#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gu7 s VAL 3 N 0.00 3.93 0.43 2.28 -7.23 -1.26 -5.06 120.40 113.50 3gu7 s VAL 3 Ca 0.00 -1.35 0.07 0.00 -1.81 0.00 0.00 61.98 58.88 3gu7 s VAL 3 Cb 0.00 -3.00 -0.04 0.00 0.56 0.00 0.00 36.38 33.90 3gu7 s VAL 3 CO 0.00 -0.13 0.17 -0.36 -0.31 0.00 0.00 175.10 174.47 3gu7 s PHE 4 N -1.78 2.46 0.13 2.82 0.08 -1.26 -5.08 117.98 115.35 3gu7 s PHE 4 Ca 0.29 -0.65 -0.32 0.00 0.12 0.00 0.00 56.93 56.37 3gu7 s PHE 4 Cb -0.09 -1.91 -0.11 0.00 -0.57 0.00 0.00 43.02 40.33 3gu7 s PHE 4 CO 0.20 0.16 1.80 0.54 -0.10 0.00 0.00 175.22 177.82 3gu7 n ARG 5 N -1.26 2.70 -0.28 0.44 1.74 -1.19 -4.63 116.66 114.18 3gu7 n ARG 5 Ca -0.03 0.98 0.09 0.00 -0.77 0.00 0.00 57.85 58.12 3gu7 n ARG 5 Cb 0.65 -2.85 0.24 0.00 -1.02 0.00 0.00 32.46 29.48 3gu7 n ARG 5 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3gu7 n GLN 6 N 5.23 2.82 -1.91 5.56 6.02 -1.26 -0.35 117.38 133.49 3gu7 n GLN 6 Ca 0.18 -2.36 -0.34 0.00 -0.01 0.00 0.00 57.00 54.46 3gu7 n GLN 6 Cb 0.36 -1.43 0.04 0.00 1.02 0.00 0.00 30.24 30.23 3gu7 n GLN 6 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3gu7 s GLU 7 N -1.02 2.93 0.07 -1.09 2.02 -1.26 -4.89 118.70 115.46 3gu7 s GLU 7 Ca 0.36 1.54 -0.31 0.00 0.02 0.00 0.00 54.97 56.58 3gu7 s GLU 7 Cb 0.19 -1.95 -0.10 0.00 0.10 0.00 0.00 34.13 32.37 3gu7 s GLU 7 CO 0.24 -1.18 1.91 -1.71 0.02 0.00 0.00 175.26 174.54 3gu7 n ASN 8 N -2.01 4.08 0.25 -0.19 2.85 -1.26 -4.78 115.26 114.20 3gu7 n ASN 8 Ca 0.11 0.95 0.08 0.00 -0.11 0.00 0.00 54.58 55.61 3gu7 n ASN 8 Cb 0.51 -1.53 0.62 0.00 1.24 0.00 0.00 39.78 40.62 3gu7 n ASN 8 CO 0.00 0.00 0.00 1.62 -2.11 0.00 0.00 177.26 176.77 3gu7 h VAL 9 N 5.15 0.95 0.00 3.44 3.04 -1.95 -1.27 116.25 125.61 3gu7 h VAL 9 Ca -0.48 -0.37 0.00 0.00 -1.01 0.00 0.00 66.70 64.84 3gu7 h VAL 9 Cb 1.23 1.21 0.00 0.00 -2.01 0.00 0.00 31.29 31.72 3gu7 h VAL 9 CO 0.94 0.10 0.00 0.47 -1.01 0.00 0.00 177.57 178.08 3gu7 n ASP 10 N -4.24 0.45 0.24 3.17 8.00 -1.26 -1.09 116.55 121.82 3gu7 n ASP 10 Ca -0.03 0.64 0.13 0.00 0.71 0.00 0.00 54.79 56.24 3gu7 n ASP 10 Cb 0.18 -0.73 0.42 0.00 -0.02 0.00 0.00 41.12 40.98 3gu7 n ASP 10 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 3gu7 h ASP 11 N 0.00 0.00 0.00 -2.24 3.32 -1.60 -3.37 116.42 112.53 3gu7 h ASP 11 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 3gu7 h ASP 11 Cb 0.22 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 3gu7 h ASP 11 CO 0.00 0.10 -1.14 -1.22 -1.72 0.00 0.00 179.24 175.26 3gu7 n TYR 12 N -3.18 0.00 -4.08 4.55 4.01 -0.25 -4.96 117.16 113.25 3gu7 n TYR 12 Ca 0.02 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.62 3gu7 n TYR 12 Cb 0.44 -0.08 -0.12 0.00 -0.31 0.00 0.00 39.34 39.28 3gu7 n TYR 12 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 3gu7 s TYR 13 N -2.19 0.77 -0.11 -0.72 2.02 -0.44 -0.43 117.35 116.25 3gu7 s TYR 13 Ca -0.01 -0.49 -0.02 0.00 -0.37 0.00 0.00 57.07 56.18 3gu7 s TYR 13 Cb 0.02 -0.45 -0.03 0.00 -0.40 0.00 0.00 41.96 41.10 3gu7 s TYR 13 CO 0.12 -0.06 -0.04 -0.51 -1.57 0.00 0.00 175.55 173.49 3gu7 s ASP 14 N -1.60 4.81 0.20 2.29 1.01 -0.11 -4.38 116.67 118.90 3gu7 s ASP 14 Ca -0.08 -0.04 0.01 0.00 0.71 0.00 0.00 52.55 53.14 3gu7 s ASP 14 Cb -0.10 -1.50 -0.04 0.00 1.01 0.00 0.00 42.92 42.29 3gu7 s ASP 14 CO 0.01 0.28 0.37 0.42 0.21 0.00 0.00 175.17 176.45 3gu7 s THR 15 N -0.29 5.24 0.00 -1.27 -4.23 -1.26 -0.26 115.64 113.57 3gu7 s THR 15 Ca 0.05 -0.56 0.00 0.00 -1.18 0.00 0.00 61.69 60.00 3gu7 s THR 15 Cb -0.13 -3.77 0.00 0.00 1.34 0.00 0.00 72.50 69.95 3gu7 s THR 15 CO 0.02 -0.20 0.00 0.61 -0.54 0.00 0.00 174.62 174.51 3gu7 n GLY 16 N -0.83 4.04 3.77 3.99 0.00 0.90 -4.95 105.19 112.11 3gu7 n GLY 16 Ca -0.06 -0.50 -0.35 0.00 0.00 0.00 0.00 46.02 45.10 3gu7 n GLY 16 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3gu7 s GLU 17 N 4.07 3.16 0.14 1.61 -1.05 -1.26 -4.57 118.70 120.80 3gu7 s GLU 17 Ca 0.00 1.68 -0.30 0.00 -0.15 0.00 0.00 54.97 56.20 3gu7 s GLU 17 Cb 0.00 -1.97 -0.07 0.00 -0.44 0.00 0.00 34.13 31.65 3gu7 s GLU 17 CO 0.00 -1.02 1.08 -2.00 0.95 0.00 0.00 175.26 174.27 3gu7 s GLU 18 N -3.36 4.60 -0.04 -4.83 2.12 -1.26 -0.52 118.70 115.40 3gu7 s GLU 18 Ca 0.74 1.65 0.21 0.00 0.36 0.00 0.00 54.97 57.93 3gu7 s GLU 18 Cb -0.26 -3.32 -0.32 0.00 0.26 0.00 0.00 34.13 30.49 3gu7 s GLU 18 CO 0.30 0.06 0.43 1.28 -0.54 0.00 0.00 175.26 176.80 3gu7 n LEU 19 N 2.73 0.00 0.00 2.70 4.77 0.19 -4.88 117.00 122.51 3gu7 n LEU 19 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 3gu7 n LEU 19 Cb 0.47 0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 3gu7 n LEU 19 CO 0.53 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 3gu7 n GLY 20 N 1.33 0.35 3.11 -0.72 0.00 -1.08 -5.00 105.19 103.18 3gu7 n GLY 20 Ca -0.06 -1.14 -0.08 0.00 0.00 0.00 0.00 46.02 44.74 3gu7 n GLY 20 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gu7 s SER 21 N 0.00 0.53 0.00 1.61 0.01 -1.26 -0.51 113.70 114.08 3gu7 s SER 21 Ca 0.00 -1.04 0.00 0.00 1.31 0.00 0.00 55.95 56.22 3gu7 s SER 21 Cb 0.00 0.21 0.00 0.00 0.21 0.00 0.00 66.02 66.44 3gu7 s SER 21 CO 0.00 -0.61 0.00 0.61 0.41 0.00 0.00 173.24 173.65 3gu7 n GLY 22 N 0.05 3.52 3.58 3.44 0.00 0.38 -4.97 105.19 111.20 3gu7 n GLY 22 Ca -0.12 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 44.91 3gu7 n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gu7 s VAL 23 N -1.14 3.30 -1.55 1.61 1.01 -1.26 -3.01 120.40 119.36 3gu7 s VAL 23 Ca 0.00 0.27 -0.07 0.00 0.00 0.00 0.00 61.98 62.19 3gu7 s VAL 23 Cb 0.00 -3.51 0.06 0.00 0.00 0.00 0.00 36.38 32.93 3gu7 s VAL 23 CO 0.00 -0.39 0.45 0.49 0.00 0.00 0.00 175.10 175.65 3gu7 n PHE 24 N 11.87 -1.57 -3.69 5.22 3.72 -1.26 -4.89 117.46 126.85 3gu7 n PHE 24 Ca 0.25 0.73 -0.14 0.00 -0.05 0.00 0.00 57.45 58.24 3gu7 n PHE 24 Cb 0.49 -3.23 -0.08 0.00 -0.94 0.00 0.00 39.48 35.72 3gu7 n PHE 24 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3gu7 s ALA 25 N -3.81 -1.17 -0.01 4.37 0.00 -1.16 -1.55 121.76 118.42 3gu7 s ALA 25 Ca 0.26 0.96 0.03 0.00 0.00 0.00 0.00 51.96 53.21 3gu7 s ALA 25 Cb -0.15 -0.28 -0.00 0.00 0.00 0.00 0.00 23.12 22.69 3gu7 s ALA 25 CO 0.93 -0.27 -0.09 0.54 0.00 0.00 0.00 175.76 176.87 3gu7 s VAL 26 N -0.67 0.74 -0.13 0.00 0.11 -0.89 -0.47 120.40 119.09 3gu7 s VAL 26 Ca -0.08 -0.38 0.02 0.00 -2.93 0.00 0.00 61.98 58.62 3gu7 s VAL 26 Cb -0.03 -0.64 0.00 0.00 -1.53 0.00 0.00 36.38 34.18 3gu7 s VAL 26 CO 0.04 0.22 -0.21 -0.69 -3.33 0.00 0.00 175.10 171.13 3gu7 s VAL 27 N -0.06 2.25 -0.01 2.04 1.01 0.34 -0.53 120.40 125.43 3gu7 s VAL 27 Ca 0.01 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.11 3gu7 s VAL 27 Cb -0.05 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.41 3gu7 s VAL 27 CO -0.00 0.54 -0.15 -0.54 0.00 0.00 0.00 175.10 174.95 3gu7 s LYS 28 N 0.64 1.27 0.47 2.72 1.02 -0.15 0.55 119.74 126.27 3gu7 s LYS 28 Ca -0.10 -0.54 -0.24 0.00 0.02 0.00 0.00 55.97 55.11 3gu7 s LYS 28 Cb -0.16 -1.21 -0.07 0.00 -0.52 0.00 0.00 37.83 35.86 3gu7 s LYS 28 CO 0.02 0.31 1.30 0.21 -0.92 0.00 0.00 175.35 176.28 3gu7 s LYS 29 N -0.30 3.59 0.17 1.68 2.20 0.32 0.08 119.74 127.48 3gu7 s LYS 29 Ca 0.05 2.12 -0.10 0.00 -0.36 0.00 0.00 55.97 57.68 3gu7 s LYS 29 Cb -0.06 -2.48 -0.00 0.00 -1.51 0.00 0.00 37.83 33.77 3gu7 s LYS 29 CO -0.00 -0.79 0.32 0.00 -0.36 0.00 0.00 175.35 174.51 3gu7 s ARG 31 N -3.95 1.01 0.03 0.00 3.52 0.64 -1.11 118.95 119.10 3gu7 s ARG 31 Ca 0.15 -0.08 -0.30 0.00 -0.13 0.00 0.00 55.73 55.37 3gu7 s ARG 31 Cb 0.03 -1.16 -0.05 0.00 -1.56 0.00 0.00 34.95 32.20 3gu7 s ARG 31 CO -0.01 -0.22 1.21 -2.00 -0.81 0.00 0.00 175.30 173.47 3gu7 s GLU 32 N 1.58 4.41 0.26 5.12 2.12 -0.05 -0.93 118.70 131.21 3gu7 s GLU 32 Ca 0.00 1.76 -0.02 0.00 0.36 0.00 0.00 54.97 57.07 3gu7 s GLU 32 Cb -0.13 -3.41 0.34 0.00 0.26 0.00 0.00 34.13 31.20 3gu7 s GLU 32 CO -0.04 -0.32 1.79 0.87 -0.54 0.00 0.00 175.26 177.02 3gu7 h LYS 33 N 7.00 0.84 0.00 4.30 1.57 -1.08 0.07 116.57 129.27 3gu7 h LYS 33 Ca -0.40 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.18 3gu7 h LYS 33 Cb 1.20 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.40 3gu7 h LYS 33 CO 0.83 0.79 0.00 0.66 -0.57 0.00 0.00 179.45 181.16 3gu7 h SER 34 N 0.80 0.00 0.00 0.86 4.64 -1.92 -3.36 113.55 114.56 3gu7 h SER 34 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 3gu7 h SER 34 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 3gu7 h SER 34 CO 0.01 0.00 -0.45 0.35 -0.87 0.00 0.00 176.83 175.87 3gu7 n THR 35 N -2.84 0.00 -0.90 2.95 -2.24 -1.18 -5.01 114.28 105.06 3gu7 n THR 35 Ca 0.04 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 3gu7 n THR 35 Cb 0.46 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 69.25 3gu7 n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gu7 n GLY 36 N 1.35 0.41 3.78 3.38 0.00 0.01 -5.01 105.19 109.11 3gu7 n GLY 36 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3gu7 n GLY 36 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gu7 s LEU 37 N 0.00 4.27 -0.05 0.99 1.43 -1.25 -4.73 118.68 119.33 3gu7 s LEU 37 Ca 0.00 1.93 -0.06 0.00 -1.03 0.00 0.00 54.13 54.97 3gu7 s LEU 37 Cb 0.00 -4.07 -0.04 0.00 0.03 0.00 0.00 46.19 42.11 3gu7 s LEU 37 CO 0.00 -0.23 0.19 -1.10 0.23 0.00 0.00 176.35 175.44 3gu7 s GLN 38 N -2.22 3.48 0.23 1.70 -0.21 -1.26 -0.87 119.66 120.51 3gu7 s GLN 38 Ca 0.53 -0.17 0.01 0.00 0.02 0.00 0.00 55.36 55.74 3gu7 s GLN 38 Cb -0.20 -3.14 -0.04 0.00 1.00 0.00 0.00 33.01 30.63 3gu7 s GLN 38 CO 0.26 0.72 0.15 0.71 -2.12 0.00 0.00 175.29 175.00 3gu7 s TYR 39 N -1.19 1.31 -0.22 0.91 2.02 -0.27 -4.36 117.35 115.56 3gu7 s TYR 39 Ca 0.22 -1.40 -0.05 0.00 -0.37 0.00 0.00 57.07 55.47 3gu7 s TYR 39 Cb -0.13 -0.64 -0.02 0.00 -0.40 0.00 0.00 41.96 40.78 3gu7 s TYR 39 CO 0.12 -0.63 -0.01 0.00 -1.57 0.00 0.00 175.55 173.45 3gu7 s ALA 40 N -3.98 2.92 -0.29 3.71 0.00 0.56 -1.15 121.76 123.54 3gu7 s ALA 40 Ca 0.39 -1.13 -0.14 0.00 0.00 0.00 0.00 51.96 51.08 3gu7 s ALA 40 Cb 0.06 -1.79 -0.03 0.00 0.00 0.00 0.00 23.12 21.36 3gu7 s ALA 40 CO 0.15 -0.39 0.34 0.00 0.00 0.00 0.00 175.76 175.86 3gu7 s ALA 41 N 1.42 3.54 -0.36 0.00 0.00 0.11 0.12 121.76 126.60 3gu7 s ALA 41 Ca 0.05 -0.97 -0.12 0.00 0.00 0.00 0.00 51.96 50.92 3gu7 s ALA 41 Cb -0.14 -2.71 0.01 0.00 0.00 0.00 0.00 23.12 20.27 3gu7 s ALA 41 CO -0.01 -0.76 0.23 0.21 0.00 0.00 0.00 175.76 175.43 3gu7 s LYS 42 N 2.01 3.12 -0.40 0.00 2.20 0.33 -0.97 119.74 126.03 3gu7 s LYS 42 Ca 0.13 -0.89 -0.19 0.00 -0.36 0.00 0.00 55.97 54.66 3gu7 s LYS 42 Cb -0.16 -3.78 0.01 0.00 -1.51 0.00 0.00 37.83 32.39 3gu7 s LYS 42 CO 0.11 -0.60 0.57 -0.06 -0.36 0.00 0.00 175.35 175.01 3gu7 s PHE 43 N 1.64 3.12 -0.23 4.03 0.40 0.31 -1.27 117.98 125.98 3gu7 s PHE 43 Ca 0.04 -0.02 -0.07 0.00 -0.60 0.00 0.00 56.93 56.28 3gu7 s PHE 43 Cb -0.18 -3.12 -0.03 0.00 0.51 0.00 0.00 43.02 40.19 3gu7 s PHE 43 CO 0.08 -0.72 0.07 0.42 0.70 0.00 0.00 175.22 175.77 3gu7 s ILE 44 N 2.56 4.43 0.05 0.64 1.01 0.11 -2.09 121.20 127.90 3gu7 s ILE 44 Ca 0.20 -0.14 -0.31 0.00 0.00 0.00 0.00 60.65 60.40 3gu7 s ILE 44 Cb -0.15 -3.05 -0.07 0.00 0.01 0.00 0.00 42.46 39.20 3gu7 s ILE 44 CO 0.16 0.37 1.41 -0.75 0.00 0.00 0.00 174.94 176.12 3gu7 s LYS 45 N 1.31 4.30 0.47 2.79 2.47 -0.60 -0.52 119.74 129.96 3gu7 s LYS 45 Ca 0.05 2.03 -0.17 0.00 -1.56 0.00 0.00 55.97 56.32 3gu7 s LYS 45 Cb -0.15 -3.45 -0.09 0.00 -1.46 0.00 0.00 37.83 32.69 3gu7 s LYS 45 CO 0.04 -0.52 0.94 0.15 0.16 0.00 0.00 175.35 176.11 3gu7 s LYS 46 N 1.88 4.01 0.22 4.03 1.02 0.16 -0.80 119.74 130.27 3gu7 s LYS 46 Ca 0.65 0.93 -0.30 0.00 0.02 0.00 0.00 55.97 57.27 3gu7 s LYS 46 Cb -0.34 -2.19 -0.09 0.00 -0.52 0.00 0.00 37.83 34.68 3gu7 s LYS 46 CO 0.28 -0.16 1.39 1.03 -0.92 0.00 0.00 175.35 176.98 3gu7 s ARG 47 N -3.75 4.32 0.29 1.68 0.52 -1.09 -4.50 118.95 116.42 3gu7 s ARG 47 Ca 0.59 2.19 0.23 0.00 -0.52 0.00 0.00 55.73 58.22 3gu7 s ARG 47 Cb -0.10 -3.15 0.15 0.00 0.52 0.00 0.00 34.95 32.37 3gu7 s ARG 47 CO 0.26 -0.36 1.28 0.00 0.02 0.00 0.00 175.30 176.50 3gu7 h ARG 48 N 5.27 0.00 -3.60 3.54 2.47 -1.95 -3.47 114.38 116.64 3gu7 h ARG 48 Ca -0.45 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.19 3gu7 h ARG 48 Cb 1.22 0.00 -0.14 0.00 -1.65 0.00 0.00 29.97 29.39 3gu7 h ARG 48 CO 0.78 0.00 -0.28 0.95 0.56 0.00 0.00 179.97 181.98 3gu7 s THR 49 N -3.30 0.11 0.13 2.04 -4.23 -1.26 -5.05 115.64 104.09 3gu7 s THR 49 Ca 0.03 -0.93 -0.31 0.00 -1.18 0.00 0.00 61.69 59.30 3gu7 s THR 49 Cb 0.08 -1.20 -0.08 0.00 1.34 0.00 0.00 72.50 72.65 3gu7 s THR 49 CO 0.74 -0.51 1.56 0.11 -0.54 0.00 0.00 174.62 175.98 3gu7 h LYS 50 N 2.80 -0.44 0.00 3.99 1.79 -2.01 -2.60 116.57 120.09 3gu7 h LYS 50 Ca -0.33 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.17 3gu7 h LYS 50 Cb 1.21 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.96 3gu7 h LYS 50 CO 0.52 -0.29 0.00 -1.13 -1.08 0.00 0.00 179.45 177.46 3gu7 n SER 51 N -5.42 0.00 -4.73 0.86 3.41 -1.26 -4.91 113.62 101.57 3gu7 n SER 51 Ca -0.04 0.21 -0.36 0.00 -0.26 0.00 0.00 58.87 58.43 3gu7 n SER 51 Cb 0.36 -0.39 0.07 0.00 -0.26 0.00 0.00 64.21 64.00 3gu7 n SER 51 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3gu7 s SER 52 N -2.77 4.57 -0.15 4.04 0.15 -0.98 -4.97 113.70 113.59 3gu7 s SER 52 Ca 0.16 2.46 0.14 0.00 0.70 0.00 0.00 55.95 59.41 3gu7 s SER 52 Cb 0.15 -2.60 -0.24 0.00 -1.71 0.00 0.00 66.02 61.62 3gu7 s SER 52 CO 0.37 -2.02 0.26 -2.11 1.20 0.00 0.00 173.24 170.94 3gu7 n ARG 53 N -2.16 0.67 -2.41 5.44 0.00 -1.26 -4.93 116.66 112.00 3gu7 n ARG 53 Ca 0.14 0.12 -0.40 0.00 -0.00 0.00 0.00 57.85 57.71 3gu7 n ARG 53 Cb 0.49 -1.62 -0.04 0.00 -0.00 0.00 0.00 32.46 31.30 3gu7 n ARG 53 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 3gu7 s ARG 54 N -2.53 4.50 0.00 2.89 3.00 -1.26 -4.85 118.95 120.69 3gu7 s ARG 54 Ca -0.11 1.84 0.00 0.00 0.00 0.00 0.00 55.73 57.46 3gu7 s ARG 54 Cb 0.07 -3.06 0.00 0.00 0.00 0.00 0.00 34.95 31.96 3gu7 s ARG 54 CO 0.81 0.07 0.00 0.41 0.00 0.00 0.00 175.30 176.59 3gu7 n GLY 55 N 1.00 -0.69 3.48 -3.53 0.00 -1.26 -4.34 105.19 99.86 3gu7 n GLY 55 Ca 0.00 -1.72 -0.33 0.00 0.00 0.00 0.00 46.02 43.97 3gu7 n GLY 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gu7 s VAL 56 N -1.56 3.47 0.64 1.61 1.01 0.02 -4.66 120.40 120.93 3gu7 s VAL 56 Ca 0.00 -0.54 -0.17 0.00 0.00 0.00 0.00 61.98 61.27 3gu7 s VAL 56 Cb 0.00 -2.45 -0.01 0.00 0.00 0.00 0.00 36.38 33.92 3gu7 s VAL 56 CO 0.00 0.55 1.21 -0.94 0.00 0.00 0.00 175.10 175.92 3gu7 s SER 57 N -0.16 4.81 0.31 3.32 1.04 -1.26 -2.67 113.70 119.08 3gu7 s SER 57 Ca 0.01 2.39 -0.01 0.00 0.48 0.00 0.00 55.95 58.82 3gu7 s SER 57 Cb -0.13 -2.60 0.49 0.00 0.10 0.00 0.00 66.02 63.88 3gu7 s SER 57 CO 0.03 -1.85 1.95 -0.09 0.98 0.00 0.00 173.24 174.26 3gu7 h ARG 58 N 0.44 0.98 -0.39 4.02 2.43 -1.98 -1.63 114.38 118.24 3gu7 h ARG 58 Ca -0.49 -0.08 0.07 0.00 -0.81 0.00 0.00 59.98 58.66 3gu7 h ARG 58 Cb 1.30 -0.21 -0.06 0.00 -0.42 0.00 0.00 29.97 30.58 3gu7 h ARG 58 CO 0.53 0.68 0.03 1.49 -1.51 0.00 0.00 179.97 181.19 3gu7 h GLU 59 N 0.99 0.14 -0.48 0.20 4.81 -1.99 0.23 114.58 118.49 3gu7 h GLU 59 Ca 0.26 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.40 3gu7 h GLU 59 Cb -0.05 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 3gu7 h GLU 59 CO -0.05 0.09 -0.02 -0.44 -0.73 0.00 0.00 179.01 177.86 3gu7 h ASP 60 N 0.14 0.78 -0.25 1.04 3.32 -1.75 -1.60 116.42 118.09 3gu7 h ASP 60 Ca 0.19 -0.20 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 3gu7 h ASP 60 Cb 0.25 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 3gu7 h ASP 60 CO -0.29 0.86 -0.09 0.40 -1.72 0.00 0.00 179.24 178.40 3gu7 h ILE 61 N 0.75 1.29 -0.85 0.35 2.04 -0.89 -2.24 117.51 117.95 3gu7 h ILE 61 Ca 0.14 -1.14 0.00 0.00 1.00 0.00 0.00 64.86 64.86 3gu7 h ILE 61 Cb 0.49 1.51 -0.04 0.00 -0.74 0.00 0.00 36.82 38.04 3gu7 h ILE 61 CO 0.02 0.36 0.54 -0.33 0.00 0.00 0.00 178.15 178.74 3gu7 h GLU 62 N 0.24 1.14 -0.14 2.37 5.08 -0.80 -0.84 114.58 121.62 3gu7 h GLU 62 Ca 0.06 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 3gu7 h GLU 62 Cb 0.58 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 3gu7 h GLU 62 CO 0.03 0.77 0.06 -0.09 -1.00 0.00 0.00 179.01 178.79 3gu7 h ARG 63 N 1.16 0.21 -0.45 2.33 2.43 -1.23 0.22 114.38 119.06 3gu7 h ARG 63 Ca 0.31 -0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.47 3gu7 h ARG 63 Cb -0.09 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 3gu7 h ARG 63 CO -0.06 0.27 0.25 1.49 -1.51 0.00 0.00 179.97 180.41 3gu7 h GLU 64 N 0.09 0.48 -0.49 0.20 4.81 -1.00 -1.75 114.58 116.92 3gu7 h GLU 64 Ca 0.05 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.21 3gu7 h GLU 64 Cb 0.14 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 3gu7 h GLU 64 CO -0.01 0.32 0.15 0.28 -0.73 0.00 0.00 179.01 179.03 3gu7 h VAL 65 N 0.49 1.23 -0.63 0.32 2.07 -1.07 -0.82 116.25 117.84 3gu7 h VAL 65 Ca 0.19 -0.75 -0.03 0.00 0.82 0.00 0.00 66.70 66.93 3gu7 h VAL 65 Cb 0.05 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 3gu7 h VAL 65 CO -0.11 0.27 0.27 -1.28 0.02 0.00 0.00 177.57 176.75 3gu7 h SER 66 N 0.65 0.82 0.06 0.57 0.87 -0.73 0.71 113.55 116.50 3gu7 h SER 66 Ca 0.16 -0.10 -0.00 0.00 -1.23 0.00 0.00 61.79 60.62 3gu7 h SER 66 Cb 0.27 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.02 3gu7 h SER 66 CO -0.01 0.72 -0.03 0.40 -0.53 0.00 0.00 176.83 177.38 3gu7 h ILE 67 N 0.89 1.22 -0.97 2.23 2.04 -1.26 -3.23 117.51 118.44 3gu7 h ILE 67 Ca 0.22 -1.04 0.12 0.00 1.00 0.00 0.00 64.86 65.15 3gu7 h ILE 67 Cb 0.14 1.89 -0.08 0.00 -0.74 0.00 0.00 36.82 38.03 3gu7 h ILE 67 CO -0.02 0.26 0.62 -0.07 0.00 0.00 0.00 178.15 178.93 3gu7 h LEU 68 N -0.56 0.87 -2.15 1.44 3.38 -0.87 -0.87 115.31 116.54 3gu7 h LEU 68 Ca -0.01 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3gu7 h LEU 68 Cb 0.48 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 3gu7 h LEU 68 CO 0.01 0.46 -0.07 0.11 0.09 0.00 0.00 178.44 179.05 3gu7 h LYS 69 N 0.93 0.00 0.00 1.13 1.57 -0.90 -2.62 116.57 116.68 3gu7 h LYS 69 Ca 0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 3gu7 h LYS 69 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3gu7 h LYS 69 CO -0.24 0.07 -0.17 0.93 -0.57 0.00 0.00 179.45 179.47 3gu7 h GLU 70 N 0.00 0.00 -6.33 3.15 5.08 -1.17 -3.47 114.58 111.84 3gu7 h GLU 70 Ca -0.00 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.82 3gu7 h GLU 70 Cb 0.24 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 3gu7 h GLU 70 CO 0.01 0.00 0.21 0.42 -1.00 0.00 0.00 179.01 178.65 3gu7 s ILE 71 N -3.20 4.73 -0.28 3.13 1.01 -0.99 -5.03 121.20 120.57 3gu7 s ILE 71 Ca 0.07 1.73 0.01 0.00 0.00 0.00 0.00 60.65 62.46 3gu7 s ILE 71 Cb 0.08 -4.16 0.16 0.00 0.01 0.00 0.00 42.46 38.55 3gu7 s ILE 71 CO 0.67 0.33 0.45 -1.58 0.00 0.00 0.00 174.94 174.81 3gu7 s GLN 72 N 0.13 0.44 -0.22 2.79 2.00 -1.26 -4.74 119.66 118.80 3gu7 s GLN 72 Ca 0.41 0.36 -0.27 0.00 -2.00 0.00 0.00 55.36 53.86 3gu7 s GLN 72 Cb -0.21 -0.18 0.08 0.00 0.80 0.00 0.00 33.01 33.50 3gu7 s GLN 72 CO 0.24 -0.91 0.74 -1.58 -0.50 0.00 0.00 175.29 173.28 3gu7 s HIS 73 N 2.61 -0.72 0.56 1.67 2.46 -1.26 -5.05 115.29 115.56 3gu7 s HIS 73 Ca 0.11 1.64 0.26 0.00 0.47 0.00 0.00 55.06 57.55 3gu7 s HIS 73 Cb -0.13 0.32 1.51 0.00 -0.13 0.00 0.00 32.58 34.15 3gu7 s HIS 73 CO -0.26 -0.42 2.07 -1.35 -2.47 0.00 0.00 174.74 172.31 3gu7 h PRO 74 N 4.40 0.00 -0.71 2.88 0.11 -2.00 -2.57 132.00 134.12 3gu7 h PRO 74 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3gu7 h PRO 74 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3gu7 h PRO 74 CO 0.14 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.02 3gu7 n ASN 75 N -4.08 3.89 -3.97 -2.05 4.13 -1.26 -4.75 115.26 107.17 3gu7 n ASN 75 Ca 0.04 -2.03 -0.16 0.00 1.68 0.00 0.00 54.58 54.10 3gu7 n ASN 75 Cb 0.38 -0.49 -0.14 0.00 -1.54 0.00 0.00 39.78 37.99 3gu7 n ASN 75 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3gu7 s VAL 76 N -1.10 0.47 0.72 2.41 1.01 -0.97 -0.28 120.40 122.67 3gu7 s VAL 76 Ca 0.48 -0.25 -0.16 0.00 0.00 0.00 0.00 61.98 62.05 3gu7 s VAL 76 Cb 0.25 -0.40 0.03 0.00 0.00 0.00 0.00 36.38 36.26 3gu7 s VAL 76 CO 0.32 0.14 1.17 0.00 0.00 0.00 0.00 175.10 176.73 3gu7 n ILE 77 N 2.95 3.39 -4.43 2.22 0.13 -0.91 -4.40 119.36 118.32 3gu7 n ILE 77 Ca -0.13 -0.37 -0.24 0.00 -1.10 0.00 0.00 62.75 60.91 3gu7 n ILE 77 Cb 0.58 -1.28 -0.09 0.00 -0.84 0.00 0.00 39.64 38.00 3gu7 n ILE 77 CO 0.00 0.00 0.00 0.42 2.80 0.00 0.00 176.55 179.77 3gu7 s THR 78 N -1.75 2.67 -0.18 9.51 -4.23 -1.26 -4.85 115.64 115.55 3gu7 s THR 78 Ca 0.77 -2.22 -0.05 0.00 -1.18 0.00 0.00 61.69 59.01 3gu7 s THR 78 Cb -0.34 -2.52 -0.03 0.00 1.34 0.00 0.00 72.50 70.94 3gu7 s THR 78 CO 0.46 -0.34 0.00 -0.22 -0.54 0.00 0.00 174.62 173.99 3gu7 s LEU 79 N -3.58 3.38 -0.19 4.79 2.96 -1.26 -1.34 118.68 123.43 3gu7 s LEU 79 Ca 0.31 -0.12 -0.17 0.00 -0.22 0.00 0.00 54.13 53.93 3gu7 s LEU 79 Cb -0.04 -1.84 -0.14 0.00 0.50 0.00 0.00 46.19 44.67 3gu7 s LEU 79 CO 0.17 0.12 0.05 1.57 -1.32 0.00 0.00 176.35 176.94 3gu7 n HIS 80 N 3.86 0.92 -3.74 5.38 -0.00 0.14 -4.97 115.22 116.81 3gu7 n HIS 80 Ca -0.17 0.40 -0.10 0.00 -0.00 0.00 0.00 57.72 57.85 3gu7 n HIS 80 Cb 0.52 -0.99 -0.05 0.00 -0.00 0.00 0.00 29.99 29.48 3gu7 n HIS 80 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 3gu7 s GLU 81 N -2.35 1.22 -0.03 1.57 2.02 -1.14 -5.01 118.70 114.99 3gu7 s GLU 81 Ca -0.25 -0.86 0.04 0.00 0.02 0.00 0.00 54.97 53.92 3gu7 s GLU 81 Cb 0.05 0.48 -0.01 0.00 0.10 0.00 0.00 34.13 34.75 3gu7 s GLU 81 CO 0.47 -0.49 -0.15 0.08 0.02 0.00 0.00 175.26 175.20 3gu7 s VAL 82 N -3.86 1.20 0.26 2.63 1.01 -1.26 -0.56 120.40 119.82 3gu7 s VAL 82 Ca 0.08 -0.62 0.09 0.00 0.00 0.00 0.00 61.98 61.53 3gu7 s VAL 82 Cb 0.01 -1.03 -0.05 0.00 0.00 0.00 0.00 36.38 35.31 3gu7 s VAL 82 CO -0.06 0.35 -0.13 -0.31 0.00 0.00 0.00 175.10 174.95 3gu7 s TYR 83 N -0.08 1.99 0.07 5.22 1.51 0.31 -3.18 117.35 123.18 3gu7 s TYR 83 Ca 0.00 -0.53 -0.17 0.00 -1.01 0.00 0.00 57.07 55.36 3gu7 s TYR 83 Cb -0.09 -0.98 0.03 0.00 -0.11 0.00 0.00 41.96 40.82 3gu7 s TYR 83 CO 0.01 0.46 0.39 -1.83 -1.11 0.00 0.00 175.55 173.47 3gu7 s GLU 84 N -3.63 0.95 0.07 -0.62 -1.05 0.52 0.21 118.70 115.15 3gu7 s GLU 84 Ca 0.27 -0.48 0.01 0.00 -0.15 0.00 0.00 54.97 54.62 3gu7 s GLU 84 Cb -0.01 0.42 -0.00 0.00 -0.44 0.00 0.00 34.13 34.10 3gu7 s GLU 84 CO 0.11 -0.34 0.07 0.27 0.95 0.00 0.00 175.26 176.32 3gu7 n ASN 85 N 0.30 -0.18 0.27 0.83 0.23 -0.60 -4.28 115.26 111.82 3gu7 n ASN 85 Ca -0.18 -1.42 0.13 0.00 -0.53 0.00 0.00 54.58 52.58 3gu7 n ASN 85 Cb 0.61 0.39 0.77 0.00 -2.08 0.00 0.00 39.78 39.47 3gu7 n ASN 85 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 3gu7 h LYS 86 N 0.00 0.00 0.05 -3.83 1.79 -2.02 -3.22 116.57 109.35 3gu7 h LYS 86 Ca -0.05 0.00 -0.38 0.00 -2.18 0.00 0.00 60.65 58.04 3gu7 h LYS 86 Cb 0.24 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.84 3gu7 h LYS 86 CO 0.07 0.09 -2.25 2.41 -1.08 0.00 0.00 179.45 178.69 3gu7 n THR 87 N -3.75 1.62 -4.13 -0.16 -1.04 -1.26 -4.84 114.28 100.71 3gu7 n THR 87 Ca -0.02 -0.62 -0.12 0.00 -2.04 0.00 0.00 64.05 61.25 3gu7 n THR 87 Cb 0.19 -1.51 -0.11 0.00 -1.82 0.00 0.00 70.33 67.08 3gu7 n THR 87 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 3gu7 s ASP 88 N -6.69 1.07 -0.12 8.00 1.01 -1.22 -0.66 116.67 118.05 3gu7 s ASP 88 Ca -0.28 -0.83 -0.07 0.00 0.71 0.00 0.00 52.55 52.09 3gu7 s ASP 88 Cb 0.08 0.07 -0.04 0.00 1.01 0.00 0.00 42.92 44.04 3gu7 s ASP 88 CO 0.69 -0.36 0.12 -0.69 0.21 0.00 0.00 175.17 175.14 3gu7 s VAL 89 N -2.73 5.35 -0.24 -1.27 1.01 0.32 -1.56 120.40 121.28 3gu7 s VAL 89 Ca 0.04 0.15 0.02 0.00 0.00 0.00 0.00 61.98 62.19 3gu7 s VAL 89 Cb -0.01 -3.33 0.05 0.00 0.00 0.00 0.00 36.38 33.09 3gu7 s VAL 89 CO -0.03 0.61 -0.12 -0.63 0.00 0.00 0.00 175.10 174.93 3gu7 s ILE 90 N -0.93 2.04 -0.19 2.22 1.09 0.13 0.05 121.20 125.62 3gu7 s ILE 90 Ca 0.14 -1.42 -0.15 0.00 -1.10 0.00 0.00 60.65 58.13 3gu7 s ILE 90 Cb -0.12 -2.11 -0.04 0.00 -1.06 0.00 0.00 42.46 39.13 3gu7 s ILE 90 CO 0.03 0.08 0.33 -0.76 -0.10 0.00 0.00 174.94 174.53 3gu7 s LEU 91 N 1.19 4.18 -0.45 2.97 1.43 -0.40 -0.53 118.68 127.06 3gu7 s LEU 91 Ca -0.06 0.46 -0.18 0.00 -1.03 0.00 0.00 54.13 53.33 3gu7 s LEU 91 Cb -0.18 -2.42 0.04 0.00 0.03 0.00 0.00 46.19 43.66 3gu7 s LEU 91 CO -0.07 -0.00 0.50 -0.63 0.23 0.00 0.00 176.35 176.38 3gu7 s ILE 92 N 1.02 5.02 0.20 -0.59 -1.09 0.28 -0.52 121.20 125.52 3gu7 s ILE 92 Ca 0.17 -0.45 0.06 0.00 -2.23 0.00 0.00 60.65 58.20 3gu7 s ILE 92 Cb -0.14 -4.14 -0.04 0.00 -1.58 0.00 0.00 42.46 36.56 3gu7 s ILE 92 CO 0.06 -0.57 0.16 -0.76 -1.23 0.00 0.00 174.94 172.60 3gu7 s LEU 93 N 2.27 3.80 0.14 2.97 1.43 0.12 0.23 118.68 129.64 3gu7 s LEU 93 Ca 0.13 -0.18 -0.34 0.00 -1.03 0.00 0.00 54.13 52.71 3gu7 s LEU 93 Cb -0.18 -2.39 -0.14 0.00 0.03 0.00 0.00 46.19 43.51 3gu7 s LEU 93 CO 0.13 0.03 1.57 1.21 0.23 0.00 0.00 176.35 179.51 3gu7 n GLU 94 N -0.66 2.05 -2.52 1.70 2.13 -0.45 -0.32 120.64 122.57 3gu7 n GLU 94 Ca -0.08 0.74 -0.42 0.00 0.66 0.00 0.00 57.16 58.06 3gu7 n GLU 94 Cb 0.56 -2.50 -0.03 0.00 0.27 0.00 0.00 31.44 29.74 3gu7 n GLU 94 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 3gu7 s LEU 95 N 1.00 4.40 -0.25 4.31 2.96 -1.26 -4.40 118.68 125.43 3gu7 s LEU 95 Ca 0.80 1.95 -0.00 0.00 -0.22 0.00 0.00 54.13 56.66 3gu7 s LEU 95 Cb -0.71 -3.58 0.04 0.00 0.50 0.00 0.00 46.19 42.44 3gu7 s LEU 95 CO 0.39 -0.36 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.30 3gu7 s VAL 96 N 0.72 2.60 -2.23 1.68 1.01 -1.26 -4.96 120.40 117.96 3gu7 s VAL 96 Ca 0.55 -1.26 0.21 0.00 0.00 0.00 0.00 61.98 61.47 3gu7 s VAL 96 Cb -0.27 -2.39 0.07 0.00 0.00 0.00 0.00 36.38 33.79 3gu7 s VAL 96 CO 0.30 0.11 1.09 0.00 0.00 0.00 0.00 175.10 176.60 3gu7 n ALA 97 N 4.59 2.99 -0.03 5.51 0.00 -1.24 -4.33 120.51 127.99 3gu7 n ALA 97 Ca -0.16 -0.64 0.08 0.00 0.00 0.00 0.00 53.44 52.73 3gu7 n ALA 97 Cb 0.45 -0.72 0.27 0.00 0.00 0.00 0.00 19.45 19.46 3gu7 n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gu7 n GLY 98 N 1.28 1.99 0.15 0.00 0.00 0.18 -4.90 105.19 103.88 3gu7 n GLY 98 Ca 0.10 -0.65 0.02 0.00 0.00 0.00 0.00 46.02 45.49 3gu7 n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gu7 n GLY 99 N 1.14 -1.85 3.77 -0.02 0.00 -1.23 -4.15 105.19 102.86 3gu7 n GLY 99 Ca 0.20 -1.47 -0.37 0.00 0.00 0.00 0.00 46.02 44.38 3gu7 n GLY 99 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gu7 s GLU 100 N -1.88 3.93 0.38 1.61 2.02 -1.26 -0.54 118.70 122.96 3gu7 s GLU 100 Ca 0.00 1.70 0.09 0.00 0.02 0.00 0.00 54.97 56.78 3gu7 s GLU 100 Cb 0.00 -2.49 0.84 0.00 0.10 0.00 0.00 34.13 32.57 3gu7 s GLU 100 CO 0.00 -0.39 1.94 1.25 0.02 0.00 0.00 175.26 178.09 3gu7 h LEU 101 N 2.29 0.58 -0.67 1.80 5.85 -0.83 -1.70 115.31 122.62 3gu7 h LEU 101 Ca -0.49 0.01 0.13 0.00 0.84 0.00 0.00 57.88 58.37 3gu7 h LEU 101 Cb 1.23 -0.11 -0.09 0.00 0.37 0.00 0.00 40.66 42.06 3gu7 h LEU 101 CO 0.61 0.35 0.20 0.15 -0.34 0.00 0.00 178.44 179.42 3gu7 h PHE 102 N 0.65 0.34 0.00 1.25 3.57 -1.56 -0.64 116.94 120.54 3gu7 h PHE 102 Ca 0.33 0.04 -0.20 0.00 3.53 0.00 0.00 57.97 61.67 3gu7 h PHE 102 Cb 0.44 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.11 3gu7 h PHE 102 CO -0.00 0.01 -0.93 -0.44 -2.23 0.00 0.00 178.31 174.71 3gu7 h ASP 103 N 0.34 0.01 -0.59 0.41 3.32 -1.66 -2.49 116.42 115.76 3gu7 h ASP 103 Ca 0.36 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.36 3gu7 h ASP 103 Cb 0.55 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.07 3gu7 h ASP 103 CO -0.41 0.93 0.20 0.15 -1.72 0.00 0.00 179.24 178.39 3gu7 h PHE 104 N 0.00 0.93 -0.27 4.55 3.04 -1.01 -2.18 116.94 122.00 3gu7 h PHE 104 Ca -0.01 -0.09 -0.08 0.00 3.98 0.00 0.00 57.97 61.77 3gu7 h PHE 104 Cb 1.64 -0.27 -0.01 0.00 2.56 0.00 0.00 35.95 39.87 3gu7 h PHE 104 CO 0.00 0.77 -0.20 -0.07 -2.02 0.00 0.00 178.31 176.79 3gu7 h LEU 105 N 0.82 0.48 -1.30 0.59 3.38 -1.09 -2.47 115.31 115.73 3gu7 h LEU 105 Ca 0.19 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 3gu7 h LEU 105 Cb 0.26 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 3gu7 h LEU 105 CO -0.01 0.69 -0.15 0.00 0.09 0.00 0.00 178.44 179.06 3gu7 h ALA 106 N 1.36 1.42 -0.41 1.53 0.00 -1.14 0.20 119.26 122.21 3gu7 h ALA 106 Ca 0.07 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3gu7 h ALA 106 Cb 0.59 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3gu7 h ALA 106 CO 0.04 0.40 0.00 0.39 0.00 0.00 0.00 179.25 180.08 3gu7 n GLU 107 N -4.24 2.63 0.00 0.00 1.02 -0.85 -4.15 120.64 115.06 3gu7 n GLU 107 Ca -0.00 -1.75 0.00 0.00 -0.02 0.00 0.00 57.16 55.38 3gu7 n GLU 107 Cb 0.30 -1.62 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 3gu7 n GLU 107 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3gu7 n LYS 108 N 0.63 2.94 0.00 3.49 5.02 -0.91 -5.05 118.16 124.28 3gu7 n LYS 108 Ca 0.16 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.45 3gu7 n LYS 108 Cb 0.58 -0.52 0.00 0.00 -0.02 0.00 0.00 35.03 35.07 3gu7 n LYS 108 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 3gu7 n GLU 109 N -0.31 0.00 0.00 1.97 -0.00 0.64 -4.77 120.64 118.18 3gu7 n GLU 109 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.16 3gu7 n GLU 109 Cb 0.01 -2.40 0.00 0.00 -0.00 0.00 0.00 31.44 29.05 3gu7 n GLU 109 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 3gu7 n SER 110 N 0.00 0.00 -4.86 -1.84 2.88 -1.26 -4.30 113.62 104.23 3gu7 n SER 110 Ca 0.00 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.33 3gu7 n SER 110 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 3gu7 n SER 110 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 3gu7 s LEU 111 N 0.00 3.80 0.76 2.46 1.43 -1.04 -5.06 118.68 121.03 3gu7 s LEU 111 Ca 0.00 -0.30 -0.11 0.00 -1.03 0.00 0.00 54.13 52.68 3gu7 s LEU 111 Cb 0.00 -2.39 0.05 0.00 0.03 0.00 0.00 46.19 43.88 3gu7 s LEU 111 CO 0.00 -0.19 1.10 0.42 0.23 0.00 0.00 176.35 177.90 3gu7 s THR 112 N -2.19 3.27 0.38 5.49 -4.23 -1.26 -4.70 115.64 112.41 3gu7 s THR 112 Ca 0.37 0.41 0.06 0.00 -1.18 0.00 0.00 61.69 61.35 3gu7 s THR 112 Cb -0.07 -3.25 0.28 0.00 1.34 0.00 0.00 72.50 70.79 3gu7 s THR 112 CO 0.27 -0.54 2.01 -0.33 -0.54 0.00 0.00 174.62 175.49 3gu7 h GLU 113 N -0.91 0.66 -0.24 3.99 5.08 -1.95 0.15 114.58 121.37 3gu7 h GLU 113 Ca -0.46 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 57.77 3gu7 h GLU 113 Cb 1.26 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 3gu7 h GLU 113 CO 0.61 0.44 -0.22 0.93 -1.00 0.00 0.00 179.01 179.77 3gu7 h GLU 114 N 0.68 0.57 -0.64 2.33 5.08 -1.98 0.10 114.58 120.73 3gu7 h GLU 114 Ca 0.23 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 3gu7 h GLU 114 Cb 0.07 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 3gu7 h GLU 114 CO -0.06 0.88 0.31 0.93 -1.00 0.00 0.00 179.01 180.07 3gu7 h GLU 115 N 0.28 0.92 -0.25 2.33 5.08 -1.83 -1.12 114.58 120.00 3gu7 h GLU 115 Ca 0.04 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3gu7 h GLU 115 Cb 0.77 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 3gu7 h GLU 115 CO 0.06 0.73 0.14 0.00 -1.00 0.00 0.00 179.01 178.94 3gu7 h ALA 116 N 1.14 0.32 0.00 3.43 0.00 -0.58 -2.78 119.26 120.79 3gu7 h ALA 116 Ca 0.22 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 3gu7 h ALA 116 Cb 0.11 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3gu7 h ALA 116 CO -0.03 -0.16 -0.32 1.79 0.00 0.00 0.00 179.25 180.53 3gu7 h THR 117 N 0.29 1.01 -0.49 0.00 1.35 -0.63 0.74 112.91 115.18 3gu7 h THR 117 Ca 0.09 -1.20 -0.09 0.00 -0.55 0.00 0.00 66.41 64.66 3gu7 h THR 117 Cb 0.05 1.69 -0.02 0.00 -1.73 0.00 0.00 68.15 68.14 3gu7 h THR 117 CO -0.01 0.32 -0.06 -0.08 -0.25 0.00 0.00 175.52 175.43 3gu7 h GLU 118 N 0.00 0.90 -0.05 4.72 4.81 -1.02 0.90 114.58 124.84 3gu7 h GLU 118 Ca -0.00 -0.32 -0.02 0.00 -0.13 0.00 0.00 59.36 58.89 3gu7 h GLU 118 Cb 0.66 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.98 3gu7 h GLU 118 CO 0.04 0.96 -0.03 0.74 -0.73 0.00 0.00 179.01 179.99 3gu7 h PHE 119 N 0.75 0.13 -0.86 0.92 0.05 -1.21 -3.25 116.94 113.46 3gu7 h PHE 119 Ca 0.13 -0.03 0.01 0.00 3.82 0.00 0.00 57.97 61.90 3gu7 h PHE 119 Cb 0.59 -0.03 -0.04 0.00 2.00 0.00 0.00 35.95 38.47 3gu7 h PHE 119 CO 0.04 0.52 0.57 1.25 -0.18 0.00 0.00 178.31 180.51 3gu7 h LEU 120 N -0.30 0.97 -1.37 1.54 7.12 -0.74 -1.82 115.31 120.72 3gu7 h LEU 120 Ca 0.01 -0.02 -0.02 0.00 0.13 0.00 0.00 57.88 57.98 3gu7 h LEU 120 Cb 0.49 -0.24 -0.02 0.00 -0.53 0.00 0.00 40.66 40.36 3gu7 h LEU 120 CO 0.01 0.70 0.23 0.11 -0.13 0.00 0.00 178.44 179.35 3gu7 h LYS 121 N 1.15 0.66 -0.36 1.25 1.57 -0.88 -0.15 116.57 119.80 3gu7 h LYS 121 Ca 0.32 -0.07 -0.12 0.00 -1.87 0.00 0.00 60.65 58.91 3gu7 h LYS 121 Cb -0.10 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.07 3gu7 h LYS 121 CO -0.08 0.51 -0.24 1.96 -0.57 0.00 0.00 179.45 181.03 3gu7 h GLN 122 N 0.66 0.79 -0.19 3.15 4.20 -1.42 -0.67 115.11 121.63 3gu7 h GLN 122 Ca 0.17 -0.37 -0.00 0.00 0.06 0.00 0.00 58.65 58.50 3gu7 h GLN 122 Cb 0.07 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 3gu7 h GLN 122 CO -0.02 1.00 0.10 0.82 -0.67 0.00 0.00 178.83 180.06 3gu7 h ILE 123 N 0.58 1.11 -0.78 2.54 2.04 -0.99 -0.33 117.51 121.68 3gu7 h ILE 123 Ca 0.07 -0.30 0.01 0.00 1.00 0.00 0.00 64.86 65.64 3gu7 h ILE 123 Cb 0.80 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 37.80 3gu7 h ILE 123 CO 0.07 0.11 0.52 -0.07 0.00 0.00 0.00 178.15 178.77 3gu7 h LEU 124 N 0.20 0.89 -0.62 1.44 3.38 -0.97 0.49 115.31 120.13 3gu7 h LEU 124 Ca 0.07 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 3gu7 h LEU 124 Cb 0.08 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 3gu7 h LEU 124 CO -0.01 0.64 0.38 0.78 0.09 0.00 0.00 178.44 180.32 3gu7 h ASN 125 N 1.06 0.75 -0.41 -0.43 2.35 -0.73 0.32 115.58 118.49 3gu7 h ASN 125 Ca 0.29 -0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.96 3gu7 h ASN 125 Cb -0.11 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.05 3gu7 h ASN 125 CO -0.07 0.59 0.17 1.23 -1.65 0.00 0.00 177.43 177.70 3gu7 h GLY 126 N 0.85 0.65 1.46 2.83 0.00 -0.63 -1.99 103.07 106.23 3gu7 h GLY 126 Ca 0.22 -0.35 -0.09 0.00 0.00 0.00 0.00 47.33 47.12 3gu7 h GLY 126 CO -0.04 0.33 -0.13 -2.08 0.00 0.00 0.00 176.54 174.62 3gu7 h VAL 127 N 0.52 1.25 -0.36 4.60 2.07 -0.62 -1.84 116.25 121.87 3gu7 h VAL 127 Ca 0.14 -1.12 0.01 0.00 0.82 0.00 0.00 66.70 66.54 3gu7 h VAL 127 Cb 0.17 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 3gu7 h VAL 127 CO -0.01 0.38 0.23 0.22 0.02 0.00 0.00 177.57 178.40 3gu7 h TYR 128 N 0.59 0.43 -0.10 1.57 3.20 -0.20 0.13 116.97 122.59 3gu7 h TYR 128 Ca 0.10 0.01 0.04 0.00 3.14 0.00 0.00 58.73 62.02 3gu7 h TYR 128 Cb 0.56 -0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.64 3gu7 h TYR 128 CO 0.02 0.26 -0.15 -0.92 -1.64 0.00 0.00 178.16 175.74 3gu7 h TYR 129 N 0.46 -0.38 -0.35 -3.82 3.20 -1.20 0.88 116.97 115.77 3gu7 h TYR 129 Ca 0.13 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 3gu7 h TYR 129 Cb -0.04 0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 3gu7 h TYR 129 CO -0.06 -0.22 0.19 -0.07 -1.64 0.00 0.00 178.16 176.36 3gu7 h LEU 130 N -0.20 0.43 -1.07 2.82 3.38 -0.98 -2.50 115.31 117.19 3gu7 h LEU 130 Ca 0.08 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 3gu7 h LEU 130 Cb 0.32 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3gu7 h LEU 130 CO -0.22 0.39 -0.34 0.45 0.09 0.00 0.00 178.44 178.81 3gu7 h HIS 131 N 0.44 0.25 -0.35 1.13 3.86 -0.64 -0.17 115.15 119.67 3gu7 h HIS 131 Ca 0.12 -0.06 0.03 0.00 -1.16 0.00 0.00 60.37 59.30 3gu7 h HIS 131 Cb 0.05 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 3gu7 h HIS 131 CO -0.03 0.54 0.24 0.77 0.86 0.00 0.00 177.93 180.31 3gu7 h SER 132 N 0.19 0.31 0.21 2.45 0.02 -0.53 -0.40 113.55 115.81 3gu7 h SER 132 Ca 0.02 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3gu7 h SER 132 Cb 0.70 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.16 3gu7 h SER 132 CO 0.05 0.22 -0.09 0.18 -1.14 0.00 0.00 176.83 176.05 3gu7 n LEU 133 N -4.49 0.69 -0.79 5.07 4.32 -0.46 -4.93 117.00 116.41 3gu7 n LEU 133 Ca 0.03 -0.13 -0.07 0.00 -0.02 0.00 0.00 56.01 55.81 3gu7 n LEU 133 Cb 0.15 -0.11 -0.01 0.00 -1.62 0.00 0.00 43.42 41.84 3gu7 n LEU 133 CO 0.35 0.12 -0.09 0.00 -1.22 0.00 0.00 177.39 176.55 3gu7 n GLN 134 N -0.68 -0.58 -3.59 3.23 1.13 -0.16 -4.89 117.38 111.84 3gu7 n GLN 134 Ca 0.17 0.43 -0.38 0.00 -1.94 0.00 0.00 57.00 55.27 3gu7 n GLN 134 Cb 0.28 -4.32 -0.11 0.00 0.11 0.00 0.00 30.24 26.20 3gu7 n GLN 134 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 3gu7 s ILE 135 N -2.35 5.22 -0.04 5.09 1.01 -0.20 -0.04 121.20 129.88 3gu7 s ILE 135 Ca 0.00 0.05 -0.18 0.00 0.00 0.00 0.00 60.65 60.51 3gu7 s ILE 135 Cb 0.00 -3.53 -0.05 0.00 0.01 0.00 0.00 42.46 38.89 3gu7 s ILE 135 CO 0.00 0.19 0.51 0.00 0.00 0.00 0.00 174.94 175.64 3gu7 s ALA 136 N 1.74 3.53 -0.04 9.38 0.00 -0.44 -3.68 121.76 132.25 3gu7 s ALA 136 Ca 0.07 -0.11 -0.21 0.00 0.00 0.00 0.00 51.96 51.70 3gu7 s ALA 136 Cb -0.16 -2.62 -0.32 0.00 0.00 0.00 0.00 23.12 20.02 3gu7 s ALA 136 CO 0.10 0.18 0.91 1.25 0.00 0.00 0.00 175.76 178.20 3gu7 h HIS 137 N 5.81 0.59 0.00 0.00 2.76 -1.91 -0.92 115.15 121.47 3gu7 h HIS 137 Ca -0.45 -0.43 0.00 0.00 -2.20 0.00 0.00 60.37 57.29 3gu7 h HIS 137 Cb 1.20 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 30.13 3gu7 h HIS 137 CO 0.65 1.33 0.00 1.19 -1.30 0.00 0.00 177.93 179.81 3gu7 n PHE 138 N -4.09 0.00 -2.75 5.26 3.72 -1.26 -2.66 117.46 115.68 3gu7 n PHE 138 Ca -0.14 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.26 3gu7 n PHE 138 Cb 0.85 -1.31 0.05 0.00 -0.94 0.00 0.00 39.48 38.13 3gu7 n PHE 138 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3gu7 n ASP 139 N -0.32 1.22 -4.67 4.37 2.03 -1.26 -4.53 116.55 113.39 3gu7 n ASP 139 Ca 0.00 -2.03 -0.43 0.00 0.52 0.00 0.00 54.79 52.86 3gu7 n ASP 139 Cb 0.16 -0.36 -0.02 0.00 -0.72 0.00 0.00 41.12 40.18 3gu7 n ASP 139 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3gu7 s LEU 140 N -2.99 4.22 0.09 -2.67 1.43 -1.26 -4.76 118.68 112.74 3gu7 s LEU 140 Ca 0.27 1.79 -0.26 0.00 -1.03 0.00 0.00 54.13 54.90 3gu7 s LEU 140 Cb 0.34 -3.54 0.08 0.00 0.03 0.00 0.00 46.19 43.09 3gu7 s LEU 140 CO -0.07 -0.74 0.89 -1.59 0.23 0.00 0.00 176.35 175.08 3gu7 s LYS 141 N 3.20 1.05 0.53 1.70 -2.85 -1.26 -4.86 119.74 117.26 3gu7 s LYS 141 Ca 0.57 -0.50 0.24 0.00 -1.00 0.00 0.00 55.97 55.28 3gu7 s LYS 141 Cb -0.24 0.41 1.39 0.00 -2.06 0.00 0.00 37.83 37.34 3gu7 s LYS 141 CO 0.18 -0.47 2.04 -1.35 0.10 0.00 0.00 175.35 175.84 3gu7 h PRO 142 N 2.00 0.00 0.00 1.78 0.11 -1.93 0.10 132.00 134.07 3gu7 h PRO 142 Ca -0.24 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 3gu7 h PRO 142 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3gu7 h PRO 142 CO 0.29 0.00 0.00 1.05 -0.21 0.00 0.00 178.00 179.13 3gu7 h GLU 143 N 0.00 0.00 -0.61 1.05 4.11 -1.95 -1.80 114.58 115.38 3gu7 h GLU 143 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.61 3gu7 h GLU 143 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 3gu7 h GLU 143 CO -0.00 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.17 3gu7 n ASN 144 N -3.00 5.50 -4.19 3.06 5.03 0.36 -4.80 115.26 117.22 3gu7 n ASN 144 Ca 0.01 -2.79 -0.30 0.00 0.87 0.00 0.00 54.58 52.37 3gu7 n ASN 144 Cb 0.31 -0.66 -0.17 0.00 -1.02 0.00 0.00 39.78 38.24 3gu7 n ASN 144 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3gu7 s ILE 145 N -2.50 1.84 0.07 2.41 1.01 -1.15 -0.76 121.20 122.12 3gu7 s ILE 145 Ca 0.54 -0.91 0.09 0.00 0.00 0.00 0.00 60.65 60.37 3gu7 s ILE 145 Cb 0.39 -1.59 -0.03 0.00 0.01 0.00 0.00 42.46 41.24 3gu7 s ILE 145 CO 0.19 0.51 -0.24 -0.04 0.00 0.00 0.00 174.94 175.36 3gu7 s MET 146 N 0.23 1.50 -0.06 2.79 -1.94 -0.16 -0.74 119.30 120.93 3gu7 s MET 146 Ca -0.13 -1.11 -0.15 0.00 -1.71 0.00 0.00 55.69 52.60 3gu7 s MET 146 Cb -0.16 -1.73 -0.05 0.00 2.01 0.00 0.00 34.83 34.90 3gu7 s MET 146 CO 0.06 0.43 0.39 -0.51 -0.01 0.00 0.00 175.02 175.38 3gu7 s LEU 147 N -1.46 4.39 0.28 -0.03 1.02 0.29 -0.87 118.68 122.30 3gu7 s LEU 147 Ca 0.10 0.82 -0.02 0.00 0.02 0.00 0.00 54.13 55.06 3gu7 s LEU 147 Cb -0.10 -2.54 0.38 0.00 0.02 0.00 0.00 46.19 43.96 3gu7 s LEU 147 CO 0.03 0.22 1.82 -0.07 0.02 0.00 0.00 176.35 178.37 3gu7 h LEU 148 N 5.51 0.79 -6.56 1.79 3.38 -1.49 0.52 115.31 119.25 3gu7 h LEU 148 Ca -0.48 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.35 3gu7 h LEU 148 Cb 1.20 -0.21 -0.24 0.00 0.09 0.00 0.00 40.66 41.50 3gu7 h LEU 148 CO 0.67 0.77 -0.30 -0.62 0.09 0.00 0.00 178.44 179.05 3gu7 s ASP 149 N -6.57 -0.74 0.00 -0.43 -1.08 -1.26 -2.97 116.67 103.62 3gu7 s ASP 149 Ca -0.10 0.92 0.29 0.00 -0.52 0.00 0.00 52.55 53.14 3gu7 s ASP 149 Cb 0.15 1.80 1.23 0.00 -1.46 0.00 0.00 42.92 44.65 3gu7 s ASP 149 CO 0.80 -0.25 1.90 -2.11 0.52 0.00 0.00 175.17 176.03 3gu7 n ARG 150 N 5.41 0.14 -1.51 4.34 1.85 -1.26 -3.89 116.66 121.74 3gu7 n ARG 150 Ca -0.06 -0.02 -0.29 0.00 -1.00 0.00 0.00 57.85 56.49 3gu7 n ARG 150 Cb 0.50 -1.50 0.08 0.00 -1.05 0.00 0.00 32.46 30.49 3gu7 n ARG 150 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 3gu7 n ASN 151 N -1.42 6.21 -4.35 2.89 3.02 -1.26 -4.92 115.26 115.43 3gu7 n ASN 151 Ca 0.09 -3.77 -0.24 0.00 -0.03 0.00 0.00 54.58 50.63 3gu7 n ASN 151 Cb 0.31 -0.74 -0.12 0.00 -0.61 0.00 0.00 39.78 38.63 3gu7 n ASN 151 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3gu7 s VAL 152 N -4.55 1.97 0.28 2.41 -7.23 -1.25 -5.05 120.40 106.97 3gu7 s VAL 152 Ca 0.59 -1.88 0.31 0.00 -1.81 0.00 0.00 61.98 59.18 3gu7 s VAL 152 Cb 0.47 -1.88 0.33 0.00 0.56 0.00 0.00 36.38 35.86 3gu7 s VAL 152 CO 0.01 -0.20 2.02 1.55 -0.31 0.00 0.00 175.10 178.17 3gu7 h PRO 153 N 3.41 0.00 -2.28 4.82 0.13 -1.94 -3.33 132.00 132.81 3gu7 h PRO 153 Ca -0.44 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.10 3gu7 h PRO 153 Cb 1.20 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.93 3gu7 h PRO 153 CO 0.48 0.10 -0.91 1.63 -0.23 0.00 0.00 178.00 179.06 3gu7 n LYS 154 N -3.34 1.03 -1.77 0.86 5.02 -1.26 -5.08 118.16 113.63 3gu7 n LYS 154 Ca -0.01 -3.63 -0.40 0.00 -2.02 0.00 0.00 58.31 52.25 3gu7 n LYS 154 Cb 0.29 -1.68 0.02 0.00 -0.02 0.00 0.00 35.03 33.64 3gu7 n LYS 154 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 3gu7 n PRO 155 N 1.80 2.32 -3.39 1.97 -0.02 -1.25 -5.01 135.00 131.42 3gu7 n PRO 155 Ca 0.25 0.82 -0.36 0.00 -2.02 0.00 0.00 63.50 62.19 3gu7 n PRO 155 Cb 0.47 -2.65 -0.06 0.00 -0.02 0.00 0.00 33.50 31.24 3gu7 n PRO 155 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 3gu7 s ARG 156 N -2.42 3.98 0.22 -0.52 0.52 -1.26 -4.87 118.95 114.61 3gu7 s ARG 156 Ca 0.60 0.49 0.10 0.00 -0.52 0.00 0.00 55.73 56.40 3gu7 s ARG 156 Cb -0.45 -3.04 -0.05 0.00 0.52 0.00 0.00 34.95 31.93 3gu7 s ARG 156 CO 0.58 0.55 -0.18 0.96 0.02 0.00 0.00 175.30 177.23 3gu7 s ILE 157 N -1.33 2.09 -0.02 1.52 -5.25 -1.26 -1.23 121.20 115.72 3gu7 s ILE 157 Ca 0.33 -2.20 0.02 0.00 -0.99 0.00 0.00 60.65 57.81 3gu7 s ILE 157 Cb -0.16 -2.10 0.00 0.00 2.95 0.00 0.00 42.46 43.15 3gu7 s ILE 157 CO 0.18 -0.42 -0.07 -0.54 -1.79 0.00 0.00 174.94 172.30 3gu7 s LYS 158 N -3.32 0.69 0.01 0.37 1.02 -0.04 -4.38 119.74 114.08 3gu7 s LYS 158 Ca 0.24 -0.24 -0.29 0.00 0.02 0.00 0.00 55.97 55.70 3gu7 s LYS 158 Cb -0.04 -0.67 -0.04 0.00 -0.52 0.00 0.00 37.83 36.57 3gu7 s LYS 158 CO 0.10 0.11 0.93 0.42 -0.92 0.00 0.00 175.35 175.99 3gu7 s ILE 159 N 0.08 4.84 0.31 2.17 1.01 0.62 -0.99 121.20 129.24 3gu7 s ILE 159 Ca -0.01 1.97 0.00 0.00 0.00 0.00 0.00 60.65 62.61 3gu7 s ILE 159 Cb -0.06 -4.28 0.00 0.00 0.01 0.00 0.00 42.46 38.14 3gu7 s ILE 159 CO -0.00 0.20 0.01 2.30 0.00 0.00 0.00 174.94 177.45 3gu7 n ILE 160 N 3.71 0.00 -2.63 2.92 -5.35 0.06 -2.13 119.36 115.94 3gu7 n ILE 160 Ca 0.04 -1.43 -0.05 0.00 -0.27 0.00 0.00 62.75 61.04 3gu7 n ILE 160 Cb 0.51 0.27 0.01 0.00 -1.74 0.00 0.00 39.64 38.68 3gu7 n ILE 160 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 3gu7 n ASP 161 N -1.21 -7.10 -1.73 7.28 2.03 -1.26 -4.84 116.55 109.71 3gu7 n ASP 161 Ca -0.12 0.63 -0.06 0.00 0.52 0.00 0.00 54.79 55.75 3gu7 n ASP 161 Cb 0.38 -4.75 0.22 0.00 -0.72 0.00 0.00 41.12 36.26 3gu7 n ASP 161 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3gu7 n PHE 162 N -0.13 1.93 0.27 -0.67 3.01 -1.26 -4.56 117.46 116.05 3gu7 n PHE 162 Ca 0.08 -1.01 0.17 0.00 1.01 0.00 0.00 57.45 57.69 3gu7 n PHE 162 Cb 0.31 -0.59 0.68 0.00 -0.01 0.00 0.00 39.48 39.87 3gu7 n PHE 162 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 3gu7 h GLY 163 N 3.05 0.00 -0.42 1.37 0.00 -1.92 -2.87 103.07 102.29 3gu7 h GLY 163 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 3gu7 h GLY 163 CO 0.59 0.00 -0.05 1.04 0.00 0.00 0.00 176.54 178.13 3gu7 n LEU 164 N -3.13 1.30 -4.76 3.11 4.77 -1.26 -4.93 117.00 112.11 3gu7 n LEU 164 Ca 0.00 -0.91 -0.39 0.00 -0.03 0.00 0.00 56.01 54.69 3gu7 n LEU 164 Cb 0.31 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.42 3gu7 n LEU 164 CO 0.28 0.27 0.98 0.00 -1.33 0.00 0.00 177.39 177.58 3gu7 s ALA 165 N -0.70 3.02 0.02 -1.18 0.00 -1.08 -4.70 121.76 117.14 3gu7 s ALA 165 Ca 0.06 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.31 3gu7 s ALA 165 Cb 0.05 -3.53 -0.02 0.00 0.00 0.00 0.00 23.12 19.62 3gu7 s ALA 165 CO 0.11 -1.12 -0.03 -1.01 0.00 0.00 0.00 175.76 173.70 3gu7 s HIS 166 N -1.31 0.26 -0.18 0.00 3.76 -0.35 -4.81 115.29 112.66 3gu7 s HIS 166 Ca 0.65 -0.43 -0.26 0.00 -0.15 0.00 0.00 55.06 54.87 3gu7 s HIS 166 Cb -0.39 -0.18 -0.01 0.00 1.11 0.00 0.00 32.58 33.11 3gu7 s HIS 166 CO 0.48 -0.14 0.87 0.21 -0.85 0.00 0.00 174.74 175.31 3gu7 s LYS 167 N -1.19 4.29 -0.67 1.40 2.47 -1.26 -1.33 119.74 123.44 3gu7 s LYS 167 Ca -0.12 1.08 -0.17 0.00 -1.56 0.00 0.00 55.97 55.20 3gu7 s LYS 167 Cb -0.08 -3.59 0.14 0.00 -1.46 0.00 0.00 37.83 32.84 3gu7 s LYS 167 CO -0.01 -0.39 0.71 0.42 0.16 0.00 0.00 175.35 176.24 3gu7 s ILE 168 N 2.37 5.09 0.10 5.43 -1.09 0.94 -4.90 121.20 129.14 3gu7 s ILE 168 Ca 0.39 -1.53 0.08 0.00 -2.23 0.00 0.00 60.65 57.36 3gu7 s ILE 168 Cb -0.16 -4.48 -0.20 0.00 -1.58 0.00 0.00 42.46 36.04 3gu7 s ILE 168 CO 0.11 -1.08 1.24 0.44 -1.23 0.00 0.00 174.94 174.42 3gu7 h ASP 169 N 8.75 0.00 -0.19 3.58 3.32 -1.85 -3.34 116.42 126.69 3gu7 h ASP 169 Ca -0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.89 3gu7 h ASP 169 Cb 1.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.62 3gu7 h ASP 169 CO 1.01 0.98 0.00 0.49 -1.72 0.00 0.00 179.24 180.00 3gu7 n PHE 170 N -3.32 0.67 0.00 4.55 3.01 -1.26 -4.95 117.46 116.16 3gu7 n PHE 170 Ca -0.01 -0.91 0.00 0.00 1.01 0.00 0.00 57.45 57.54 3gu7 n PHE 170 Cb 0.94 -0.27 0.00 0.00 -0.01 0.00 0.00 39.48 40.15 3gu7 n PHE 170 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3gu7 n GLY 171 N -0.77 2.95 3.22 1.37 0.00 -1.26 -4.92 105.19 105.78 3gu7 n GLY 171 Ca 0.20 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 3gu7 n GLY 171 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gu7 s ASN 172 N -0.99 0.05 0.16 1.61 2.20 -1.26 -4.47 114.94 112.23 3gu7 s ASN 172 Ca 0.00 -0.54 0.06 0.00 -0.94 0.00 0.00 52.86 51.44 3gu7 s ASN 172 Cb 0.00 0.35 -0.04 0.00 -2.00 0.00 0.00 41.25 39.56 3gu7 s ASN 172 CO 0.00 -0.71 -0.13 -1.83 -2.94 0.00 0.00 177.10 171.49 3gu7 s GLU 173 N -3.59 1.14 -0.33 3.55 4.04 0.11 -4.73 118.70 118.88 3gu7 s GLU 173 Ca 0.03 -1.44 0.16 0.00 0.04 0.00 0.00 54.97 53.76 3gu7 s GLU 173 Cb 0.03 -0.86 0.46 0.00 0.02 0.00 0.00 34.13 33.78 3gu7 s GLU 173 CO -0.10 0.14 1.01 0.34 -1.84 0.00 0.00 175.26 174.81 3gu7 n PHE 174 N -0.06 1.63 -1.51 4.83 7.35 -1.26 -0.62 117.46 127.82 3gu7 n PHE 174 Ca -0.11 -2.75 -0.16 0.00 -0.76 0.00 0.00 57.45 53.67 3gu7 n PHE 174 Cb 0.60 -0.31 0.14 0.00 0.35 0.00 0.00 39.48 40.26 3gu7 n PHE 174 CO 0.00 0.00 0.00 0.36 -0.76 0.00 0.00 176.76 176.36 3gu7 n LYS 175 N -0.22 2.36 -2.86 -4.13 2.85 -1.26 -5.02 118.16 109.88 3gu7 n LYS 175 Ca 0.15 -3.36 -0.08 0.00 -1.05 0.00 0.00 58.31 53.97 3gu7 n LYS 175 Cb 0.79 -2.04 0.01 0.00 -0.65 0.00 0.00 35.03 33.15 3gu7 n LYS 175 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3gu7 n ASN 176 N -1.02 -7.82 -4.28 -5.58 3.02 -1.26 -5.04 115.26 93.28 3gu7 n ASN 176 Ca 0.44 0.74 -0.27 0.00 -0.03 0.00 0.00 54.58 55.46 3gu7 n ASN 176 Cb 1.05 -5.09 -0.14 0.00 -0.61 0.00 0.00 39.78 34.99 3gu7 n ASN 176 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3gu7 s ILE 177 N -2.25 1.85 -0.30 2.41 1.01 -1.26 -5.12 121.20 117.53 3gu7 s ILE 177 Ca 0.19 -1.24 -0.07 0.00 0.00 0.00 0.00 60.65 59.52 3gu7 s ILE 177 Cb -0.05 -1.59 0.16 0.00 0.01 0.00 0.00 42.46 41.00 3gu7 s ILE 177 CO 0.76 0.29 0.70 0.12 0.00 0.00 0.00 174.94 176.81 3gu7 s PHE 178 N -0.77 -1.32 0.00 3.97 2.19 -1.26 -4.95 117.98 115.83 3gu7 s PHE 178 Ca 0.09 1.82 0.00 0.00 0.33 0.00 0.00 56.93 59.17 3gu7 s PHE 178 Cb -0.09 0.62 0.00 0.00 -1.31 0.00 0.00 43.02 42.24 3gu7 s PHE 178 CO 0.02 -0.69 0.00 0.41 1.83 0.00 0.00 175.22 176.78 3gu7 n GLY 179 N 5.39 1.64 3.68 13.12 0.00 -1.26 -4.78 105.19 122.98 3gu7 n GLY 179 Ca -0.07 -1.65 -0.41 0.00 0.00 0.00 0.00 46.02 43.89 3gu7 n GLY 179 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gu7 s THR 180 N 3.64 4.88 0.32 2.61 2.01 -1.26 -4.26 115.64 123.57 3gu7 s THR 180 Ca 0.00 1.69 0.10 0.00 0.31 0.00 0.00 61.69 63.78 3gu7 s THR 180 Cb 0.00 -4.16 0.31 0.00 0.01 0.00 0.00 72.50 68.66 3gu7 s THR 180 CO 0.00 0.04 1.69 -0.65 -0.69 0.00 0.00 174.62 175.01 3gu7 h PRO 181 N 7.24 0.40 -0.36 4.92 0.11 -1.93 -0.21 132.00 142.17 3gu7 h PRO 181 Ca -0.31 -0.02 0.11 0.00 0.11 0.00 0.00 66.00 65.89 3gu7 h PRO 181 Cb 1.14 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 3gu7 h PRO 181 CO 0.83 0.27 0.28 1.49 -0.21 0.00 0.00 178.00 180.66 3gu7 h GLU 182 N 0.42 0.00 0.00 1.05 4.81 -1.93 -3.17 114.58 115.76 3gu7 h GLU 182 Ca 0.66 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.89 3gu7 h GLU 182 Cb 1.36 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.74 3gu7 h GLU 182 CO -0.55 0.00 -0.21 1.19 -0.73 0.00 0.00 179.01 178.71 3gu7 n PHE 183 N -4.29 0.00 -2.58 0.92 3.01 -0.13 -4.79 117.46 109.60 3gu7 n PHE 183 Ca 0.06 0.00 -0.38 0.00 1.01 0.00 0.00 57.45 58.13 3gu7 n PHE 183 Cb 0.46 -0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.88 3gu7 n PHE 183 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 3gu7 s VAL 184 N -1.38 3.74 0.67 -4.37 -7.23 -0.95 -4.13 120.40 106.74 3gu7 s VAL 184 Ca 0.01 1.54 -0.12 0.00 -1.81 0.00 0.00 61.98 61.60 3gu7 s VAL 184 Cb 0.03 -3.90 -0.00 0.00 0.56 0.00 0.00 36.38 33.07 3gu7 s VAL 184 CO 0.16 0.21 1.06 0.00 -0.31 0.00 0.00 175.10 176.21 3gu7 s ALA 185 N -1.42 2.68 0.49 1.32 0.00 -1.26 -4.88 121.76 118.70 3gu7 s ALA 185 Ca 0.50 0.18 0.19 0.00 0.00 0.00 0.00 51.96 52.83 3gu7 s ALA 185 Cb -0.26 -3.19 1.23 0.00 0.00 0.00 0.00 23.12 20.90 3gu7 s ALA 185 CO 0.32 -1.12 2.03 -1.35 0.00 0.00 0.00 175.76 175.64 3gu7 h PRO 186 N -0.40 0.15 -0.04 0.00 0.11 -1.87 -1.67 132.00 128.27 3gu7 h PRO 186 Ca -0.45 -0.01 -0.08 0.00 0.11 0.00 0.00 66.00 65.58 3gu7 h PRO 186 Cb 1.21 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3gu7 h PRO 186 CO 0.57 0.10 -0.34 1.05 -0.21 0.00 0.00 178.00 179.16 3gu7 h GLU 187 N 0.15 0.07 -0.11 1.05 9.09 -1.93 0.04 114.58 122.94 3gu7 h GLU 187 Ca 0.20 -0.02 -0.03 0.00 0.05 0.00 0.00 59.36 59.55 3gu7 h GLU 187 Cb 0.59 -0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.68 3gu7 h GLU 187 CO -0.03 0.40 -0.06 0.82 0.05 0.00 0.00 179.01 180.20 3gu7 h ILE 188 N 0.06 1.32 -0.98 -1.06 2.04 -1.59 0.12 117.51 117.42 3gu7 h ILE 188 Ca 0.01 -1.11 0.06 0.00 1.00 0.00 0.00 64.86 64.82 3gu7 h ILE 188 Cb 0.64 1.82 -0.06 0.00 -0.74 0.00 0.00 36.82 38.47 3gu7 h ILE 188 CO 0.05 0.32 0.64 0.58 0.00 0.00 0.00 178.15 179.73 3gu7 h VAL 189 N -0.12 1.09 -0.21 1.67 2.07 -1.11 -2.38 116.25 117.26 3gu7 h VAL 189 Ca 0.02 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.15 3gu7 h VAL 189 Cb 0.53 -0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.14 3gu7 h VAL 189 CO 0.02 0.21 0.00 0.59 0.02 0.00 0.00 177.57 178.41 3gu7 n ASN 190 N -4.49 1.86 -3.53 0.57 4.13 -0.05 -4.94 115.26 108.81 3gu7 n ASN 190 Ca 0.15 -1.77 -0.24 0.00 1.68 0.00 0.00 54.58 54.40 3gu7 n ASN 190 Cb 0.18 -0.14 0.07 0.00 -1.54 0.00 0.00 39.78 38.35 3gu7 n ASN 190 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 3gu7 n TYR 191 N 0.45 -2.68 -3.10 3.10 4.01 -0.78 -5.01 117.16 113.16 3gu7 n TYR 191 Ca 0.16 0.92 -0.22 0.00 -0.16 0.00 0.00 57.90 58.60 3gu7 n TYR 191 Cb 0.35 -4.85 0.01 0.00 -0.31 0.00 0.00 39.34 34.54 3gu7 n TYR 191 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 3gu7 s GLU 192 N -6.24 3.07 0.39 -0.72 2.02 0.34 -5.04 118.70 112.52 3gu7 s GLU 192 Ca 0.55 -0.62 -0.26 0.00 0.02 0.00 0.00 54.97 54.65 3gu7 s GLU 192 Cb -0.24 -2.62 -0.11 0.00 0.10 0.00 0.00 34.13 31.26 3gu7 s GLU 192 CO 0.68 -0.20 1.27 -2.30 0.02 0.00 0.00 175.26 174.73 3gu7 n PRO 193 N -1.98 1.98 -4.39 0.39 -0.02 -1.26 -4.69 135.00 125.04 3gu7 n PRO 193 Ca 0.01 0.70 -0.29 0.00 -2.02 0.00 0.00 63.50 61.91 3gu7 n PRO 193 Cb 0.58 -2.35 -0.13 0.00 -0.02 0.00 0.00 33.50 31.58 3gu7 n PRO 193 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3gu7 s LEU 194 N -1.38 2.33 0.00 2.45 1.43 0.21 -4.88 118.68 118.83 3gu7 s LEU 194 Ca 0.59 -0.75 0.00 0.00 -1.03 0.00 0.00 54.13 52.93 3gu7 s LEU 194 Cb -0.53 -1.20 0.00 0.00 0.03 0.00 0.00 46.19 44.49 3gu7 s LEU 194 CO 0.60 0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.96 3gu7 n GLY 195 N 0.88 4.12 0.30 -3.19 0.00 -1.26 0.08 105.19 106.11 3gu7 n GLY 195 Ca -0.18 -1.28 0.15 0.00 0.00 0.00 0.00 46.02 44.71 3gu7 n GLY 195 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3gu7 h LEU 196 N 0.00 0.00 -1.91 0.99 3.38 -1.96 -2.58 115.31 113.23 3gu7 h LEU 196 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 3gu7 h LEU 196 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 3gu7 h LEU 196 CO 0.00 0.02 -0.08 -0.33 0.09 0.00 0.00 178.44 178.13 3gu7 h GLU 197 N 0.00 0.00 -0.77 1.13 4.39 -1.94 -2.21 114.58 115.18 3gu7 h GLU 197 Ca -0.00 0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.73 3gu7 h GLU 197 Cb 0.05 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.65 3gu7 h GLU 197 CO 0.00 0.08 0.51 0.00 -1.16 0.00 0.00 179.01 178.44 3gu7 h ALA 198 N 1.92 1.54 -0.52 3.43 0.00 -1.87 -1.86 119.26 121.91 3gu7 h ALA 198 Ca -0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 3gu7 h ALA 198 Cb 0.36 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3gu7 h ALA 198 CO 0.01 0.38 0.15 -0.44 0.00 0.00 0.00 179.25 179.35 3gu7 h ASP 199 N 0.94 0.71 -0.34 0.00 3.32 -1.61 -2.86 116.42 116.59 3gu7 h ASP 199 Ca 0.31 -0.11 -0.10 0.00 0.02 0.00 0.00 57.03 57.15 3gu7 h ASP 199 Cb 0.05 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 3gu7 h ASP 199 CO -0.09 0.68 -0.13 0.24 -1.72 0.00 0.00 179.24 178.23 3gu7 h MET 200 N 0.76 0.78 -0.05 3.56 2.86 -1.41 -1.01 114.93 120.41 3gu7 h MET 200 Ca 0.17 -0.27 0.00 0.00 -2.06 0.00 0.00 59.70 57.55 3gu7 h MET 200 Cb 0.23 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 31.83 3gu7 h MET 200 CO -0.01 0.87 0.04 2.35 1.06 0.00 0.00 176.91 181.22 3gu7 h TRP 201 N 0.70 0.07 -0.96 -0.22 2.91 -1.35 -2.12 115.95 114.98 3gu7 h TRP 201 Ca 0.12 0.00 0.10 0.00 1.13 0.00 0.00 58.89 60.23 3gu7 h TRP 201 Cb 0.61 -0.02 -0.08 0.00 -0.51 0.00 0.00 29.16 29.16 3gu7 h TRP 201 CO 0.03 0.06 0.60 0.77 -1.03 0.00 0.00 178.44 178.87 3gu7 h SER 202 N 0.06 0.91 -0.85 2.65 0.02 -1.25 0.12 113.55 115.19 3gu7 h SER 202 Ca 0.02 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 61.04 3gu7 h SER 202 Cb 0.01 -0.15 -0.05 0.00 0.14 0.00 0.00 62.40 62.35 3gu7 h SER 202 CO -0.00 0.52 0.55 0.40 -1.14 0.00 0.00 176.83 177.16 3gu7 h ILE 203 N 1.01 1.14 -0.68 3.27 2.04 -0.90 0.79 117.51 124.18 3gu7 h ILE 203 Ca 0.46 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.94 3gu7 h ILE 203 Cb 0.36 -0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.38 3gu7 h ILE 203 CO -0.23 0.20 0.40 1.23 0.00 0.00 0.00 178.15 179.75 3gu7 h GLY 204 N 1.07 0.98 0.77 5.37 0.00 -0.34 0.33 103.07 111.25 3gu7 h GLY 204 Ca 0.34 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.26 3gu7 h GLY 204 CO -0.12 0.40 -0.01 -2.08 0.00 0.00 0.00 176.54 174.74 3gu7 h VAL 205 N 0.92 1.16 -0.77 4.60 2.07 -0.60 -1.54 116.25 122.09 3gu7 h VAL 205 Ca 0.24 -0.53 0.12 0.00 0.82 0.00 0.00 66.70 67.35 3gu7 h VAL 205 Cb -0.02 1.52 -0.08 0.00 -1.52 0.00 0.00 31.29 31.19 3gu7 h VAL 205 CO -0.04 0.14 0.38 0.40 0.02 0.00 0.00 177.57 178.47 3gu7 h ILE 206 N -0.25 0.78 -0.35 4.57 2.04 -0.71 -1.93 117.51 121.66 3gu7 h ILE 206 Ca -0.00 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.63 3gu7 h ILE 206 Cb 0.24 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 36.43 3gu7 h ILE 206 CO 0.00 0.11 0.13 0.74 0.00 0.00 0.00 178.15 179.13 3gu7 h THR 207 N 0.60 1.20 -0.42 -0.27 2.02 -0.63 -0.44 112.91 114.97 3gu7 h THR 207 Ca 0.40 -0.61 0.06 0.00 0.77 0.00 0.00 66.41 67.03 3gu7 h THR 207 Cb 0.50 0.94 -0.05 0.00 -1.74 0.00 0.00 68.15 67.80 3gu7 h THR 207 CO -0.32 0.21 0.11 0.22 0.37 0.00 0.00 175.52 176.12 3gu7 h TYR 208 N 0.42 0.19 -0.50 3.16 5.03 -0.91 -1.37 116.97 122.99 3gu7 h TYR 208 Ca 0.12 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.42 3gu7 h TYR 208 Cb 0.21 -0.02 -0.02 0.00 1.55 0.00 0.00 36.73 38.44 3gu7 h TYR 208 CO 0.00 0.05 0.19 0.82 -1.32 0.00 0.00 178.16 177.90 3gu7 h ILE 209 N 0.26 1.21 0.00 1.81 2.04 -1.00 -1.44 117.51 120.39 3gu7 h ILE 209 Ca 0.20 -0.67 -0.06 0.00 1.00 0.00 0.00 64.86 65.33 3gu7 h ILE 209 Cb 0.23 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.02 3gu7 h ILE 209 CO -0.24 0.25 -0.30 0.17 0.00 0.00 0.00 178.15 178.03 3gu7 h LEU 210 N 0.67 0.00 -0.03 1.44 8.10 -0.65 0.28 115.31 125.13 3gu7 h LEU 210 Ca 0.17 0.00 -0.21 0.00 0.11 0.00 0.00 57.88 57.95 3gu7 h LEU 210 Cb 0.20 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 40.40 3gu7 h LEU 210 CO -0.01 0.30 -0.99 -0.07 -4.11 0.00 0.00 178.44 173.56 3gu7 h LEU 211 N 0.00 0.01 0.00 0.17 3.38 -1.11 -2.76 115.31 114.99 3gu7 h LEU 211 Ca -0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3gu7 h LEU 211 Cb 0.62 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 3gu7 h LEU 211 CO 0.04 0.99 -1.07 -1.54 0.09 0.00 0.00 178.44 176.96 3gu7 n SER 212 N -3.37 4.68 0.00 -0.43 3.41 -0.56 -4.63 113.62 112.73 3gu7 n SER 212 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3gu7 n SER 212 Cb 0.93 1.01 0.00 0.00 -0.26 0.00 0.00 64.21 65.89 3gu7 n SER 212 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gu7 n GLY 213 N 2.47 0.52 3.40 5.00 0.00 0.95 -4.91 105.19 112.62 3gu7 n GLY 213 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 3gu7 n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gu7 s ALA 214 N -2.33 2.41 -0.22 4.61 0.00 -1.26 -5.03 121.76 119.94 3gu7 s ALA 214 Ca 0.00 -1.55 -0.12 0.00 0.00 0.00 0.00 51.96 50.29 3gu7 s ALA 214 Cb 0.00 -0.34 -0.05 0.00 0.00 0.00 0.00 23.12 22.74 3gu7 s ALA 214 CO 0.00 0.46 0.21 0.45 0.00 0.00 0.00 175.76 176.88 3gu7 s SER 215 N -2.40 6.22 0.39 0.00 0.15 -1.26 -3.81 113.70 112.99 3gu7 s SER 215 Ca 0.17 0.24 0.17 0.00 0.70 0.00 0.00 55.95 57.23 3gu7 s SER 215 Cb -0.09 -2.13 0.80 0.00 -1.71 0.00 0.00 66.02 62.89 3gu7 s SER 215 CO 0.08 0.05 1.82 1.55 1.20 0.00 0.00 173.24 177.94 3gu7 h PRO 216 N 7.30 0.00 -0.02 5.44 0.13 -1.91 -3.20 132.00 139.75 3gu7 h PRO 216 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 3gu7 h PRO 216 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3gu7 h PRO 216 CO 0.69 0.35 0.00 1.19 -0.23 0.00 0.00 178.00 180.00 3gu7 n PHE 217 N -3.80 0.01 -1.88 1.56 3.72 -1.26 -4.42 117.46 111.38 3gu7 n PHE 217 Ca -0.01 -0.02 -0.42 0.00 -0.05 0.00 0.00 57.45 56.95 3gu7 n PHE 217 Cb 0.43 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.94 3gu7 n PHE 217 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 3gu7 s LEU 218 N -0.57 4.37 0.00 4.37 2.96 -1.21 -4.45 118.68 124.16 3gu7 s LEU 218 Ca 0.08 2.51 0.02 0.00 -0.22 0.00 0.00 54.13 56.52 3gu7 s LEU 218 Cb 0.06 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 43.20 3gu7 s LEU 218 CO 0.08 -0.92 0.14 0.61 -1.32 0.00 0.00 176.35 174.94 3gu7 n GLY 219 N 4.09 2.71 0.11 7.98 0.00 -1.26 -4.94 105.19 113.89 3gu7 n GLY 219 Ca 0.17 -2.19 0.13 0.00 0.00 0.00 0.00 46.02 44.12 3gu7 n GLY 219 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3gu7 h ASP 220 N 0.14 0.00 -4.99 1.61 3.32 -1.94 -3.45 116.42 111.12 3gu7 h ASP 220 Ca -0.09 -0.03 -0.18 0.00 0.02 0.00 0.00 57.03 56.75 3gu7 h ASP 220 Cb 0.35 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 39.75 3gu7 h ASP 220 CO 0.14 0.01 -0.68 0.42 -1.72 0.00 0.00 179.24 177.41 3gu7 s THR 221 N -3.12 0.40 0.24 0.35 -4.23 -1.26 -5.05 115.64 102.98 3gu7 s THR 221 Ca 0.10 -1.88 -0.06 0.00 -1.18 0.00 0.00 61.69 58.67 3gu7 s THR 221 Cb 0.12 -1.69 0.24 0.00 1.34 0.00 0.00 72.50 72.51 3gu7 s THR 221 CO 0.62 -0.85 1.90 0.11 -0.54 0.00 0.00 174.62 175.86 3gu7 h LYS 222 N 3.02 1.15 -0.60 3.99 1.57 -1.89 -1.76 116.57 122.06 3gu7 h LYS 222 Ca -0.35 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.30 3gu7 h LYS 222 Cb 1.16 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 33.19 3gu7 h LYS 222 CO 0.64 0.76 0.15 -0.56 -0.57 0.00 0.00 179.45 179.87 3gu7 h GLN 223 N 1.19 0.96 -0.73 3.15 -0.00 -1.97 -1.51 115.11 116.20 3gu7 h GLN 223 Ca 0.37 -0.23 -0.02 0.00 -0.00 0.00 0.00 58.65 58.77 3gu7 h GLN 223 Cb -0.02 -0.13 -0.03 0.00 -0.00 0.00 0.00 27.48 27.30 3gu7 h GLN 223 CO -0.12 0.88 0.39 0.93 -0.00 0.00 0.00 178.83 180.91 3gu7 h GLU 224 N 0.87 1.03 -0.33 0.06 5.08 -1.86 -1.15 114.58 118.28 3gu7 h GLU 224 Ca 0.19 -0.13 0.04 0.00 -1.00 0.00 0.00 59.36 58.45 3gu7 h GLU 224 Cb 0.35 -0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 3gu7 h GLU 224 CO 0.00 0.78 0.12 1.15 -1.00 0.00 0.00 179.01 180.06 3gu7 h THR 225 N 1.02 0.91 -0.77 1.13 2.02 -0.88 -0.89 112.91 115.45 3gu7 h THR 225 Ca 0.26 -0.09 0.01 0.00 0.77 0.00 0.00 66.41 67.36 3gu7 h THR 225 Cb 0.06 0.62 -0.04 0.00 -1.74 0.00 0.00 68.15 67.06 3gu7 h THR 225 CO -0.04 0.05 0.50 -0.07 0.37 0.00 0.00 175.52 176.33 3gu7 h LEU 226 N 0.26 0.86 -0.39 2.58 3.38 -1.03 0.49 115.31 121.45 3gu7 h LEU 226 Ca 0.15 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 3gu7 h LEU 226 Cb 0.12 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 3gu7 h LEU 226 CO -0.15 0.62 0.24 0.00 0.09 0.00 0.00 178.44 179.24 3gu7 h ALA 227 N 1.29 0.50 -0.76 1.53 0.00 -0.98 -1.82 119.26 119.02 3gu7 h ALA 227 Ca 0.29 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.22 3gu7 h ALA 227 Cb -0.08 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.49 3gu7 h ALA 227 CO -0.07 -0.01 0.45 -0.91 0.00 0.00 0.00 179.25 178.70 3gu7 h ASN 228 N 0.52 0.67 0.08 0.00 -0.26 -0.58 -2.15 115.58 113.86 3gu7 h ASN 228 Ca 0.14 0.03 -0.00 0.00 -0.56 0.00 0.00 56.30 55.91 3gu7 h ASN 228 Cb -0.01 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 37.14 3gu7 h ASN 228 CO -0.03 0.42 -0.04 0.58 -1.06 0.00 0.00 177.43 177.31 3gu7 h VAL 229 N 0.80 1.00 -0.39 2.81 2.07 -0.60 0.20 116.25 122.15 3gu7 h VAL 229 Ca 0.34 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.58 3gu7 h VAL 229 Cb 0.21 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 3gu7 h VAL 229 CO -0.19 0.07 0.21 -1.28 0.02 0.00 0.00 177.57 176.40 3gu7 h SER 230 N -0.23 0.47 0.54 0.57 0.87 -1.15 -0.86 113.55 113.75 3gu7 h SER 230 Ca -0.01 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 3gu7 h SER 230 Cb 0.20 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 3gu7 h SER 230 CO 0.02 0.38 -0.17 0.00 -0.53 0.00 0.00 176.83 176.53 3gu7 n ALA 231 N -2.48 2.83 -3.75 6.23 0.00 -0.82 -4.92 120.51 117.60 3gu7 n ALA 231 Ca 0.03 -0.25 -0.25 0.00 0.00 0.00 0.00 53.44 52.97 3gu7 n ALA 231 Cb 0.10 -1.32 0.04 0.00 0.00 0.00 0.00 19.45 18.27 3gu7 n ALA 231 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3gu7 n VAL 232 N -1.19 -3.38 -2.56 0.00 0.31 -0.33 -4.90 118.33 106.27 3gu7 n VAL 232 Ca 0.11 -0.22 -0.43 0.00 -0.01 0.00 0.00 64.34 63.79 3gu7 n VAL 232 Cb 0.31 -3.54 0.00 0.00 -0.91 0.00 0.00 33.84 29.69 3gu7 n VAL 232 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 3gu7 n ASN 233 N -2.97 4.90 -4.00 4.52 5.15 0.60 -4.91 115.26 118.54 3gu7 n ASN 233 Ca -0.11 -2.93 -0.08 0.00 -0.60 0.00 0.00 54.58 50.85 3gu7 n ASN 233 Cb 0.60 -1.69 -0.09 0.00 -0.53 0.00 0.00 39.78 38.07 3gu7 n ASN 233 CO 0.00 0.00 0.00 -0.72 1.40 0.00 0.00 177.26 177.94 3gu7 s TYR 234 N 3.34 0.43 0.14 1.20 1.13 -1.26 -4.61 117.35 117.72 3gu7 s TYR 234 Ca 0.50 -0.89 -0.15 0.00 -1.41 0.00 0.00 57.07 55.12 3gu7 s TYR 234 Cb 0.04 -0.25 0.03 0.00 -1.10 0.00 0.00 41.96 40.67 3gu7 s TYR 234 CO 0.04 -0.49 0.41 -1.83 -2.51 0.00 0.00 175.55 171.17 3gu7 s GLU 235 N -3.92 1.14 -0.72 -3.49 -1.05 -1.26 -5.11 118.70 104.29 3gu7 s GLU 235 Ca 0.10 -0.79 -0.21 0.00 -0.15 0.00 0.00 54.97 53.91 3gu7 s GLU 235 Cb 0.06 0.47 0.09 0.00 -0.44 0.00 0.00 34.13 34.31 3gu7 s GLU 235 CO -0.08 -0.45 0.96 -0.06 0.95 0.00 0.00 175.26 176.59 3gu7 s PHE 236 N -3.84 2.84 0.18 4.83 0.08 -1.26 -5.00 117.98 115.82 3gu7 s PHE 236 Ca 0.06 -0.84 -0.32 0.00 0.12 0.00 0.00 56.93 55.94 3gu7 s PHE 236 Cb 0.01 -4.24 -0.12 0.00 -0.57 0.00 0.00 43.02 38.10 3gu7 s PHE 236 CO -0.09 -1.55 1.71 0.39 -0.10 0.00 0.00 175.22 175.58 3gu7 n GLU 237 N 7.17 2.63 -0.25 0.44 -0.58 -1.26 -4.80 120.64 123.99 3gu7 n GLU 237 Ca 0.02 0.95 0.05 0.00 -0.42 0.00 0.00 57.16 57.77 3gu7 n GLU 237 Cb 0.46 -2.79 0.29 0.00 -0.57 0.00 0.00 31.44 28.84 3gu7 n GLU 237 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 3gu7 h ASP 238 N 6.82 0.79 -0.03 1.62 3.32 -1.94 0.69 116.42 127.69 3gu7 h ASP 238 Ca -0.44 0.01 0.01 0.00 0.02 0.00 0.00 57.03 56.63 3gu7 h ASP 238 Cb 1.22 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.60 3gu7 h ASP 238 CO 0.94 0.50 0.03 -0.08 -1.72 0.00 0.00 179.24 178.91 3gu7 h GLU 239 N 0.90 0.00 0.00 3.56 4.81 -2.01 0.90 114.58 122.74 3gu7 h GLU 239 Ca 0.36 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.39 3gu7 h GLU 239 Cb 0.26 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.60 3gu7 h GLU 239 CO -0.13 0.00 -2.05 0.66 -0.73 0.00 0.00 179.01 176.76 3gu7 n TYR 240 N -4.39 0.00 0.29 0.92 0.53 -0.53 -4.69 117.16 109.29 3gu7 n TYR 240 Ca -0.02 0.00 0.03 0.00 -1.02 0.00 0.00 57.90 56.89 3gu7 n TYR 240 Cb 0.12 -0.69 0.00 0.00 -1.03 0.00 0.00 39.34 37.75 3gu7 n TYR 240 CO 0.00 0.00 0.00 1.19 -1.02 0.00 0.00 176.86 177.03 3gu7 n PHE 241 N -2.45 0.00 -0.27 -0.72 3.01 0.12 -4.77 117.46 112.38 3gu7 n PHE 241 Ca -0.19 0.00 0.23 0.00 1.01 0.00 0.00 57.45 58.50 3gu7 n PHE 241 Cb 0.85 0.00 0.56 0.00 -0.01 0.00 0.00 39.48 40.87 3gu7 n PHE 241 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3gu7 h SER 242 N 0.81 0.34 -0.37 4.37 4.64 -1.01 0.77 113.55 123.09 3gu7 h SER 242 Ca 0.00 0.05 -0.10 0.00 -0.47 0.00 0.00 61.79 61.27 3gu7 h SER 242 Cb 0.23 -0.01 -0.06 0.00 -0.31 0.00 0.00 62.40 62.25 3gu7 h SER 242 CO 0.00 0.10 0.03 0.59 -0.87 0.00 0.00 176.83 176.69 3gu7 n ASN 243 N -4.49 3.61 -4.85 4.97 4.13 -1.26 -4.97 115.26 112.39 3gu7 n ASN 243 Ca 0.22 -3.28 -0.36 0.00 1.68 0.00 0.00 54.58 52.83 3gu7 n ASN 243 Cb 0.83 -0.61 -0.06 0.00 -1.54 0.00 0.00 39.78 38.41 3gu7 n ASN 243 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 3gu7 s THR 244 N -2.99 5.10 0.63 3.41 2.01 0.26 -5.06 115.64 119.00 3gu7 s THR 244 Ca 0.45 0.61 -0.17 0.00 0.31 0.00 0.00 61.69 62.89 3gu7 s THR 244 Cb 0.38 -3.66 -0.01 0.00 0.01 0.00 0.00 72.50 69.22 3gu7 s THR 244 CO 0.07 0.44 1.19 -0.94 -0.69 0.00 0.00 174.62 174.70 3gu7 s SER 245 N -1.40 4.94 0.41 3.53 1.04 -1.26 -4.91 113.70 116.05 3gu7 s SER 245 Ca 0.27 2.32 0.16 0.00 0.48 0.00 0.00 55.95 59.18 3gu7 s SER 245 Cb -0.15 -2.59 0.88 0.00 0.10 0.00 0.00 66.02 64.26 3gu7 s SER 245 CO 0.15 -1.76 1.89 0.00 0.98 0.00 0.00 173.24 174.50 3gu7 h ALA 246 N 0.48 1.40 -0.37 5.32 0.00 -1.97 -2.56 119.26 121.57 3gu7 h ALA 246 Ca -0.49 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.04 3gu7 h ALA 246 Cb 1.29 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3gu7 h ALA 246 CO 0.54 0.37 -0.21 -0.07 0.00 0.00 0.00 179.25 179.88 3gu7 h LEU 247 N 0.00 0.71 -0.37 0.00 3.38 -1.99 0.18 115.31 117.23 3gu7 h LEU 247 Ca -0.00 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 3gu7 h LEU 247 Cb 0.56 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 3gu7 h LEU 247 CO 0.04 0.91 0.21 0.00 0.09 0.00 0.00 178.44 179.69 3gu7 h ALA 248 N 1.15 0.47 -0.90 1.53 0.00 -1.84 -1.23 119.26 118.44 3gu7 h ALA 248 Ca 0.09 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3gu7 h ALA 248 Cb 0.69 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 3gu7 h ALA 248 CO 0.05 -0.02 0.55 0.87 0.00 0.00 0.00 179.25 180.70 3gu7 h LYS 249 N 0.47 1.21 -0.26 0.00 1.57 -1.28 -2.26 116.57 116.02 3gu7 h LYS 249 Ca 0.13 -0.11 0.01 0.00 -1.87 0.00 0.00 60.65 58.81 3gu7 h LYS 249 Cb 0.03 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.06 3gu7 h LYS 249 CO -0.02 0.84 0.15 0.22 -0.57 0.00 0.00 179.45 180.07 3gu7 h ASP 250 N 1.23 0.25 -0.15 0.86 1.82 -0.71 0.79 116.42 120.51 3gu7 h ASP 250 Ca 0.32 0.00 0.05 0.00 -0.39 0.00 0.00 57.03 57.01 3gu7 h ASP 250 Cb -0.06 -0.05 -0.05 0.00 0.68 0.00 0.00 39.33 39.85 3gu7 h ASP 250 CO -0.06 0.18 -0.17 0.15 -1.61 0.00 0.00 179.24 177.73 3gu7 h PHE 251 N 0.31 -0.44 -0.22 0.28 3.04 -0.96 -1.82 116.94 117.14 3gu7 h PHE 251 Ca 0.10 0.03 0.02 0.00 3.98 0.00 0.00 57.97 62.10 3gu7 h PHE 251 Cb -0.01 0.22 -0.02 0.00 2.56 0.00 0.00 35.95 38.70 3gu7 h PHE 251 CO -0.08 -0.24 0.08 0.82 -2.02 0.00 0.00 178.31 176.87 3gu7 h ILE 252 N -0.20 0.95 -0.55 1.41 2.04 -1.14 -2.76 117.51 117.25 3gu7 h ILE 252 Ca 0.10 -0.06 0.06 0.00 1.00 0.00 0.00 64.86 65.97 3gu7 h ILE 252 Cb 0.36 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 3gu7 h ILE 252 CO -0.27 0.03 0.37 0.03 0.00 0.00 0.00 178.15 178.31 3gu7 h ARG 253 N 0.18 0.48 0.00 2.37 3.08 -0.47 -0.84 114.38 119.19 3gu7 h ARG 253 Ca 0.09 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3gu7 h ARG 253 Cb 0.06 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.00 3gu7 h ARG 253 CO -0.09 0.32 0.00 0.54 -1.07 0.00 0.00 179.97 179.67 3gu7 n ARG 254 N -4.47 0.06 -0.11 0.04 1.74 -0.72 -3.42 116.66 109.77 3gu7 n ARG 254 Ca 0.08 0.13 -0.17 0.00 -0.77 0.00 0.00 57.85 57.12 3gu7 n ARG 254 Cb 0.26 -1.58 -0.13 0.00 -1.02 0.00 0.00 32.46 29.99 3gu7 n ARG 254 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3gu7 n LEU 255 N -1.68 2.42 -3.47 0.55 4.77 -0.59 -1.76 117.00 117.24 3gu7 n LEU 255 Ca 0.05 -0.07 -0.40 0.00 -0.03 0.00 0.00 56.01 55.57 3gu7 n LEU 255 Cb 0.30 -0.68 -0.01 0.00 -2.33 0.00 0.00 43.42 40.70 3gu7 n LEU 255 CO 0.23 0.85 2.80 0.18 -1.33 0.00 0.00 177.39 180.12 3gu7 n LEU 256 N -3.20 8.13 -4.26 2.23 4.77 -0.43 -4.28 117.00 119.97 3gu7 n LEU 256 Ca -0.42 -4.60 -0.33 0.00 -0.03 0.00 0.00 56.01 50.64 3gu7 n LEU 256 Cb 1.03 -1.48 -0.16 0.00 -2.33 0.00 0.00 43.42 40.48 3gu7 n LEU 256 CO 0.31 1.93 -0.50 -0.69 -1.33 0.00 0.00 177.39 177.11 3gu7 s VAL 257 N 0.68 2.53 0.11 4.08 1.01 -1.26 -4.94 120.40 122.60 3gu7 s VAL 257 Ca 0.59 -0.83 -0.18 0.00 0.00 0.00 0.00 61.98 61.55 3gu7 s VAL 257 Cb 0.17 -2.04 -0.06 0.00 0.00 0.00 0.00 36.38 34.45 3gu7 s VAL 257 CO -0.07 0.53 1.64 0.50 0.00 0.00 0.00 175.10 177.69 3gu7 h LYS 258 N 7.11 0.41 -6.37 2.72 3.64 -1.96 -3.41 116.57 118.72 3gu7 h LYS 258 Ca -0.29 -0.08 -0.57 0.00 -1.27 0.00 0.00 60.65 58.44 3gu7 h LYS 258 Cb 1.20 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.91 3gu7 h LYS 258 CO 0.55 0.45 1.02 0.34 -2.27 0.00 0.00 179.45 179.54 3gu7 s ASP 259 N -5.72 6.55 0.53 4.20 -1.08 -1.26 -4.74 116.67 115.15 3gu7 s ASP 259 Ca -0.13 1.22 0.19 0.00 -0.52 0.00 0.00 52.55 53.30 3gu7 s ASP 259 Cb 0.08 -2.54 1.38 0.00 -1.46 0.00 0.00 42.92 40.38 3gu7 s ASP 259 CO 0.73 -1.18 2.17 1.55 0.52 0.00 0.00 175.17 178.95 3gu7 h PRO 260 N 9.83 0.00 -0.02 4.34 0.13 -1.96 -0.19 132.00 144.13 3gu7 h PRO 260 Ca -0.28 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.81 3gu7 h PRO 260 Cb 1.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 3gu7 h PRO 260 CO 1.04 0.00 -0.21 0.87 -0.23 0.00 0.00 178.00 179.47 3gu7 h LYS 261 N 0.00 0.04 -0.02 0.86 1.57 -1.95 -2.58 116.57 114.49 3gu7 h LYS 261 Ca 0.01 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3gu7 h LYS 261 Cb 0.03 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 3gu7 h LYS 261 CO -0.00 0.24 -0.22 1.63 -0.57 0.00 0.00 179.45 180.53 3gu7 n LYS 262 N -4.28 1.61 -2.86 3.15 5.02 -0.12 -4.96 118.16 115.72 3gu7 n LYS 262 Ca -0.02 -1.26 -0.35 0.00 -2.02 0.00 0.00 58.31 54.66 3gu7 n LYS 262 Cb 0.27 -1.47 -0.07 0.00 -0.02 0.00 0.00 35.03 33.75 3gu7 n LYS 262 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 3gu7 s ARG 263 N -2.25 4.38 0.52 1.97 3.52 -0.97 -5.01 118.95 121.11 3gu7 s ARG 263 Ca 0.25 1.15 -0.23 0.00 -0.13 0.00 0.00 55.73 56.77 3gu7 s ARG 263 Cb 0.19 -2.59 -0.06 0.00 -1.56 0.00 0.00 34.95 30.94 3gu7 s ARG 263 CO 0.44 0.19 1.39 -1.64 -0.81 0.00 0.00 175.30 174.87 3gu7 s MET 264 N -2.46 3.28 0.65 5.12 -1.94 -0.72 -5.01 119.30 118.22 3gu7 s MET 264 Ca 0.53 2.31 -0.03 0.00 -1.71 0.00 0.00 55.69 56.79 3gu7 s MET 264 Cb -0.15 -2.37 0.06 0.00 2.01 0.00 0.00 34.83 34.39 3gu7 s MET 264 CO 0.20 -1.10 0.93 0.95 -0.01 0.00 0.00 175.02 175.98 3gu7 s THR 265 N -1.27 2.40 0.24 2.05 -4.23 -1.26 -4.89 115.64 108.69 3gu7 s THR 265 Ca 0.69 -0.47 -0.06 0.00 -1.18 0.00 0.00 61.69 60.67 3gu7 s THR 265 Cb -0.42 -2.93 0.24 0.00 1.34 0.00 0.00 72.50 70.73 3gu7 s THR 265 CO 0.51 0.00 1.92 -0.29 -0.54 0.00 0.00 174.62 176.21 3gu7 h ILE 266 N -0.36 1.23 -0.73 2.99 6.09 -1.95 -1.65 117.51 123.13 3gu7 h ILE 266 Ca -0.42 -0.44 -0.05 0.00 -1.37 0.00 0.00 64.86 62.57 3gu7 h ILE 266 Cb 1.30 -0.17 -0.03 0.00 0.47 0.00 0.00 36.82 38.38 3gu7 h ILE 266 CO 0.53 0.23 0.25 1.56 -3.07 0.00 0.00 178.15 177.65 3gu7 h GLN 267 N 1.29 1.12 -0.85 2.19 4.20 -1.98 -2.64 115.11 118.43 3gu7 h GLN 267 Ca 0.36 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.83 3gu7 h GLN 267 Cb -0.11 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 27.45 3gu7 h GLN 267 CO -0.09 0.94 0.48 -0.44 -0.67 0.00 0.00 178.83 179.06 3gu7 h ASP 268 N 1.08 1.05 -0.84 1.46 3.32 -1.84 -2.84 116.42 117.82 3gu7 h ASP 268 Ca 0.24 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.20 3gu7 h ASP 268 Cb 0.27 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 3gu7 h ASP 268 CO -0.01 0.84 0.53 0.28 -1.72 0.00 0.00 179.24 179.16 3gu7 h SER 269 N 1.18 0.98 1.02 6.45 0.02 -1.00 -0.46 113.55 121.76 3gu7 h SER 269 Ca 0.30 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.17 3gu7 h SER 269 Cb 0.00 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.29 3gu7 h SER 269 CO -0.05 0.73 -0.19 -0.07 -1.14 0.00 0.00 176.83 176.11 3gu7 h LEU 270 N 1.15 0.00 -0.64 5.07 3.38 -1.25 -2.98 115.31 120.04 3gu7 h LEU 270 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.27 3gu7 h LEU 270 Cb -0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.66 3gu7 h LEU 270 CO -0.06 0.19 -0.61 0.00 0.09 0.00 0.00 178.44 178.05 3gu7 n GLN 271 N -3.32 0.79 -1.82 1.13 1.13 -0.83 -3.71 117.38 110.75 3gu7 n GLN 271 Ca 0.00 -0.64 -0.41 0.00 -1.94 0.00 0.00 57.00 54.01 3gu7 n GLN 271 Cb 0.43 -1.49 -0.02 0.00 0.11 0.00 0.00 30.24 29.28 3gu7 n GLN 271 CO 0.00 0.00 0.00 -1.58 -1.44 0.00 0.00 177.06 174.04 3gu7 s HIS 272 N -2.65 2.78 0.46 1.08 2.46 -0.24 -4.62 115.29 114.56 3gu7 s HIS 272 Ca 0.16 0.87 0.23 0.00 0.47 0.00 0.00 55.06 56.79 3gu7 s HIS 272 Cb 0.18 -4.02 1.24 0.00 -0.13 0.00 0.00 32.58 29.84 3gu7 s HIS 272 CO 0.66 -3.37 1.84 -1.35 -2.47 0.00 0.00 174.74 170.05 3gu7 h PRO 273 N 4.66 0.25 0.00 2.88 0.11 -1.90 0.12 132.00 138.11 3gu7 h PRO 273 Ca -0.47 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 3gu7 h PRO 273 Cb 1.22 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 3gu7 h PRO 273 CO 0.77 0.16 -0.21 2.35 -0.21 0.00 0.00 178.00 180.87 3gu7 h TRP 274 N 0.25 0.00 0.01 0.65 7.01 -1.90 -3.35 115.95 118.62 3gu7 h TRP 274 Ca 0.50 0.00 -0.42 0.00 2.11 0.00 0.00 58.89 61.08 3gu7 h TRP 274 Cb 1.50 0.00 -0.06 0.00 -2.10 0.00 0.00 29.16 28.50 3gu7 h TRP 274 CO -0.00 0.21 -2.40 -0.89 -2.79 0.00 0.00 178.44 172.56 3gu7 n ILE 275 N -4.25 1.53 -1.68 2.65 2.08 0.22 -4.98 119.36 114.93 3gu7 n ILE 275 Ca -0.02 -0.44 -0.43 0.00 0.56 0.00 0.00 62.75 62.42 3gu7 n ILE 275 Cb 0.27 -1.73 -0.03 0.00 -0.75 0.00 0.00 39.64 37.39 3gu7 n ILE 275 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 3gu7 n LYS 276 N -3.89 2.69 0.00 0.38 3.00 -0.01 -5.01 118.16 115.32 3gu7 n LYS 276 Ca -0.49 0.98 0.00 0.00 -0.00 0.00 0.00 58.31 58.80 3gu7 n LYS 276 Cb 0.92 -2.87 0.00 0.00 0.00 0.00 0.00 35.03 33.08 3gu7 n LYS 276 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 3gu7 n PRO 277 N 5.94 0.27 0.00 1.64 -0.02 -1.26 -4.89 135.00 136.68 3gu7 n PRO 277 Ca 0.19 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 3gu7 n PRO 277 Cb 0.36 -1.00 0.00 0.00 -0.02 0.00 0.00 33.50 32.84 3gu7 n PRO 277 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3gu7 n PRO 291 N -0.50 0.00 0.17 0.52 -0.04 -1.26 -5.14 135.00 128.74 3gu7 n PRO 291 Ca 0.00 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.59 3gu7 n PRO 291 Cb 0.00 0.00 0.34 0.00 -0.04 0.00 0.00 33.50 33.80 3gu7 n PRO 291 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 3gu7 h GLN 292 N 0.00 0.00 -5.85 0.54 -0.00 -1.87 -3.43 115.11 104.50 3gu7 h GLN 292 Ca 0.00 0.00 -0.63 0.00 -0.00 0.00 0.00 58.65 58.02 3gu7 h GLN 292 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 27.48 27.43 3gu7 h GLN 292 CO 0.00 0.00 -0.47 -0.06 -0.00 0.00 0.00 178.83 178.30 3gu7 s PHE 293 N -3.22 3.55 -2.00 0.06 0.08 -1.26 -4.62 117.98 110.57 3gu7 s PHE 293 Ca 0.08 0.37 0.22 0.00 0.12 0.00 0.00 56.93 57.72 3gu7 s PHE 293 Cb 0.09 -1.84 1.29 0.00 -0.57 0.00 0.00 43.02 41.99 3gu7 s PHE 293 CO 0.60 0.63 1.67 0.39 -0.10 0.00 0.00 175.22 178.41