#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gxw s THR 2 N 0.00 5.15 0.00 1.39 2.01 -1.26 -5.00 115.64 117.93 1gxw s THR 2 Ca 0.00 0.65 0.00 0.00 0.31 0.00 0.00 61.69 62.65 1gxw s THR 2 Cb 0.00 -3.73 0.00 0.00 0.01 0.00 0.00 72.50 68.78 1gxw s THR 2 CO 0.00 0.15 0.00 0.61 -0.69 0.00 0.00 174.62 174.69 1gxw n GLY 3 N 4.57 2.46 3.56 4.40 0.00 -1.26 -4.85 105.19 114.08 1gxw n GLY 3 Ca -0.07 -0.71 -0.36 0.00 0.00 0.00 0.00 46.02 44.88 1gxw n GLY 3 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gxw s THR 4 N -2.73 4.72 0.22 2.61 2.01 -0.19 -4.84 115.64 117.44 1gxw s THR 4 Ca 0.00 -0.04 -0.30 0.00 0.31 0.00 0.00 61.69 61.66 1gxw s THR 4 Cb 0.00 -3.18 -0.09 0.00 0.01 0.00 0.00 72.50 69.24 1gxw s THR 4 CO 0.00 0.38 1.35 -0.44 -0.69 0.00 0.00 174.62 175.23 1gxw s SER 5 N 1.03 6.81 0.33 3.53 0.01 -1.26 -0.12 113.70 124.03 1gxw s SER 5 Ca 0.05 2.50 -0.04 0.00 1.31 0.00 0.00 55.95 59.77 1gxw s SER 5 Cb -0.14 -2.62 0.02 0.00 0.21 0.00 0.00 66.02 63.49 1gxw s SER 5 CO 0.03 -0.59 0.51 1.07 0.41 0.00 0.00 173.24 174.68 1gxw n THR 6 N 2.46 0.00 -4.81 1.44 5.66 -0.45 -4.90 114.28 113.68 1gxw n THR 6 Ca 0.06 -1.50 -0.29 0.00 -3.05 0.00 0.00 64.05 59.27 1gxw n THR 6 Cb 0.42 1.00 -0.17 0.00 -1.55 0.00 0.00 70.33 70.03 1gxw n THR 6 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1gxw s VAL 7 N -2.66 1.63 0.51 1.08 1.01 -1.26 -0.85 120.40 119.85 1gxw s VAL 7 Ca 0.24 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.53 1gxw s VAL 7 Cb -0.02 -1.44 0.02 0.00 0.00 0.00 0.00 36.38 34.94 1gxw s VAL 7 CO 0.18 0.46 0.38 -0.83 0.00 0.00 0.00 175.10 175.29 1gxw s GLY 8 N 0.61 2.32 0.02 4.51 0.00 0.10 -4.92 107.32 109.96 1gxw s GLY 8 Ca -0.14 -1.45 0.03 0.00 0.00 0.00 0.00 44.72 43.15 1gxw s GLY 8 CO 0.04 -1.90 -0.09 0.54 0.00 0.00 0.00 173.10 171.70 1gxw s VAL 9 N -2.71 0.67 0.00 1.40 0.11 -1.11 -0.61 120.40 118.15 1gxw s VAL 9 Ca 0.37 -0.65 0.00 0.00 -2.93 0.00 0.00 61.98 58.77 1gxw s VAL 9 Cb -0.02 -0.62 0.00 0.00 -1.53 0.00 0.00 36.38 34.21 1gxw s VAL 9 CO 0.23 -0.02 0.00 0.61 -3.33 0.00 0.00 175.10 172.59 1gxw n GLY 10 N 2.32 2.47 3.03 6.54 0.00 -0.15 -0.02 105.19 119.38 1gxw n GLY 10 Ca -0.17 -1.16 -0.23 0.00 0.00 0.00 0.00 46.02 44.46 1gxw n GLY 10 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1gxw s ARG 11 N -1.99 1.36 0.45 1.61 3.52 -0.85 -0.97 118.95 122.09 1gxw s ARG 11 Ca 0.00 -0.39 -0.05 0.00 -0.13 0.00 0.00 55.73 55.16 1gxw s ARG 11 Cb 0.00 -1.20 0.10 0.00 -1.56 0.00 0.00 34.95 32.29 1gxw s ARG 11 CO 0.00 0.10 0.61 0.41 -0.81 0.00 0.00 175.30 175.62 1gxw n GLY 12 N 3.48 -0.58 0.36 8.12 0.00 0.32 -4.14 105.19 112.76 1gxw n GLY 12 Ca -0.20 -1.80 0.06 0.00 0.00 0.00 0.00 46.02 44.07 1gxw n GLY 12 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1gxw h VAL 13 N -1.06 0.96 -0.21 1.61 2.07 -1.89 -0.96 116.25 116.76 1gxw h VAL 13 Ca -0.20 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 66.97 1gxw h VAL 13 Cb 0.61 -0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1gxw h VAL 13 CO 0.16 0.19 0.00 0.18 0.02 0.00 0.00 177.57 178.12 1gxw n LEU 14 N -4.60 1.34 0.00 2.57 4.77 -1.26 -4.88 117.00 114.94 1gxw n LEU 14 Ca 0.18 -0.67 0.00 0.00 -0.03 0.00 0.00 56.01 55.49 1gxw n LEU 14 Cb 0.31 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1gxw n LEU 14 CO 0.28 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 1gxw n GLY 15 N 0.75 0.67 3.79 -0.72 0.00 -0.37 -5.03 105.19 104.29 1gxw n GLY 15 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 1gxw n GLY 15 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1gxw s ASP 16 N -2.33 7.25 0.03 1.61 -4.77 -1.26 -4.76 116.67 112.44 1gxw s ASP 16 Ca 0.00 1.53 -0.18 0.00 -3.30 0.00 0.00 52.55 50.60 1gxw s ASP 16 Cb 0.00 -2.46 -0.06 0.00 -1.09 0.00 0.00 42.92 39.31 1gxw s ASP 16 CO 0.00 0.16 0.53 -1.58 0.70 0.00 0.00 175.17 174.98 1gxw s GLN 17 N -1.40 4.17 0.08 2.11 0.74 -1.26 -0.52 119.66 123.57 1gxw s GLN 17 Ca 0.37 0.65 -0.13 0.00 0.05 0.00 0.00 55.36 56.30 1gxw s GLN 17 Cb -0.21 -3.26 0.02 0.00 1.10 0.00 0.00 33.01 30.66 1gxw s GLN 17 CO 0.24 0.58 0.29 -1.59 -0.55 0.00 0.00 175.29 174.25 1gxw s LYS 18 N -0.84 0.88 0.14 1.67 -2.85 -0.14 -4.97 119.74 113.62 1gxw s LYS 18 Ca 0.28 -0.69 -0.12 0.00 -1.00 0.00 0.00 55.97 54.44 1gxw s LYS 18 Cb -0.18 0.38 -0.07 0.00 -2.06 0.00 0.00 37.83 35.89 1gxw s LYS 18 CO 0.17 -0.30 0.51 -0.80 0.10 0.00 0.00 175.35 175.03 1gxw s ASN 19 N -2.48 6.75 0.02 0.03 0.01 -1.26 -0.97 114.94 117.04 1gxw s ASN 19 Ca -0.00 0.98 0.02 0.00 -0.71 0.00 0.00 52.86 53.15 1gxw s ASN 19 Cb 0.01 -2.25 -0.01 0.00 0.41 0.00 0.00 41.25 39.41 1gxw s ASN 19 CO -0.08 0.09 -0.06 0.27 -1.51 0.00 0.00 177.10 175.82 1gxw s ILE 20 N -1.50 0.41 -0.14 0.60 -4.36 0.22 -4.96 121.20 111.46 1gxw s ILE 20 Ca 0.38 -0.67 -0.29 0.00 -0.26 0.00 0.00 60.65 59.81 1gxw s ILE 20 Cb -0.14 -0.43 -0.01 0.00 1.25 0.00 0.00 42.46 43.13 1gxw s ILE 20 CO 0.19 -0.18 1.01 0.20 0.24 0.00 0.00 174.94 176.40 1gxw s ASN 21 N -0.92 7.19 0.44 4.36 0.01 -1.26 0.02 114.94 124.78 1gxw s ASN 21 Ca -0.05 1.47 0.03 0.00 -0.71 0.00 0.00 52.86 53.60 1gxw s ASN 21 Cb -0.06 -2.55 -0.02 0.00 0.41 0.00 0.00 41.25 39.03 1gxw s ASN 21 CO 0.00 -0.51 0.09 0.42 -1.51 0.00 0.00 177.10 175.59 1gxw s THR 22 N 2.36 0.80 -0.04 1.60 -4.23 -0.03 -3.81 115.64 112.29 1gxw s THR 22 Ca 0.47 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 59.00 1gxw s THR 22 Cb -0.17 -2.30 0.01 0.00 1.34 0.00 0.00 72.50 71.37 1gxw s THR 22 CO 0.14 0.00 -0.08 -0.89 -0.54 0.00 0.00 174.62 173.25 1gxw s THR 23 N -3.10 0.77 -0.17 3.99 2.01 -0.30 -1.34 115.64 117.50 1gxw s THR 23 Ca 0.18 -0.31 -0.05 0.00 0.31 0.00 0.00 61.69 61.82 1gxw s THR 23 Cb 0.02 -0.71 -0.03 0.00 0.01 0.00 0.00 72.50 71.79 1gxw s THR 23 CO 0.11 0.26 0.01 -0.47 -0.69 0.00 0.00 174.62 173.84 1gxw s TYR 24 N 0.49 3.13 -0.42 4.92 5.04 0.82 0.04 117.35 131.37 1gxw s TYR 24 Ca -0.08 -0.15 0.01 0.00 -2.44 0.00 0.00 57.07 54.41 1gxw s TYR 24 Cb -0.12 -2.02 0.20 0.00 0.35 0.00 0.00 41.96 40.36 1gxw s TYR 24 CO 0.01 0.03 0.87 0.45 -1.34 0.00 0.00 175.55 175.57 1gxw s SER 25 N 0.43 -0.96 0.00 4.32 0.15 -1.26 -1.03 113.70 115.36 1gxw s SER 25 Ca -0.00 -0.95 0.00 0.00 0.70 0.00 0.00 55.95 55.70 1gxw s SER 25 Cb -0.13 1.25 0.00 0.00 -1.71 0.00 0.00 66.02 65.42 1gxw s SER 25 CO 0.02 -0.06 0.00 0.41 1.20 0.00 0.00 173.24 174.81 1gxw n THR 26 N 3.17 0.00 -3.86 6.45 -1.04 -1.26 -4.79 114.28 112.94 1gxw n THR 26 Ca 0.13 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.91 1gxw n THR 26 Cb 0.60 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 69.06 1gxw n THR 26 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1gxw s TYR 27 N 0.00 2.66 -0.27 -1.42 2.02 -1.26 -4.97 117.35 114.12 1gxw s TYR 27 Ca 0.00 -0.53 -0.08 0.00 -0.37 0.00 0.00 57.07 56.08 1gxw s TYR 27 Cb 0.00 -2.05 -0.03 0.00 -0.40 0.00 0.00 41.96 39.49 1gxw s TYR 27 CO 0.00 0.05 0.11 0.71 -1.57 0.00 0.00 175.55 174.85 1gxw s TYR 28 N -2.53 3.13 0.02 2.71 2.02 0.30 -4.32 117.35 118.67 1gxw s TYR 28 Ca 0.44 -0.38 0.00 0.00 -0.37 0.00 0.00 57.07 56.77 1gxw s TYR 28 Cb 0.00 -2.29 -0.04 0.00 -0.40 0.00 0.00 41.96 39.24 1gxw s TYR 28 CO 0.25 -0.35 0.08 0.71 -1.57 0.00 0.00 175.55 174.67 1gxw s TYR 29 N 1.64 3.26 -1.34 2.71 2.02 0.11 0.42 117.35 126.17 1gxw s TYR 29 Ca 0.06 0.17 -0.17 0.00 -0.37 0.00 0.00 57.07 56.76 1gxw s TYR 29 Cb -0.16 -1.71 0.05 0.00 -0.40 0.00 0.00 41.96 39.75 1gxw s TYR 29 CO 0.05 0.54 1.91 1.28 -1.57 0.00 0.00 175.55 177.76 1gxw n LEU 30 N 0.99 5.49 -3.77 -1.29 4.77 -0.40 -1.15 117.00 121.64 1gxw n LEU 30 Ca -0.12 -3.95 -0.27 0.00 -0.03 0.00 0.00 56.01 51.64 1gxw n LEU 30 Cb 0.52 -1.71 -0.17 0.00 -2.33 0.00 0.00 43.42 39.74 1gxw n LEU 30 CO 0.40 0.39 -0.38 -1.58 -1.33 0.00 0.00 177.39 174.89 1gxw s GLN 31 N 3.98 0.79 -0.42 3.23 0.74 -1.26 -1.90 119.66 124.82 1gxw s GLN 31 Ca 0.52 -0.35 -0.18 0.00 0.05 0.00 0.00 55.36 55.41 1gxw s GLN 31 Cb 0.07 -1.88 0.02 0.00 1.10 0.00 0.00 33.01 32.33 1gxw s GLN 31 CO 0.03 -0.54 0.46 0.34 -0.55 0.00 0.00 175.29 175.03 1gxw s ASP 32 N 1.83 6.21 0.00 6.67 -1.08 0.58 -3.10 116.67 127.79 1gxw s ASP 32 Ca 0.00 -0.62 0.27 0.00 -0.52 0.00 0.00 52.55 51.68 1gxw s ASP 32 Cb -0.16 -2.23 0.80 0.00 -1.46 0.00 0.00 42.92 39.87 1gxw s ASP 32 CO -0.07 -0.60 1.60 0.59 0.52 0.00 0.00 175.17 177.21 1gxw n ASN 33 N 5.67 1.59 -0.06 -0.34 3.02 -1.26 -1.38 115.26 122.50 1gxw n ASN 33 Ca -0.07 -1.40 0.14 0.00 -0.03 0.00 0.00 54.58 53.22 1gxw n ASN 33 Cb 0.47 0.06 0.59 0.00 -0.61 0.00 0.00 39.78 40.30 1gxw n ASN 33 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1gxw n THR 34 N 0.09 0.00 -3.95 3.41 -2.24 -1.26 -4.72 114.28 105.61 1gxw n THR 34 Ca 0.16 -0.03 -0.30 0.00 -2.27 0.00 0.00 64.05 61.61 1gxw n THR 34 Cb 0.39 -0.20 -0.16 0.00 -2.10 0.00 0.00 70.33 68.26 1gxw n THR 34 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1gxw s ARG 35 N -2.67 1.73 3.23 -0.78 0.52 -1.26 -5.06 118.95 114.66 1gxw s ARG 35 Ca 0.23 -0.89 0.00 0.00 -0.52 0.00 0.00 55.73 54.55 1gxw s ARG 35 Cb 0.20 -2.47 0.00 0.00 0.52 0.00 0.00 34.95 33.20 1gxw s ARG 35 CO 0.51 -0.53 0.00 0.41 0.02 0.00 0.00 175.30 175.72 1gxw n GLY 36 N 4.70 1.84 0.16 -3.53 0.00 -1.26 -0.65 105.19 106.44 1gxw n GLY 36 Ca -0.13 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.47 1gxw n GLY 36 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gxw n ASP 37 N -1.29 0.32 0.00 1.61 8.00 -0.82 -4.95 116.55 119.41 1gxw n ASP 37 Ca 0.00 -2.00 0.00 0.00 0.71 0.00 0.00 54.79 53.50 1gxw n ASP 37 Cb 0.00 -0.15 0.00 0.00 -0.02 0.00 0.00 41.12 40.95 1gxw n ASP 37 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gxw n GLY 38 N 0.35 2.79 3.08 0.44 0.00 0.17 -4.66 105.19 107.36 1gxw n GLY 38 Ca 0.00 -1.86 -0.32 0.00 0.00 0.00 0.00 46.02 43.85 1gxw n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gxw s ILE 39 N -2.56 1.86 -0.11 -0.61 1.01 -0.48 -0.92 121.20 119.39 1gxw s ILE 39 Ca 0.00 -0.82 0.02 0.00 0.00 0.00 0.00 60.65 59.86 1gxw s ILE 39 Cb 0.00 -1.70 -0.01 0.00 0.01 0.00 0.00 42.46 40.76 1gxw s ILE 39 CO 0.00 0.51 -0.20 -0.36 0.00 0.00 0.00 174.94 174.89 1gxw s PHE 40 N 1.36 2.66 -0.12 3.97 0.40 0.98 -0.31 117.98 126.91 1gxw s PHE 40 Ca 0.05 -0.88 0.02 0.00 -0.60 0.00 0.00 56.93 55.52 1gxw s PHE 40 Cb -0.13 -1.76 -0.00 0.00 0.51 0.00 0.00 43.02 41.64 1gxw s PHE 40 CO -0.12 -0.33 -0.19 0.99 0.70 0.00 0.00 175.22 176.27 1gxw s THR 41 N 0.33 2.46 0.24 0.64 2.01 -0.80 -1.37 115.64 119.16 1gxw s THR 41 Ca -0.16 -0.86 0.09 0.00 0.31 0.00 0.00 61.69 61.08 1gxw s THR 41 Cb -0.17 -2.00 -0.04 0.00 0.01 0.00 0.00 72.50 70.30 1gxw s THR 41 CO 0.08 0.54 -0.03 -0.31 -0.69 0.00 0.00 174.62 174.20 1gxw s TYR 42 N 0.49 2.67 -0.26 4.92 1.51 0.24 -1.29 117.35 125.62 1gxw s TYR 42 Ca -0.13 -0.22 -0.08 0.00 -1.01 0.00 0.00 57.07 55.63 1gxw s TYR 42 Cb -0.17 -1.21 -0.03 0.00 -0.11 0.00 0.00 41.96 40.45 1gxw s TYR 42 CO 0.05 0.60 0.10 0.34 -1.11 0.00 0.00 175.55 175.53 1gxw s ASP 43 N -3.46 5.34 0.00 2.29 2.15 0.20 -1.40 116.67 121.79 1gxw s ASP 43 Ca 0.30 -0.23 0.28 0.00 0.43 0.00 0.00 52.55 53.33 1gxw s ASP 43 Cb -0.07 -1.97 1.10 0.00 -0.30 0.00 0.00 42.92 41.68 1gxw s ASP 43 CO 0.19 -0.06 1.77 0.00 -0.17 0.00 0.00 175.17 176.89 1gxw n ALA 44 N 4.95 2.78 -4.05 3.66 0.00 -0.25 -1.72 120.51 125.89 1gxw n ALA 44 Ca -0.15 -0.36 -0.32 0.00 0.00 0.00 0.00 53.44 52.60 1gxw n ALA 44 Cb 0.51 -1.23 -0.00 0.00 0.00 0.00 0.00 19.45 18.72 1gxw n ALA 44 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1gxw n LYS 45 N -0.46 -4.17 -1.05 0.00 5.02 -1.23 -0.91 118.16 115.35 1gxw n LYS 45 Ca 0.16 0.47 -0.02 0.00 -2.02 0.00 0.00 58.31 56.91 1gxw n LYS 45 Cb 0.31 -5.18 -0.01 0.00 -0.02 0.00 0.00 35.03 30.13 1gxw n LYS 45 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1gxw n TYR 46 N -4.50 0.00 -3.65 2.13 4.01 0.15 -4.95 117.16 110.35 1gxw n TYR 46 Ca -0.00 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.50 1gxw n TYR 46 Cb 0.54 -1.38 -0.00 0.00 -0.31 0.00 0.00 39.34 38.19 1gxw n TYR 46 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1gxw s ARG 47 N -1.49 2.35 0.00 -0.72 0.52 -0.08 -3.66 118.95 115.86 1gxw s ARG 47 Ca 0.00 -1.81 0.17 0.00 -0.52 0.00 0.00 55.73 53.57 1gxw s ARG 47 Cb 0.00 -2.27 0.14 0.00 0.52 0.00 0.00 34.95 33.34 1gxw s ARG 47 CO 0.00 -0.52 1.04 0.25 0.02 0.00 0.00 175.30 176.09 1gxw n THR 48 N -1.77 0.01 -2.79 0.02 -2.24 -1.26 -0.69 114.28 105.55 1gxw n THR 48 Ca 0.03 -0.50 -0.41 0.00 -2.27 0.00 0.00 64.05 60.90 1gxw n THR 48 Cb 0.63 1.35 -0.05 0.00 -2.10 0.00 0.00 70.33 70.16 1gxw n THR 48 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1gxw s THR 49 N -1.42 4.52 0.19 4.28 -4.23 -1.26 -5.00 115.64 112.73 1gxw s THR 49 Ca 0.20 1.97 0.10 0.00 -1.18 0.00 0.00 61.69 62.79 1gxw s THR 49 Cb 0.14 -4.28 -0.04 0.00 1.34 0.00 0.00 72.50 69.66 1gxw s THR 49 CO 0.21 0.34 -0.18 -0.76 -0.54 0.00 0.00 174.62 173.69 1gxw s LEU 50 N -0.10 2.65 0.32 4.79 1.43 -1.26 -4.01 118.68 122.50 1gxw s LEU 50 Ca 0.45 -0.76 0.24 0.00 -1.03 0.00 0.00 54.13 53.02 1gxw s LEU 50 Cb -0.23 -1.36 0.41 0.00 0.03 0.00 0.00 46.19 45.05 1gxw s LEU 50 CO 0.28 0.11 1.55 1.55 0.23 0.00 0.00 176.35 180.08 1gxw h PRO 51 N 3.04 0.00 0.00 1.29 0.13 -1.97 -3.51 132.00 130.98 1gxw h PRO 51 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1gxw h PRO 51 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1gxw h PRO 51 CO 0.51 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.69 1gxw n GLY 52 N 1.18 0.31 3.51 1.56 0.00 -1.26 -4.28 105.19 106.21 1gxw n GLY 52 Ca 0.04 -1.84 -0.34 0.00 0.00 0.00 0.00 46.02 43.88 1gxw n GLY 52 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gxw s SER 53 N -4.00 4.57 0.16 1.61 0.01 -0.70 -4.88 113.70 110.47 1gxw s SER 53 Ca 0.00 -0.13 -0.34 0.00 1.31 0.00 0.00 55.95 56.79 1gxw s SER 53 Cb 0.00 -1.49 -0.14 0.00 0.21 0.00 0.00 66.02 64.60 1gxw s SER 53 CO 0.00 0.25 1.57 -0.11 0.41 0.00 0.00 173.24 175.36 1gxw n LEU 54 N 3.00 3.08 -4.60 2.44 7.94 -1.26 -0.63 117.00 126.97 1gxw n LEU 54 Ca -0.18 1.08 -0.45 0.00 -1.11 0.00 0.00 56.01 55.35 1gxw n LEU 54 Cb 0.53 -1.43 -0.04 0.00 0.53 0.00 0.00 43.42 43.01 1gxw n LEU 54 CO 0.30 -0.30 1.74 1.87 -1.11 0.00 0.00 177.39 179.89 1gxw n TRP 55 N 3.38 2.06 -4.50 1.96 -0.00 -0.41 -4.81 117.44 115.12 1gxw n TRP 55 Ca 0.17 -0.07 -0.34 0.00 -0.00 0.00 0.00 57.50 57.25 1gxw n TRP 55 Cb 0.29 -2.69 -0.11 0.00 -0.00 0.00 0.00 31.31 28.79 1gxw n TRP 55 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1gxw s ALA 56 N 6.73 3.08 -0.00 5.87 0.00 -1.26 -1.28 121.76 134.89 1gxw s ALA 56 Ca 0.99 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 52.11 1gxw s ALA 56 Cb -0.51 -1.38 0.00 0.00 0.00 0.00 0.00 23.12 21.23 1gxw s ALA 56 CO 0.42 0.50 -0.01 0.34 0.00 0.00 0.00 175.76 177.00 1gxw s ASP 57 N -0.57 0.22 0.16 0.00 2.15 0.17 -4.94 116.67 113.87 1gxw s ASP 57 Ca 0.09 -0.03 -0.02 0.00 0.43 0.00 0.00 52.55 53.02 1gxw s ASP 57 Cb -0.12 -0.04 0.01 0.00 -0.30 0.00 0.00 42.92 42.46 1gxw s ASP 57 CO 0.02 0.00 1.39 0.00 -0.17 0.00 0.00 175.17 176.42 1gxw h ALA 58 N 6.26 0.52 0.00 3.66 0.00 -1.93 0.86 119.26 128.63 1gxw h ALA 58 Ca -0.28 -0.65 0.00 0.00 0.00 0.00 0.00 54.91 53.99 1gxw h ALA 58 Cb 1.19 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1gxw h ALA 58 CO 0.50 0.79 -0.01 -0.40 0.00 0.00 0.00 179.25 180.13 1gxw n ASP 59 N -3.80 2.02 -1.44 0.00 5.68 -1.26 -4.67 116.55 113.08 1gxw n ASP 59 Ca -0.05 -2.36 -0.19 0.00 -0.50 0.00 0.00 54.79 51.69 1gxw n ASP 59 Cb 0.75 -0.16 -0.08 0.00 -1.14 0.00 0.00 41.12 40.49 1gxw n ASP 59 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1gxw n ASN 60 N -0.82 -5.32 -4.15 -1.12 5.15 -1.26 -4.96 115.26 102.78 1gxw n ASN 60 Ca 0.06 0.47 -0.33 0.00 -0.60 0.00 0.00 54.58 54.17 1gxw n ASN 60 Cb 0.41 -4.47 -0.16 0.00 -0.53 0.00 0.00 39.78 35.03 1gxw n ASN 60 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1gxw s GLN 61 N -3.59 2.98 -0.80 1.20 -0.21 -1.26 -2.74 119.66 115.24 1gxw s GLN 61 Ca 0.00 -0.85 0.02 0.00 0.02 0.00 0.00 55.36 54.55 1gxw s GLN 61 Cb 0.00 -2.68 0.29 0.00 1.00 0.00 0.00 33.01 31.62 1gxw s GLN 61 CO 0.00 -0.25 1.11 1.19 -2.12 0.00 0.00 175.29 175.23 1gxw n PHE 62 N 4.64 3.20 0.71 0.91 3.01 0.97 -4.78 117.46 126.12 1gxw n PHE 62 Ca -0.20 -3.49 0.11 0.00 1.01 0.00 0.00 57.45 54.88 1gxw n PHE 62 Cb 0.49 -0.82 0.11 0.00 -0.01 0.00 0.00 39.48 39.26 1gxw n PHE 62 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1gxw n PHE 63 N 0.72 0.12 -2.55 1.38 3.72 -1.26 -2.01 117.46 117.57 1gxw n PHE 63 Ca 0.31 -0.07 -0.36 0.00 -0.05 0.00 0.00 57.45 57.28 1gxw n PHE 63 Cb 0.37 -0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.87 1gxw n PHE 63 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1gxw s ALA 64 N -1.65 3.08 0.47 4.37 0.00 -1.26 -4.91 121.76 121.87 1gxw s ALA 64 Ca 0.27 0.69 0.13 0.00 0.00 0.00 0.00 51.96 53.05 1gxw s ALA 64 Cb 0.18 -3.27 1.11 0.00 0.00 0.00 0.00 23.12 21.14 1gxw s ALA 64 CO 0.27 -0.20 2.10 0.66 0.00 0.00 0.00 175.76 178.59 1gxw h SER 65 N 2.47 0.20 0.19 0.00 4.64 -1.96 0.11 113.55 119.20 1gxw h SER 65 Ca -0.48 -0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.79 1gxw h SER 65 Cb 1.21 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 1gxw h SER 65 CO 0.62 0.14 -0.20 0.22 -0.87 0.00 0.00 176.83 176.74 1gxw h TYR 66 N 0.23 0.04 -0.01 4.77 3.20 -1.99 -2.90 116.97 120.31 1gxw h TYR 66 Ca 0.08 -0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.79 1gxw h TYR 66 Cb 0.05 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.29 1gxw h TYR 66 CO -0.00 0.24 -0.73 -0.44 -1.64 0.00 0.00 178.16 175.59 1gxw h ASP 67 N 0.03 0.08 -0.97 -2.11 3.32 -1.12 -3.40 116.42 112.26 1gxw h ASP 67 Ca 0.00 -0.05 0.12 0.00 0.02 0.00 0.00 57.03 57.12 1gxw h ASP 67 Cb 0.38 -0.02 -0.14 0.00 0.22 0.00 0.00 39.33 39.77 1gxw h ASP 67 CO 0.03 0.77 -0.47 0.00 -1.72 0.00 0.00 179.24 177.85 1gxw n ALA 68 N -2.42 -0.35 0.19 3.45 0.00 -1.09 -0.75 120.51 119.53 1gxw n ALA 68 Ca -0.01 0.90 0.06 0.00 0.00 0.00 0.00 53.44 54.39 1gxw n ALA 68 Cb 0.70 -0.29 0.56 0.00 0.00 0.00 0.00 19.45 20.42 1gxw n ALA 68 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1gxw h PRO 69 N 0.00 0.14 -0.21 0.00 0.11 -1.79 -2.32 132.00 127.93 1gxw h PRO 69 Ca 0.25 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 66.20 1gxw h PRO 69 Cb 0.50 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.58 1gxw h PRO 69 CO -0.94 0.12 -0.45 0.00 -0.21 0.00 0.00 178.00 176.53 1gxw h ALA 70 N 1.90 0.34 -0.10 -0.75 0.00 -1.20 -1.40 119.26 118.05 1gxw h ALA 70 Ca 0.04 -0.47 0.03 0.00 0.00 0.00 0.00 54.91 54.51 1gxw h ALA 70 Cb 0.03 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1gxw h ALA 70 CO -0.00 0.48 -0.09 0.28 0.00 0.00 0.00 179.25 179.92 1gxw h VAL 71 N 0.38 0.75 -0.37 0.00 2.07 -0.79 -1.34 116.25 116.94 1gxw h VAL 71 Ca 0.00 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.45 1gxw h VAL 71 Cb 1.05 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1gxw h VAL 71 CO 0.10 0.00 -0.06 0.44 0.02 0.00 0.00 177.57 178.07 1gxw h ASP 72 N -0.10 0.69 -0.23 0.57 3.32 -1.47 0.32 116.42 119.53 1gxw h ASP 72 Ca 0.07 -0.34 0.04 0.00 0.02 0.00 0.00 57.03 56.81 1gxw h ASP 72 Cb 0.20 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 1gxw h ASP 72 CO -0.16 0.87 0.01 0.00 -1.72 0.00 0.00 179.24 178.24 1gxw h ALA 73 N 0.84 0.21 -0.16 3.45 0.00 -1.13 0.32 119.26 122.79 1gxw h ALA 73 Ca 0.10 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1gxw h ALA 73 Cb 0.55 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1gxw h ALA 73 CO 0.03 -0.41 0.06 1.25 0.00 0.00 0.00 179.25 180.18 1gxw h HIS 74 N 0.09 0.24 -0.14 0.00 -0.00 -1.18 -1.80 115.15 112.36 1gxw h HIS 74 Ca 0.11 -0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 60.41 1gxw h HIS 74 Cb 0.13 -0.07 -0.00 0.00 -0.00 0.00 0.00 27.41 27.46 1gxw h HIS 74 CO -0.18 0.31 -0.11 -0.92 -0.00 0.00 0.00 177.93 177.03 1gxw h TYR 75 N 0.10 0.38 0.00 5.26 3.20 -0.72 -2.81 116.97 122.37 1gxw h TYR 75 Ca 0.05 -0.11 -0.07 0.00 3.14 0.00 0.00 58.73 61.74 1gxw h TYR 75 Cb 0.17 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.35 1gxw h TYR 75 CO -0.01 0.69 -0.35 1.88 -1.64 0.00 0.00 178.16 178.73 1gxw h TYR 76 N -0.05 0.00 -0.39 -3.82 0.05 -0.41 -1.41 116.97 110.94 1gxw h TYR 76 Ca 0.03 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.71 1gxw h TYR 76 Cb 0.62 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.34 1gxw h TYR 76 CO 0.08 0.35 -0.15 0.00 -1.05 0.00 0.00 178.16 177.38 1gxw h ALA 77 N 1.65 0.99 -0.40 3.88 0.00 -1.32 -1.09 119.26 122.96 1gxw h ALA 77 Ca -0.00 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 1gxw h ALA 77 Cb 0.72 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1gxw h ALA 77 CO 0.05 0.60 0.11 0.78 0.00 0.00 0.00 179.25 180.79 1gxw h GLY 78 N 0.98 0.67 0.99 0.00 0.00 -1.02 -1.05 103.07 103.64 1gxw h GLY 78 Ca 0.10 -0.41 -0.03 0.00 0.00 0.00 0.00 47.33 46.99 1gxw h GLY 78 CO 0.04 0.38 0.24 -2.08 0.00 0.00 0.00 176.54 175.12 1gxw h VAL 79 N 0.50 1.22 -0.68 4.60 2.07 -1.11 -1.39 116.25 121.46 1gxw h VAL 79 Ca 0.13 -0.69 -0.04 0.00 0.82 0.00 0.00 66.70 66.92 1gxw h VAL 79 Cb 0.28 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 1gxw h VAL 79 CO -0.00 0.27 0.27 0.74 0.02 0.00 0.00 177.57 178.86 1gxw h THR 80 N 0.79 1.24 -0.53 2.57 2.02 -1.07 0.64 112.91 118.57 1gxw h THR 80 Ca 0.19 -0.74 -0.02 0.00 0.77 0.00 0.00 66.41 66.61 1gxw h THR 80 Cb 0.19 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.00 1gxw h THR 80 CO -0.02 0.30 0.23 0.22 0.37 0.00 0.00 175.52 176.63 1gxw h TYR 81 N 0.98 0.78 -0.63 3.16 5.03 -0.81 -2.32 116.97 123.16 1gxw h TYR 81 Ca 0.23 -0.05 -0.02 0.00 2.58 0.00 0.00 58.73 61.47 1gxw h TYR 81 Cb 0.19 -0.24 -0.03 0.00 1.55 0.00 0.00 36.73 38.21 1gxw h TYR 81 CO 0.02 0.62 0.33 -0.44 -1.32 0.00 0.00 178.16 177.37 1gxw h ASP 82 N 0.71 0.80 0.20 -2.11 3.32 -0.60 -1.33 116.42 117.40 1gxw h ASP 82 Ca 0.18 -0.11 0.01 0.00 0.02 0.00 0.00 57.03 57.13 1gxw h ASP 82 Cb 0.16 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.46 1gxw h ASP 82 CO -0.02 0.68 -0.41 0.22 -1.72 0.00 0.00 179.24 177.99 1gxw h TYR 83 N 0.86 -1.13 -0.90 4.55 3.20 -0.60 0.18 116.97 123.13 1gxw h TYR 83 Ca 0.22 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.15 1gxw h TYR 83 Cb 0.07 0.47 -0.05 0.00 1.54 0.00 0.00 36.73 38.76 1gxw h TYR 83 CO -0.00 -0.52 0.59 1.88 -1.64 0.00 0.00 178.16 178.47 1gxw h TYR 84 N -0.69 1.09 0.16 -3.82 0.05 -1.27 0.45 116.97 112.93 1gxw h TYR 84 Ca 0.01 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.80 1gxw h TYR 84 Cb 0.69 -0.37 0.00 0.00 1.01 0.00 0.00 36.73 38.06 1gxw h TYR 84 CO -0.32 0.64 -0.07 -0.22 -1.05 0.00 0.00 178.16 177.13 1gxw h LYS 85 N 1.13 -0.20 -0.12 4.88 3.64 -0.89 -0.25 116.57 124.76 1gxw h LYS 85 Ca 0.36 0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.61 1gxw h LYS 85 Cb 0.01 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 1gxw h LYS 85 CO -0.11 0.23 -0.54 -0.91 -2.27 0.00 0.00 179.45 175.86 1gxw h ASN 86 N -0.77 0.39 0.09 4.20 2.35 -0.57 -1.63 115.58 119.64 1gxw h ASN 86 Ca -0.02 -0.21 -0.37 0.00 -0.55 0.00 0.00 56.30 55.15 1gxw h ASN 86 Cb 0.53 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.75 1gxw h ASN 86 CO 0.03 0.86 -2.14 0.52 -1.65 0.00 0.00 177.43 175.06 1gxw n VAL 87 N -3.94 1.70 0.12 2.81 0.31 0.14 -4.57 118.33 114.91 1gxw n VAL 87 Ca -0.02 -0.63 0.04 0.00 -0.01 0.00 0.00 64.34 63.71 1gxw n VAL 87 Cb 0.58 -1.65 0.06 0.00 -0.91 0.00 0.00 33.84 31.93 1gxw n VAL 87 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1gxw n HIS 88 N -3.42 0.14 -2.93 3.52 8.25 -0.92 -4.99 115.22 114.86 1gxw n HIS 88 Ca -0.36 -0.22 -0.21 0.00 -0.26 0.00 0.00 57.72 56.67 1gxw n HIS 88 Cb 1.03 -0.02 0.02 0.00 1.12 0.00 0.00 29.99 32.14 1gxw n HIS 88 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1gxw n ASN 89 N 0.32 -5.49 -4.52 0.41 2.85 -0.61 -4.95 115.26 103.26 1gxw n ASN 89 Ca 0.06 -0.22 -0.34 0.00 -0.11 0.00 0.00 54.58 53.97 1gxw n ASN 89 Cb 0.27 -4.49 -0.12 0.00 1.24 0.00 0.00 39.78 36.68 1gxw n ASN 89 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 1gxw s ARG 90 N -5.60 3.61 -0.57 1.20 3.52 -0.20 -4.94 118.95 115.97 1gxw s ARG 90 Ca 0.25 -0.50 -0.19 0.00 -0.13 0.00 0.00 55.73 55.16 1gxw s ARG 90 Cb -0.12 -2.91 0.09 0.00 -1.56 0.00 0.00 34.95 30.45 1gxw s ARG 90 CO 0.31 0.30 0.68 -0.51 -0.81 0.00 0.00 175.30 175.26 1gxw s LEU 91 N 0.22 5.24 0.00 -0.88 1.43 -1.26 -2.63 118.68 120.79 1gxw s LEU 91 Ca -0.02 -1.26 0.00 0.00 -1.03 0.00 0.00 54.13 51.82 1gxw s LEU 91 Cb -0.14 -2.35 0.00 0.00 0.03 0.00 0.00 46.19 43.74 1gxw s LEU 91 CO 0.03 -1.05 0.00 -0.24 0.23 0.00 0.00 176.35 175.32 1gxw n SER 92 N 6.29 -6.59 0.22 2.29 2.88 -1.26 -1.45 113.62 116.01 1gxw n SER 92 Ca -0.09 1.05 0.09 0.00 -1.33 0.00 0.00 58.87 58.59 1gxw n SER 92 Cb 0.43 -2.94 0.48 0.00 -0.75 0.00 0.00 64.21 61.43 1gxw n SER 92 CO 0.00 0.00 0.00 0.10 -1.23 0.00 0.00 175.04 173.91 1gxw h TYR 93 N -0.90 0.00 -0.00 0.66 -0.00 -1.92 -2.81 116.97 112.00 1gxw h TYR 93 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.75 1gxw h TYR 93 Cb 0.89 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.62 1gxw h TYR 93 CO 0.00 0.25 -0.60 -0.40 -0.00 0.00 0.00 178.16 177.42 1gxw n ASP 94 N -3.55 1.02 0.00 0.10 5.75 -1.26 -4.28 116.55 114.33 1gxw n ASP 94 Ca -0.01 -0.82 0.00 0.00 -0.01 0.00 0.00 54.79 53.95 1gxw n ASP 94 Cb 0.40 0.49 0.00 0.00 -1.03 0.00 0.00 41.12 40.98 1gxw n ASP 94 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gxw n GLY 95 N 1.45 0.74 2.50 6.12 0.00 -0.58 -4.88 105.19 110.55 1gxw n GLY 95 Ca 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.04 1gxw n GLY 95 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1gxw n ASN 96 N 0.00 2.25 -3.43 1.61 5.15 -0.71 -4.32 115.26 115.82 1gxw n ASN 96 Ca 0.00 -2.44 -0.25 0.00 -0.60 0.00 0.00 54.58 51.29 1gxw n ASN 96 Cb 0.00 -0.44 0.01 0.00 -0.53 0.00 0.00 39.78 38.83 1gxw n ASN 96 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1gxw n ASN 97 N -0.55 -4.65 -4.69 1.20 5.03 -0.53 -4.94 115.26 106.14 1gxw n ASN 97 Ca 0.15 -0.47 -0.38 0.00 0.87 0.00 0.00 54.58 54.75 1gxw n ASN 97 Cb 0.86 -3.78 0.05 0.00 -1.02 0.00 0.00 39.78 35.90 1gxw n ASN 97 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1gxw n ALA 98 N -3.85 0.92 -1.77 5.41 0.00 -1.26 -1.95 120.51 118.00 1gxw n ALA 98 Ca -0.02 0.06 -0.40 0.00 0.00 0.00 0.00 53.44 53.08 1gxw n ALA 98 Cb 0.56 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.76 1gxw n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gxw s ALA 99 N -1.39 3.26 -0.22 0.00 0.00 -1.26 -4.57 121.76 117.58 1gxw s ALA 99 Ca 0.75 1.32 -0.07 0.00 0.00 0.00 0.00 51.96 53.96 1gxw s ALA 99 Cb -0.42 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.15 1gxw s ALA 99 CO 0.47 -0.95 0.06 0.42 0.00 0.00 0.00 175.76 175.75 1gxw s ILE 100 N -1.24 4.41 0.03 0.00 1.01 -0.10 -5.01 121.20 120.30 1gxw s ILE 100 Ca 0.58 -0.15 0.08 0.00 0.00 0.00 0.00 60.65 61.16 1gxw s ILE 100 Cb -0.40 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.02 1gxw s ILE 100 CO 0.52 0.39 -0.25 -0.13 0.00 0.00 0.00 174.94 175.47 1gxw s ARG 101 N 1.12 1.76 -0.02 2.79 0.52 -1.26 -0.02 118.95 123.85 1gxw s ARG 101 Ca 0.04 -1.01 -0.04 0.00 -0.52 0.00 0.00 55.73 54.21 1gxw s ARG 101 Cb -0.14 -1.86 0.00 0.00 0.52 0.00 0.00 34.95 33.47 1gxw s ARG 101 CO 0.03 0.49 0.09 -1.12 0.02 0.00 0.00 175.30 174.81 1gxw s SER 102 N -1.03 -0.03 -0.04 0.23 0.01 -0.47 -1.44 113.70 110.93 1gxw s SER 102 Ca 0.10 0.03 0.06 0.00 1.31 0.00 0.00 55.95 57.45 1gxw s SER 102 Cb -0.10 0.19 -0.01 0.00 0.21 0.00 0.00 66.02 66.31 1gxw s SER 102 CO 0.01 -0.13 -0.23 -0.44 0.41 0.00 0.00 173.24 172.86 1gxw s SER 103 N -0.41 2.76 0.46 2.44 0.01 -0.85 0.80 113.70 118.92 1gxw s SER 103 Ca -0.05 -0.45 0.05 0.00 1.31 0.00 0.00 55.95 56.81 1gxw s SER 103 Cb -0.03 -0.58 -0.04 0.00 0.21 0.00 0.00 66.02 65.58 1gxw s SER 103 CO 0.00 0.24 0.08 0.68 0.41 0.00 0.00 173.24 174.65 1gxw s VAL 104 N -0.28 1.71 -1.45 3.43 -7.23 -0.49 -1.22 120.40 114.87 1gxw s VAL 104 Ca 0.01 -1.90 -0.08 0.00 -1.81 0.00 0.00 61.98 58.20 1gxw s VAL 104 Cb -0.11 -2.60 0.02 0.00 0.56 0.00 0.00 36.38 34.25 1gxw s VAL 104 CO 0.02 0.00 0.94 1.41 -0.31 0.00 0.00 175.10 177.16 1gxw n HIS 105 N -1.21 -2.46 -2.46 2.82 8.25 -1.18 -1.09 115.22 117.90 1gxw n HIS 105 Ca -0.09 0.82 -0.42 0.00 -0.26 0.00 0.00 57.72 57.76 1gxw n HIS 105 Cb 0.66 -4.62 -0.03 0.00 1.12 0.00 0.00 29.99 27.12 1gxw n HIS 105 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1gxw s TYR 106 N -3.25 3.22 0.00 4.41 5.04 -1.01 0.31 117.35 126.07 1gxw s TYR 106 Ca 0.50 1.22 0.00 0.00 -2.44 0.00 0.00 57.07 56.35 1gxw s TYR 106 Cb -0.23 -3.42 0.00 0.00 0.35 0.00 0.00 41.96 38.66 1gxw s TYR 106 CO 0.62 -1.31 0.00 0.45 -1.34 0.00 0.00 175.55 173.97 1gxw n SER 107 N 5.04 -1.95 -3.99 4.32 2.88 0.13 -4.33 113.62 115.71 1gxw n SER 107 Ca 0.11 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.38 1gxw n SER 107 Cb 0.46 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 63.76 1gxw n SER 107 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 1gxw s GLN 108 N 0.00 1.83 -1.75 -1.46 -0.21 -1.26 -4.18 119.66 112.63 1gxw s GLN 108 Ca 0.00 -0.41 0.00 0.00 0.02 0.00 0.00 55.36 54.97 1gxw s GLN 108 Cb 0.00 -1.65 0.00 0.00 1.00 0.00 0.00 33.01 32.36 1gxw s GLN 108 CO 0.00 -0.11 0.00 0.41 -2.12 0.00 0.00 175.29 173.47 1gxw n GLY 109 N 4.36 -0.40 3.65 3.09 0.00 -1.26 -4.92 105.19 109.71 1gxw n GLY 109 Ca -0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.41 1gxw n GLY 109 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1gxw s TYR 110 N -3.00 3.16 -0.49 1.61 5.04 -1.26 -4.14 117.35 118.27 1gxw s TYR 110 Ca 0.00 1.27 -0.02 0.00 -2.44 0.00 0.00 57.07 55.88 1gxw s TYR 110 Cb 0.00 -3.50 0.24 0.00 0.35 0.00 0.00 41.96 39.04 1gxw s TYR 110 CO 0.00 -0.83 2.24 0.09 -1.34 0.00 0.00 175.55 175.71 1gxw n ASN 111 N 6.66 6.87 -3.27 4.32 3.02 -1.26 -0.55 115.26 131.05 1gxw n ASN 111 Ca 0.12 -3.35 -0.10 0.00 -0.03 0.00 0.00 54.58 51.22 1gxw n ASN 111 Cb 0.46 -1.09 -0.01 0.00 -0.61 0.00 0.00 39.78 38.53 1gxw n ASN 111 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1gxw s ASN 112 N -0.36 0.23 0.06 6.41 3.84 -1.26 -4.99 114.94 118.88 1gxw s ASN 112 Ca 0.49 -1.15 -0.11 0.00 0.21 0.00 0.00 52.86 52.29 1gxw s ASN 112 Cb 0.36 0.75 0.01 0.00 -0.55 0.00 0.00 41.25 41.82 1gxw s ASN 112 CO -0.11 -1.46 0.25 0.00 -2.79 0.00 0.00 177.10 172.98 1gxw s ALA 113 N -2.95 -0.47 0.02 1.71 0.00 -1.26 -1.34 121.76 117.47 1gxw s ALA 113 Ca 0.20 -0.27 -0.29 0.00 0.00 0.00 0.00 51.96 51.61 1gxw s ALA 113 Cb -0.03 0.39 0.10 0.00 0.00 0.00 0.00 23.12 23.57 1gxw s ALA 113 CO 0.13 -0.45 1.03 -0.59 0.00 0.00 0.00 175.76 175.89 1gxw s PHE 114 N -3.05 -0.18 -0.24 0.00 -0.71 -0.27 -4.98 117.98 108.54 1gxw s PHE 114 Ca -0.01 0.00 -0.07 0.00 -1.04 0.00 0.00 56.93 55.81 1gxw s PHE 114 Cb 0.01 0.57 -0.02 0.00 -1.21 0.00 0.00 43.02 42.37 1gxw s PHE 114 CO -0.07 -0.55 0.05 -0.46 -1.34 0.00 0.00 175.22 172.85 1gxw s TRP 115 N -2.96 3.06 -0.83 3.49 -0.11 -1.26 0.52 118.94 120.85 1gxw s TRP 115 Ca 0.10 -0.54 0.12 0.00 1.22 0.00 0.00 56.10 57.00 1gxw s TRP 115 Cb -0.00 -2.21 0.58 0.00 -1.50 0.00 0.00 33.47 30.33 1gxw s TRP 115 CO -0.03 -0.40 1.42 0.27 -4.62 0.00 0.00 176.95 173.58 1gxw n ASN 116 N 4.90 4.11 0.00 5.86 6.94 -0.26 -4.87 115.26 131.93 1gxw n ASN 116 Ca -0.17 -2.51 0.00 0.00 -0.02 0.00 0.00 54.58 51.88 1gxw n ASN 116 Cb 0.51 -0.57 0.00 0.00 -2.36 0.00 0.00 39.78 37.36 1gxw n ASN 116 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1gxw n GLY 117 N 0.69 2.72 0.00 4.83 0.00 -1.26 -4.76 105.19 107.41 1gxw n GLY 117 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1gxw n GLY 117 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1gxw n SER 118 N 0.00 1.20 -3.73 1.61 7.64 -1.26 -5.12 113.62 113.96 1gxw n SER 118 Ca 0.00 0.00 -0.07 0.00 1.01 0.00 0.00 58.87 59.81 1gxw n SER 118 Cb 0.00 0.22 -0.02 0.00 -1.01 0.00 0.00 64.21 63.40 1gxw n SER 118 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1gxw s GLU 119 N -0.60 1.49 0.22 1.43 -1.05 -1.26 -4.74 118.70 114.19 1gxw s GLU 119 Ca 0.00 -0.77 -0.10 0.00 -0.15 0.00 0.00 54.97 53.95 1gxw s GLU 119 Cb 0.00 0.54 -0.07 0.00 -0.44 0.00 0.00 34.13 34.16 1gxw s GLU 119 CO 0.00 -0.68 0.54 -1.64 0.95 0.00 0.00 175.26 174.43 1gxw s MET 120 N -3.69 3.81 -0.02 -4.83 -1.94 -0.52 -1.11 119.30 111.01 1gxw s MET 120 Ca 0.09 0.28 0.01 0.00 -1.71 0.00 0.00 55.69 54.36 1gxw s MET 120 Cb -0.04 -2.68 0.01 0.00 2.01 0.00 0.00 34.83 34.13 1gxw s MET 120 CO 0.01 0.34 -0.04 0.08 -0.01 0.00 0.00 175.02 175.40 1gxw s VAL 121 N -1.77 0.40 -0.09 -6.03 1.01 0.18 -2.00 120.40 112.11 1gxw s VAL 121 Ca 0.46 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.32 1gxw s VAL 121 Cb -0.12 -0.39 0.02 0.00 0.00 0.00 0.00 36.38 35.89 1gxw s VAL 121 CO 0.21 0.15 -0.12 -0.31 0.00 0.00 0.00 175.10 175.04 1gxw s TYR 122 N 0.40 1.56 0.70 5.22 2.02 -0.36 -1.11 117.35 125.79 1gxw s TYR 122 Ca -0.05 -0.66 -0.08 0.00 -0.37 0.00 0.00 57.07 55.91 1gxw s TYR 122 Cb -0.08 -1.18 0.05 0.00 -0.40 0.00 0.00 41.96 40.35 1gxw s TYR 122 CO -0.00 -0.37 1.03 0.20 -1.57 0.00 0.00 175.55 174.83 1gxw s GLY 123 N 0.98 1.65 0.00 0.71 0.00 -0.45 -2.40 107.32 107.81 1gxw s GLY 123 Ca -0.08 -0.77 0.24 0.00 0.00 0.00 0.00 44.72 44.11 1gxw s GLY 123 CO -0.00 -0.38 1.31 1.22 0.00 0.00 0.00 173.10 175.25 1gxw n ASP 124 N -2.93 0.71 -0.13 1.64 8.00 -1.19 -2.61 116.55 120.03 1gxw n ASP 124 Ca 0.07 -0.52 0.02 0.00 0.71 0.00 0.00 54.79 55.07 1gxw n ASP 124 Cb 0.60 0.41 -0.01 0.00 -0.02 0.00 0.00 41.12 42.10 1gxw n ASP 124 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gxw n GLY 125 N 1.48 -2.14 1.08 0.44 0.00 0.29 -1.03 105.19 105.31 1gxw n GLY 125 Ca 0.06 -1.45 0.10 0.00 0.00 0.00 0.00 46.02 44.73 1gxw n GLY 125 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gxw n ASP 126 N -2.58 3.15 0.00 1.61 5.68 -1.17 -4.14 116.55 119.11 1gxw n ASP 126 Ca -0.00 -1.97 0.00 0.00 -0.50 0.00 0.00 54.79 52.32 1gxw n ASP 126 Cb 0.06 -0.34 0.00 0.00 -1.14 0.00 0.00 41.12 39.70 1gxw n ASP 126 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gxw n GLY 127 N 1.45 2.57 0.64 6.12 0.00 0.02 -4.76 105.19 111.23 1gxw n GLY 127 Ca 0.20 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.16 1gxw n GLY 127 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1gxw n GLN 128 N -2.00 0.23 0.11 1.61 6.02 -1.26 -4.75 117.38 117.35 1gxw n GLN 128 Ca 0.00 0.09 -0.22 0.00 -0.01 0.00 0.00 57.00 56.86 1gxw n GLN 128 Cb 0.00 -0.90 -0.14 0.00 1.02 0.00 0.00 30.24 30.22 1gxw n GLN 128 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 1gxw h THR 129 N -0.42 1.32 -3.77 5.09 2.02 -1.94 -3.35 112.91 111.85 1gxw h THR 129 Ca -0.06 -2.63 -0.09 0.00 0.77 0.00 0.00 66.41 64.40 1gxw h THR 129 Cb 0.60 2.85 -0.15 0.00 -1.74 0.00 0.00 68.15 69.70 1gxw h THR 129 CO -0.04 0.79 -0.39 -0.36 0.37 0.00 0.00 175.52 175.89 1gxw s PHE 130 N -2.81 0.15 0.47 3.16 0.08 -1.26 0.68 117.98 118.44 1gxw s PHE 130 Ca -0.08 -0.53 0.06 0.00 0.12 0.00 0.00 56.93 56.49 1gxw s PHE 130 Cb 0.05 -0.07 -0.02 0.00 -0.57 0.00 0.00 43.02 42.42 1gxw s PHE 130 CO 0.93 -0.51 0.23 0.96 -0.10 0.00 0.00 175.22 176.74 1gxw s ILE 131 N -3.55 1.97 -0.47 0.64 -4.36 -0.69 -0.80 121.20 113.94 1gxw s ILE 131 Ca 0.03 -1.65 -0.43 0.00 -0.26 0.00 0.00 60.65 58.34 1gxw s ILE 131 Cb 0.04 -2.62 -0.18 0.00 1.25 0.00 0.00 42.46 40.94 1gxw s ILE 131 CO -0.09 0.00 1.79 -2.65 0.24 0.00 0.00 174.94 174.23 1gxw n PRO 132 N -1.42 0.00 0.12 0.37 -0.02 -0.20 -4.41 135.00 129.44 1gxw n PRO 132 Ca -0.04 0.00 0.17 0.00 -2.02 0.00 0.00 63.50 61.61 1gxw n PRO 132 Cb 0.65 -1.41 0.72 0.00 -0.02 0.00 0.00 33.50 33.44 1gxw n PRO 132 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1gxw h LEU 133 N 6.82 0.00 0.00 2.45 4.07 -1.74 -1.40 115.31 125.52 1gxw h LEU 133 Ca -0.23 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.73 1gxw h LEU 133 Cb 1.31 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.05 1gxw h LEU 133 CO 0.98 0.00 0.00 -1.54 -1.08 0.00 0.00 178.44 176.80 1gxw n SER 134 N -4.22 0.00 0.07 -0.43 3.41 -1.26 -2.25 113.62 108.94 1gxw n SER 134 Ca 0.05 0.38 0.10 0.00 -0.26 0.00 0.00 58.87 59.14 1gxw n SER 134 Cb 0.42 -0.43 0.43 0.00 -0.26 0.00 0.00 64.21 64.37 1gxw n SER 134 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gxw n GLY 135 N -0.49 -1.24 3.53 5.00 0.00 -0.53 -4.21 105.19 107.24 1gxw n GLY 135 Ca 0.03 0.01 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 1gxw n GLY 135 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gxw s GLY 136 N -3.30 1.92 0.33 -0.02 0.00 -0.95 -4.85 107.32 100.45 1gxw s GLY 136 Ca 0.07 -1.26 0.03 0.00 0.00 0.00 0.00 44.72 43.56 1gxw s GLY 136 CO 0.38 0.70 1.88 1.19 0.00 0.00 0.00 173.10 177.25 1gxw h ILE 137 N 5.49 1.20 0.00 0.90 2.10 -1.89 -1.30 117.51 124.01 1gxw h ILE 137 Ca -0.33 -0.74 -0.06 0.00 1.08 0.00 0.00 64.86 64.81 1gxw h ILE 137 Cb 1.17 0.84 -0.01 0.00 -1.09 0.00 0.00 36.82 37.73 1gxw h ILE 137 CO 0.60 0.26 -0.27 -2.24 -1.08 0.00 0.00 178.15 175.42 1gxw h ASP 138 N 0.58 0.00 -0.09 2.19 2.03 -1.94 -1.05 116.42 118.15 1gxw h ASP 138 Ca 0.13 0.00 -0.13 0.00 -0.73 0.00 0.00 57.03 56.30 1gxw h ASP 138 Cb 0.29 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 38.79 1gxw h ASP 138 CO 0.00 0.27 -0.46 0.58 -1.03 0.00 0.00 179.24 178.60 1gxw h VAL 139 N 0.00 1.38 -0.15 4.15 2.07 -1.58 -0.74 116.25 121.39 1gxw h VAL 139 Ca -0.00 -1.81 -0.01 0.00 0.82 0.00 0.00 66.70 65.69 1gxw h VAL 139 Cb 0.64 2.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.65 1gxw h VAL 139 CO 0.03 0.54 0.06 0.58 0.02 0.00 0.00 177.57 178.80 1gxw h VAL 140 N 0.04 1.16 -0.25 2.57 2.07 -1.11 -1.61 116.25 119.11 1gxw h VAL 140 Ca -0.03 -0.47 -0.07 0.00 0.82 0.00 0.00 66.70 66.95 1gxw h VAL 140 Cb 1.11 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 32.05 1gxw h VAL 140 CO 0.10 0.15 -0.14 0.00 0.02 0.00 0.00 177.57 177.69 1gxw h ALA 141 N 0.90 1.30 0.14 1.67 0.00 -1.25 -1.26 119.26 120.76 1gxw h ALA 141 Ca 0.05 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1gxw h ALA 141 Cb 0.17 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1gxw h ALA 141 CO -0.00 0.47 -0.07 1.25 0.00 0.00 0.00 179.25 180.90 1gxw h HIS 142 N 0.40 -0.18 -0.13 0.00 6.17 -0.86 -0.60 115.15 119.95 1gxw h HIS 142 Ca 0.07 -0.00 -0.01 0.00 0.71 0.00 0.00 60.37 61.14 1gxw h HIS 142 Cb 0.48 0.06 -0.01 0.00 2.52 0.00 0.00 27.41 30.46 1gxw h HIS 142 CO 0.01 -0.11 0.05 0.93 0.71 0.00 0.00 177.93 179.53 1gxw h GLU 143 N -0.19 0.19 -0.21 5.26 4.39 -0.98 -2.85 114.58 120.18 1gxw h GLU 143 Ca -0.02 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 1gxw h GLU 143 Cb 0.15 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 1gxw h GLU 143 CO 0.03 0.29 0.02 1.25 -1.16 0.00 0.00 179.01 179.45 1gxw h LEU 144 N 0.05 0.28 -1.80 1.33 5.85 -1.21 -0.62 115.31 119.19 1gxw h LEU 144 Ca 0.04 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 1gxw h LEU 144 Cb 0.17 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.12 1gxw h LEU 144 CO -0.00 0.31 -0.15 0.74 -0.34 0.00 0.00 178.44 179.00 1gxw h THR 145 N 0.30 0.77 -0.56 1.05 2.02 -0.88 -0.65 112.91 114.97 1gxw h THR 145 Ca 0.07 -0.60 -0.04 0.00 0.77 0.00 0.00 66.41 66.61 1gxw h THR 145 Cb 0.17 1.36 -0.03 0.00 -1.74 0.00 0.00 68.15 67.92 1gxw h THR 145 CO 0.00 0.15 0.17 0.45 0.37 0.00 0.00 175.52 176.66 1gxw h HIS 146 N 0.00 0.87 -0.63 3.16 3.86 -0.93 -0.47 115.15 121.01 1gxw h HIS 146 Ca -0.00 -0.07 -0.01 0.00 -1.16 0.00 0.00 60.37 59.13 1gxw h HIS 146 Cb 0.35 -0.26 -0.03 0.00 1.06 0.00 0.00 27.41 28.53 1gxw h HIS 146 CO 0.00 0.71 0.34 0.00 0.86 0.00 0.00 177.93 179.84 1gxw h ALA 147 N 1.36 0.80 -0.18 2.45 0.00 -1.13 0.78 119.26 123.34 1gxw h ALA 147 Ca 0.19 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1gxw h ALA 147 Cb 0.25 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1gxw h ALA 147 CO -0.01 0.32 0.08 0.28 0.00 0.00 0.00 179.25 179.92 1gxw h VAL 148 N 0.85 1.14 -0.40 0.00 2.07 -1.10 -2.26 116.25 116.55 1gxw h VAL 148 Ca 0.22 -0.42 -0.00 0.00 0.82 0.00 0.00 66.70 67.32 1gxw h VAL 148 Cb 0.04 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1gxw h VAL 148 CO -0.04 0.13 0.24 0.74 0.02 0.00 0.00 177.57 178.66 1gxw h THR 149 N 0.15 1.14 0.00 2.57 2.02 -0.84 -1.81 112.91 116.13 1gxw h THR 149 Ca 0.06 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 66.91 1gxw h THR 149 Cb 0.14 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 67.18 1gxw h THR 149 CO -0.01 0.14 -0.03 0.44 0.37 0.00 0.00 175.52 176.43 1gxw h ASP 150 N 0.52 0.00 0.74 4.18 3.32 -0.71 0.34 116.42 124.81 1gxw h ASP 150 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1gxw h ASP 150 Cb 0.02 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1gxw h ASP 150 CO -0.03 0.03 -0.59 -1.22 -1.72 0.00 0.00 179.24 175.72 1gxw n TYR 151 N -4.35 0.36 0.00 4.55 4.01 -0.86 -4.30 117.16 116.57 1gxw n TYR 151 Ca -0.03 0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.82 1gxw n TYR 151 Cb 0.12 -0.52 0.00 0.00 -0.31 0.00 0.00 39.34 38.63 1gxw n TYR 151 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1gxw n THR 152 N -1.90 0.00 -0.27 -0.72 -2.24 -0.72 -4.90 114.28 103.54 1gxw n THR 152 Ca 0.04 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.87 1gxw n THR 152 Cb 0.41 0.00 0.19 0.00 -2.10 0.00 0.00 70.33 68.82 1gxw n THR 152 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gxw h ALA 153 N -0.12 1.11 -0.49 6.98 0.00 -1.49 -3.47 119.26 121.78 1gxw h ALA 153 Ca 0.00 0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 1gxw h ALA 153 Cb 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1gxw h ALA 153 CO 0.00 -0.14 -0.11 0.41 0.00 0.00 0.00 179.25 179.41 1gxw n GLY 154 N -1.32 0.47 3.64 0.00 0.00 0.11 -2.15 105.19 105.94 1gxw n GLY 154 Ca 0.14 -0.75 -0.57 0.00 0.00 0.00 0.00 46.02 44.85 1gxw n GLY 154 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1gxw n LEU 155 N -0.66 1.71 -4.77 0.99 4.77 -1.26 -4.34 117.00 113.44 1gxw n LEU 155 Ca -0.06 1.11 -0.37 0.00 -0.03 0.00 0.00 56.01 56.67 1gxw n LEU 155 Cb 0.36 -1.11 -0.01 0.00 -2.33 0.00 0.00 43.42 40.32 1gxw n LEU 155 CO 0.07 -0.88 0.81 0.27 -1.33 0.00 0.00 177.39 176.34 1gxw s ILE 156 N 1.88 3.17 -0.94 -0.08 -4.36 -0.35 -4.85 121.20 115.67 1gxw s ILE 156 Ca 0.93 0.85 -0.08 0.00 -0.26 0.00 0.00 60.65 62.08 1gxw s ILE 156 Cb -1.09 -3.42 -0.16 0.00 1.25 0.00 0.00 42.46 39.04 1gxw s ILE 156 CO 0.59 -0.04 3.22 -1.22 0.24 0.00 0.00 174.94 177.73 1gxw n TYR 157 N -0.60 1.40 -3.56 1.37 4.02 -1.26 -1.75 117.16 116.78 1gxw n TYR 157 Ca 0.08 -2.41 -0.17 0.00 -0.01 0.00 0.00 57.90 55.39 1gxw n TYR 157 Cb 0.49 -2.11 -0.06 0.00 -0.02 0.00 0.00 39.34 37.63 1gxw n TYR 157 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 176.86 176.99 1gxw s GLN 158 N 1.71 0.99 3.97 -0.72 -2.07 -1.26 -4.83 119.66 117.44 1gxw s GLN 158 Ca 0.68 0.42 0.00 0.00 -1.82 0.00 0.00 55.36 54.64 1gxw s GLN 158 Cb 0.24 0.47 0.00 0.00 -1.09 0.00 0.00 33.01 32.62 1gxw s GLN 158 CO -0.03 -0.27 0.00 0.09 -1.32 0.00 0.00 175.29 173.76 1gxw n ASN 159 N 1.36 0.00 -0.14 12.60 3.02 -0.03 -2.17 115.26 129.91 1gxw n ASN 159 Ca -0.18 0.00 -0.01 0.00 -0.03 0.00 0.00 54.58 54.36 1gxw n ASN 159 Cb 0.57 0.00 0.24 0.00 -0.61 0.00 0.00 39.78 39.98 1gxw n ASN 159 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1gxw h GLU 160 N 0.00 0.83 -0.22 3.52 5.08 -1.91 -1.41 114.58 120.47 1gxw h GLU 160 Ca 0.00 -0.11 -0.09 0.00 -1.00 0.00 0.00 59.36 58.15 1gxw h GLU 160 Cb 0.00 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 1gxw h GLU 160 CO 0.00 0.66 -0.27 0.66 -1.00 0.00 0.00 179.01 179.07 1gxw h SER 161 N 0.83 0.42 0.60 1.42 4.64 -1.59 -1.50 113.55 118.37 1gxw h SER 161 Ca 0.20 -0.14 -0.16 0.00 -0.47 0.00 0.00 61.79 61.22 1gxw h SER 161 Cb 0.12 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.08 1gxw h SER 161 CO -0.02 0.68 -0.72 1.23 -0.87 0.00 0.00 176.83 177.13 1gxw h GLY 162 N 1.03 0.10 1.43 -0.77 0.00 -0.83 -1.31 103.07 102.73 1gxw h GLY 162 Ca 0.05 -0.16 -0.13 0.00 0.00 0.00 0.00 47.33 47.10 1gxw h GLY 162 CO 0.05 0.14 -0.33 0.00 0.00 0.00 0.00 176.54 176.39 1gxw h ALA 163 N 1.20 0.87 -0.45 3.60 0.00 -0.87 -0.59 119.26 123.02 1gxw h ALA 163 Ca -0.01 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.42 1gxw h ALA 163 Cb 1.27 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1gxw h ALA 163 CO 0.10 0.63 0.03 0.82 0.00 0.00 0.00 179.25 180.83 1gxw h ILE 164 N 0.54 1.26 -0.41 0.00 2.04 -1.09 0.94 117.51 120.78 1gxw h ILE 164 Ca 0.06 -1.00 0.05 0.00 1.00 0.00 0.00 64.86 64.98 1gxw h ILE 164 Cb 0.83 1.01 -0.05 0.00 -0.74 0.00 0.00 36.82 37.88 1gxw h ILE 164 CO 0.07 0.35 0.13 -1.13 0.00 0.00 0.00 178.15 177.57 1gxw h ASN 165 N 0.63 0.12 -0.55 1.72 -0.73 -0.87 -0.49 115.58 115.42 1gxw h ASN 165 Ca 0.13 0.05 -0.06 0.00 1.87 0.00 0.00 56.30 58.29 1gxw h ASN 165 Cb 0.46 0.05 -0.02 0.00 0.27 0.00 0.00 38.32 39.07 1gxw h ASN 165 CO 0.02 0.10 0.09 -0.33 -0.37 0.00 0.00 177.43 176.94 1gxw h GLU 166 N 0.28 0.91 -0.49 6.67 4.39 -0.76 -2.85 114.58 122.73 1gxw h GLU 166 Ca 0.19 -0.24 -0.03 0.00 0.34 0.00 0.00 59.36 59.62 1gxw h GLU 166 Cb 0.19 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 1gxw h GLU 166 CO -0.21 0.88 0.18 0.00 -1.16 0.00 0.00 179.01 178.70 1gxw h ALA 167 N 0.99 0.64 -0.97 3.43 0.00 -0.36 -1.94 119.26 121.06 1gxw h ALA 167 Ca 0.17 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.97 1gxw h ALA 167 Cb 0.41 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 1gxw h ALA 167 CO 0.01 0.26 0.62 0.82 0.00 0.00 0.00 179.25 180.97 1gxw h ILE 168 N 0.65 1.10 -0.36 0.00 2.04 -1.02 0.33 117.51 120.25 1gxw h ILE 168 Ca 0.16 -0.39 -0.09 0.00 1.00 0.00 0.00 64.86 65.54 1gxw h ILE 168 Cb 0.22 -0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.13 1gxw h ILE 168 CO -0.01 0.21 -0.14 0.28 0.00 0.00 0.00 178.15 178.49 1gxw h SER 169 N 1.15 0.64 -0.24 1.72 0.02 -1.25 -0.51 113.55 115.08 1gxw h SER 169 Ca 0.41 -0.19 -0.20 0.00 -0.84 0.00 0.00 61.79 60.98 1gxw h SER 169 Cb 0.13 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.50 1gxw h SER 169 CO -0.16 0.80 -0.61 0.44 -1.14 0.00 0.00 176.83 176.16 1gxw h ASP 170 N 0.59 0.96 0.23 3.07 3.32 -0.45 0.30 116.42 124.45 1gxw h ASP 170 Ca 0.10 -0.55 -0.01 0.00 0.02 0.00 0.00 57.03 56.59 1gxw h ASP 170 Cb 0.58 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.85 1gxw h ASP 170 CO 0.04 1.35 -0.11 0.40 -1.72 0.00 0.00 179.24 179.19 1gxw h ILE 171 N 0.64 0.82 0.00 0.35 2.04 -0.12 -0.55 117.51 120.68 1gxw h ILE 171 Ca -0.00 -0.29 -0.09 0.00 1.00 0.00 0.00 64.86 65.48 1gxw h ILE 171 Cb 1.22 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1gxw h ILE 171 CO 0.13 0.06 -0.41 -0.26 0.00 0.00 0.00 178.15 177.68 1gxw h PHE 172 N -0.45 0.00 -0.67 1.37 0.04 -1.17 -0.58 116.94 115.48 1gxw h PHE 172 Ca -0.03 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.65 1gxw h PHE 172 Cb 0.34 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.47 1gxw h PHE 172 CO -0.02 0.41 0.09 0.78 -0.60 0.00 0.00 178.31 178.96 1gxw h GLY 173 N 2.55 1.20 0.99 -1.45 0.00 -0.79 -0.47 103.07 105.10 1gxw h GLY 173 Ca -0.00 -0.82 -0.11 0.00 0.00 0.00 0.00 47.33 46.39 1gxw h GLY 173 CO 0.05 0.76 -0.24 -0.84 0.00 0.00 0.00 176.54 176.27 1gxw h THR 174 N 1.04 1.29 -0.24 4.70 2.02 -0.78 -2.31 112.91 118.63 1gxw h THR 174 Ca 0.20 -1.39 -0.05 0.00 0.77 0.00 0.00 66.41 65.94 1gxw h THR 174 Cb 0.47 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 68.33 1gxw h THR 174 CO 0.02 0.45 -0.08 -0.07 0.37 0.00 0.00 175.52 176.21 1gxw h LEU 175 N 0.51 0.35 -0.51 2.58 3.38 -0.92 -1.11 115.31 119.60 1gxw h LEU 175 Ca 0.06 -0.07 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 1gxw h LEU 175 Cb 0.80 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1gxw h LEU 175 CO 0.06 0.48 -0.35 0.58 0.09 0.00 0.00 178.44 179.30 1gxw h VAL 176 N 0.36 1.28 -0.85 1.22 2.07 -0.97 0.83 116.25 120.18 1gxw h VAL 176 Ca 0.07 -1.52 -0.01 0.00 0.82 0.00 0.00 66.70 66.06 1gxw h VAL 176 Cb 0.37 1.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 1gxw h VAL 176 CO 0.02 0.50 0.50 -0.08 0.02 0.00 0.00 177.57 178.54 1gxw h GLU 177 N 0.69 1.16 -0.36 1.57 4.81 -0.74 0.91 114.58 122.62 1gxw h GLU 177 Ca 0.07 -0.11 -0.13 0.00 -0.13 0.00 0.00 59.36 59.05 1gxw h GLU 177 Cb 0.92 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 1gxw h GLU 177 CO 0.08 0.83 -0.30 0.74 -0.73 0.00 0.00 179.01 179.63 1gxw h PHE 178 N 1.17 0.91 -0.22 0.92 0.04 -0.99 -1.52 116.94 117.24 1gxw h PHE 178 Ca 0.30 -0.23 0.01 0.00 2.80 0.00 0.00 57.97 60.85 1gxw h PHE 178 Cb -0.03 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 37.90 1gxw h PHE 178 CO -0.00 0.98 0.13 -0.92 -0.60 0.00 0.00 178.31 177.90 1gxw h TYR 179 N 0.66 0.24 0.00 -0.55 3.20 0.07 -0.27 116.97 120.33 1gxw h TYR 179 Ca 0.08 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.95 1gxw h TYR 179 Cb 0.83 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 39.02 1gxw h TYR 179 CO 0.04 0.15 0.00 0.00 -1.64 0.00 0.00 178.16 176.71 1gxw n ALA 180 N -2.18 1.94 -3.89 1.82 0.00 0.23 -4.91 120.51 113.52 1gxw n ALA 180 Ca -0.03 -0.05 -0.26 0.00 0.00 0.00 0.00 53.44 53.11 1gxw n ALA 180 Cb 0.04 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.15 1gxw n ALA 180 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1gxw n ASN 181 N -1.63 -1.37 -4.06 0.00 5.15 -0.11 -4.94 115.26 108.30 1gxw n ASN 181 Ca 0.05 -0.92 -0.34 0.00 -0.60 0.00 0.00 54.58 52.77 1gxw n ASN 181 Cb 0.25 -3.45 -0.12 0.00 -0.53 0.00 0.00 39.78 35.93 1gxw n ASN 181 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 1gxw s LYS 182 N -6.41 2.13 -1.37 1.20 -2.85 -1.14 -4.72 119.74 106.58 1gxw s LYS 182 Ca 0.15 -2.27 -0.04 0.00 -1.00 0.00 0.00 55.97 52.80 1gxw s LYS 182 Cb -0.08 -3.53 0.00 0.00 -2.06 0.00 0.00 37.83 32.17 1gxw s LYS 182 CO 0.86 -1.10 0.45 0.09 0.10 0.00 0.00 175.35 175.75 1gxw n ASN 183 N 3.80 -0.98 -4.75 0.03 3.02 -1.26 -4.88 115.26 110.25 1gxw n ASN 183 Ca 0.04 -1.04 -0.35 0.00 -0.03 0.00 0.00 54.58 53.20 1gxw n ASN 183 Cb 0.38 -2.95 0.05 0.00 -0.61 0.00 0.00 39.78 36.65 1gxw n ASN 183 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1gxw s PRO 184 N -6.57 2.77 0.15 3.52 0.04 -1.26 -5.03 135.00 128.62 1gxw s PRO 184 Ca 0.08 1.74 -0.07 0.00 0.04 0.00 0.00 61.00 62.78 1gxw s PRO 184 Cb -0.03 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.62 1gxw s PRO 184 CO 0.90 -1.35 0.37 -0.40 0.04 0.00 0.00 177.00 176.56 1gxw n ASP 185 N -1.97 -0.95 -1.46 6.66 5.68 -1.26 -5.04 116.55 118.21 1gxw n ASP 185 Ca 0.13 -1.63 -0.11 0.00 -0.50 0.00 0.00 54.79 52.68 1gxw n ASP 185 Cb 0.50 1.58 0.16 0.00 -1.14 0.00 0.00 41.12 42.23 1gxw n ASP 185 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 1gxw n TRP 186 N -0.26 1.63 -4.07 2.11 7.02 -1.26 -4.93 117.44 117.67 1gxw n TRP 186 Ca -0.03 -1.84 -0.22 0.00 -1.02 0.00 0.00 57.50 54.38 1gxw n TRP 186 Cb 0.26 -0.59 -0.05 0.00 -2.42 0.00 0.00 31.31 28.50 1gxw n TRP 186 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 1gxw s GLU 187 N -3.36 2.61 -0.16 -0.99 0.41 -1.26 -0.30 118.70 115.65 1gxw s GLU 187 Ca 0.48 -1.31 0.00 0.00 -0.41 0.00 0.00 54.97 53.74 1gxw s GLU 187 Cb 0.42 -2.36 0.00 0.00 -1.78 0.00 0.00 34.13 30.41 1gxw s GLU 187 CO 0.01 0.25 -0.16 0.42 -0.49 0.00 0.00 175.26 175.28 1gxw s ILE 188 N -2.29 2.57 -0.82 -1.63 -1.09 0.13 -4.73 121.20 113.35 1gxw s ILE 188 Ca 0.36 -0.80 0.00 0.00 -2.23 0.00 0.00 60.65 57.98 1gxw s ILE 188 Cb -0.06 -2.08 0.00 0.00 -1.58 0.00 0.00 42.46 38.74 1gxw s ILE 188 CO 0.24 0.52 0.00 0.61 -1.23 0.00 0.00 174.94 175.07 1gxw n GLY 189 N 4.13 0.95 0.31 6.18 0.00 -1.26 -1.11 105.19 114.38 1gxw n GLY 189 Ca -0.19 -0.47 0.18 0.00 0.00 0.00 0.00 46.02 45.54 1gxw n GLY 189 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1gxw h GLU 190 N 0.11 0.00 0.00 1.61 9.09 -1.85 -0.73 114.58 122.81 1gxw h GLU 190 Ca -0.16 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.25 1gxw h GLU 190 Cb 0.60 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.70 1gxw h GLU 190 CO 0.23 0.03 0.00 -0.44 0.05 0.00 0.00 179.01 178.88 1gxw h ASP 191 N 0.00 0.00 0.00 3.06 3.32 -1.91 -3.33 116.42 117.56 1gxw h ASP 191 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1gxw h ASP 191 Cb 0.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.70 1gxw h ASP 191 CO 0.00 0.00 0.00 1.33 -1.72 0.00 0.00 179.24 178.85 1gxw n VAL 192 N -2.76 0.00 -3.00 -1.35 0.24 -0.84 -4.86 118.33 105.76 1gxw n VAL 192 Ca 0.04 -0.42 -0.39 0.00 -2.04 0.00 0.00 64.34 61.52 1gxw n VAL 192 Cb 0.45 1.08 -0.06 0.00 -1.47 0.00 0.00 33.84 33.85 1gxw n VAL 192 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1gxw s TYR 193 N -0.42 3.86 -0.21 6.34 5.04 -0.34 -1.70 117.35 129.93 1gxw s TYR 193 Ca 0.00 1.58 -0.14 0.00 -2.44 0.00 0.00 57.07 56.06 1gxw s TYR 193 Cb 0.00 -2.77 0.02 0.00 0.35 0.00 0.00 41.96 39.56 1gxw s TYR 193 CO 0.00 0.46 0.27 0.25 -1.34 0.00 0.00 175.55 175.19 1gxw n THR 194 N 1.90 -1.56 0.06 4.34 -2.24 0.21 -4.81 114.28 112.19 1gxw n THR 194 Ca -0.05 0.02 0.21 0.00 -2.27 0.00 0.00 64.05 61.97 1gxw n THR 194 Cb 0.49 -1.42 0.72 0.00 -2.10 0.00 0.00 70.33 68.02 1gxw n THR 194 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1gxw h PRO 195 N 0.82 0.00 -0.10 -0.78 0.13 -1.82 -0.78 132.00 129.46 1gxw h PRO 195 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 1gxw h PRO 195 Cb 0.59 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.72 1gxw h PRO 195 CO 0.10 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.28 1gxw n GLY 196 N -1.51 -0.38 2.91 1.56 0.00 -1.26 -4.79 105.19 101.73 1gxw n GLY 196 Ca 0.09 -0.24 -0.22 0.00 0.00 0.00 0.00 46.02 45.65 1gxw n GLY 196 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gxw s ILE 197 N -1.88 0.72 0.26 -0.61 -1.09 -0.30 -5.15 121.20 113.16 1gxw s ILE 197 Ca 0.25 -0.19 -0.06 0.00 -2.23 0.00 0.00 60.65 58.42 1gxw s ILE 197 Cb 0.13 -0.74 -0.06 0.00 -1.58 0.00 0.00 42.46 40.21 1gxw s ILE 197 CO 0.20 0.28 0.53 -0.44 -1.23 0.00 0.00 174.94 174.28 1gxw s SER 198 N 1.13 6.49 0.00 3.58 0.01 -1.26 -4.47 113.70 119.19 1gxw s SER 198 Ca -0.07 0.74 0.00 0.00 1.31 0.00 0.00 55.95 57.93 1gxw s SER 198 Cb -0.14 -2.16 0.00 0.00 0.21 0.00 0.00 66.02 63.93 1gxw s SER 198 CO -0.01 -0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.12 1gxw n GLY 199 N -0.61 0.83 3.34 3.44 0.00 -1.26 -5.03 105.19 105.91 1gxw n GLY 199 Ca -0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 1gxw n GLY 199 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gxw n ASP 200 N -0.01 2.29 -3.41 1.61 5.75 -1.26 -5.14 116.55 116.38 1gxw n ASP 200 Ca 0.00 -2.54 -0.06 0.00 -0.01 0.00 0.00 54.79 52.18 1gxw n ASP 200 Cb 0.00 -0.15 0.00 0.00 -1.03 0.00 0.00 41.12 39.95 1gxw n ASP 200 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1gxw s SER 201 N -3.92 -0.10 0.05 -1.12 1.04 -1.26 -4.56 113.70 103.84 1gxw s SER 201 Ca 0.36 -0.77 -0.18 0.00 0.48 0.00 0.00 55.95 55.85 1gxw s SER 201 Cb -0.03 0.67 -0.16 0.00 0.10 0.00 0.00 66.02 66.61 1gxw s SER 201 CO 0.23 -1.30 1.28 0.25 0.98 0.00 0.00 173.24 174.68 1gxw h LEU 202 N 2.00 0.61 -7.84 2.42 5.85 -1.38 -3.47 115.31 113.50 1gxw h LEU 202 Ca -0.26 -0.59 -0.09 0.00 0.84 0.00 0.00 57.88 57.77 1gxw h LEU 202 Cb 1.24 -0.18 -0.14 0.00 0.37 0.00 0.00 40.66 41.95 1gxw h LEU 202 CO 0.32 1.09 -0.40 -0.13 -0.34 0.00 0.00 178.44 178.99 1gxw s ARG 203 N -3.88 0.82 -0.05 1.25 0.52 -1.21 -4.99 118.95 111.41 1gxw s ARG 203 Ca -0.13 -0.96 0.03 0.00 -0.52 0.00 0.00 55.73 54.15 1gxw s ARG 203 Cb 0.06 0.33 0.00 0.00 0.52 0.00 0.00 34.95 35.86 1gxw s ARG 203 CO 0.82 -0.25 -0.15 0.45 0.02 0.00 0.00 175.30 176.19 1gxw s SER 204 N -2.82 1.98 -0.05 0.23 0.15 -1.26 0.19 113.70 112.11 1gxw s SER 204 Ca 0.05 -0.33 -0.03 0.00 0.70 0.00 0.00 55.95 56.33 1gxw s SER 204 Cb 0.05 -0.71 -0.27 0.00 -1.71 0.00 0.00 66.02 63.38 1gxw s SER 204 CO -0.11 0.10 0.64 0.24 1.20 0.00 0.00 173.24 175.31 1gxw h MET 205 N 6.56 0.25 -0.13 5.44 0.00 -1.00 -2.76 114.93 123.28 1gxw h MET 205 Ca -0.31 -0.42 -0.13 0.00 0.00 0.00 0.00 59.70 58.84 1gxw h MET 205 Cb 1.18 0.16 -0.01 0.00 0.00 0.00 0.00 31.60 32.93 1gxw h MET 205 CO 0.48 1.09 -0.48 0.66 0.00 0.00 0.00 176.91 178.66 1gxw h SER 206 N 0.07 0.36 -1.71 1.22 4.64 -1.87 -3.31 113.55 112.95 1gxw h SER 206 Ca -0.33 -0.17 -0.43 0.00 -0.47 0.00 0.00 61.79 60.39 1gxw h SER 206 Cb 2.04 -0.10 -0.30 0.00 -0.31 0.00 0.00 62.40 63.73 1gxw h SER 206 CO 0.13 0.78 -0.82 -0.67 -0.87 0.00 0.00 176.83 175.38 1gxw n ASP 207 N -3.98 -1.43 -0.25 4.97 2.03 -1.26 -5.01 116.55 111.63 1gxw n ASP 207 Ca -0.02 -2.66 0.13 0.00 0.52 0.00 0.00 54.79 52.76 1gxw n ASP 207 Cb 0.54 0.29 0.41 0.00 -0.72 0.00 0.00 41.12 41.63 1gxw n ASP 207 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1gxw h PRO 208 N 5.04 0.61 -0.13 -0.67 0.11 -1.68 -1.47 132.00 133.81 1gxw h PRO 208 Ca 0.14 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 66.25 1gxw h PRO 208 Cb 0.97 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.94 1gxw h PRO 208 CO 0.28 0.40 0.13 0.00 -0.21 0.00 0.00 178.00 178.61 1gxw h ALA 209 N 1.61 1.79 -0.61 -0.75 0.00 -1.73 -1.95 119.26 117.62 1gxw h ALA 209 Ca 0.44 -0.00 0.18 0.00 0.00 0.00 0.00 54.91 55.52 1gxw h ALA 209 Cb 0.78 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1gxw h ALA 209 CO -0.19 -0.20 0.69 -0.22 0.00 0.00 0.00 179.25 179.33 1gxw h LYS 210 N 0.00 0.00 0.00 0.00 3.64 -1.55 0.26 116.57 118.92 1gxw h LYS 210 Ca 0.06 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1gxw h LYS 210 Cb 0.32 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1gxw h LYS 210 CO -0.00 0.00 -0.24 0.66 -2.27 0.00 0.00 179.45 177.60 1gxw n TYR 211 N -3.56 0.00 -0.86 1.91 4.01 -0.77 -4.98 117.16 112.92 1gxw n TYR 211 Ca 0.12 -0.88 0.00 0.00 -0.16 0.00 0.00 57.90 56.98 1gxw n TYR 211 Cb 0.91 -0.15 0.00 0.00 -0.31 0.00 0.00 39.34 39.79 1gxw n TYR 211 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gxw n GLY 212 N -1.01 0.63 3.85 2.72 0.00 0.93 -5.04 105.19 107.26 1gxw n GLY 212 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 1gxw n GLY 212 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1gxw s ASP 213 N -2.15 6.80 0.38 1.61 1.01 -0.97 -4.93 116.67 118.41 1gxw s ASP 213 Ca 0.00 1.03 -0.28 0.00 0.71 0.00 0.00 52.55 54.01 1gxw s ASP 213 Cb 0.00 -2.27 -0.11 0.00 1.01 0.00 0.00 42.92 41.56 1gxw s ASP 213 CO 0.00 0.13 1.45 -2.16 0.21 0.00 0.00 175.17 174.80 1gxw s PRO 214 N -1.89 4.12 -0.07 8.23 0.04 -1.26 -2.16 135.00 142.01 1gxw s PRO 214 Ca 0.36 2.49 0.10 0.00 0.04 0.00 0.00 61.00 63.99 1gxw s PRO 214 Cb -0.15 -2.96 0.15 0.00 0.04 0.00 0.00 34.50 31.58 1gxw s PRO 214 CO 0.19 -0.49 1.04 -0.40 0.04 0.00 0.00 177.00 177.37 1gxw n ASP 215 N 0.46 1.76 -3.66 6.66 5.68 -1.26 -2.47 116.55 123.71 1gxw n ASP 215 Ca 0.01 -2.49 -0.14 0.00 -0.50 0.00 0.00 54.79 51.67 1gxw n ASP 215 Cb 0.40 -0.25 -0.08 0.00 -1.14 0.00 0.00 41.12 40.05 1gxw n ASP 215 CO 0.00 0.00 0.00 -2.28 -1.33 0.00 0.00 177.20 173.59 1gxw s HIS 216 N -1.75 -0.61 0.49 2.11 5.04 -1.26 -4.72 115.29 114.59 1gxw s HIS 216 Ca 0.16 1.40 0.22 0.00 -1.54 0.00 0.00 55.06 55.30 1gxw s HIS 216 Cb 0.14 0.23 1.27 0.00 0.04 0.00 0.00 32.58 34.27 1gxw s HIS 216 CO 0.02 -0.36 1.97 -0.92 -2.34 0.00 0.00 174.74 173.11 1gxw h TYR 217 N 4.81 0.18 0.00 3.88 3.20 -0.76 0.90 116.97 129.17 1gxw h TYR 217 Ca -0.28 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.59 1gxw h TYR 217 Cb 1.17 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 39.38 1gxw h TYR 217 CO 0.40 0.07 0.00 0.66 -1.64 0.00 0.00 178.16 177.65 1gxw h SER 218 N 0.15 0.00 -0.43 -2.11 4.64 -1.88 -2.42 113.55 111.50 1gxw h SER 218 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 1gxw h SER 218 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1gxw h SER 218 CO -0.04 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.21 1gxw n LYS 219 N -2.77 3.34 -1.94 4.77 5.02 0.31 -5.00 118.16 121.88 1gxw n LYS 219 Ca 0.00 -2.69 -0.37 0.00 -2.02 0.00 0.00 58.31 53.23 1gxw n LYS 219 Cb 0.21 -1.75 0.03 0.00 -0.02 0.00 0.00 35.03 33.50 1gxw n LYS 219 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1gxw s ARG 220 N -2.06 3.19 -0.08 1.97 1.70 -0.91 -4.61 118.95 118.14 1gxw s ARG 220 Ca 0.41 2.02 -0.26 0.00 -0.47 0.00 0.00 55.73 57.43 1gxw s ARG 220 Cb 0.29 -2.18 -0.03 0.00 -0.57 0.00 0.00 34.95 32.46 1gxw s ARG 220 CO 0.16 -1.08 0.85 -0.47 -1.08 0.00 0.00 175.30 173.67 1gxw s TYR 221 N -1.43 3.55 -1.24 5.89 5.04 -1.26 -4.95 117.35 122.94 1gxw s TYR 221 Ca 0.72 1.41 0.11 0.00 -2.44 0.00 0.00 57.07 56.87 1gxw s TYR 221 Cb -0.35 -2.99 0.16 0.00 0.35 0.00 0.00 41.96 39.13 1gxw s TYR 221 CO 0.41 -0.07 0.99 0.25 -1.34 0.00 0.00 175.55 175.79 1gxw n THR 222 N 4.17 0.34 -0.21 4.34 -2.24 -1.26 -4.76 114.28 114.66 1gxw n THR 222 Ca 0.03 -0.67 0.00 0.00 -2.27 0.00 0.00 64.05 61.14 1gxw n THR 222 Cb 0.50 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 69.72 1gxw n THR 222 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gxw n GLY 223 N 0.59 -2.02 0.13 3.38 0.00 -1.26 -5.00 105.19 101.01 1gxw n GLY 223 Ca 0.08 -1.45 0.05 0.00 0.00 0.00 0.00 46.02 44.70 1gxw n GLY 223 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gxw n THR 224 N -1.15 0.00 -1.57 2.61 -2.24 -1.26 -4.25 114.28 106.42 1gxw n THR 224 Ca 0.00 -0.35 -0.35 0.00 -2.27 0.00 0.00 64.05 61.08 1gxw n THR 224 Cb 0.00 1.07 0.08 0.00 -2.10 0.00 0.00 70.33 69.38 1gxw n THR 224 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1gxw s GLN 225 N -1.58 2.33 -1.50 -0.78 -0.21 -1.26 -2.72 119.66 113.94 1gxw s GLN 225 Ca 0.06 1.82 -0.10 0.00 0.02 0.00 0.00 55.36 57.17 1gxw s GLN 225 Cb 0.08 -1.85 0.07 0.00 1.00 0.00 0.00 33.01 32.31 1gxw s GLN 225 CO 0.31 -1.70 0.82 -3.47 -2.12 0.00 0.00 175.29 169.13 1gxw n ASP 226 N -2.41 -3.22 -3.83 5.90 2.03 -1.26 -0.28 116.55 113.48 1gxw n ASP 226 Ca 0.14 -0.86 -0.28 0.00 0.52 0.00 0.00 54.79 54.31 1gxw n ASP 226 Cb 0.50 -3.61 0.04 0.00 -0.72 0.00 0.00 41.12 37.32 1gxw n ASP 226 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1gxw n ASN 227 N -2.87 -4.51 -0.16 1.67 4.13 -1.20 -1.43 115.26 110.88 1gxw n ASN 227 Ca -0.07 -0.75 0.00 0.00 1.68 0.00 0.00 54.58 55.45 1gxw n ASN 227 Cb 0.57 -4.11 0.00 0.00 -1.54 0.00 0.00 39.78 34.71 1gxw n ASN 227 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1gxw n GLY 228 N -1.72 0.63 2.74 7.41 0.00 0.02 -0.85 105.19 113.43 1gxw n GLY 228 Ca -0.02 -0.77 -0.14 0.00 0.00 0.00 0.00 46.02 45.09 1gxw n GLY 228 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gxw n GLY 229 N -0.82 0.06 0.28 -0.02 0.00 0.61 -4.15 105.19 101.15 1gxw n GLY 229 Ca 0.00 -0.12 0.04 0.00 0.00 0.00 0.00 46.02 45.94 1gxw n GLY 229 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1gxw h VAL 230 N -1.61 1.11 -0.01 1.61 -1.51 -1.42 0.54 116.25 114.97 1gxw h VAL 230 Ca -0.34 -0.38 0.00 0.00 -1.23 0.00 0.00 66.70 64.75 1gxw h VAL 230 Cb 1.22 0.84 0.00 0.00 -2.13 0.00 0.00 31.29 31.22 1gxw h VAL 230 CO 0.33 0.14 -0.36 1.41 -1.23 0.00 0.00 177.57 177.86 1gxw n HIS 231 N -4.41 0.00 -0.08 5.19 8.25 -1.26 -3.83 115.22 119.08 1gxw n HIS 231 Ca 0.01 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.41 1gxw n HIS 231 Cb 0.14 -0.08 -0.02 0.00 1.12 0.00 0.00 29.99 31.15 1gxw n HIS 231 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1gxw n ILE 232 N -0.47 1.43 0.61 1.59 5.41 -0.49 -4.44 119.36 123.00 1gxw n ILE 232 Ca 0.11 0.19 0.07 0.00 1.00 0.00 0.00 62.75 64.12 1gxw n ILE 232 Cb 0.39 -2.37 0.34 0.00 -0.71 0.00 0.00 39.64 37.29 1gxw n ILE 232 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1gxw n ASN 233 N -4.54 0.00 0.27 4.38 3.02 0.06 -2.00 115.26 116.45 1gxw n ASN 233 Ca -0.09 0.27 0.14 0.00 -0.03 0.00 0.00 54.58 54.86 1gxw n ASN 233 Cb 0.35 -0.38 0.77 0.00 -0.61 0.00 0.00 39.78 39.90 1gxw n ASN 233 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1gxw h SER 234 N 0.00 0.00 -0.33 6.41 4.64 -1.75 -2.12 113.55 120.40 1gxw h SER 234 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1gxw h SER 234 Cb 0.19 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.26 1gxw h SER 234 CO 0.00 0.09 0.21 1.23 -0.87 0.00 0.00 176.83 177.50 1gxw h GLY 235 N 0.77 0.47 0.92 -0.77 0.00 -1.59 0.20 103.07 103.07 1gxw h GLY 235 Ca -0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 1gxw h GLY 235 CO 0.01 0.18 0.12 -2.22 0.00 0.00 0.00 176.54 174.63 1gxw h ILE 236 N 0.46 1.20 -0.17 2.60 2.04 -1.05 -0.60 117.51 121.98 1gxw h ILE 236 Ca 0.12 -0.62 -0.19 0.00 1.00 0.00 0.00 64.86 65.18 1gxw h ILE 236 Cb -0.04 0.97 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 1gxw h ILE 236 CO -0.02 0.21 -0.66 0.40 0.00 0.00 0.00 178.15 178.08 1gxw h ILE 237 N 0.40 1.31 -0.71 -0.67 1.08 -1.50 -2.61 117.51 114.80 1gxw h ILE 237 Ca 0.11 -1.92 -0.04 0.00 -0.39 0.00 0.00 64.86 62.62 1gxw h ILE 237 Cb 0.21 1.89 -0.03 0.00 -3.07 0.00 0.00 36.82 35.82 1gxw h ILE 237 CO -0.01 0.60 0.30 0.78 -0.69 0.00 0.00 178.15 179.14 1gxw h ASN 238 N 0.47 0.95 -0.42 1.72 2.35 -0.50 -1.15 115.58 119.00 1gxw h ASN 238 Ca -0.02 -0.13 -0.05 0.00 -0.55 0.00 0.00 56.30 55.56 1gxw h ASN 238 Cb 1.25 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 39.36 1gxw h ASN 238 CO 0.13 0.83 0.07 0.50 -1.65 0.00 0.00 177.43 177.31 1gxw h LYS 239 N 1.02 0.69 -0.44 0.81 1.63 -1.02 -0.83 116.57 118.44 1gxw h LYS 239 Ca 0.24 -0.19 0.02 0.00 -0.85 0.00 0.00 60.65 59.88 1gxw h LYS 239 Cb 0.17 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.68 1gxw h LYS 239 CO -0.02 0.73 0.24 0.00 -3.45 0.00 0.00 179.45 176.95 1gxw h ALA 240 N 0.93 0.55 -0.75 5.00 0.00 -1.08 -0.46 119.26 123.46 1gxw h ALA 240 Ca 0.13 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1gxw h ALA 240 Cb 0.37 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1gxw h ALA 240 CO 0.01 -0.09 0.30 0.00 0.00 0.00 0.00 179.25 179.47 1gxw h ALA 241 N 1.21 0.97 -0.43 0.00 0.00 -0.99 -0.14 119.26 119.87 1gxw h ALA 241 Ca 0.18 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1gxw h ALA 241 Cb 0.04 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1gxw h ALA 241 CO -0.10 0.60 0.22 -0.92 0.00 0.00 0.00 179.25 179.05 1gxw h TYR 242 N 1.08 0.60 -0.49 0.00 3.20 -0.74 -2.18 116.97 118.43 1gxw h TYR 242 Ca 0.25 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.07 1gxw h TYR 242 Cb 0.21 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 1gxw h TYR 242 CO 0.02 0.47 0.19 -0.07 -1.64 0.00 0.00 178.16 177.13 1gxw h LEU 243 N 0.55 0.68 -0.84 2.82 3.38 -0.65 0.23 115.31 121.48 1gxw h LEU 243 Ca 0.15 -0.17 0.06 0.00 0.09 0.00 0.00 57.88 58.00 1gxw h LEU 243 Cb 0.08 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 40.59 1gxw h LEU 243 CO -0.02 0.66 0.52 0.40 0.09 0.00 0.00 178.44 180.09 1gxw h ILE 244 N 0.65 1.05 0.01 1.22 2.04 -0.84 0.98 117.51 122.61 1gxw h ILE 244 Ca 0.16 -0.33 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 1gxw h ILE 244 Cb 0.20 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.29 1gxw h ILE 244 CO -0.01 0.17 -0.08 -1.28 0.00 0.00 0.00 178.15 176.95 1gxw h SER 245 N 0.95 0.06 0.23 1.72 0.87 -1.13 0.25 113.55 116.51 1gxw h SER 245 Ca 0.36 -0.89 -0.18 0.00 -1.23 0.00 0.00 61.79 59.85 1gxw h SER 245 Cb 0.15 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.06 1gxw h SER 245 CO -0.17 0.94 -1.94 0.00 -0.53 0.00 0.00 176.83 175.13 1gxw n GLN 246 N -4.60 0.66 0.00 2.24 1.13 0.77 -0.57 117.38 117.01 1gxw n GLN 246 Ca -0.10 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.96 1gxw n GLN 246 Cb 0.47 -1.61 0.00 0.00 0.11 0.00 0.00 30.24 29.20 1gxw n GLN 246 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1gxw n GLY 247 N 1.48 -1.09 0.00 1.08 0.00 0.34 -4.16 105.19 102.83 1gxw n GLY 247 Ca -0.16 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.24 1gxw n GLY 247 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gxw n GLY 248 N -1.01 1.93 3.23 -0.02 0.00 -0.02 -4.72 105.19 104.58 1gxw n GLY 248 Ca 0.00 -1.89 -0.34 0.00 0.00 0.00 0.00 46.02 43.78 1gxw n GLY 248 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gxw s THR 249 N -1.42 2.83 -0.14 2.61 2.01 -1.26 -0.10 115.64 120.16 1gxw s THR 249 Ca 0.00 -0.68 0.01 0.00 0.31 0.00 0.00 61.69 61.33 1gxw s THR 249 Cb 0.00 -2.25 0.02 0.00 0.01 0.00 0.00 72.50 70.27 1gxw s THR 249 CO 0.00 0.47 -0.16 -2.28 -0.69 0.00 0.00 174.62 171.96 1gxw s HIS 250 N 1.40 2.23 -1.48 4.92 5.04 0.01 -4.71 115.29 122.70 1gxw s HIS 250 Ca 0.05 -1.21 -0.12 0.00 -1.54 0.00 0.00 55.06 52.25 1gxw s HIS 250 Cb -0.14 -1.61 0.06 0.00 0.04 0.00 0.00 32.58 30.94 1gxw s HIS 250 CO -0.07 -0.63 1.03 0.66 -2.34 0.00 0.00 174.74 173.38 1gxw n TYR 251 N 4.56 -2.46 -0.98 3.88 4.01 -1.26 -1.29 117.16 123.62 1gxw n TYR 251 Ca -0.18 0.92 0.00 0.00 -0.16 0.00 0.00 57.90 58.48 1gxw n TYR 251 Cb 0.50 -4.26 0.00 0.00 -0.31 0.00 0.00 39.34 35.27 1gxw n TYR 251 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gxw n GLY 252 N -1.77 1.03 3.55 2.72 0.00 -1.26 -5.01 105.19 104.45 1gxw n GLY 252 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 1gxw n GLY 252 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gxw s VAL 253 N -3.97 4.63 -0.06 1.61 1.01 -0.41 -5.08 120.40 118.13 1gxw s VAL 253 Ca 0.00 -0.07 -0.16 0.00 0.00 0.00 0.00 61.98 61.74 1gxw s VAL 253 Cb 0.00 -3.13 -0.05 0.00 0.00 0.00 0.00 36.38 33.20 1gxw s VAL 253 CO 0.00 0.39 0.44 -0.44 0.00 0.00 0.00 175.10 175.49 1gxw s SER 254 N 1.04 6.74 -0.07 3.32 0.01 -1.26 -0.80 113.70 122.67 1gxw s SER 254 Ca 0.04 0.88 0.02 0.00 1.31 0.00 0.00 55.95 58.21 1gxw s SER 254 Cb -0.14 -2.27 0.01 0.00 0.21 0.00 0.00 66.02 63.83 1gxw s SER 254 CO 0.03 0.16 -0.14 -0.69 0.41 0.00 0.00 173.24 173.01 1gxw s VAL 255 N -0.21 1.29 -0.26 3.43 1.01 0.85 -4.87 120.40 121.64 1gxw s VAL 255 Ca 0.24 -0.56 -0.21 0.00 0.00 0.00 0.00 61.98 61.45 1gxw s VAL 255 Cb -0.16 -1.16 -0.02 0.00 0.00 0.00 0.00 36.38 35.04 1gxw s VAL 255 CO 0.12 0.39 0.67 -0.69 0.00 0.00 0.00 175.10 175.58 1gxw s VAL 256 N 0.66 4.95 0.51 2.92 1.01 -1.26 -0.84 120.40 128.36 1gxw s VAL 256 Ca -0.14 1.19 -0.21 0.00 0.00 0.00 0.00 61.98 62.81 1gxw s VAL 256 Cb -0.16 -3.97 -0.06 0.00 0.00 0.00 0.00 36.38 32.18 1gxw s VAL 256 CO 0.04 -0.01 1.15 -0.83 0.00 0.00 0.00 175.10 175.45 1gxw s GLY 257 N 1.46 2.70 0.00 4.51 0.00 -1.26 -4.72 107.32 110.01 1gxw s GLY 257 Ca 0.28 0.88 0.03 0.00 0.00 0.00 0.00 44.72 45.90 1gxw s GLY 257 CO 0.09 1.28 0.72 0.29 0.00 0.00 0.00 173.10 175.48 1gxw n ILE 258 N -0.99 0.29 0.00 0.90 -5.35 0.89 -4.83 119.36 110.27 1gxw n ILE 258 Ca 0.10 -0.65 0.00 0.00 -0.27 0.00 0.00 62.75 61.93 1gxw n ILE 258 Cb 0.50 0.89 0.00 0.00 -1.74 0.00 0.00 39.64 39.29 1gxw n ILE 258 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1gxw n GLY 259 N 0.03 1.09 0.33 3.28 0.00 0.27 -4.51 105.19 105.68 1gxw n GLY 259 Ca 0.02 -1.74 -0.06 0.00 0.00 0.00 0.00 46.02 44.24 1gxw n GLY 259 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1gxw h ARG 260 N 0.00 1.13 -0.02 1.61 3.08 -1.93 -2.41 114.38 115.83 1gxw h ARG 260 Ca 0.00 -0.23 0.03 0.00 0.07 0.00 0.00 59.98 59.85 1gxw h ARG 260 Cb 0.00 -0.17 -0.04 0.00 0.08 0.00 0.00 29.97 29.84 1gxw h ARG 260 CO 0.00 0.95 -0.18 -0.44 -1.07 0.00 0.00 179.97 179.23 1gxw h ASP 261 N 1.09 -0.52 0.25 7.04 3.32 -1.98 0.26 116.42 125.88 1gxw h ASP 261 Ca 0.24 0.08 -0.12 0.00 0.02 0.00 0.00 57.03 57.26 1gxw h ASP 261 Cb 0.27 0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 1gxw h ASP 261 CO -0.01 -0.24 -0.45 0.11 -1.72 0.00 0.00 179.24 176.93 1gxw h LYS 262 N -0.28 0.25 -0.33 3.56 1.57 -1.78 -1.88 116.57 117.68 1gxw h LYS 262 Ca 0.06 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1gxw h LYS 262 Cb 0.36 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 1gxw h LYS 262 CO -0.18 0.65 0.21 1.25 -0.57 0.00 0.00 179.45 180.81 1gxw h LEU 263 N 0.21 0.39 -0.37 2.94 5.85 -0.90 0.35 115.31 123.78 1gxw h LEU 263 Ca 0.01 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 1gxw h LEU 263 Cb 0.87 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.79 1gxw h LEU 263 CO 0.07 0.31 0.14 1.23 -0.34 0.00 0.00 178.44 179.85 1gxw h GLY 264 N 0.44 0.60 0.97 3.75 0.00 -0.73 -1.14 103.07 106.97 1gxw h GLY 264 Ca 0.12 -0.34 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 1gxw h GLY 264 CO -0.02 0.32 0.23 0.50 0.00 0.00 0.00 176.54 177.56 1gxw h LYS 265 N 0.45 0.57 -0.32 4.80 1.57 -1.10 0.58 116.57 123.12 1gxw h LYS 265 Ca 0.12 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 1gxw h LYS 265 Cb 0.21 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1gxw h LYS 265 CO -0.01 0.45 0.13 0.82 -0.57 0.00 0.00 179.45 180.27 1gxw h ILE 266 N 0.53 1.18 -0.04 1.86 2.04 -0.82 -1.89 117.51 120.36 1gxw h ILE 266 Ca 0.14 -0.55 -0.15 0.00 1.00 0.00 0.00 64.86 65.30 1gxw h ILE 266 Cb 0.04 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 1gxw h ILE 266 CO -0.02 0.19 -0.66 -0.26 0.00 0.00 0.00 178.15 177.40 1gxw h PHE 267 N 0.37 0.25 -0.50 1.37 -1.00 -1.11 -1.56 116.94 114.76 1gxw h PHE 267 Ca 0.11 -0.10 -0.10 0.00 2.81 0.00 0.00 57.97 60.69 1gxw h PHE 267 Cb 0.18 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 39.68 1gxw h PHE 267 CO -0.01 0.79 -0.06 -0.92 -1.61 0.00 0.00 178.31 176.50 1gxw h TYR 268 N 0.13 1.02 -0.28 -0.55 3.20 -0.82 -0.72 116.97 118.96 1gxw h TYR 268 Ca -0.01 -0.20 -0.03 0.00 3.14 0.00 0.00 58.73 61.63 1gxw h TYR 268 Cb 1.18 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 39.18 1gxw h TYR 268 CO 0.02 0.97 0.05 -0.09 -1.64 0.00 0.00 178.16 177.47 1gxw h ARG 269 N 0.78 0.45 -0.70 1.82 2.43 -1.25 -1.21 114.38 116.71 1gxw h ARG 269 Ca 0.13 -0.12 0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1gxw h ARG 269 Cb 0.60 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 30.06 1gxw h ARG 269 CO 0.04 0.56 0.46 0.00 -1.51 0.00 0.00 179.97 179.52 1gxw h ALA 270 N 0.88 0.89 -0.15 2.80 0.00 -1.19 0.12 119.26 122.60 1gxw h ALA 270 Ca 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1gxw h ALA 270 Cb 0.32 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1gxw h ALA 270 CO 0.00 0.30 0.10 1.25 0.00 0.00 0.00 179.25 180.90 1gxw h LEU 271 N 0.93 0.17 0.00 0.00 5.85 -0.93 0.21 115.31 121.55 1gxw h LEU 271 Ca 0.26 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.97 1gxw h LEU 271 Cb -0.09 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 40.89 1gxw h LEU 271 CO -0.06 0.13 -0.67 0.71 -0.34 0.00 0.00 178.44 178.21 1gxw h THR 272 N 0.20 0.00 0.00 1.05 1.35 -1.07 -3.22 112.91 111.23 1gxw h THR 272 Ca 0.06 -0.90 -0.16 0.00 -0.55 0.00 0.00 66.41 64.85 1gxw h THR 272 Cb -0.02 1.55 -0.03 0.00 -1.73 0.00 0.00 68.15 67.92 1gxw h THR 272 CO -0.01 0.00 -1.62 0.00 -0.25 0.00 0.00 175.52 173.64 1gxw n GLN 273 N -2.67 1.85 -0.00 4.72 1.13 0.39 -4.86 117.38 117.93 1gxw n GLN 273 Ca 0.02 0.02 0.00 0.00 -1.94 0.00 0.00 57.00 55.09 1gxw n GLN 273 Cb 0.52 -1.23 -0.01 0.00 0.11 0.00 0.00 30.24 29.64 1gxw n GLN 273 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1gxw n TYR 274 N -2.48 0.00 -2.58 1.08 4.01 -0.57 -5.04 117.16 111.58 1gxw n TYR 274 Ca -0.16 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.21 1gxw n TYR 274 Cb 0.76 -0.04 -0.04 0.00 -0.31 0.00 0.00 39.34 39.70 1gxw n TYR 274 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1gxw s LEU 275 N -3.61 4.18 0.38 7.72 1.43 -0.04 -4.99 118.68 123.75 1gxw s LEU 275 Ca -0.01 2.02 0.04 0.00 -1.03 0.00 0.00 54.13 55.15 1gxw s LEU 275 Cb 0.01 -4.14 -0.06 0.00 0.03 0.00 0.00 46.19 42.03 1gxw s LEU 275 CO 0.05 -0.42 0.05 0.42 0.23 0.00 0.00 176.35 176.68 1gxw s THR 276 N -1.64 1.31 0.47 5.49 -4.23 -1.26 -4.47 115.64 111.32 1gxw s THR 276 Ca 0.56 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 59.32 1gxw s THR 276 Cb -0.22 -2.70 0.43 0.00 1.34 0.00 0.00 72.50 71.35 1gxw s THR 276 CO 0.27 0.00 1.86 -0.65 -0.54 0.00 0.00 174.62 175.56 1gxw h PRO 277 N 1.87 0.21 -0.15 3.99 0.11 -1.63 -2.57 132.00 133.83 1gxw h PRO 277 Ca -0.41 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.67 1gxw h PRO 277 Cb 1.26 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1gxw h PRO 277 CO 0.71 0.14 -0.02 0.25 -0.21 0.00 0.00 178.00 178.87 1gxw n THR 278 N -4.41 2.14 -1.74 -1.15 -2.24 -1.26 -1.21 114.28 104.40 1gxw n THR 278 Ca 0.20 -2.14 -0.42 0.00 -2.27 0.00 0.00 64.05 59.42 1gxw n THR 278 Cb 0.85 -0.25 -0.00 0.00 -2.10 0.00 0.00 70.33 68.83 1gxw n THR 278 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1gxw n SER 279 N -0.96 3.38 -4.15 3.42 7.64 -0.97 -4.83 113.62 117.16 1gxw n SER 279 Ca 0.20 1.22 -0.19 0.00 1.01 0.00 0.00 58.87 61.11 1gxw n SER 279 Cb 0.79 -1.57 0.01 0.00 -1.01 0.00 0.00 64.21 62.44 1gxw n SER 279 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1gxw n ASN 280 N 0.57 2.16 -0.21 6.43 0.23 -1.26 -3.55 115.26 119.64 1gxw n ASN 280 Ca 0.03 -2.37 -0.04 0.00 -0.53 0.00 0.00 54.58 51.67 1gxw n ASN 280 Cb 0.38 -0.09 0.07 0.00 -2.08 0.00 0.00 39.78 38.05 1gxw n ASN 280 CO 0.00 0.00 0.00 -0.26 -0.93 0.00 0.00 177.26 176.07 1gxw h PHE 281 N 0.51 0.64 -0.73 -2.53 -1.00 -1.95 -0.46 116.94 111.42 1gxw h PHE 281 Ca -0.25 0.02 0.03 0.00 2.81 0.00 0.00 57.97 60.58 1gxw h PHE 281 Cb 0.95 -0.20 -0.05 0.00 3.61 0.00 0.00 35.95 40.26 1gxw h PHE 281 CO 0.00 0.34 0.46 1.03 -1.61 0.00 0.00 178.31 178.53 1gxw h SER 282 N 0.67 0.75 0.42 2.17 0.87 -1.95 -0.91 113.55 115.57 1gxw h SER 282 Ca 0.26 -0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.72 1gxw h SER 282 Cb 0.09 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 1gxw h SER 282 CO -0.14 0.52 -0.44 1.56 -0.53 0.00 0.00 176.83 177.80 1gxw h GLN 283 N 0.89 0.02 -0.61 2.24 4.20 -1.73 -2.25 115.11 117.88 1gxw h GLN 283 Ca 0.29 -0.01 -0.09 0.00 0.06 0.00 0.00 58.65 58.90 1gxw h GLN 283 Cb 0.02 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 1gxw h GLN 283 CO -0.11 0.46 0.03 1.25 -0.67 0.00 0.00 178.83 179.79 1gxw h LEU 284 N 0.02 1.02 -0.21 1.46 5.85 0.06 0.19 115.31 123.70 1gxw h LEU 284 Ca -0.00 -0.27 0.01 0.00 0.84 0.00 0.00 57.88 58.45 1gxw h LEU 284 Cb 0.78 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 1gxw h LEU 284 CO 0.06 1.05 0.12 -0.09 -0.34 0.00 0.00 178.44 179.24 1gxw h ARG 285 N 0.97 0.24 -0.72 1.25 2.43 -0.73 0.26 114.38 118.08 1gxw h ARG 285 Ca 0.18 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.30 1gxw h ARG 285 Cb 0.51 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.98 1gxw h ARG 285 CO 0.02 0.16 0.31 0.00 -1.51 0.00 0.00 179.97 178.95 1gxw h ALA 286 N 1.09 0.93 -0.56 2.80 0.00 -1.07 -0.22 119.26 122.24 1gxw h ALA 286 Ca 0.08 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1gxw h ALA 286 Cb -0.00 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1gxw h ALA 286 CO -0.04 0.54 0.17 0.00 0.00 0.00 0.00 179.25 179.92 1gxw h ALA 287 N 1.15 0.73 -0.43 0.00 0.00 -0.07 -1.06 119.26 119.58 1gxw h ALA 287 Ca 0.24 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1gxw h ALA 287 Cb 0.18 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1gxw h ALA 287 CO -0.02 0.40 0.02 0.00 0.00 0.00 0.00 179.25 179.64 1gxw h ALA 288 N 1.04 0.57 -0.48 0.00 0.00 -0.18 -0.64 119.26 119.57 1gxw h ALA 288 Ca 0.18 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1gxw h ALA 288 Cb 0.29 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1gxw h ALA 288 CO -0.01 0.34 0.18 0.28 0.00 0.00 0.00 179.25 180.05 1gxw h VAL 289 N 0.58 1.21 -0.47 0.00 2.07 -0.90 -1.45 116.25 117.30 1gxw h VAL 289 Ca 0.12 -0.67 -0.07 0.00 0.82 0.00 0.00 66.70 66.90 1gxw h VAL 289 Cb 0.46 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 1gxw h VAL 289 CO 0.02 0.25 0.00 -0.61 0.02 0.00 0.00 177.57 177.25 1gxw h GLN 290 N 0.64 0.78 -0.27 1.57 5.75 -1.09 -0.33 115.11 122.16 1gxw h GLN 290 Ca 0.16 -0.21 -0.04 0.00 -0.15 0.00 0.00 58.65 58.41 1gxw h GLN 290 Cb 0.21 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.66 1gxw h GLN 290 CO -0.01 0.79 -0.00 0.77 -2.65 0.00 0.00 178.83 177.72 1gxw h SER 291 N 0.73 0.48 -0.24 -0.69 0.02 -0.86 -0.41 113.55 112.57 1gxw h SER 291 Ca 0.14 -0.31 -0.07 0.00 -0.84 0.00 0.00 61.79 60.71 1gxw h SER 291 Cb 0.44 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.84 1gxw h SER 291 CO 0.02 0.67 -0.07 0.00 -1.14 0.00 0.00 176.83 176.31 1gxw h ALA 292 N 0.82 1.20 -0.41 3.77 0.00 -1.08 -1.58 119.26 121.98 1gxw h ALA 292 Ca 0.08 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1gxw h ALA 292 Cb 0.43 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1gxw h ALA 292 CO 0.01 0.52 0.13 1.15 0.00 0.00 0.00 179.25 181.06 1gxw h THR 293 N 0.57 1.22 -0.77 0.00 2.02 -0.80 0.29 112.91 115.43 1gxw h THR 293 Ca 0.11 -0.71 0.00 0.00 0.77 0.00 0.00 66.41 66.58 1gxw h THR 293 Cb 0.46 0.91 -0.04 0.00 -1.74 0.00 0.00 68.15 67.74 1gxw h THR 293 CO 0.02 0.25 0.50 0.44 0.37 0.00 0.00 175.52 177.10 1gxw h ASP 294 N 0.52 0.90 0.83 4.18 3.32 -0.66 0.22 116.42 125.74 1gxw h ASP 294 Ca 0.13 -0.04 -0.24 0.00 0.02 0.00 0.00 57.03 56.91 1gxw h ASP 294 Cb 0.26 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 1gxw h ASP 294 CO -0.00 0.67 -1.17 -0.07 -1.72 0.00 0.00 179.24 176.95 1gxw h LEU 295 N 1.05 0.10 -0.54 1.55 3.38 -1.06 -3.41 115.31 116.39 1gxw h LEU 295 Ca 0.28 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1gxw h LEU 295 Cb -0.09 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1gxw h LEU 295 CO -0.06 1.09 0.00 -1.22 0.09 0.00 0.00 178.44 178.35 1gxw n TYR 296 N -3.35 0.00 0.00 1.13 4.01 0.10 -5.09 117.16 113.96 1gxw n TYR 296 Ca -0.05 -0.02 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 1gxw n TYR 296 Cb 0.98 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.00 1gxw n TYR 296 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gxw n GLY 297 N -0.02 0.89 0.32 2.72 0.00 0.06 -4.34 105.19 104.81 1gxw n GLY 297 Ca 0.00 -1.53 0.21 0.00 0.00 0.00 0.00 46.02 44.69 1gxw n GLY 297 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1gxw h SER 298 N 0.00 0.00 -0.42 1.61 4.64 -1.89 -2.10 113.55 115.39 1gxw h SER 298 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1gxw h SER 298 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1gxw h SER 298 CO 0.00 0.01 0.00 0.35 -0.87 0.00 0.00 176.83 176.32 1gxw n THR 299 N -3.14 2.26 -1.79 2.95 -2.24 -1.26 -4.86 114.28 106.20 1gxw n THR 299 Ca -0.02 -1.56 -0.30 0.00 -2.27 0.00 0.00 64.05 59.89 1gxw n THR 299 Cb 0.13 -0.14 0.05 0.00 -2.10 0.00 0.00 70.33 68.27 1gxw n THR 299 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1gxw s SER 300 N -1.35 5.47 0.34 3.42 1.04 -0.79 -4.96 113.70 116.87 1gxw s SER 300 Ca 0.46 1.28 0.14 0.00 0.48 0.00 0.00 55.95 58.31 1gxw s SER 300 Cb 0.34 -2.14 0.61 0.00 0.10 0.00 0.00 66.02 64.93 1gxw s SER 300 CO 0.14 -1.35 1.74 -0.61 0.98 0.00 0.00 173.24 174.14 1gxw h GLN 301 N -0.65 0.00 -0.20 4.02 5.75 -1.90 -2.63 115.11 119.49 1gxw h GLN 301 Ca -0.45 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.04 1gxw h GLN 301 Cb 1.24 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.78 1gxw h GLN 301 CO 0.62 0.46 0.08 0.93 -2.65 0.00 0.00 178.83 178.26 1gxw h GLU 302 N 0.00 0.31 -0.34 1.69 3.07 -1.92 0.39 114.58 117.77 1gxw h GLU 302 Ca -0.00 -0.06 -0.07 0.00 -0.50 0.00 0.00 59.36 58.72 1gxw h GLU 302 Cb 0.86 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.71 1gxw h GLU 302 CO 0.06 0.38 -0.09 0.28 -1.40 0.00 0.00 179.01 178.23 1gxw h VAL 303 N 0.17 1.23 -0.40 3.13 2.07 -1.79 -2.43 116.25 118.24 1gxw h VAL 303 Ca 0.07 -1.02 -0.06 0.00 0.82 0.00 0.00 66.70 66.52 1gxw h VAL 303 Cb 0.19 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1gxw h VAL 303 CO -0.00 0.34 0.03 0.00 0.02 0.00 0.00 177.57 177.96 1gxw h ALA 304 N 1.37 0.53 -0.24 1.67 0.00 -1.09 -2.64 119.26 118.85 1gxw h ALA 304 Ca 0.10 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 1gxw h ALA 304 Cb 0.48 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1gxw h ALA 304 CO 0.03 0.28 -0.24 0.77 0.00 0.00 0.00 179.25 180.09 1gxw h SER 305 N 0.52 0.46 -0.60 0.00 0.02 -0.74 -1.74 113.55 111.46 1gxw h SER 305 Ca 0.12 -0.15 -0.06 0.00 -0.84 0.00 0.00 61.79 60.86 1gxw h SER 305 Cb 0.42 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1gxw h SER 305 CO 0.01 0.70 0.13 0.58 -1.14 0.00 0.00 176.83 177.11 1gxw h VAL 306 N 0.41 1.25 -0.23 2.27 2.07 -1.35 -1.05 116.25 119.62 1gxw h VAL 306 Ca 0.06 -0.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.62 1gxw h VAL 306 Cb 0.64 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 1gxw h VAL 306 CO 0.05 0.35 0.04 0.11 0.02 0.00 0.00 177.57 178.14 1gxw h LYS 307 N 0.89 0.38 -0.45 1.57 1.57 -1.17 -2.33 116.57 117.02 1gxw h LYS 307 Ca 0.19 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1gxw h LYS 307 Cb 0.38 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1gxw h LYS 307 CO 0.01 0.51 0.26 1.96 -0.57 0.00 0.00 179.45 181.62 1gxw h GLN 308 N 0.19 0.62 -0.22 3.15 1.08 -1.25 -0.83 115.11 117.85 1gxw h GLN 308 Ca 0.07 -0.06 0.04 0.00 -1.45 0.00 0.00 58.65 57.24 1gxw h GLN 308 Cb 0.31 -0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 27.58 1gxw h GLN 308 CO 0.00 0.47 -0.00 0.00 -0.95 0.00 0.00 178.83 178.35 1gxw h ALA 309 N 1.12 0.19 -0.01 3.87 0.00 -1.12 0.46 119.26 123.76 1gxw h ALA 309 Ca 0.16 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 1gxw h ALA 309 Cb 0.02 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1gxw h ALA 309 CO -0.03 -0.43 -0.48 0.74 0.00 0.00 0.00 179.25 179.05 1gxw h PHE 310 N 0.07 0.03 -0.47 0.00 0.04 -1.31 -2.40 116.94 112.89 1gxw h PHE 310 Ca 0.10 -0.01 -0.14 0.00 2.80 0.00 0.00 57.97 60.73 1gxw h PHE 310 Cb 0.13 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.26 1gxw h PHE 310 CO -0.19 0.50 -0.24 -0.44 -0.60 0.00 0.00 178.31 177.35 1gxw h ASP 311 N 0.02 1.02 -0.98 2.17 3.32 -0.41 0.42 116.42 121.99 1gxw h ASP 311 Ca -0.00 -0.41 0.07 0.00 0.02 0.00 0.00 57.03 56.71 1gxw h ASP 311 Cb 0.86 -0.28 -0.06 0.00 0.22 0.00 0.00 39.33 40.06 1gxw h ASP 311 CO 0.06 1.20 0.63 0.00 -1.72 0.00 0.00 179.24 179.42 1gxw h ALA 312 N 0.85 1.44 -0.41 3.45 0.00 0.34 0.14 119.26 125.07 1gxw h ALA 312 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1gxw h ALA 312 Cb 0.82 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1gxw h ALA 312 CO 0.07 0.42 0.00 1.33 0.00 0.00 0.00 179.25 181.07 1gxw n VAL 313 N -4.50 1.08 -1.96 0.00 0.24 -0.94 -4.70 118.33 107.54 1gxw n VAL 313 Ca 0.15 -0.71 -0.14 0.00 -2.04 0.00 0.00 64.34 61.59 1gxw n VAL 313 Cb 0.19 0.01 -0.03 0.00 -1.47 0.00 0.00 33.84 32.54 1gxw n VAL 313 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1gxw n GLY 314 N 0.85 0.40 3.39 7.63 0.00 0.04 -0.10 105.19 117.39 1gxw n GLY 314 Ca 0.16 -0.31 -0.43 0.00 0.00 0.00 0.00 46.02 45.44 1gxw n GLY 314 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gxw s VAL 315 N -2.65 5.06 -1.54 1.61 1.01 0.14 -4.60 120.40 119.43 1gxw s VAL 315 Ca 0.00 -1.00 0.12 0.00 0.00 0.00 0.00 61.98 61.10 1gxw s VAL 315 Cb 0.00 -3.97 0.10 0.00 0.00 0.00 0.00 36.38 32.51 1gxw s VAL 315 CO 0.00 -0.48 0.89 0.29 0.00 0.00 0.00 175.10 175.80