 N 0.87 0.87 -0.41 0.04 0.00 -0.94 -2.93 119.26 116.76 1g4x h ALA 283 Ca 0.10 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1g4x h ALA 283 Cb 0.45 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1g4x h ALA 283 CO 0.02 0.59 -0.04 0.35 0.00 0.00 0.00 179.25 180.17 1g4x h PHE 284 N 0.98 0.73 -0.60 0.00 3.57 -0.60 -2.12 116.94 118.90 1g4x h PHE 284 Ca 0.21 -0.10 0.02 0.00 3.53 0.00 0.00 57.97 61.63 1g4x h PHE 284 Cb 0.36 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.87 1g4x h PHE 284 CO 0.03 0.71 0.40 0.66 -2.23 0.00 0.00 178.31 177.88 1g4x h SER 285 N 0.64 0.63 0.61 0.41 4.64 -0.97 -0.34 113.55 119.18 1g4x h SER 285 Ca 0.12 -0.01 -0.17 0.00 -0.47 0.00 0.00 61.79 61.27 1g4x h SER 285 Cb 0.46 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.38 1g4x h SER 285 CO 0.02 0.45 -0.76 1.56 -0.87 0.00 0.00 176.83 177.23 1g4x h GLN 286 N 0.74 0.11 -0.64 4.77 1.08 -1.40 -1.69 115.11 118.08 1g4x h GLN 286 Ca 0.23 -0.10 -0.06 0.00 -1.45 0.00 0.00 58.65 57.27 1g4x h GLN 286 Cb 0.03 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.45 1g4x h GLN 286 CO -0.06 0.81 0.15 1.98 -0.95 0.00 0.00 178.83 180.76 1g4x h MET 287 N 0.07 1.01 -0.54 1.46 4.05 -0.64 -1.32 114.93 119.02 1g4x h MET 287 Ca -0.02 -0.23 -0.06 0.00 -0.28 0.00 0.00 59.70 59.11 1g4x h MET 287 Cb 1.33 -0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 31.97 1g4x h MET 287 CO 0.11 0.90 0.08 0.87 0.23 0.00 0.00 176.91 179.10 1g4x h LYS 288 N 0.96 0.86 -0.90 0.39 1.57 -0.90 -1.42 116.57 117.13 1g4x h LYS 288 Ca 0.20 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1g4x h LYS 288 Cb 0.35 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.50 1g4x h LYS 288 CO 0.00 0.81 0.53 0.00 -0.57 0.00 0.00 179.45 180.22 1g4x h ALA 289 N 1.27 1.15 -0.91 3.86 0.00 -0.73 -1.44 119.26 122.46 1g4x h ALA 289 Ca 0.17 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1g4x h ALA 289 Cb 0.37 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1g4x h ALA 289 CO 0.01 0.62 0.55 0.00 0.00 0.00 0.00 179.25 180.42 1g4x h ALA 290 N 1.29 1.24 -0.29 0.00 0.00 -0.62 -2.39 119.26 118.50 1g4x h ALA 290 Ca 0.32 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 1g4x h ALA 290 Cb -0.03 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 1g4x h ALA 290 CO -0.06 0.64 -0.08 0.82 0.00 0.00 0.00 179.25 180.57 1g4x h ILE 291 N 1.26 1.28 0.00 0.00 2.04 -0.62 -3.04 117.51 118.43 1g4x h ILE 291 Ca 0.33 -1.13 -0.05 0.00 1.00 0.00 0.00 64.86 65.01 1g4x h ILE 291 Cb -0.05 1.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 1g4x h ILE 291 CO -0.06 0.36 -0.26 0.25 0.00 0.00 0.00 178.15 178.44 1g4x h LEU 292 N 0.32 0.00 0.00 1.44 5.85 -1.10 -0.34 115.31 121.48 1g4x h LEU 292 Ca 0.07 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1g4x h LEU 292 Cb 0.57 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.60 1g4x h LEU 292 CO 0.03 0.26 0.00 0.00 -0.34 0.00 0.00 178.44 178.39 1g4x n ALA 293 N -2.44 2.26 -1.07 1.25 0.00 -0.91 -3.86 120.51 115.74 1g4x n ALA 293 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1g4x n ALA 293 Cb 0.32 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1g4x n ALA 293 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1g4x n ASN 294 N -1.19 0.00 -0.13 0.00 2.85 -0.22 -4.97 115.26 111.60 1g4x n ASN 294 Ca 0.13 0.00 0.01 0.00 -0.11 0.00 0.00 54.58 54.62 1g4x n ASN 294 Cb 0.15 0.00 0.03 0.00 1.24 0.00 0.00 39.78 41.20 1g4x n ASN 294 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1g4x n TYR 295 N -1.02 0.07 0.00 1.20 0.18 -0.69 -5.03 117.16 111.87 1g4x n TYR 295 Ca 0.00 -0.32 0.00 0.00 1.88 0.00 0.00 57.90 59.46 1g4x n TYR 295 Cb 0.00 -0.03 0.00 0.00 -0.38 0.00 0.00 39.34 38.93 1g4x n TYR 295 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 1g4x n SER 296 N -0.12 0.00 -3.56 9.48 2.88 -0.73 -4.78 113.62 116.78 1g4x n SER 296 Ca 0.02 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.45 1g4x n SER 296 Cb 0.21 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.63 1g4x n SER 296 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1g4x s ASN 297 N 0.00 -0.36 0.37 -3.46 2.20 -1.26 -4.18 114.94 108.24 1g4x s ASN 297 Ca 0.00 -0.17 -0.04 0.00 -0.94 0.00 0.00 52.86 51.71 1g4x s ASN 297 Cb 0.00 0.52 -0.04 0.00 -2.00 0.00 0.00 41.25 39.72 1g4x s ASN 297 CO 0.00 -0.88 0.63 -2.16 -2.94 0.00 0.00 177.10 171.75 1g4x s PRO 298 N -3.66 3.58 -0.00 3.55 0.04 -1.26 -5.02 135.00 132.23 1g4x s PRO 298 Ca 0.01 0.00 -0.30 0.00 0.04 0.00 0.00 61.00 60.76 1g4x s PRO 298 Cb 0.01 -2.56 -0.07 0.00 0.04 0.00 0.00 34.50 31.92 1g4x s PRO 298 CO -0.11 0.07 1.82 -1.25 0.04 0.00 0.00 177.00 177.56 1g4x s PRO 299 N -4.10 4.16 0.14 0.56 0.04 -1.26 -4.78 135.00 129.77 1g4x s PRO 299 Ca 0.44 2.42 -0.13 0.00 0.04 0.00 0.00 61.00 63.77 1g4x s PRO 299 Cb -0.10 -4.07 0.01 0.00 0.04 0.00 0.00 34.50 30.38 1g4x s PRO 299 CO 0.36 -0.90 1.59 0.00 0.04 0.00 0.00 177.00 178.08 1g4x h ALA 300 N 10.06 0.64 -0.10 8.56 0.00 -1.95 -3.39 119.26 133.08 1g4x h ALA 300 Ca -0.45 -0.29 0.04 0.00 0.00 0.00 0.00 54.91 54.22 1g4x h ALA 300 Cb 1.21 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.78 1g4x h ALA 300 CO 0.95 0.45 -0.18 1.25 0.00 0.00 0.00 179.25 181.72 1g4x h HIS 301 N 0.69 -0.47 -0.38 0.00 -0.00 -1.92 0.12 115.15 113.19 1g4x h HIS 301 Ca 0.13 0.02 -0.03 0.00 -0.00 0.00 0.00 60.37 60.49 1g4x h HIS 301 Cb 0.53 0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 28.15 1g4x h HIS 301 CO 0.04 -0.26 0.11 0.78 -0.00 0.00 0.00 177.93 178.60 1g4x h GLY 302 N -0.25 0.65 1.55 5.26 0.00 -1.77 -2.42 103.07 106.11 1g4x h GLY 302 Ca 0.09 -0.39 -0.06 0.00 0.00 0.00 0.00 47.33 46.96 1g4x h GLY 302 CO -0.24 0.37 -0.04 0.00 0.00 0.00 0.00 176.54 176.63 1g4x h ALA 303 N 0.95 1.29 -0.70 3.60 0.00 -1.66 -1.97 119.26 120.78 1g4x h ALA 303 Ca 0.12 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 1g4x h ALA 303 Cb 0.28 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1g4x h ALA 303 CO -0.00 0.47 0.25 0.77 0.00 0.00 0.00 179.25 180.75 1g4x h SER 304 N 0.52 0.99 -0.05 0.00 0.02 -0.58 -1.00 113.55 113.45 1g4x h SER 304 Ca 0.11 -0.19 -0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1g4x h SER 304 Cb 0.40 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.68 1g4x h SER 304 CO 0.02 0.91 0.03 0.58 -1.14 0.00 0.00 176.83 177.22 1g4x h VAL 305 N 1.01 1.08 -0.47 2.27 2.07 -1.08 -0.14 116.25 120.98 1g4x h VAL 305 Ca 0.23 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.53 1g4x h VAL 305 Cb 0.25 1.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 1g4x h VAL 305 CO -0.01 0.06 0.30 0.58 0.02 0.00 0.00 177.57 178.52 1g4x h VAL 306 N -0.01 1.14 -0.67 2.57 2.07 -1.02 -1.27 116.25 119.07 1g4x h VAL 306 Ca 0.02 -0.29 -0.04 0.00 0.82 0.00 0.00 66.70 67.20 1g4x h VAL 306 Cb 0.08 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.30 1g4x h VAL 306 CO -0.00 0.14 0.25 0.00 0.02 0.00 0.00 177.57 177.97 1g4x h ALA 307 N 1.15 0.87 -0.11 1.67 0.00 -1.09 -0.92 119.26 120.82 1g4x h ALA 307 Ca 0.17 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1g4x h ALA 307 Cb -0.03 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1g4x h ALA 307 CO -0.03 0.51 0.06 1.15 0.00 0.00 0.00 179.25 180.94 1g4x h THR 308 N 0.95 1.10 0.26 0.00 2.02 -0.56 -2.14 112.91 114.54 1g4x h THR 308 Ca 0.22 -0.27 -0.01 0.00 0.77 0.00 0.00 66.41 67.12 1g4x h THR 308 Cb 0.24 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 1g4x h THR 308 CO -0.01 0.09 -0.13 0.40 0.37 0.00 0.00 175.52 176.24 1g4x h ILE 309 N 0.08 0.78 0.00 3.11 2.04 -1.09 -2.99 117.51 119.44 1g4x h ILE 309 Ca 0.04 -0.26 -0.03 0.00 1.00 0.00 0.00 64.86 65.62 1g4x h ILE 309 Cb 0.08 0.92 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1g4x h ILE 309 CO -0.01 0.06 -0.12 -0.07 0.00 0.00 0.00 178.15 178.01 1g4x h LEU 310 N -0.48 0.00 -0.70 1.44 3.38 -1.14 -2.34 115.31 115.46 1g4x h LEU 310 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1g4x h LEU 310 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1g4x h LEU 310 CO 0.06 0.12 -0.23 -1.54 0.09 0.00 0.00 178.44 176.94 1g4x n SER 311 N -3.61 1.32 -4.32 -0.43 3.41 -0.81 -4.83 113.62 104.36 1g4x n SER 311 Ca -0.02 -1.13 -0.35 0.00 -0.26 0.00 0.00 58.87 57.12 1g4x n SER 311 Cb 0.25 0.15 -0.14 0.00 -0.26 0.00 0.00 64.21 64.21 1g4x n SER 311 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1g4x s ASN 312 N -2.39 4.26 0.23 4.04 3.84 -0.89 -5.01 114.94 119.02 1g4x s ASN 312 Ca 0.26 -0.38 -0.07 0.00 0.21 0.00 0.00 52.86 52.88 1g4x s ASN 312 Cb 0.19 -1.72 0.32 0.00 -0.55 0.00 0.00 41.25 39.49 1g4x s ASN 312 CO 0.49 0.01 1.81 0.44 -2.79 0.00 0.00 177.10 177.05 1g4x h ASP 313 N 7.87 0.60 0.16 -4.21 3.32 -1.88 0.01 116.42 122.29 1g4x h ASP 313 Ca -0.39 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 56.69 1g4x h ASP 313 Cb 1.17 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1g4x h ASP 313 CO 0.60 0.37 -0.08 0.00 -1.72 0.00 0.00 179.24 178.41 1g4x h ALA 314 N 1.40 -0.21 -0.51 3.45 0.00 -1.95 -2.42 119.26 119.03 1g4x h ALA 314 Ca 0.35 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1g4x h ALA 314 Cb 0.27 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1g4x h ALA 314 CO -0.22 -0.42 0.09 -0.07 0.00 0.00 0.00 179.25 178.63 1g4x h LEU 315 N -0.60 0.74 -0.63 0.00 4.07 -1.80 -2.41 115.31 114.69 1g4x h LEU 315 Ca -0.02 -0.14 -0.11 0.00 0.08 0.00 0.00 57.88 57.69 1g4x h LEU 315 Cb 0.45 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 41.98 1g4x h LEU 315 CO 0.04 0.75 -0.09 -0.09 -1.08 0.00 0.00 178.44 177.97 1g4x h ARG 316 N 0.76 0.98 -0.50 1.13 2.43 -0.91 -1.43 114.38 116.84 1g4x h ARG 316 Ca 0.16 -0.34 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 1g4x h ARG 316 Cb 0.33 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 1g4x h ARG 316 CO 0.00 1.02 0.33 0.00 -1.51 0.00 0.00 179.97 179.81 1g4x h ALA 317 N 1.01 0.63 -0.04 2.80 0.00 -0.96 0.31 119.26 123.01 1g4x h ALA 317 Ca 0.14 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1g4x h ALA 317 Cb 0.64 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1g4x h ALA 317 CO 0.04 0.08 0.02 0.82 0.00 0.00 0.00 179.25 180.22 1g4x h ILE 318 N 0.67 1.12 -0.30 0.00 2.04 -1.28 -2.47 117.51 117.29 1g4x h ILE 318 Ca 0.18 -0.35 0.02 0.00 1.00 0.00 0.00 64.86 65.71 1g4x h ILE 318 Cb -0.07 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 1g4x h ILE 318 CO -0.04 0.10 0.14 -0.25 0.00 0.00 0.00 178.15 178.10 1g4x h TRP 319 N -0.07 0.26 -0.91 1.37 7.01 -0.91 -0.85 115.95 121.84 1g4x h TRP 319 Ca 0.01 0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.09 1g4x h TRP 319 Cb 0.14 -0.07 -0.07 0.00 -2.10 0.00 0.00 29.16 27.06 1g4x h TRP 319 CO -0.03 0.14 0.57 0.93 -2.79 0.00 0.00 178.44 177.27 1g4x h GLU 320 N 0.30 1.00 -0.54 2.65 5.08 -0.88 0.11 114.58 122.30 1g4x h GLU 320 Ca 0.12 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.34 1g4x h GLU 320 Cb 0.05 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.05 1g4x h GLU 320 CO -0.09 0.66 -0.00 0.37 -1.00 0.00 0.00 179.01 178.95 1g4x h GLN 321 N 1.03 0.96 -0.37 2.33 5.75 -1.05 -1.16 115.11 122.60 1g4x h GLN 321 Ca 0.40 -0.31 -0.04 0.00 -0.15 0.00 0.00 58.65 58.56 1g4x h GLN 321 Cb 0.20 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.64 1g4x h GLN 321 CO -0.18 0.97 0.08 0.93 -2.65 0.00 0.00 178.83 177.97 1g4x h GLU 322 N 0.84 0.54 -0.26 1.69 5.08 0.30 -1.49 114.58 121.28 1g4x h GLU 322 Ca 0.15 -0.09 -0.16 0.00 -1.00 0.00 0.00 59.36 58.26 1g4x h GLU 322 Cb 0.54 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1g4x h GLU 322 CO 0.03 0.51 -0.45 1.25 -1.00 0.00 0.00 179.01 179.35 1g4x h LEU 323 N 0.53 0.85 -0.85 1.33 5.85 -0.40 -2.74 115.31 119.88 1g4x h LEU 323 Ca 0.12 -0.53 -0.10 0.00 0.84 0.00 0.00 57.88 58.21 1g4x h LEU 323 Cb 0.23 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 1g4x h LEU 323 CO -0.00 1.22 -0.27 0.71 -0.34 0.00 0.00 178.44 179.75 1g4x h THR 324 N 0.51 1.27 -0.96 1.05 1.35 -0.77 -1.27 112.91 114.08 1g4x h THR 324 Ca 0.02 -1.33 0.06 0.00 -0.55 0.00 0.00 66.41 64.60 1g4x h THR 324 Cb 1.06 1.36 -0.06 0.00 -1.73 0.00 0.00 68.15 68.77 1g4x h THR 324 CO 0.10 0.43 0.63 0.44 -0.25 0.00 0.00 175.52 176.86 1g4x h ASP 325 N 0.48 1.00 -0.08 5.36 3.45 -1.24 0.17 116.42 125.55 1g4x h ASP 325 Ca 0.07 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.52 1g4x h ASP 325 Cb 0.72 -0.21 -0.00 0.00 -0.56 0.00 0.00 39.33 39.27 1g4x h ASP 325 CO 0.06 0.65 0.01 0.24 -1.57 0.00 0.00 179.24 178.63 1g4x h MET 326 N 1.14 0.13 -0.30 3.56 2.86 -1.03 -0.92 114.93 120.36 1g4x h MET 326 Ca 0.41 -0.03 0.05 0.00 -2.06 0.00 0.00 59.70 58.06 1g4x h MET 326 Cb 0.14 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.74 1g4x h MET 326 CO -0.15 0.34 0.01 -0.09 1.06 0.00 0.00 176.91 178.09 1g4x h ARG 327 N -0.11 0.10 -0.56 1.72 2.43 -0.70 -1.80 114.38 115.46 1g4x h ARG 327 Ca 0.02 -0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.10 1g4x h ARG 327 Cb 0.28 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 1g4x h ARG 327 CO 0.00 0.07 0.00 1.96 -1.51 0.00 0.00 179.97 180.49 1g4x h GLN 328 N 0.10 0.95 -0.70 0.20 4.20 -0.65 -0.91 115.11 118.31 1g4x h GLN 328 Ca 0.14 -0.28 -0.04 0.00 0.06 0.00 0.00 58.65 58.53 1g4x h GLN 328 Cb 0.18 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.83 1g4x h GLN 328 CO -0.23 0.94 0.27 -0.09 -0.67 0.00 0.00 178.83 179.05 1g4x h ARG 329 N 0.88 1.05 -0.37 1.46 2.43 -0.70 -0.49 114.38 118.63 1g4x h ARG 329 Ca 0.16 -0.19 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 1g4x h ARG 329 Cb 0.51 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 1g4x h ARG 329 CO 0.03 0.87 0.16 0.82 -1.51 0.00 0.00 179.97 180.34 1g4x h ILE 330 N 1.00 1.18 -0.94 1.20 2.04 -0.86 -1.27 117.51 119.86 1g4x h ILE 330 Ca 0.23 -0.53 0.00 0.00 1.00 0.00 0.00 64.86 65.56 1g4x h ILE 330 Cb 0.22 0.84 -0.05 0.00 -0.74 0.00 0.00 36.82 37.10 1g4x h ILE 330 CO -0.02 0.20 0.60 1.56 0.00 0.00 0.00 178.15 180.49 1g4x h GLN 331 N 0.46 1.25 -0.46 2.37 4.20 -0.81 -1.96 115.11 120.16 1g4x h GLN 331 Ca 0.13 -0.09 -0.07 0.00 0.06 0.00 0.00 58.65 58.68 1g4x h GLN 331 Cb 0.15 -0.28 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 1g4x h GLN 331 CO -0.01 0.84 0.01 0.00 -0.67 0.00 0.00 178.83 179.00 1g4x h ARG 332 N 1.28 0.81 -0.43 1.46 -0.00 -0.75 -2.55 114.38 114.20 1g4x h ARG 332 Ca 0.34 -0.25 -0.06 0.00 -0.50 0.00 0.00 59.98 59.51 1g4x h ARG 332 Cb -0.12 -0.08 -0.02 0.00 0.00 0.00 0.00 29.97 29.76 1g4x h ARG 332 CO -0.07 0.86 0.03 0.52 0.00 0.00 0.00 179.97 181.32 1g4x h MET 333 N 0.66 0.68 -0.68 0.04 2.86 -0.77 0.80 114.93 118.53 1g4x h MET 333 Ca 0.13 -0.15 -0.03 0.00 -2.06 0.00 0.00 59.70 57.59 1g4x h MET 333 Cb 0.49 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.03 1g4x h MET 333 CO 0.02 0.67 0.31 0.00 1.06 0.00 0.00 176.91 178.98 1g4x h ARG 334 N 0.65 0.99 -0.10 1.72 3.08 -1.24 -0.08 114.38 119.40 1g4x h ARG 334 Ca 0.14 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 1g4x h ARG 334 Cb 0.36 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.23 1g4x h ARG 334 CO 0.01 0.79 0.01 1.96 -1.07 0.00 0.00 179.97 181.67 1g4x h GLN 335 N 0.95 0.18 -0.41 0.04 7.50 -0.88 -2.78 115.11 119.70 1g4x h GLN 335 Ca 0.23 -0.05 -0.01 0.00 0.50 0.00 0.00 58.65 59.33 1g4x h GLN 335 Cb 0.14 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 27.63 1g4x h GLN 335 CO -0.03 0.40 0.23 -0.07 -1.50 0.00 0.00 178.83 177.86 1g4x h LEU 336 N -0.07 0.50 0.51 1.46 3.38 -0.68 -1.22 115.31 119.18 1g4x h LEU 336 Ca 0.03 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1g4x h LEU 336 Cb 0.31 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 40.94 1g4x h LEU 336 CO 0.00 0.40 -0.25 0.15 0.09 0.00 0.00 178.44 178.84 1g4x h PHE 337 N 0.57 -0.64 -0.96 1.13 -0.00 -0.88 0.62 116.94 116.79 1g4x h PHE 337 Ca 0.15 -0.02 0.05 0.00 -0.00 0.00 0.00 57.97 58.15 1g4x h PHE 337 Cb 0.01 0.21 -0.06 0.00 -0.00 0.00 0.00 35.95 36.11 1g4x h PHE 337 CO 0.00 -0.33 0.62 0.28 -0.00 0.00 0.00 178.31 178.88 1g4x h VAL 338 N -0.87 1.13 -0.09 1.41 2.07 -1.20 -0.19 116.25 118.51 1g4x h VAL 338 Ca -0.07 -0.40 -0.06 0.00 0.82 0.00 0.00 66.70 66.99 1g4x h VAL 338 Cb 0.60 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1g4x h VAL 338 CO 0.12 0.21 -0.17 0.78 0.02 0.00 0.00 177.57 178.53 1g4x h ASN 339 N 1.17 0.31 0.40 0.57 2.35 -1.18 -0.86 115.58 118.33 1g4x h ASN 339 Ca 0.39 -0.56 -0.09 0.00 -0.55 0.00 0.00 56.30 55.50 1g4x h ASN 339 Cb 0.07 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1g4x h ASN 339 CO -0.14 0.81 -0.41 0.74 -1.65 0.00 0.00 177.43 176.77 1g4x h THR 340 N -0.18 1.30 -0.17 2.81 2.02 -0.57 0.52 112.91 118.64 1g4x h THR 340 Ca 0.00 -1.41 -0.03 0.00 0.77 0.00 0.00 66.41 65.75 1g4x h THR 340 Cb 0.75 1.75 -0.01 0.00 -1.74 0.00 0.00 68.15 68.91 1g4x h THR 340 CO 0.04 0.40 0.00 -0.07 0.37 0.00 0.00 175.52 176.26 1g4x h LEU 341 N 0.01 0.29 -0.63 2.58 3.38 -1.02 0.90 115.31 120.81 1g4x h LEU 341 Ca -0.00 -0.31 0.12 0.00 0.09 0.00 0.00 57.88 57.78 1g4x h LEU 341 Cb 0.73 -0.08 -0.09 0.00 0.09 0.00 0.00 40.66 41.31 1g4x h LEU 341 CO 0.05 0.52 0.15 -0.61 0.09 0.00 0.00 178.44 178.64 1g4x h GLN 342 N 0.04 0.27 -0.24 1.13 5.75 -0.19 -0.86 115.11 121.00 1g4x h GLN 342 Ca 0.05 -0.02 -0.18 0.00 -0.15 0.00 0.00 58.65 58.35 1g4x h GLN 342 Cb 0.38 -0.06 -0.00 0.00 1.07 0.00 0.00 27.48 28.87 1g4x h GLN 342 CO 0.01 0.18 -0.58 1.49 -2.65 0.00 0.00 178.83 177.27 1g4x h GLU 343 N 0.27 0.78 0.00 1.69 4.81 -0.83 -2.92 114.58 118.38 1g4x h GLU 343 Ca 0.34 -0.51 0.00 0.00 -0.13 0.00 0.00 59.36 59.05 1g4x h GLU 343 Cb 0.51 0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.96 1g4x h GLU 343 CO -0.42 1.14 0.00 0.87 -0.73 0.00 0.00 179.01 179.87 1g4x h LYS 344 N 0.59 0.00 -3.61 1.92 1.79 -0.02 -3.49 116.57 113.75 1g4x h LYS 344 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1g4x h LYS 344 Cb 1.18 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.82 1g4x h LYS 344 CO 0.12 0.00 -0.59 0.41 -1.08 0.00 0.00 179.45 178.31 1g4x n GLY 345 N 0.69 -4.59 0.00 3.86 0.00 -0.40 -5.03 105.19 99.71 1g4x n GLY 345 Ca 0.04 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1g4x n GLY 345 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g4x n ALA 346 N 1.07 0.00 -3.58 4.61 0.00 -1.26 -5.02 120.51 116.33 1g4x n ALA 346 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.03 1g4x n ALA 346 Cb 0.02 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.40 1g4x n ALA 346 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1g4x s ASN 347 N 2.00 5.75 0.10 0.00 0.02 -1.26 -4.96 114.94 116.60 1g4x s ASN 347 Ca 0.00 -2.70 -0.31 0.00 -1.02 0.00 0.00 52.86 48.83 1g4x s ASN 347 Cb 0.00 -1.98 -0.07 0.00 0.02 0.00 0.00 41.25 39.22 1g4x s ASN 347 CO 0.00 -0.47 1.32 -0.13 0.02 0.00 0.00 177.10 177.84 1g4x s ARG 348 N 0.16 4.36 -0.46 -0.60 3.00 -1.26 -4.91 118.95 119.25 1g4x s ARG 348 Ca 0.16 1.97 0.06 0.00 0.00 0.00 0.00 55.73 57.92 1g4x s ARG 348 Cb -0.18 -3.28 0.19 0.00 0.00 0.00 0.00 34.95 31.68 1g4x s ARG 348 CO -0.05 -0.36 0.74 0.34 0.00 0.00 0.00 175.30 175.97 1g4x s ASP 349 N 1.02 -1.35 0.00 0.23 2.15 -1.26 -4.97 116.67 112.50 1g4x s ASP 349 Ca 0.62 -1.23 0.17 0.00 0.43 0.00 0.00 52.55 52.53 1g4x s ASP 349 Cb -0.34 1.75 0.47 0.00 -0.30 0.00 0.00 42.92 44.50 1g4x s ASP 349 CO 0.30 -0.09 1.39 0.49 -0.17 0.00 0.00 175.17 177.10 1g4x n PHE 350 N 3.47 0.72 -0.04 -5.34 3.72 -1.26 -4.70 117.46 114.02 1g4x n PHE 350 Ca 0.15 -0.50 0.23 0.00 -0.05 0.00 0.00 57.45 57.28 1g4x n PHE 350 Cb 0.57 -0.01 0.71 0.00 -0.94 0.00 0.00 39.48 39.81 1g4x n PHE 350 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1g4x h SER 351 N 3.15 0.00 -0.07 4.37 0.02 -1.94 -0.12 113.55 118.96 1g4x h SER 351 Ca 0.00 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.97 1g4x h SER 351 Cb 0.86 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.40 1g4x h SER 351 CO 0.00 0.00 0.06 2.19 -1.14 0.00 0.00 176.83 177.94 1g4x h PHE 352 N 0.00 0.00 -0.85 3.45 -0.00 -1.96 -1.27 116.94 116.32 1g4x h PHE 352 Ca 0.30 0.00 0.02 0.00 -0.00 0.00 0.00 57.97 58.29 1g4x h PHE 352 Cb 1.26 0.00 -0.05 0.00 -0.00 0.00 0.00 35.95 37.16 1g4x h PHE 352 CO 0.00 0.00 0.56 0.82 -0.00 0.00 0.00 178.31 179.69 1g4x h ILE 353 N 0.00 1.18 0.00 0.88 1.08 -1.40 -0.75 117.51 118.50 1g4x h ILE 353 Ca 0.03 -0.38 -0.01 0.00 -0.39 0.00 0.00 64.86 64.11 1g4x h ILE 353 Cb 0.15 -0.02 -0.00 0.00 -3.07 0.00 0.00 36.82 33.88 1g4x h ILE 353 CO -0.00 0.20 -0.07 0.40 -0.69 0.00 0.00 178.15 177.99 1g4x h ILE 354 N 1.10 0.57 -0.08 -0.67 1.08 -1.40 -2.61 117.51 115.51 1g4x h ILE 354 Ca 0.32 -0.30 0.00 0.00 -0.39 0.00 0.00 64.86 64.49 1g4x h ILE 354 Cb -0.05 1.19 0.00 0.00 -3.07 0.00 0.00 36.82 34.89 1g4x h ILE 354 CO -0.08 0.07 0.00 0.29 -0.69 0.00 0.00 178.15 177.73 1g4x n LYS 355 N -3.76 2.17 -4.15 2.37 4.76 -0.30 -4.94 118.16 114.31 1g4x n LYS 355 Ca -0.02 -1.72 -0.24 0.00 -2.87 0.00 0.00 58.31 53.46 1g4x n LYS 355 Cb 0.17 -1.47 -0.06 0.00 -1.84 0.00 0.00 35.03 31.83 1g4x n LYS 355 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1g4x s GLN 356 N -1.93 2.72 -0.06 1.97 -0.21 -0.99 -4.95 119.66 116.22 1g4x s GLN 356 Ca 0.32 -1.05 0.03 0.00 0.02 0.00 0.00 55.36 54.68 1g4x s GLN 356 Cb 0.20 -2.49 -0.03 0.00 1.00 0.00 0.00 33.01 31.69 1g4x s GLN 356 CO 0.31 0.44 -0.13 -0.80 -2.12 0.00 0.00 175.29 172.98 1g4x s ASN 357 N -3.37 4.11 0.00 5.90 0.01 0.05 -5.02 114.94 116.61 1g4x s ASN 357 Ca 0.31 -0.18 0.00 0.00 -0.71 0.00 0.00 52.86 52.28 1g4x s ASN 357 Cb -0.09 -0.94 0.00 0.00 0.41 0.00 0.00 41.25 40.63 1g4x s ASN 357 CO 0.22 0.34 0.00 0.61 -1.51 0.00 0.00 177.10 176.76 1g4x n GLY 358 N 2.38 -1.44 0.15 0.66 0.00 -1.26 -4.38 105.19 101.30 1g4x n GLY 358 Ca -0.17 -2.09 0.12 0.00 0.00 0.00 0.00 46.02 43.88 1g4x n GLY 358 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1g4x h MET 359 N 1.03 0.00 -6.61 1.61 2.86 -1.93 -3.47 114.93 108.43 1g4x h MET 359 Ca 0.00 0.00 -0.67 0.00 -2.06 0.00 0.00 59.70 56.97 1g4x h MET 359 Cb 0.00 0.00 -0.17 0.00 0.06 0.00 0.00 31.60 31.49 1g4x h MET 359 CO 0.00 0.00 -0.76 -0.06 1.06 0.00 0.00 176.91 177.15 1g4x s PHE 360 N -3.18 2.67 0.05 -0.22 0.08 -1.26 -0.58 117.98 115.53 1g4x s PHE 360 Ca 0.07 -0.19 -0.25 0.00 0.12 0.00 0.00 56.93 56.69 1g4x s PHE 360 Cb 0.09 -1.40 0.06 0.00 -0.57 0.00 0.00 43.02 41.19 1g4x s PHE 360 CO 0.66 0.41 0.58 -1.12 -0.10 0.00 0.00 175.22 175.65 1g4x s SER 361 N -2.18 -0.52 -0.23 1.36 0.01 -1.06 -3.53 113.70 107.55 1g4x s SER 361 Ca 0.20 0.28 -0.22 0.00 1.31 0.00 0.00 55.95 57.52 1g4x s SER 361 Cb -0.11 0.53 -0.02 0.00 0.21 0.00 0.00 66.02 66.63 1g4x s SER 361 CO 0.12 -0.74 0.70 -0.36 0.41 0.00 0.00 173.24 173.37 1g4x s PHE 362 N -2.39 3.33 0.33 2.43 2.99 -1.25 -0.93 117.98 122.49 1g4x s PHE 362 Ca -0.05 0.97 0.12 0.00 0.00 0.00 0.00 56.93 57.97 1g4x s PHE 362 Cb -0.01 -2.89 0.60 0.00 0.00 0.00 0.00 43.02 40.72 1g4x s PHE 362 CO -0.01 -0.29 1.75 0.66 -0.00 0.00 0.00 175.22 177.33 1g4x h SER 363 N 7.66 0.00 0.00 1.36 4.64 -1.21 -3.47 113.55 122.53 1g4x h SER 363 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1g4x h SER 363 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1g4x h SER 363 CO 0.80 0.46 0.00 0.61 -0.87 0.00 0.00 176.83 177.83 1g4x n GLY 364 N -0.18 1.04 3.83 -0.77 0.00 -1.26 -5.03 105.19 102.82 1g4x n GLY 364 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 1g4x n GLY 364 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1g4x s LEU 365 N 0.00 4.36 0.56 0.99 1.02 -1.26 -5.06 118.68 119.29 1g4x s LEU 365 Ca 0.00 1.21 -0.12 0.00 0.02 0.00 0.00 54.13 55.24 1g4x s LEU 365 Cb 0.00 -3.33 -0.05 0.00 0.02 0.00 0.00 46.19 42.83 1g4x s LEU 365 CO 0.00 0.10 0.97 0.42 0.02 0.00 0.00 176.35 177.86 1g4x s THR 366 N -1.44 4.69 0.34 5.49 -4.23 -1.26 -4.21 115.64 115.02 1g4x s THR 366 Ca 0.38 0.87 0.12 0.00 -1.18 0.00 0.00 61.69 61.88 1g4x s THR 366 Cb -0.16 -3.82 0.34 0.00 1.34 0.00 0.00 72.50 70.20 1g4x s THR 366 CO 0.20 -0.93 1.75 0.50 -0.54 0.00 0.00 174.62 175.60 1g4x h LYS 367 N 0.22 0.53 -0.00 3.99 3.64 -1.95 -0.08 116.57 122.93 1g4x h LYS 367 Ca -0.45 -0.03 -0.24 0.00 -1.27 0.00 0.00 60.65 58.66 1g4x h LYS 367 Cb 1.19 -0.12 0.01 0.00 -0.41 0.00 0.00 32.23 32.90 1g4x h LYS 367 CO 0.62 0.35 -0.97 0.93 -2.27 0.00 0.00 179.45 178.11 1g4x h GLU 368 N 0.55 0.50 -0.52 1.90 3.07 -1.93 -1.49 114.58 116.66 1g4x h GLU 368 Ca 0.61 -0.54 -0.05 0.00 -0.50 0.00 0.00 59.36 58.89 1g4x h GLU 368 Cb 1.26 0.15 -0.02 0.00 -0.84 0.00 0.00 28.75 29.30 1g4x h GLU 368 CO -0.39 1.18 0.14 1.96 -1.40 0.00 0.00 179.01 180.49 1g4x h GLN 369 N 0.28 0.82 -0.17 2.33 4.20 -1.55 -0.32 115.11 120.70 1g4x h GLN 369 Ca -0.09 -0.19 -0.10 0.00 0.06 0.00 0.00 58.65 58.32 1g4x h GLN 369 Cb 1.61 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 29.27 1g4x h GLN 369 CO 0.18 0.78 -0.34 -0.39 -0.67 0.00 0.00 178.83 178.38 1g4x h VAL 370 N 0.72 1.29 -0.27 -0.54 -1.51 -0.97 -0.81 116.25 114.16 1g4x h VAL 370 Ca 0.16 -1.40 -0.01 0.00 -1.23 0.00 0.00 66.70 64.22 1g4x h VAL 370 Cb 0.31 1.53 -0.01 0.00 -2.13 0.00 0.00 31.29 30.99 1g4x h VAL 370 CO -0.00 0.43 0.12 0.25 -1.23 0.00 0.00 177.57 177.14 1g4x h LEU 371 N 0.31 0.36 -0.12 4.19 6.46 -0.91 -1.48 115.31 124.11 1g4x h LEU 371 Ca 0.04 -0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.66 1g4x h LEU 371 Cb 0.75 -0.09 0.00 0.00 -0.73 0.00 0.00 40.66 40.59 1g4x h LEU 371 CO 0.06 0.40 0.00 0.08 -0.62 0.00 0.00 178.44 178.36 1g4x h ARG 372 N 0.29 0.00 -0.59 1.25 0.11 -0.84 -1.41 114.38 113.20 1g4x h ARG 372 Ca 0.09 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.15 1g4x h ARG 372 Cb 0.14 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.20 1g4x h ARG 372 CO -0.01 0.00 0.27 1.25 0.10 0.00 0.00 179.97 181.58 1g4x h LEU 373 N 0.00 0.78 0.57 0.08 5.85 -0.80 0.89 115.31 122.68 1g4x h LEU 373 Ca 0.00 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.55 1g4x h LEU 373 Cb 0.90 -0.20 0.01 0.00 0.37 0.00 0.00 40.66 41.74 1g4x h LEU 373 CO 0.00 0.71 -0.27 -0.09 -0.34 0.00 0.00 178.44 178.44 1g4x h ARG 374 N 0.80 -0.73 -0.32 1.25 2.43 -0.67 -1.12 114.38 116.02 1g4x h ARG 374 Ca 0.20 0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.42 1g4x h ARG 374 Cb 0.14 0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 1g4x h ARG 374 CO -0.02 -0.49 0.18 0.93 -1.51 0.00 0.00 179.97 179.06 1g4x h GLU 375 N -1.15 0.44 0.00 0.20 4.39 -1.22 0.24 114.58 117.48 1g4x h GLU 375 Ca -0.08 -0.05 -0.16 0.00 0.34 0.00 0.00 59.36 59.42 1g4x h GLU 375 Cb 0.58 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 29.12 1g4x h GLU 375 CO 0.13 0.36 -1.18 1.49 -1.16 0.00 0.00 179.01 178.65 1g4x h GLU 376 N 0.40 0.00 0.00 2.33 4.81 -0.96 -3.40 114.58 117.76 1g4x h GLU 376 Ca 0.11 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1g4x h GLU 376 Cb 0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1g4x h GLU 376 CO -0.02 0.37 -0.14 1.19 -0.73 0.00 0.00 179.01 179.69 1g4x n PHE 377 N -2.99 0.00 -1.09 0.92 3.01 -0.50 -5.02 117.46 111.79 1g4x n PHE 377 Ca -0.06 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.36 1g4x n PHE 377 Cb 0.82 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 40.28 1g4x n PHE 377 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1g4x n GLY 378 N 1.03 0.63 3.62 1.37 0.00 0.07 -4.72 105.19 107.19 1g4x n GLY 378 Ca 0.00 -0.65 -0.39 0.00 0.00 0.00 0.00 46.02 44.98 1g4x n GLY 378 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g4x s VAL 379 N -2.06 5.20 -0.21 1.61 1.01 -0.95 -1.01 120.40 123.99 1g4x s VAL 379 Ca 0.00 0.54 -0.07 0.00 0.00 0.00 0.00 61.98 62.45 1g4x s VAL 379 Cb 0.00 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 1g4x s VAL 379 CO 0.00 0.20 0.06 -0.31 0.00 0.00 0.00 175.10 175.05 1g4x s TYR 380 N 1.82 3.16 0.11 5.22 2.02 0.66 -2.03 117.35 128.31 1g4x s TYR 380 Ca 0.15 -0.16 -0.05 0.00 -0.37 0.00 0.00 57.07 56.64 1g4x s TYR 380 Cb -0.15 -2.14 -0.02 0.00 -0.40 0.00 0.00 41.96 39.24 1g4x s TYR 380 CO 0.09 -0.08 0.12 0.00 -1.57 0.00 0.00 175.55 174.11 1g4x s ALA 381 N 0.93 0.33 0.43 3.71 0.00 -1.26 -0.14 121.76 125.75 1g4x s ALA 381 Ca 0.04 -1.08 -0.16 0.00 0.00 0.00 0.00 51.96 50.75 1g4x s ALA 381 Cb -0.14 0.65 -0.09 0.00 0.00 0.00 0.00 23.12 23.54 1g4x s ALA 381 CO 0.03 -0.51 0.88 0.14 0.00 0.00 0.00 175.76 176.30 1g4x s VAL 382 N -3.96 4.57 0.65 0.00 -7.23 -1.23 -4.90 120.40 108.30 1g4x s VAL 382 Ca 0.14 1.12 0.25 0.00 -1.81 0.00 0.00 61.98 61.69 1g4x s VAL 382 Cb 0.06 -3.66 0.28 0.00 0.56 0.00 0.00 36.38 33.61 1g4x s VAL 382 CO -0.04 -0.44 1.75 0.00 -0.31 0.00 0.00 175.10 176.06 1g4x h ALA 383 N 1.56 1.68 -0.00 1.32 0.00 -1.93 -0.15 119.26 121.74 1g4x h ALA 383 Ca -0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1g4x h ALA 383 Cb 1.18 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1g4x h ALA 383 CO 0.63 -0.57 -0.01 -1.13 0.00 0.00 0.00 179.25 178.16 1g4x n SER 384 N -3.03 0.38 0.00 0.00 3.41 -1.26 -3.88 113.62 109.24 1g4x n SER 384 Ca 0.02 -1.02 0.00 0.00 -0.26 0.00 0.00 58.87 57.61 1g4x n SER 384 Cb 0.58 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 1g4x n SER 384 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1g4x n GLY 385 N 1.08 0.54 3.75 5.00 0.00 -0.07 -4.78 105.19 110.71 1g4x n GLY 385 Ca 0.21 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 1g4x n GLY 385 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1g4x s ARG 386 N -0.13 4.60 -0.03 1.61 3.52 -1.25 -0.69 118.95 126.59 1g4x s ARG 386 Ca 0.00 1.78 0.04 0.00 -0.13 0.00 0.00 55.73 57.41 1g4x s ARG 386 Cb 0.00 -3.23 -0.00 0.00 -1.56 0.00 0.00 34.95 30.15 1g4x s ARG 386 CO 0.00 0.12 -0.13 0.08 -0.81 0.00 0.00 175.30 174.55 1g4x s VAL 387 N -0.63 1.12 -0.35 7.11 1.01 -0.10 -3.58 120.40 124.97 1g4x s VAL 387 Ca 0.48 -0.56 -0.12 0.00 0.00 0.00 0.00 61.98 61.77 1g4x s VAL 387 Cb -0.31 -0.96 -0.00 0.00 0.00 0.00 0.00 36.38 35.10 1g4x s VAL 387 CO 0.38 0.33 0.23 0.21 0.00 0.00 0.00 175.10 176.25 1g4x s ASN 388 N -0.01 5.93 0.52 3.32 3.84 -0.46 -2.58 114.94 125.50 1g4x s ASN 388 Ca -0.01 -0.59 0.17 0.00 0.21 0.00 0.00 52.86 52.65 1g4x s ASN 388 Cb -0.09 -2.10 1.29 0.00 -0.55 0.00 0.00 41.25 39.80 1g4x s ASN 388 CO 0.01 -0.28 2.14 0.58 -2.79 0.00 0.00 177.10 176.76 1g4x h VAL 389 N 5.59 0.97 0.00 -5.21 2.07 -1.17 -1.90 116.25 116.60 1g4x h VAL 389 Ca -0.30 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.13 1g4x h VAL 389 Cb 1.14 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 1g4x h VAL 389 CO 0.65 0.02 0.00 0.00 0.02 0.00 0.00 177.57 178.27 1g4x n ALA 390 N -2.51 1.80 1.11 1.67 0.00 -1.26 -1.43 120.51 119.89 1g4x n ALA 390 Ca -0.03 -0.07 0.13 0.00 0.00 0.00 0.00 53.44 53.48 1g4x n ALA 390 Cb 0.11 -1.23 0.52 0.00 0.00 0.00 0.00 19.45 18.85 1g4x n ALA 390 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1g4x n GLY 391 N -0.06 -1.29 3.81 0.00 0.00 -0.71 -4.03 105.19 102.90 1g4x n GLY 391 Ca 0.06 -0.21 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 1g4x n GLY 391 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1g4x s MET 392 N -2.86 3.98 0.23 1.61 -1.94 -0.52 -4.84 119.30 114.96 1g4x s MET 392 Ca 0.17 0.29 0.08 0.00 -1.71 0.00 0.00 55.69 54.52 1g4x s MET 392 Cb 0.19 -3.28 -0.05 0.00 2.01 0.00 0.00 34.83 33.70 1g4x s MET 392 CO 0.56 0.55 -0.13 0.95 -0.01 0.00 0.00 175.02 176.94 1g4x s THR 393 N -0.56 1.81 0.52 2.05 -4.23 -1.26 -4.95 115.64 109.01 1g4x s THR 393 Ca 0.22 -2.22 0.27 0.00 -1.18 0.00 0.00 61.69 58.78 1g4x s THR 393 Cb -0.15 -2.16 0.43 0.00 1.34 0.00 0.00 72.50 71.96 1g4x s THR 393 CO 0.10 -0.51 1.93 1.55 -0.54 0.00 0.00 174.62 177.15 1g4x h PRO 394 N 2.47 0.05 -0.11 3.99 0.13 -1.99 -2.11 132.00 134.42 1g4x h PRO 394 Ca -0.39 -0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.60 1g4x h PRO 394 Cb 1.23 -0.01 0.01 0.00 0.13 0.00 0.00 31.00 32.35 1g4x h PRO 394 CO 0.63 0.03 -0.46 -0.44 -0.23 0.00 0.00 178.00 177.53 1g4x h ASP 395 N 0.05 0.60 0.34 1.44 3.45 -1.95 -3.31 116.42 117.04 1g4x h ASP 395 Ca 0.35 -0.62 0.00 0.00 0.43 0.00 0.00 57.03 57.19 1g4x h ASP 395 Cb 1.33 -0.18 0.00 0.00 -0.56 0.00 0.00 39.33 39.92 1g4x h ASP 395 CO -0.02 1.12 -0.29 -0.46 -1.57 0.00 0.00 179.24 178.02 1g4x n ASN 396 N -4.26 0.79 -0.13 6.45 0.23 -1.01 -4.40 115.26 112.92 1g4x n ASN 396 Ca -0.08 -0.65 -0.04 0.00 -0.53 0.00 0.00 54.58 53.28 1g4x n ASN 396 Cb 0.57 0.12 0.04 0.00 -2.08 0.00 0.00 39.78 38.43 1g4x n ASN 396 CO 0.00 0.00 0.00 -0.03 -0.93 0.00 0.00 177.26 176.30 1g4x h MET 397 N 0.79 0.11 -0.17 -3.83 4.05 -1.48 -1.97 114.93 112.42 1g4x h MET 397 Ca 0.00 -0.01 -0.06 0.00 -0.28 0.00 0.00 59.70 59.35 1g4x h MET 397 Cb 0.48 -0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.26 1g4x h MET 397 CO 0.00 0.07 -0.14 0.00 0.23 0.00 0.00 176.91 177.08 1g4x h ALA 398 N 1.38 0.25 -0.52 0.39 0.00 -1.81 -0.89 119.26 118.06 1g4x h ALA 398 Ca 0.21 -0.32 0.09 0.00 0.00 0.00 0.00 54.91 54.89 1g4x h ALA 398 Cb 0.31 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1g4x h ALA 398 CO -0.35 0.12 0.35 -1.00 0.00 0.00 0.00 179.25 178.37 1g4x h PRO 399 N 0.06 0.33 0.69 0.00 0.13 -1.83 -1.11 132.00 130.27 1g4x h PRO 399 Ca 0.03 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 65.11 1g4x h PRO 399 Cb 0.65 -0.08 0.01 0.00 0.13 0.00 0.00 31.00 31.72 1g4x h PRO 399 CO 0.04 0.22 -0.33 1.25 -0.23 0.00 0.00 178.00 178.94 1g4x h LEU 400 N 0.34 -0.79 -1.23 1.56 6.46 -1.13 -1.94 115.31 118.59 1g4x h LEU 400 Ca 0.24 -0.00 -0.02 0.00 -0.12 0.00 0.00 57.88 57.98 1g4x h LEU 400 Cb 0.49 0.20 -0.03 0.00 -0.73 0.00 0.00 40.66 40.59 1g4x h LEU 400 CO -0.06 -0.45 0.31 0.00 -0.62 0.00 0.00 178.44 177.62 1g4x h GLU 402 N 0.85 0.19 -0.33 0.00 5.08 -1.19 -0.02 114.58 119.16 1g4x h GLU 402 Ca 0.21 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1g4x h GLU 402 Cb 0.06 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 1g4x h GLU 402 CO -0.03 0.13 0.21 0.00 -1.00 0.00 0.00 179.01 178.32 1g4x h ALA 403 N 1.23 0.42 -0.38 3.43 0.00 -0.52 -1.71 119.26 121.73 1g4x h ALA 403 Ca 0.15 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1g4x h ALA 403 Cb 0.15 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1g4x h ALA 403 CO -0.18 -0.12 0.17 0.82 0.00 0.00 0.00 179.25 179.93 1g4x h ILE 404 N 0.44 1.18 -0.60 0.00 2.04 -0.91 -2.65 117.51 117.02 1g4x h ILE 404 Ca 0.12 -0.54 0.03 0.00 1.00 0.00 0.00 64.86 65.47 1g4x h ILE 404 Cb -0.05 0.83 -0.04 0.00 -0.74 0.00 0.00 36.82 36.82 1g4x h ILE 404 CO -0.03 0.20 0.36 0.58 0.00 0.00 0.00 178.15 179.26 1g4x h VAL 405 N 0.48 1.05 0.00 1.67 2.07 -0.84 -2.09 116.25 118.58 1g4x h VAL 405 Ca 0.13 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.41 1g4x h VAL 405 Cb 0.16 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1g4x h VAL 405 CO -0.01 0.13 0.00 0.00 0.02 0.00 0.00 177.57 177.70 1g4x h ALA 406 N 1.27 1.00 -0.11 1.67 0.00 -0.97 -2.83 119.26 119.29 1g4x h ALA 406 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1g4x h ALA 406 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1g4x h ALA 406 CO -0.11 0.00 0.00 1.33 0.00 0.00 0.00 179.25 180.47 1g4x n VAL 408 N -2.42 0.24 1.67 0.00 0.24 -0.80 -5.09 118.33 112.16 1g4x n VAL 408 Ca -0.00 -0.62 0.13 0.00 -2.04 0.00 0.00 64.34 61.81 1g4x n VAL 408 Cb 0.14 1.08 0.79 0.00 -1.47 0.00 0.00 33.84 34.38 1g4x n VAL 408 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87