#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gqw s ARG 16 N 0.00 0.00 -1.18 -0.52 0.52 -1.26 -5.11 118.95 111.40 3gqw s ARG 16 Ca 0.00 0.00 -0.07 0.00 -0.52 0.00 0.00 55.73 55.14 3gqw s ARG 16 Cb 0.00 0.00 0.24 0.00 0.52 0.00 0.00 34.95 35.71 3gqw s ARG 16 CO 0.00 -0.00 1.68 0.66 0.02 0.00 0.00 175.30 177.66 3gqw n TYR 17 N 2.25 2.59 -1.11 -0.53 4.02 -1.26 -4.28 117.16 118.84 3gqw n TYR 17 Ca -0.13 -2.68 -0.04 0.00 -0.01 0.00 0.00 57.90 55.04 3gqw n TYR 17 Cb 0.57 -1.60 -0.02 0.00 -0.02 0.00 0.00 39.34 38.27 3gqw n TYR 17 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3gqw n ALA 18 N 2.59 -0.06 -0.02 -0.72 0.00 -0.77 -4.49 120.51 117.04 3gqw n ALA 18 Ca 0.33 0.06 0.09 0.00 0.00 0.00 0.00 53.44 53.92 3gqw n ALA 18 Cb 0.35 -1.44 0.14 0.00 0.00 0.00 0.00 19.45 18.50 3gqw n ALA 18 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3gqw n ASP 19 N -0.91 0.00 -4.88 0.00 8.00 -1.26 -4.55 116.55 112.95 3gqw n ASP 19 Ca -0.04 0.34 -0.30 0.00 0.71 0.00 0.00 54.79 55.50 3gqw n ASP 19 Cb 0.48 -0.09 -0.02 0.00 -0.02 0.00 0.00 41.12 41.47 3gqw n ASP 19 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3gqw s PHE 20 N -2.99 3.49 0.17 1.24 0.08 -1.26 -5.00 117.98 113.72 3gqw s PHE 20 Ca -0.01 0.98 -0.06 0.00 0.12 0.00 0.00 56.93 57.96 3gqw s PHE 20 Cb 0.05 -2.40 0.06 0.00 -0.57 0.00 0.00 43.02 40.16 3gqw s PHE 20 CO 0.16 -0.14 1.50 -1.35 -0.10 0.00 0.00 175.22 175.28 3gqw h PRO 21 N 1.03 0.71 -4.07 0.24 0.11 -1.96 -3.47 132.00 124.60 3gqw h PRO 21 Ca -0.47 -0.41 -0.21 0.00 0.11 0.00 0.00 66.00 65.02 3gqw h PRO 21 Cb 1.19 0.03 -0.23 0.00 0.11 0.00 0.00 31.00 32.11 3gqw h PRO 21 CO 0.63 1.03 -0.71 0.99 -0.21 0.00 0.00 178.00 179.73 3gqw s THR 22 N -4.17 0.19 0.41 -1.15 2.01 -1.26 -4.17 115.64 107.51 3gqw s THR 22 Ca -0.09 -0.74 0.10 0.00 0.31 0.00 0.00 61.69 61.27 3gqw s THR 22 Cb 0.11 -0.29 0.30 0.00 0.01 0.00 0.00 72.50 72.63 3gqw s THR 22 CO 0.86 -0.35 2.00 -0.07 -0.69 0.00 0.00 174.62 176.37 3gqw h LEU 23 N 4.98 0.46 -0.18 4.42 3.38 -1.91 0.15 115.31 126.61 3gqw h LEU 23 Ca -0.31 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.62 3gqw h LEU 23 Cb 1.21 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 3gqw h LEU 23 CO 0.43 0.30 -0.05 0.58 0.09 0.00 0.00 178.44 179.80 3gqw h VAL 24 N 0.53 1.29 -0.39 1.22 2.07 -1.96 0.34 116.25 119.35 3gqw h VAL 24 Ca 0.24 -1.02 0.08 0.00 0.82 0.00 0.00 66.70 66.82 3gqw h VAL 24 Cb 0.28 1.59 -0.09 0.00 -1.52 0.00 0.00 31.29 31.55 3gqw h VAL 24 CO -0.07 0.31 -0.21 0.44 0.02 0.00 0.00 177.57 178.06 3gqw h ASP 25 N 0.07 -0.72 -0.10 0.57 3.32 -1.64 0.12 116.42 118.04 3gqw h ASP 25 Ca 0.05 0.16 0.04 0.00 0.02 0.00 0.00 57.03 57.29 3gqw h ASP 25 Cb 0.49 0.38 -0.06 0.00 0.22 0.00 0.00 39.33 40.35 3gqw h ASP 25 CO 0.02 -0.24 -0.38 0.00 -1.72 0.00 0.00 179.24 176.92 3gqw h ALA 26 N 1.09 -0.52 -0.30 3.45 0.00 -0.35 -2.02 119.26 120.62 3gqw h ALA 26 Ca 0.19 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 3gqw h ALA 26 Cb 0.44 0.70 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 3gqw h ALA 26 CO -0.48 -0.88 -0.05 1.25 0.00 0.00 0.00 179.25 179.10 3gqw h LEU 27 N -0.47 0.44 -0.88 0.00 5.85 -0.58 -2.25 115.31 117.42 3gqw h LEU 27 Ca 0.08 -0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.78 3gqw h LEU 27 Cb 0.60 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.45 3gqw h LEU 27 CO -0.36 0.54 0.54 0.44 -0.34 0.00 0.00 178.44 179.27 3gqw h ASP 28 N 0.45 0.84 -0.01 1.25 5.19 -0.06 -0.04 116.42 124.03 3gqw h ASP 28 Ca 0.09 0.02 -0.12 0.00 -0.62 0.00 0.00 57.03 56.41 3gqw h ASP 28 Cb 0.36 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.71 3gqw h ASP 28 CO 0.02 0.53 -0.35 0.22 -3.12 0.00 0.00 179.24 176.53 3gqw h TYR 29 N 0.97 0.58 0.00 4.55 3.20 -0.90 -3.22 116.97 122.15 3gqw h TYR 29 Ca 0.39 -0.15 -0.12 0.00 3.14 0.00 0.00 58.73 61.99 3gqw h TYR 29 Cb 0.22 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 3gqw h TYR 29 CO -0.03 0.79 -0.57 0.00 -1.64 0.00 0.00 178.16 176.71 3gqw h ALA 30 N 1.20 0.71 0.00 1.82 0.00 -0.84 -2.65 119.26 119.50 3gqw h ALA 30 Ca 0.05 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.44 3gqw h ALA 30 Cb 0.82 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3gqw h ALA 30 CO 0.07 0.71 0.00 0.00 0.00 0.00 0.00 179.25 180.02 3gqw n ALA 31 N -2.27 1.74 1.03 0.00 0.00 -0.16 -1.15 120.51 119.70 3gqw n ALA 31 Ca 0.01 -0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.50 3gqw n ALA 31 Cb 0.71 -1.18 0.08 0.00 0.00 0.00 0.00 19.45 19.06 3gqw n ALA 31 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3gqw n LEU 32 N -1.22 0.99 0.00 0.00 4.77 -1.00 -4.05 117.00 116.49 3gqw n LEU 32 Ca 0.06 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.69 3gqw n LEU 32 Cb 0.08 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 3gqw n LEU 32 CO 0.08 0.22 0.00 -1.54 -1.33 0.00 0.00 177.39 174.82 3gqw n SER 33 N -1.18 0.00 -0.10 -1.43 3.41 -0.30 -5.03 113.62 108.99 3gqw n SER 33 Ca 0.06 -0.98 0.01 0.00 -0.26 0.00 0.00 58.87 57.71 3gqw n SER 33 Cb 0.35 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.33 3gqw n SER 33 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3gqw n SER 34 N -2.93 1.99 -4.91 4.04 3.41 -1.26 -4.70 113.62 109.27 3gqw n SER 34 Ca 0.00 -1.85 -0.28 0.00 -0.26 0.00 0.00 58.87 56.47 3gqw n SER 34 Cb 0.00 -0.03 0.08 0.00 -0.26 0.00 0.00 64.21 64.00 3gqw n SER 34 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gqw s ALA 35 N -0.86 2.77 0.00 7.33 0.00 -1.26 -4.92 121.76 124.82 3gqw s ALA 35 Ca 0.04 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.30 3gqw s ALA 35 Cb 0.02 -2.89 0.00 0.00 0.00 0.00 0.00 23.12 20.25 3gqw s ALA 35 CO 0.03 -1.57 0.00 0.41 0.00 0.00 0.00 175.76 174.62 3gqw n GLY 36 N -3.22 -0.38 3.19 0.00 0.00 -1.26 -1.84 105.19 101.67 3gqw n GLY 36 Ca 0.08 0.65 0.04 0.00 0.00 0.00 0.00 46.02 46.79 3gqw n GLY 36 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3gqw s ASN 38 N -4.00 -0.23 -0.26 1.61 0.01 -0.26 -2.38 114.94 109.44 3gqw s ASN 38 Ca 0.00 0.22 -0.17 0.00 -0.71 0.00 0.00 52.86 52.20 3gqw s ASN 38 Cb 0.00 1.22 -0.03 0.00 0.41 0.00 0.00 41.25 42.85 3gqw s ASN 38 CO 0.00 -0.04 0.47 -0.36 -1.51 0.00 0.00 177.10 175.66 3gqw s PHE 39 N 2.58 3.26 -0.02 2.20 0.08 0.18 -0.99 117.98 125.28 3gqw s PHE 39 Ca -0.03 0.56 0.01 0.00 0.12 0.00 0.00 56.93 57.59 3gqw s PHE 39 Cb -0.06 -2.67 -0.03 0.00 -0.57 0.00 0.00 43.02 39.68 3gqw s PHE 39 CO -0.12 -0.27 -0.02 0.71 -0.10 0.00 0.00 175.22 175.42 3gqw s TYR 40 N 2.23 3.04 0.63 0.36 1.51 -0.56 -0.43 117.35 124.13 3gqw s TYR 40 Ca 0.19 0.07 -0.11 0.00 -1.01 0.00 0.00 57.07 56.22 3gqw s TYR 40 Cb -0.16 -1.68 0.15 0.00 -0.11 0.00 0.00 41.96 40.16 3gqw s TYR 40 CO 0.09 0.43 0.82 -0.40 -1.11 0.00 0.00 175.55 175.39 3gqw n ASP 41 N 1.63 -0.13 0.00 2.29 5.68 -0.41 -4.38 116.55 121.23 3gqw n ASP 41 Ca -0.16 -1.26 0.11 0.00 -0.50 0.00 0.00 54.79 52.98 3gqw n ASP 41 Cb 0.53 -0.64 0.64 0.00 -1.14 0.00 0.00 41.12 40.51 3gqw n ASP 41 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 3gqw n ARG 42 N -2.86 0.70 -0.81 0.11 1.85 -1.26 -1.85 116.66 112.53 3gqw n ARG 42 Ca 0.10 0.00 -0.02 0.00 -1.00 0.00 0.00 57.85 56.94 3gqw n ARG 42 Cb 0.36 -1.48 0.19 0.00 -1.05 0.00 0.00 32.46 30.48 3gqw n ARG 42 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 3gqw n ARG 43 N -0.98 1.86 -4.08 2.89 1.74 -1.26 -4.97 116.66 111.85 3gqw n ARG 43 Ca 0.16 -3.32 -0.34 0.00 -0.77 0.00 0.00 57.85 53.58 3gqw n ARG 43 Cb 0.07 -1.77 -0.03 0.00 -1.02 0.00 0.00 32.46 29.72 3gqw n ARG 43 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3gqw s GLN 45 N -7.03 3.06 0.00 0.00 -1.52 -1.26 -4.91 119.66 108.00 3gqw s GLN 45 Ca 0.20 -0.84 -0.30 0.00 -1.95 0.00 0.00 55.36 52.47 3gqw s GLN 45 Cb -0.10 -2.35 -0.09 0.00 -0.22 0.00 0.00 33.01 30.25 3gqw s GLN 45 CO 0.95 0.21 2.00 -0.11 -0.25 0.00 0.00 175.29 178.09 3gqw n LEU 46 N 3.45 4.05 -0.02 2.90 0.00 -1.26 -1.29 117.00 124.82 3gqw n LEU 46 Ca -0.19 0.83 0.03 0.00 0.00 0.00 0.00 56.01 56.68 3gqw n LEU 46 Cb 0.53 -1.52 -0.10 0.00 0.00 0.00 0.00 43.42 42.32 3gqw n LEU 46 CO 0.28 0.10 -0.73 1.21 0.00 0.00 0.00 177.39 178.25 3gqw n GLU 47 N 7.64 0.90 -3.64 1.96 2.13 0.43 -4.92 120.64 125.14 3gqw n GLU 47 Ca 0.21 -0.08 -0.04 0.00 0.66 0.00 0.00 57.16 57.90 3gqw n GLU 47 Cb 0.41 -1.31 -0.07 0.00 0.27 0.00 0.00 31.44 30.74 3gqw n GLU 47 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 3gqw s ASP 48 N -3.81 -0.15 0.10 4.31 2.15 -1.08 -5.02 116.67 113.17 3gqw s ASP 48 Ca -0.05 0.27 0.08 0.00 0.43 0.00 0.00 52.55 53.28 3gqw s ASP 48 Cb 0.07 0.27 -0.03 0.00 -0.30 0.00 0.00 42.92 42.92 3gqw s ASP 48 CO 0.53 -0.06 -0.21 -1.58 -0.17 0.00 0.00 175.17 173.68 3gqw s GLN 49 N -0.12 1.13 -0.23 4.34 0.74 -1.26 -0.64 119.66 123.62 3gqw s GLN 49 Ca 0.06 -1.14 -0.04 0.00 0.05 0.00 0.00 55.36 54.29 3gqw s GLN 49 Cb -0.04 -1.39 0.09 0.00 1.10 0.00 0.00 33.01 32.77 3gqw s GLN 49 CO -0.12 0.32 0.18 -1.17 -0.55 0.00 0.00 175.29 173.95 3gqw s LEU 50 N -1.86 0.14 0.34 3.68 2.96 -1.26 -5.01 118.68 117.67 3gqw s LEU 50 Ca 0.06 -0.67 -0.25 0.00 -0.22 0.00 0.00 54.13 53.05 3gqw s LEU 50 Cb -0.10 0.07 -0.10 0.00 0.50 0.00 0.00 46.19 46.56 3gqw s LEU 50 CO 0.04 -0.37 0.96 -1.61 -1.32 0.00 0.00 176.35 174.05 3gqw s GLU 51 N 2.23 4.51 0.19 1.98 2.02 -1.26 -4.42 118.70 123.95 3gqw s GLU 51 Ca 0.07 1.33 -0.12 0.00 0.02 0.00 0.00 54.97 56.26 3gqw s GLU 51 Cb -0.16 -2.71 0.12 0.00 0.10 0.00 0.00 34.13 31.49 3gqw s GLU 51 CO -0.21 0.21 1.85 1.88 0.02 0.00 0.00 175.26 179.01 3gqw h TYR 52 N 2.98 0.79 -0.67 1.61 0.05 -1.65 0.57 116.97 120.63 3gqw h TYR 52 Ca -0.47 0.02 0.12 0.00 0.05 0.00 0.00 58.73 58.44 3gqw h TYR 52 Cb 1.19 -0.26 -0.12 0.00 1.01 0.00 0.00 36.73 38.54 3gqw h TYR 52 CO 0.61 0.48 -0.34 0.37 -1.05 0.00 0.00 178.16 178.24 3gqw h GLN 53 N 0.84 -0.12 -0.49 4.88 4.15 -1.75 0.12 115.11 122.75 3gqw h GLN 53 Ca 0.24 0.01 -0.07 0.00 0.77 0.00 0.00 58.65 59.60 3gqw h GLN 53 Cb -0.07 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.63 3gqw h GLN 53 CO -0.06 -0.08 0.03 1.15 -1.93 0.00 0.00 178.83 177.94 3gqw h THR 54 N -0.12 1.26 -0.58 2.39 2.02 -1.54 -3.08 112.91 113.26 3gqw h THR 54 Ca 0.26 -1.01 0.08 0.00 0.77 0.00 0.00 66.41 66.51 3gqw h THR 54 Cb 0.56 0.96 -0.07 0.00 -1.74 0.00 0.00 68.15 67.86 3gqw h THR 54 CO -0.74 0.36 0.22 0.25 0.37 0.00 0.00 175.52 175.98 3gqw h LEU 55 N 0.70 0.24 -0.48 2.58 5.85 0.14 -1.33 115.31 123.01 3gqw h LEU 55 Ca 0.14 0.07 0.10 0.00 0.84 0.00 0.00 57.88 59.03 3gqw h LEU 55 Cb 0.46 0.04 -0.09 0.00 0.37 0.00 0.00 40.66 41.45 3gqw h LEU 55 CO 0.02 0.15 -0.10 0.50 -0.34 0.00 0.00 178.44 178.67 3gqw h LYS 56 N 0.41 0.02 0.92 1.25 3.64 -0.73 0.18 116.57 122.26 3gqw h LYS 56 Ca 0.28 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.62 3gqw h LYS 56 Cb 0.32 -0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.14 3gqw h LYS 56 CO -0.27 0.01 -0.46 0.00 -2.27 0.00 0.00 179.45 176.46 3gqw h ALA 57 N 1.47 -1.26 -0.56 5.00 0.00 -1.34 -0.07 119.26 122.50 3gqw h ALA 57 Ca 0.23 -0.27 0.13 0.00 0.00 0.00 0.00 54.91 55.00 3gqw h ALA 57 Cb 0.35 0.51 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 3gqw h ALA 57 CO -0.48 -1.21 0.39 0.00 0.00 0.00 0.00 179.25 177.95 3gqw h ARG 58 N -1.26 0.16 -0.18 0.00 3.08 -1.08 -1.14 114.38 113.97 3gqw h ARG 58 Ca -0.13 -0.01 -0.13 0.00 0.07 0.00 0.00 59.98 59.78 3gqw h ARG 58 Cb 0.97 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.98 3gqw h ARG 58 CO 0.20 0.11 -0.40 0.00 -1.07 0.00 0.00 179.97 178.81 3gqw h ALA 59 N 1.73 0.30 0.37 0.04 0.00 -0.24 -1.21 119.26 120.25 3gqw h ALA 59 Ca 0.26 -0.45 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 3gqw h ALA 59 Cb 0.82 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3gqw h ALA 59 CO -0.04 0.39 -0.19 0.93 0.00 0.00 0.00 179.25 180.35 3gqw h GLU 60 N 0.26 -0.49 -0.05 0.00 5.08 -0.01 0.98 114.58 120.34 3gqw h GLU 60 Ca 0.00 0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.43 3gqw h GLU 60 Cb 1.00 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 30.32 3gqw h GLU 60 CO 0.09 -0.33 -0.17 0.00 -1.00 0.00 0.00 179.01 177.60 3gqw h ALA 61 N 0.12 -0.16 -0.87 3.43 0.00 -1.32 -2.01 119.26 118.46 3gqw h ALA 61 Ca -0.05 0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.98 3gqw h ALA 61 Cb 0.40 0.31 -0.07 0.00 0.00 0.00 0.00 17.79 18.42 3gqw h ALA 61 CO 0.08 -0.64 0.51 0.78 0.00 0.00 0.00 179.25 179.98 3gqw h GLY 62 N -0.24 1.35 0.61 0.00 0.00 -1.14 0.36 103.07 104.01 3gqw h GLY 62 Ca 0.07 -0.35 0.11 0.00 0.00 0.00 0.00 47.33 47.16 3gqw h GLY 62 CO -0.20 0.16 0.60 0.00 0.00 0.00 0.00 176.54 177.10 3gqw h ALA 63 N 1.46 1.61 0.02 3.60 0.00 -0.11 0.39 119.26 126.23 3gqw h ALA 63 Ca 0.41 0.01 -0.27 0.00 0.00 0.00 0.00 54.91 55.06 3gqw h ALA 63 Cb 0.35 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 17.96 3gqw h ALA 63 CO -0.24 0.18 -1.05 0.87 0.00 0.00 0.00 179.25 179.01 3gqw h LYS 64 N 0.92 0.68 0.10 0.00 1.57 -0.36 -2.69 116.57 116.78 3gqw h LYS 64 Ca 0.45 -0.76 0.02 0.00 -1.87 0.00 0.00 60.65 58.49 3gqw h LYS 64 Cb 0.46 0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.95 3gqw h LYS 64 CO -0.21 1.33 -0.34 0.00 -0.57 0.00 0.00 179.45 179.66 3gqw h ARG 65 N 0.35 -0.53 -1.01 3.15 3.08 -0.55 -1.30 114.38 117.57 3gqw h ARG 65 Ca -0.14 0.04 0.23 0.00 0.07 0.00 0.00 59.98 60.18 3gqw h ARG 65 Cb 1.71 0.12 -0.10 0.00 0.08 0.00 0.00 29.97 31.78 3gqw h ARG 65 CO 0.21 -0.35 0.63 -0.07 -1.07 0.00 0.00 179.97 179.31 3gqw h LEU 66 N -0.55 0.58 -0.79 3.04 3.38 -0.96 0.45 115.31 120.46 3gqw h LEU 66 Ca 0.04 0.09 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 3gqw h LEU 66 Cb 0.59 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 3gqw h LEU 66 CO -0.21 0.15 -0.47 -0.07 0.09 0.00 0.00 178.44 177.92 3gqw h LEU 67 N 0.53 0.00 -1.53 1.67 3.38 -1.04 -2.65 115.31 115.66 3gqw h LEU 67 Ca 0.59 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.56 3gqw h LEU 67 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 3gqw h LEU 67 CO -0.34 0.47 0.00 0.77 0.09 0.00 0.00 178.44 179.43 3gqw h SER 68 N 0.00 0.00 -0.18 -0.43 4.64 -0.21 0.16 113.55 117.53 3gqw h SER 68 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3gqw h SER 68 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 3gqw h SER 68 CO 0.06 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.20 3gqw n LEU 69 N -2.42 2.33 -3.89 5.97 4.77 -1.00 -4.89 117.00 117.87 3gqw n LEU 69 Ca -0.01 -1.18 -0.31 0.00 -0.03 0.00 0.00 56.01 54.49 3gqw n LEU 69 Cb 0.09 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 3gqw n LEU 69 CO 0.14 0.36 0.04 0.59 -1.33 0.00 0.00 177.39 177.19 3gqw n ASN 70 N 0.19 -4.22 -4.80 -1.43 5.03 0.55 -4.95 115.26 105.63 3gqw n ASN 70 Ca 0.08 -0.77 -0.38 0.00 0.87 0.00 0.00 54.58 54.38 3gqw n ASN 70 Cb 0.51 -3.41 -0.06 0.00 -1.02 0.00 0.00 39.78 35.80 3gqw n ASN 70 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3gqw s LEU 71 N -7.13 4.47 0.06 3.41 1.43 -1.25 -5.07 118.68 114.60 3gqw s LEU 71 Ca 0.64 1.14 -0.01 0.00 -1.03 0.00 0.00 54.13 54.87 3gqw s LEU 71 Cb -0.33 -2.82 -0.04 0.00 0.03 0.00 0.00 46.19 43.03 3gqw s LEU 71 CO 0.79 0.23 0.22 -0.54 0.23 0.00 0.00 176.35 177.28 3gqw s LYS 72 N -0.76 3.45 0.44 1.70 3.01 -1.26 -4.86 119.74 121.47 3gqw s LYS 72 Ca 0.28 -0.40 -0.22 0.00 -1.01 0.00 0.00 55.97 54.62 3gqw s LYS 72 Cb -0.18 -3.03 -0.12 0.00 -1.01 0.00 0.00 37.83 33.49 3gqw s LYS 72 CO 0.17 0.60 0.54 1.17 0.51 0.00 0.00 175.35 178.34 3gqw n LYS 73 N 0.32 0.57 0.00 1.68 4.81 -1.26 -1.56 118.16 122.72 3gqw n LYS 73 Ca -0.05 0.21 0.00 0.00 -0.87 0.00 0.00 58.31 57.60 3gqw n LYS 73 Cb 0.51 -1.52 0.00 0.00 0.02 0.00 0.00 35.03 34.04 3gqw n LYS 73 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3gqw n GLY 74 N 1.79 2.84 3.69 3.14 0.00 -1.19 -5.02 105.19 110.44 3gqw n GLY 74 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 3gqw n GLY 74 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3gqw n ASP 75 N 0.35 1.39 -4.78 1.61 8.00 -0.60 -4.44 116.55 118.08 3gqw n ASP 75 Ca 0.00 0.73 -0.35 0.00 0.71 0.00 0.00 54.79 55.88 3gqw n ASP 75 Cb 0.00 -1.50 -0.08 0.00 -0.02 0.00 0.00 41.12 39.52 3gqw n ASP 75 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3gqw s ARG 76 N -3.53 3.15 -0.25 -1.24 0.52 -1.26 0.44 118.95 116.78 3gqw s ARG 76 Ca 0.78 -0.35 0.00 0.00 -0.52 0.00 0.00 55.73 55.64 3gqw s ARG 76 Cb -0.35 -2.93 0.07 0.00 0.52 0.00 0.00 34.95 32.26 3gqw s ARG 76 CO 0.45 0.70 -0.01 0.08 0.02 0.00 0.00 175.30 176.55 3gqw s VAL 77 N -1.04 1.35 0.08 3.52 1.01 -0.06 -0.43 120.40 124.82 3gqw s VAL 77 Ca 0.17 -1.26 -0.31 0.00 0.00 0.00 0.00 61.98 60.59 3gqw s VAL 77 Cb -0.12 -1.75 -0.08 0.00 0.00 0.00 0.00 36.38 34.44 3gqw s VAL 77 CO 0.07 -0.25 1.46 0.00 0.00 0.00 0.00 175.10 176.38 3gqw s ALA 78 N 1.45 3.62 -0.09 5.51 0.00 -0.63 -2.08 121.76 129.55 3gqw s ALA 78 Ca -0.01 1.09 0.02 0.00 0.00 0.00 0.00 51.96 53.06 3gqw s ALA 78 Cb -0.18 -3.59 -0.02 0.00 0.00 0.00 0.00 23.12 19.32 3gqw s ALA 78 CO -0.10 -0.81 -0.13 -0.51 0.00 0.00 0.00 175.76 174.22 3gqw s LEU 79 N 1.76 2.78 -0.65 0.00 1.43 -0.54 -0.98 118.68 122.48 3gqw s LEU 79 Ca 0.67 -0.23 -0.27 0.00 -1.03 0.00 0.00 54.13 53.26 3gqw s LEU 79 Cb -0.37 -1.60 0.03 0.00 0.03 0.00 0.00 46.19 44.29 3gqw s LEU 79 CO 0.30 0.26 1.19 -0.63 0.23 0.00 0.00 176.35 177.70 3gqw s ILE 80 N -0.24 3.95 -1.29 -0.59 -1.09 -0.85 -0.07 121.20 121.01 3gqw s ILE 80 Ca 0.01 0.55 -0.18 0.00 -2.23 0.00 0.00 60.65 58.81 3gqw s ILE 80 Cb -0.13 -4.79 0.03 0.00 -1.58 0.00 0.00 42.46 35.99 3gqw s ILE 80 CO 0.03 -1.55 1.91 0.00 -1.23 0.00 0.00 174.94 174.10 3gqw n ALA 81 N 8.70 3.83 -2.05 9.38 0.00 0.14 -4.82 120.51 135.70 3gqw n ALA 81 Ca 0.05 -3.71 -0.30 0.00 0.00 0.00 0.00 53.44 49.48 3gqw n ALA 81 Cb 0.49 -3.58 -0.00 0.00 0.00 0.00 0.00 19.45 16.36 3gqw n ALA 81 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3gqw s GLU 82 N 4.30 3.63 -1.26 0.00 2.02 -1.26 -4.16 118.70 121.97 3gqw s GLU 82 Ca 0.54 0.54 -0.18 0.00 0.02 0.00 0.00 54.97 55.89 3gqw s GLU 82 Cb 0.07 -2.23 0.08 0.00 0.10 0.00 0.00 34.13 32.15 3gqw s GLU 82 CO 0.05 -0.35 1.67 0.99 0.02 0.00 0.00 175.26 177.64 3gqw s THR 83 N -2.88 4.22 -0.09 3.63 2.01 -1.26 -4.68 115.64 116.58 3gqw s THR 83 Ca 0.52 -1.90 -0.13 0.00 0.31 0.00 0.00 61.69 60.49 3gqw s THR 83 Cb -0.11 -5.15 0.03 0.00 0.01 0.00 0.00 72.50 67.28 3gqw s THR 83 CO 0.46 -1.97 0.33 -0.94 -0.69 0.00 0.00 174.62 171.81 3gqw s SER 84 N 4.13 -0.30 0.48 3.53 1.04 -1.26 -4.93 113.70 116.37 3gqw s SER 84 Ca 0.52 0.50 0.32 0.00 0.48 0.00 0.00 55.95 57.76 3gqw s SER 84 Cb 0.03 0.58 1.42 0.00 0.10 0.00 0.00 66.02 68.15 3gqw s SER 84 CO 0.05 -0.22 1.72 -1.28 0.98 0.00 0.00 173.24 174.49 3gqw h SER 85 N 5.06 0.19 -0.21 7.02 0.87 -1.96 0.09 113.55 124.60 3gqw h SER 85 Ca -0.27 0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.33 3gqw h SER 85 Cb 1.18 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 63.17 3gqw h SER 85 CO 0.33 -0.02 0.06 -0.33 -0.53 0.00 0.00 176.83 176.33 3gqw h GLU 86 N 0.13 0.34 -0.52 2.24 5.08 -1.95 -2.67 114.58 117.23 3gqw h GLU 86 Ca 0.69 -0.08 -0.12 0.00 -1.00 0.00 0.00 59.36 58.86 3gqw h GLU 86 Cb 2.34 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 31.52 3gqw h GLU 86 CO -0.20 0.44 -0.14 0.35 -1.00 0.00 0.00 179.01 178.46 3gqw h PHE 87 N 0.17 1.14 0.01 4.33 3.57 -1.27 -2.42 116.94 122.48 3gqw h PHE 87 Ca 0.07 -0.25 0.01 0.00 3.53 0.00 0.00 57.97 61.32 3gqw h PHE 87 Cb 0.24 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 3gqw h PHE 87 CO 0.00 1.07 -0.05 0.28 -2.23 0.00 0.00 178.31 177.39 3gqw h VAL 88 N 0.88 0.88 -0.21 1.41 2.07 -1.43 -1.08 116.25 118.77 3gqw h VAL 88 Ca 0.13 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.69 3gqw h VAL 88 Cb 0.72 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 3gqw h VAL 88 CO 0.05 0.00 -0.00 -0.33 0.02 0.00 0.00 177.57 177.31 3gqw h GLU 89 N -0.09 0.06 -0.85 1.57 5.08 -1.41 -2.02 114.58 116.92 3gqw h GLU 89 Ca 0.02 -0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.47 3gqw h GLU 89 Cb 0.11 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.27 3gqw h GLU 89 CO -0.04 0.04 0.49 0.00 -1.00 0.00 0.00 179.01 178.50 3gqw h ALA 90 N 1.18 1.22 -0.01 3.43 0.00 -1.24 0.27 119.26 124.11 3gqw h ALA 90 Ca 0.10 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 3gqw h ALA 90 Cb 0.13 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3gqw h ALA 90 CO -0.17 0.11 0.01 0.35 0.00 0.00 0.00 179.25 179.54 3gqw h PHE 91 N 0.81 0.02 -0.04 0.00 3.04 -0.50 -1.90 116.94 118.37 3gqw h PHE 91 Ca 0.41 -0.00 -0.15 0.00 3.98 0.00 0.00 57.97 62.21 3gqw h PHE 91 Cb 0.39 -0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.88 3gqw h PHE 91 CO -0.06 0.14 -0.67 0.74 -2.02 0.00 0.00 178.31 176.44 3gqw h PHE 92 N -0.11 0.22 -0.93 0.41 0.04 -1.16 -1.97 116.94 113.44 3gqw h PHE 92 Ca 0.00 -0.09 0.21 0.00 2.80 0.00 0.00 57.97 60.89 3gqw h PHE 92 Cb 0.13 -0.04 -0.07 0.00 2.20 0.00 0.00 35.95 38.17 3gqw h PHE 92 CO -0.03 0.78 0.61 0.00 -0.60 0.00 0.00 178.31 179.07 3gqw h ALA 93 N 1.19 2.16 -0.21 2.45 0.00 -0.32 -0.46 119.26 124.06 3gqw h ALA 93 Ca -0.01 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 3gqw h ALA 93 Cb 1.19 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 3gqw h ALA 93 CO 0.10 -0.46 -0.20 0.00 0.00 0.00 0.00 179.25 178.68 3gqw h GLN 95 N 0.20 0.20 -0.10 0.00 1.08 -0.89 0.11 115.11 115.71 3gqw h GLN 95 Ca 0.04 -0.01 -0.09 0.00 -1.45 0.00 0.00 58.65 57.13 3gqw h GLN 95 Cb 0.75 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 28.12 3gqw h GLN 95 CO 0.05 0.13 -0.36 1.88 -0.95 0.00 0.00 178.83 179.59 3gqw h TYR 96 N 0.21 0.23 -0.06 2.96 -1.99 -1.19 -1.85 116.97 115.28 3gqw h TYR 96 Ca 0.12 -0.05 0.00 0.00 2.00 0.00 0.00 58.73 60.79 3gqw h TYR 96 Cb 0.09 -0.06 0.00 0.00 2.00 0.00 0.00 36.73 38.76 3gqw h TYR 96 CO -0.13 0.54 0.00 0.00 -0.00 0.00 0.00 178.16 178.57 3gqw n ALA 97 N -2.47 2.58 -1.10 3.88 0.00 -0.89 -4.65 120.51 117.85 3gqw n ALA 97 Ca -0.01 -0.33 -0.04 0.00 0.00 0.00 0.00 53.44 53.06 3gqw n ALA 97 Cb 0.43 -1.23 -0.02 0.00 0.00 0.00 0.00 19.45 18.63 3gqw n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gqw n GLY 98 N 1.01 0.55 3.87 0.00 0.00 -0.60 -4.76 105.19 105.26 3gqw n GLY 98 Ca 0.17 -0.15 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3gqw n GLY 98 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gqw s LEU 99 N -0.82 3.94 -0.46 0.99 1.43 0.29 -3.15 118.68 120.91 3gqw s LEU 99 Ca 0.00 1.09 -0.23 0.00 -1.03 0.00 0.00 54.13 53.96 3gqw s LEU 99 Cb 0.00 -3.93 0.03 0.00 0.03 0.00 0.00 46.19 42.31 3gqw s LEU 99 CO 0.00 -0.31 0.77 -0.69 0.23 0.00 0.00 176.35 176.35 3gqw s VAL 100 N -2.21 4.66 0.28 -1.59 1.01 0.17 -4.20 120.40 118.52 3gqw s VAL 100 Ca 0.50 0.30 -0.29 0.00 0.00 0.00 0.00 61.98 62.49 3gqw s VAL 100 Cb -0.10 -4.33 -0.10 0.00 0.00 0.00 0.00 36.38 31.85 3gqw s VAL 100 CO 0.27 -0.75 1.19 0.00 0.00 0.00 0.00 175.10 175.82 3gqw s ALA 101 N 3.24 3.45 -0.39 5.51 0.00 -1.09 -0.89 121.76 131.59 3gqw s ALA 101 Ca 0.28 1.04 0.01 0.00 0.00 0.00 0.00 51.96 53.29 3gqw s ALA 101 Cb -0.13 -3.40 0.14 0.00 0.00 0.00 0.00 23.12 19.73 3gqw s ALA 101 CO 0.21 -0.37 0.23 0.08 0.00 0.00 0.00 175.76 175.91 3gqw s VAL 102 N -0.93 0.73 0.08 0.00 1.01 -0.89 -0.49 120.40 119.91 3gqw s VAL 102 Ca 0.48 -2.11 -0.31 0.00 0.00 0.00 0.00 61.98 60.04 3gqw s VAL 102 Cb -0.35 -1.52 -0.07 0.00 0.00 0.00 0.00 36.38 34.44 3gqw s VAL 102 CO 0.44 -0.95 1.35 -2.84 0.00 0.00 0.00 175.10 173.10 3gqw s PRO 103 N 0.72 4.34 0.11 2.72 0.02 -1.26 -1.46 135.00 140.20 3gqw s PRO 103 Ca 0.18 1.98 0.09 0.00 0.02 0.00 0.00 61.00 63.27 3gqw s PRO 103 Cb -0.23 -3.35 -0.04 0.00 0.02 0.00 0.00 34.50 30.90 3gqw s PRO 103 CO 0.00 -0.43 -0.20 -0.51 -0.33 0.00 0.00 177.00 175.54 3gqw s LEU 104 N 1.40 2.62 0.24 -5.54 1.43 0.91 -4.65 118.68 115.08 3gqw s LEU 104 Ca 0.63 -0.58 -0.23 0.00 -1.03 0.00 0.00 54.13 52.92 3gqw s LEU 104 Cb -0.34 -1.49 -0.09 0.00 0.03 0.00 0.00 46.19 44.31 3gqw s LEU 104 CO 0.29 0.19 0.80 0.00 0.23 0.00 0.00 176.35 177.86 3gqw s ALA 105 N -1.11 3.36 1.44 4.21 0.00 -1.26 -0.68 121.76 127.72 3gqw s ALA 105 Ca 0.17 0.33 -0.23 0.00 0.00 0.00 0.00 51.96 52.23 3gqw s ALA 105 Cb -0.10 -2.96 0.37 0.00 0.00 0.00 0.00 23.12 20.42 3gqw s ALA 105 CO 0.09 0.27 0.92 0.96 0.00 0.00 0.00 175.76 178.00 3gqw s ILE 106 N -1.45 1.20 0.00 0.00 -4.36 -1.26 -4.90 121.20 110.43 3gqw s ILE 106 Ca 0.43 0.00 0.00 0.00 -0.26 0.00 0.00 60.65 60.82 3gqw s ILE 106 Cb -0.19 -2.03 0.00 0.00 1.25 0.00 0.00 42.46 41.49 3gqw s ILE 106 CO 0.23 0.00 0.00 -2.65 0.24 0.00 0.00 174.94 172.76 3gqw n PRO 107 N -5.70 2.39 0.00 0.37 -0.02 -1.26 -5.08 135.00 125.70 3gqw n PRO 107 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 3gqw n PRO 107 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.08 3gqw n PRO 107 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gqw n GLY 109 N 2.73 -2.24 3.31 -1.23 0.00 -1.26 -5.06 105.19 101.43 3gqw n GLY 109 Ca 0.00 -0.41 -0.08 0.00 0.00 0.00 0.00 46.02 45.53 3gqw n GLY 109 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gqw s VAL 110 N 0.00 -0.64 0.00 1.61 1.01 -1.26 -4.53 120.40 116.58 3gqw s VAL 110 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.13 3gqw s VAL 110 Cb 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 36.38 35.68 3gqw s VAL 110 CO 0.00 0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.77 3gqw n GLY 111 N 5.32 1.71 0.73 4.51 0.00 -1.26 -4.75 105.19 111.45 3gqw n GLY 111 Ca -0.10 -0.06 0.12 0.00 0.00 0.00 0.00 46.02 45.98 3gqw n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3gqw n GLN 112 N 0.00 1.97 0.10 1.61 6.02 -1.26 -4.44 117.38 121.38 3gqw n GLN 112 Ca 0.00 -1.45 0.12 0.00 -0.01 0.00 0.00 57.00 55.66 3gqw n GLN 112 Cb 0.00 -1.45 0.46 0.00 1.02 0.00 0.00 30.24 30.27 3gqw n GLN 112 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3gqw n ARG 113 N 0.69 0.17 0.03 -1.09 5.12 -1.26 -1.52 116.66 118.81 3gqw n ARG 113 Ca 0.17 0.34 -0.20 0.00 -1.93 0.00 0.00 57.85 56.23 3gqw n ARG 113 Cb 0.44 -1.79 -0.14 0.00 -1.16 0.00 0.00 32.46 29.80 3gqw n ARG 113 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 3gqw h ASP 114 N 0.00 0.44 -0.67 0.55 5.19 -1.98 -3.23 116.42 116.72 3gqw h ASP 114 Ca 0.00 -0.81 0.13 0.00 -0.62 0.00 0.00 57.03 55.72 3gqw h ASP 114 Cb 0.43 -0.14 -0.09 0.00 0.18 0.00 0.00 39.33 39.70 3gqw h ASP 114 CO 0.00 1.71 0.20 -1.28 -3.12 0.00 0.00 179.24 176.76 3gqw h SER 115 N 0.08 0.12 -0.01 6.45 0.87 -1.72 -2.70 113.55 116.64 3gqw h SER 115 Ca -0.37 0.11 0.02 0.00 -1.23 0.00 0.00 61.79 60.33 3gqw h SER 115 Cb 2.05 0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 64.11 3gqw h SER 115 CO 0.12 0.05 -0.12 -0.25 -0.53 0.00 0.00 176.83 176.10 3gqw h TRP 116 N 0.34 -0.31 -0.33 2.24 7.01 -1.37 -2.26 115.95 121.27 3gqw h TRP 116 Ca 0.36 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.38 3gqw h TRP 116 Cb 0.55 0.14 -0.02 0.00 -2.10 0.00 0.00 29.16 27.73 3gqw h TRP 116 CO -0.21 -0.18 0.21 0.77 -2.79 0.00 0.00 178.44 176.24 3gqw h SER 117 N -0.20 0.37 -0.42 2.65 0.02 -1.53 0.37 113.55 114.81 3gqw h SER 117 Ca 0.05 -0.01 0.09 0.00 -0.84 0.00 0.00 61.79 61.07 3gqw h SER 117 Cb 0.26 -0.09 -0.09 0.00 0.14 0.00 0.00 62.40 62.62 3gqw h SER 117 CO -0.13 0.27 -0.25 0.00 -1.14 0.00 0.00 176.83 175.58 3gqw h ALA 118 N 1.12 -0.00 -0.21 3.77 0.00 -1.40 -0.74 119.26 121.80 3gqw h ALA 118 Ca 0.12 0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.22 3gqw h ALA 118 Cb -0.04 0.58 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 3gqw h ALA 118 CO -0.03 -0.62 -0.13 0.87 0.00 0.00 0.00 179.25 179.34 3gqw h LYS 119 N -0.18 -0.11 -0.92 0.00 1.57 -0.70 -2.88 116.57 113.35 3gqw h LYS 119 Ca 0.20 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 59.04 3gqw h LYS 119 Cb 0.49 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.76 3gqw h LYS 119 CO -0.52 -0.07 0.60 1.25 -0.57 0.00 0.00 179.45 180.13 3gqw h LEU 120 N -0.11 0.95 -0.98 2.94 5.85 0.46 -1.64 115.31 122.78 3gqw h LEU 120 Ca 0.12 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.73 3gqw h LEU 120 Cb 0.29 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 3gqw h LEU 120 CO -0.28 0.62 -0.50 1.56 -0.34 0.00 0.00 178.44 179.51 3gqw h GLN 121 N 1.09 0.03 -0.08 1.25 4.20 -0.96 -1.84 115.11 118.80 3gqw h GLN 121 Ca 0.38 -0.02 -0.21 0.00 0.06 0.00 0.00 58.65 58.87 3gqw h GLN 121 Cb 0.13 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.91 3gqw h GLN 121 CO -0.14 0.52 -0.79 0.78 -0.67 0.00 0.00 178.83 178.53 3gqw h GLY 122 N 1.48 0.59 0.75 3.46 0.00 -1.20 -0.99 103.07 107.16 3gqw h GLY 122 Ca -0.00 -0.88 0.04 0.00 0.00 0.00 0.00 47.33 46.49 3gqw h GLY 122 CO 0.07 0.78 0.32 -2.00 0.00 0.00 0.00 176.54 175.71 3gqw h LEU 123 N 0.35 0.49 -0.51 3.11 7.12 -1.00 -1.30 115.31 123.57 3gqw h LEU 123 Ca -0.05 0.02 -0.11 0.00 0.13 0.00 0.00 57.88 57.87 3gqw h LEU 123 Cb 1.40 -0.08 -0.02 0.00 -0.53 0.00 0.00 40.66 41.44 3gqw h LEU 123 CO 0.15 0.33 -0.12 -0.07 -0.13 0.00 0.00 178.44 178.60 3gqw h LEU 124 N 0.62 0.99 -1.59 2.25 4.07 -1.19 -2.46 115.31 118.00 3gqw h LEU 124 Ca 0.25 -0.36 -0.02 0.00 0.08 0.00 0.00 57.88 57.83 3gqw h LEU 124 Cb 0.12 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.58 3gqw h LEU 124 CO -0.15 1.12 -0.00 0.00 -1.08 0.00 0.00 178.44 178.33 3gqw h ALA 125 N 0.91 1.67 0.01 1.53 0.00 -0.87 0.15 119.26 122.65 3gqw h ALA 125 Ca 0.13 -0.11 -0.22 0.00 0.00 0.00 0.00 54.91 54.71 3gqw h ALA 125 Cb 0.68 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 3gqw h ALA 125 CO 0.05 0.25 -0.94 1.03 0.00 0.00 0.00 179.25 179.64 3gqw h SER 126 N 0.26 0.47 0.00 0.00 0.87 -0.80 -3.39 113.55 110.96 3gqw h SER 126 Ca 0.06 -0.38 0.00 0.00 -1.23 0.00 0.00 61.79 60.24 3gqw h SER 126 Cb 0.18 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 3gqw h SER 126 CO 0.00 1.19 0.00 0.00 -0.53 0.00 0.00 176.83 177.49 3gqw n GLN 128 N -0.02 -0.99 -1.92 0.00 3.00 0.50 -4.76 117.38 113.18 3gqw n GLN 128 Ca 0.00 0.51 -0.36 0.00 -0.01 0.00 0.00 57.00 57.13 3gqw n GLN 128 Cb 0.10 -3.06 0.04 0.00 0.00 0.00 0.00 30.24 27.32 3gqw n GLN 128 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.06 174.92 3gqw s PRO 129 N -5.90 2.87 0.00 -1.09 0.02 -1.26 -4.59 135.00 125.05 3gqw s PRO 129 Ca 0.28 1.93 0.23 0.00 0.02 0.00 0.00 61.00 63.47 3gqw s PRO 129 Cb -0.13 -1.94 0.18 0.00 0.02 0.00 0.00 34.50 32.63 3gqw s PRO 129 CO 0.90 -1.31 1.19 0.00 -0.33 0.00 0.00 177.00 177.45 3gqw n ALA 130 N -1.61 3.90 -3.48 -1.55 0.00 0.43 -4.73 120.51 113.46 3gqw n ALA 130 Ca 0.14 -0.51 -0.11 0.00 0.00 0.00 0.00 53.44 52.96 3gqw n ALA 130 Cb 0.49 -0.93 -0.03 0.00 0.00 0.00 0.00 19.45 18.98 3gqw n ALA 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gqw s ALA 131 N -2.80 -1.75 -0.08 0.00 0.00 -1.24 -2.69 121.76 113.20 3gqw s ALA 131 Ca 0.14 0.90 -0.03 0.00 0.00 0.00 0.00 51.96 52.97 3gqw s ALA 131 Cb 0.17 0.45 0.04 0.00 0.00 0.00 0.00 23.12 23.79 3gqw s ALA 131 CO 0.70 -0.66 0.17 -1.50 0.00 0.00 0.00 175.76 174.47 3gqw s ILE 132 N -3.00 -0.17 -0.18 0.00 2.07 -0.09 -1.60 121.20 118.23 3gqw s ILE 132 Ca 0.01 0.26 -0.08 0.00 -1.41 0.00 0.00 60.65 59.44 3gqw s ILE 132 Cb -0.01 -0.29 -0.04 0.00 0.13 0.00 0.00 42.46 42.25 3gqw s ILE 132 CO -0.08 0.11 0.09 -0.63 -1.91 0.00 0.00 174.94 172.52 3gqw s ILE 133 N 1.76 5.02 0.12 2.00 1.01 -0.15 -1.09 121.20 129.87 3gqw s ILE 133 Ca -0.03 0.05 -0.01 0.00 0.00 0.00 0.00 60.65 60.66 3gqw s ILE 133 Cb -0.12 -3.27 -0.04 0.00 0.01 0.00 0.00 42.46 39.05 3gqw s ILE 133 CO -0.06 0.46 0.03 0.28 0.00 0.00 0.00 174.94 175.65 3gqw s THR 134 N 0.30 0.18 0.53 2.92 -1.32 -0.40 -2.02 115.64 115.83 3gqw s THR 134 Ca 0.05 -1.90 -0.10 0.00 -1.21 0.00 0.00 61.69 58.54 3gqw s THR 134 Cb -0.12 -1.93 -0.05 0.00 -1.51 0.00 0.00 72.50 68.89 3gqw s THR 134 CO -0.01 -0.59 0.90 -0.83 -2.21 0.00 0.00 174.62 171.89 3gqw s GLY 135 N -3.03 1.69 0.27 6.08 0.00 -1.26 -0.85 107.32 110.22 3gqw s GLY 135 Ca 0.20 -0.22 -0.00 0.00 0.00 0.00 0.00 44.72 44.70 3gqw s GLY 135 CO -0.01 0.00 1.75 -0.55 0.00 0.00 0.00 173.10 174.30 3gqw h ASP 136 N 0.24 0.49 -0.86 1.64 3.32 -1.98 -2.24 116.42 117.04 3gqw h ASP 136 Ca -0.46 0.10 0.20 0.00 0.02 0.00 0.00 57.03 56.89 3gqw h ASP 136 Cb 1.19 0.03 -0.12 0.00 0.22 0.00 0.00 39.33 40.66 3gqw h ASP 136 CO 0.62 0.18 0.35 -0.08 -1.72 0.00 0.00 179.24 178.59 3gqw h GLU 137 N 0.58 0.39 -0.02 3.56 4.81 -2.05 -0.57 114.58 121.27 3gqw h GLU 137 Ca 0.48 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.69 3gqw h GLU 137 Cb 0.73 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.02 3gqw h GLU 137 CO -0.39 0.25 -0.24 0.91 -0.73 0.00 0.00 179.01 178.82 3gqw n TRP 138 N -5.05 0.00 -0.03 0.92 7.02 -0.88 -4.52 117.44 114.90 3gqw n TRP 138 Ca 0.20 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.58 3gqw n TRP 138 Cb 0.59 -0.01 -0.03 0.00 -2.42 0.00 0.00 31.31 29.43 3gqw n TRP 138 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 3gqw h LEU 139 N 3.11 -0.90 0.04 -0.99 5.85 -0.67 -0.23 115.31 121.52 3gqw h LEU 139 Ca 0.00 0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.87 3gqw h LEU 139 Cb 0.79 0.40 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 3gqw h LEU 139 CO 0.00 -0.32 -0.33 -0.65 -0.34 0.00 0.00 178.44 176.80 3gqw h PRO 140 N -0.32 -0.43 -0.89 5.25 0.11 -1.80 -1.67 132.00 132.25 3gqw h PRO 140 Ca 0.12 0.03 0.21 0.00 0.11 0.00 0.00 66.00 66.47 3gqw h PRO 140 Cb 0.51 0.10 -0.16 0.00 0.11 0.00 0.00 31.00 31.55 3gqw h PRO 140 CO -0.37 -0.29 -0.06 1.25 -0.21 0.00 0.00 178.00 178.31 3gqw h LEU 141 N -0.45 -0.56 0.22 2.35 5.85 -1.77 0.12 115.31 121.07 3gqw h LEU 141 Ca 0.00 0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.98 3gqw h LEU 141 Cb 0.47 0.47 -0.03 0.00 0.37 0.00 0.00 40.66 41.93 3gqw h LEU 141 CO -0.20 -0.28 -0.32 0.58 -0.34 0.00 0.00 178.44 177.88 3gqw h VAL 142 N 0.04 0.32 -0.99 1.05 2.07 -0.59 -0.43 116.25 117.71 3gqw h VAL 142 Ca 0.49 0.00 0.06 0.00 0.82 0.00 0.00 66.70 68.06 3gqw h VAL 142 Cb 0.88 0.32 -0.06 0.00 -1.52 0.00 0.00 31.29 30.90 3gqw h VAL 142 CO -0.85 0.00 0.64 0.78 0.02 0.00 0.00 177.57 178.17 3gqw h ASN 143 N -0.61 1.04 0.47 0.57 2.35 0.04 0.16 115.58 119.60 3gqw h ASN 143 Ca 0.01 0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.73 3gqw h ASN 143 Cb 0.60 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.74 3gqw h ASN 143 CO -0.13 0.68 -0.13 0.00 -1.65 0.00 0.00 177.43 176.19 3gqw h ALA 144 N 1.44 1.22 0.00 -0.83 0.00 -0.36 -3.16 119.26 117.57 3gqw h ALA 144 Ca 0.42 -0.12 -0.36 0.00 0.00 0.00 0.00 54.91 54.84 3gqw h ALA 144 Cb 0.13 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.83 3gqw h ALA 144 CO -0.16 0.17 -2.33 0.00 0.00 0.00 0.00 179.25 176.93 3gqw n ALA 145 N -2.26 1.49 0.13 0.00 0.00 -0.22 -4.06 120.51 115.60 3gqw n ALA 145 Ca -0.01 -1.27 -0.04 0.00 0.00 0.00 0.00 53.44 52.11 3gqw n ALA 145 Cb 0.27 -0.24 0.12 0.00 0.00 0.00 0.00 19.45 19.60 3gqw n ALA 145 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3gqw n THR 146 N -2.80 1.58 -0.33 0.00 -2.24 0.41 -4.43 114.28 106.46 3gqw n THR 146 Ca -0.32 -0.70 0.14 0.00 -2.27 0.00 0.00 64.05 60.90 3gqw n THR 146 Cb 1.14 -0.62 0.36 0.00 -2.10 0.00 0.00 70.33 69.12 3gqw n THR 146 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 3gqw h HIS 147 N 0.97 0.96 -0.13 4.78 2.76 -1.69 -2.39 115.15 120.41 3gqw h HIS 147 Ca 0.15 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.35 3gqw h HIS 147 Cb 1.49 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 30.16 3gqw h HIS 147 CO 0.57 0.22 0.00 -0.25 -1.30 0.00 0.00 177.93 177.17 3gqw n ASP 148 N -4.71 3.12 -4.12 3.26 8.00 -1.26 -4.75 116.55 116.09 3gqw n ASP 148 Ca 0.23 -3.02 -0.37 0.00 0.71 0.00 0.00 54.79 52.33 3gqw n ASP 148 Cb 0.61 -0.48 -0.09 0.00 -0.02 0.00 0.00 41.12 41.14 3gqw n ASP 148 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 3gqw s ASN 149 N -2.36 5.39 0.20 -2.24 0.01 -0.90 -4.94 114.94 110.11 3gqw s ASN 149 Ca 0.36 -2.77 -0.01 0.00 -0.71 0.00 0.00 52.86 49.73 3gqw s ASN 149 Cb 0.30 -1.89 0.15 0.00 0.41 0.00 0.00 41.25 40.22 3gqw s ASN 149 CO 0.06 -0.41 1.52 -0.65 -1.51 0.00 0.00 177.10 176.11 3gqw h PRO 150 N 7.19 0.47 -0.02 -0.60 0.11 -1.85 -3.14 132.00 134.16 3gqw h PRO 150 Ca -0.02 -0.30 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3gqw h PRO 150 Cb 0.97 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.12 3gqw h PRO 150 CO 0.72 0.91 0.00 -0.85 -0.21 0.00 0.00 178.00 178.57 3gqw n GLU 151 N -3.93 0.59 -3.87 1.05 0.00 -1.26 -4.67 120.64 108.55 3gqw n GLU 151 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 57.16 56.77 3gqw n GLU 151 Cb 0.61 -1.01 -0.14 0.00 0.00 0.00 0.00 31.44 30.90 3gqw n GLU 151 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 3gqw s LEU 152 N -0.96 3.12 0.18 -1.84 2.96 -1.19 -4.74 118.68 116.21 3gqw s LEU 152 Ca 0.00 -0.47 -0.30 0.00 -0.22 0.00 0.00 54.13 53.14 3gqw s LEU 152 Cb 0.00 -1.77 -0.08 0.00 0.50 0.00 0.00 46.19 44.84 3gqw s LEU 152 CO 0.00 -0.06 1.27 -1.00 -1.32 0.00 0.00 176.35 175.24 3gqw s HIS 153 N 1.48 3.32 -0.26 5.38 3.76 -1.10 -4.95 115.29 122.92 3gqw s HIS 153 Ca 0.05 1.28 -0.03 0.00 -0.15 0.00 0.00 55.06 56.21 3gqw s HIS 153 Cb -0.15 -3.54 0.03 0.00 1.11 0.00 0.00 32.58 30.03 3gqw s HIS 153 CO -0.02 -1.65 -0.02 0.08 -0.85 0.00 0.00 174.74 172.28 3gqw s VAL 154 N 0.19 3.11 -0.13 -0.90 1.01 -1.26 -0.92 120.40 121.50 3gqw s VAL 154 Ca 0.56 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 61.55 3gqw s VAL 154 Cb -0.35 -2.61 -0.00 0.00 0.00 0.00 0.00 36.38 33.42 3gqw s VAL 154 CO 0.37 0.13 -0.18 -0.76 0.00 0.00 0.00 175.10 174.65 3gqw s LEU 155 N 1.35 2.36 0.88 3.92 1.02 -0.25 -4.98 118.68 122.98 3gqw s LEU 155 Ca -0.00 -0.48 -0.11 0.00 0.02 0.00 0.00 54.13 53.55 3gqw s LEU 155 Cb -0.17 -1.51 0.12 0.00 0.02 0.00 0.00 46.19 44.65 3gqw s LEU 155 CO -0.03 0.13 1.09 -0.94 0.02 0.00 0.00 176.35 176.63 3gqw s SER 156 N 0.54 3.62 0.38 2.29 1.04 -1.26 -1.27 113.70 119.04 3gqw s SER 156 Ca -0.11 1.51 0.09 0.00 0.48 0.00 0.00 55.95 57.91 3gqw s SER 156 Cb -0.16 -2.19 0.75 0.00 0.10 0.00 0.00 66.02 64.51 3gqw s SER 156 CO 0.04 -2.55 1.90 0.45 0.98 0.00 0.00 173.24 174.07 3gqw h HIS 157 N -1.49 0.29 0.26 5.02 3.86 -1.34 -0.08 115.15 121.66 3gqw h HIS 157 Ca -0.49 -0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 58.68 3gqw h HIS 157 Cb 1.28 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 29.67 3gqw h HIS 157 CO 0.44 0.40 -0.13 0.00 0.86 0.00 0.00 177.93 179.50 3gqw h ALA 158 N 1.62 -0.35 -0.54 2.45 0.00 -1.91 0.11 119.26 120.63 3gqw h ALA 158 Ca 0.05 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.86 3gqw h ALA 158 Cb 0.38 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 3gqw h ALA 158 CO 0.02 -0.57 0.26 -1.49 0.00 0.00 0.00 179.25 177.47 3gqw h TRP 159 N -0.61 0.47 -0.13 0.00 6.55 -1.89 0.13 115.95 120.46 3gqw h TRP 159 Ca -0.04 0.02 0.04 0.00 0.95 0.00 0.00 58.89 59.87 3gqw h TRP 159 Cb 0.44 -0.13 -0.05 0.00 -0.86 0.00 0.00 29.16 28.56 3gqw h TRP 159 CO 0.01 0.21 -0.16 0.35 -1.05 0.00 0.00 178.44 177.79 3gqw h PHE 160 N 0.50 -0.42 0.00 0.49 3.57 -0.92 -0.67 116.94 119.48 3gqw h PHE 160 Ca 0.25 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.77 3gqw h PHE 160 Cb 0.19 0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.14 3gqw h PHE 160 CO -0.11 -0.24 -0.01 0.87 -2.23 0.00 0.00 178.31 176.59 3gqw h LYS 161 N -0.21 0.00 -0.00 1.11 1.57 -0.16 -2.33 116.57 116.55 3gqw h LYS 161 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 3gqw h LYS 161 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 3gqw h LYS 161 CO -0.25 0.01 -0.19 0.00 -0.57 0.00 0.00 179.45 178.45 3gqw n ALA 162 N -2.10 2.91 -1.21 3.86 0.00 0.38 -4.92 120.51 119.44 3gqw n ALA 162 Ca -0.01 -0.31 -0.30 0.00 0.00 0.00 0.00 53.44 52.81 3gqw n ALA 162 Cb 0.20 -1.25 0.13 0.00 0.00 0.00 0.00 19.45 18.53 3gqw n ALA 162 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3gqw s LEU 163 N -2.55 2.36 0.10 0.00 1.02 -0.86 -5.04 118.68 113.71 3gqw s LEU 163 Ca 0.25 1.53 -0.21 0.00 0.02 0.00 0.00 54.13 55.73 3gqw s LEU 163 Cb 0.19 -3.99 -0.07 0.00 0.02 0.00 0.00 46.19 42.35 3gqw s LEU 163 CO 0.51 -2.57 0.63 -2.84 0.02 0.00 0.00 176.35 172.10 3gqw s PRO 164 N -4.93 4.29 -0.34 1.29 0.02 -1.26 -4.90 135.00 129.16 3gqw s PRO 164 Ca 0.63 0.84 -0.29 0.00 0.02 0.00 0.00 61.00 62.20 3gqw s PRO 164 Cb -0.18 -3.23 -0.07 0.00 0.02 0.00 0.00 34.50 31.04 3gqw s PRO 164 CO 0.57 0.61 2.29 0.39 -0.33 0.00 0.00 177.00 180.53 3gqw n GLU 165 N 1.64 1.47 -1.66 5.54 -0.58 -1.26 -4.00 120.64 121.79 3gqw n GLU 165 Ca -0.09 0.32 -0.48 0.00 -0.42 0.00 0.00 57.16 56.50 3gqw n GLU 165 Cb 0.50 -3.08 -0.05 0.00 -0.57 0.00 0.00 31.44 28.24 3gqw n GLU 165 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3gqw n ALA 166 N 12.46 1.02 -2.31 0.62 0.00 -0.55 -4.82 120.51 126.93 3gqw n ALA 166 Ca 0.35 0.21 -0.35 0.00 0.00 0.00 0.00 53.44 53.66 3gqw n ALA 166 Cb 0.42 -2.55 -0.03 0.00 0.00 0.00 0.00 19.45 17.28 3gqw n ALA 166 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3gqw s ASP 167 N 4.70 5.86 0.06 0.00 2.15 -1.26 -4.86 116.67 123.32 3gqw s ASP 167 Ca 0.94 -1.78 -0.09 0.00 0.43 0.00 0.00 52.55 52.06 3gqw s ASP 167 Cb -0.65 -2.58 -0.00 0.00 -0.30 0.00 0.00 42.92 39.39 3gqw s ASP 167 CO 0.49 -2.17 0.18 0.54 -0.17 0.00 0.00 175.17 174.05 3gqw s VAL 168 N 7.75 0.13 -0.36 1.11 0.11 -1.26 -5.13 120.40 122.76 3gqw s VAL 168 Ca 0.61 -1.06 -0.27 0.00 -2.93 0.00 0.00 61.98 58.33 3gqw s VAL 168 Cb 0.00 -1.12 0.02 0.00 -1.53 0.00 0.00 36.38 33.75 3gqw s VAL 168 CO 0.07 -0.58 0.97 0.00 -3.33 0.00 0.00 175.10 172.22 3gqw s ALA 169 N -3.19 3.43 -0.05 1.54 0.00 -1.26 -4.99 121.76 117.23 3gqw s ALA 169 Ca -0.00 -0.34 -0.29 0.00 0.00 0.00 0.00 51.96 51.33 3gqw s ALA 169 Cb 0.02 -3.58 -0.07 0.00 0.00 0.00 0.00 23.12 19.49 3gqw s ALA 169 CO -0.07 -1.57 1.95 -0.51 0.00 0.00 0.00 175.76 175.55 3gqw s LEU 170 N 3.53 4.17 0.14 0.00 1.02 -1.26 -4.96 118.68 121.31 3gqw s LEU 170 Ca 0.40 2.36 -0.30 0.00 0.02 0.00 0.00 54.13 56.61 3gqw s LEU 170 Cb -0.12 -3.53 -0.07 0.00 0.02 0.00 0.00 46.19 42.50 3gqw s LEU 170 CO 0.18 -1.24 1.04 0.00 0.02 0.00 0.00 176.35 176.35 3gqw s GLN 171 N 4.82 4.63 0.13 1.70 -2.07 -1.26 -5.02 119.66 122.59 3gqw s GLN 171 Ca 0.87 1.60 -0.30 0.00 -1.82 0.00 0.00 55.36 55.71 3gqw s GLN 171 Cb -0.38 -3.33 -0.07 0.00 -1.09 0.00 0.00 33.01 28.15 3gqw s GLN 171 CO 0.38 0.12 1.08 0.50 -1.32 0.00 0.00 175.29 176.04 3gqw s ARG 172 N -0.09 4.59 0.50 9.60 6.06 -1.26 -4.81 118.95 133.54 3gqw s ARG 172 Ca 0.49 1.65 -0.20 0.00 -2.50 0.00 0.00 55.73 55.17 3gqw s ARG 172 Cb -0.26 -3.32 -0.08 0.00 0.06 0.00 0.00 34.95 31.35 3gqw s ARG 172 CO 0.32 0.05 1.06 -2.14 -2.50 0.00 0.00 175.30 172.09 3gqw s PRO 173 N 0.01 3.69 0.23 5.12 0.02 -1.26 -5.07 135.00 137.74 3gqw s PRO 173 Ca 0.50 1.40 0.08 0.00 0.02 0.00 0.00 61.00 63.01 3gqw s PRO 173 Cb -0.27 -2.07 -0.04 0.00 0.02 0.00 0.00 34.50 32.13 3gqw s PRO 173 CO 0.32 -0.53 0.06 0.14 -0.33 0.00 0.00 177.00 176.66 3gqw s VAL 174 N -1.96 3.87 0.40 3.83 -7.23 -1.26 -4.92 120.40 113.14 3gqw s VAL 174 Ca 0.68 -1.57 0.21 0.00 -1.81 0.00 0.00 61.98 59.49 3gqw s VAL 174 Cb -0.18 -3.03 0.41 0.00 0.56 0.00 0.00 36.38 34.14 3gqw s VAL 174 CO 0.22 -0.27 1.73 -0.65 -0.31 0.00 0.00 175.10 175.83 3gqw h PRO 175 N 2.08 0.31 -0.15 4.82 0.11 -1.96 -1.44 132.00 135.77 3gqw h PRO 175 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3gqw h PRO 175 Cb 1.23 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3gqw h PRO 175 CO 0.60 0.21 0.00 0.09 -0.21 0.00 0.00 178.00 178.69 3gqw n ASN 176 N -4.66 1.84 -4.76 -2.05 5.03 -1.26 -0.37 115.26 109.03 3gqw n ASN 176 Ca 0.28 -1.71 -0.34 0.00 0.87 0.00 0.00 54.58 53.69 3gqw n ASN 176 Cb 1.00 -0.10 0.04 0.00 -1.02 0.00 0.00 39.78 39.71 3gqw n ASN 176 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 3gqw s ASP 177 N -1.65 5.10 -0.07 6.41 1.01 -0.54 -4.82 116.67 122.11 3gqw s ASP 177 Ca 0.34 2.14 -0.30 0.00 0.71 0.00 0.00 52.55 55.44 3gqw s ASP 177 Cb 0.19 -2.57 -0.02 0.00 1.01 0.00 0.00 42.92 41.52 3gqw s ASP 177 CO 0.28 -1.64 1.05 -0.63 0.21 0.00 0.00 175.17 174.45 3gqw s ILE 178 N -2.08 4.64 -0.14 0.77 1.01 -1.26 -1.50 121.20 122.65 3gqw s ILE 178 Ca 0.71 1.92 -0.12 0.00 0.00 0.00 0.00 60.65 63.15 3gqw s ILE 178 Cb -0.24 -4.23 -0.25 0.00 0.01 0.00 0.00 42.46 37.76 3gqw s ILE 178 CO 0.38 0.04 0.38 0.00 0.00 0.00 0.00 174.94 175.73 3gqw h ALA 179 N 7.10 0.33 -2.19 9.38 0.00 -0.84 -3.42 119.26 129.62 3gqw h ALA 179 Ca -0.34 -1.28 0.17 0.00 0.00 0.00 0.00 54.91 53.46 3gqw h ALA 179 Cb 1.17 0.67 -0.12 0.00 0.00 0.00 0.00 17.79 19.51 3gqw h ALA 179 CO 0.84 1.06 0.54 1.52 0.00 0.00 0.00 179.25 183.20 3gqw s TYR 180 N -2.49 -0.20 -0.06 0.00 1.13 -1.14 -2.68 117.35 111.90 3gqw s TYR 180 Ca -0.23 -0.01 0.05 0.00 -1.41 0.00 0.00 57.07 55.47 3gqw s TYR 180 Cb 0.06 0.59 -0.01 0.00 -1.10 0.00 0.00 41.96 41.49 3gqw s TYR 180 CO 0.73 -0.64 -0.21 -0.51 -2.51 0.00 0.00 175.55 172.41 3gqw s LEU 181 N -2.74 2.29 -0.30 -3.49 1.43 0.36 -2.12 118.68 114.11 3gqw s LEU 181 Ca 0.10 -0.42 -0.05 0.00 -1.03 0.00 0.00 54.13 52.72 3gqw s LEU 181 Cb -0.01 -1.44 0.02 0.00 0.03 0.00 0.00 46.19 44.80 3gqw s LEU 181 CO -0.03 0.26 0.05 -1.58 0.23 0.00 0.00 176.35 175.28 3gqw s GLN 182 N -0.23 2.86 0.00 1.70 2.00 -0.50 -4.06 119.66 121.44 3gqw s GLN 182 Ca -0.01 -1.00 0.25 0.00 -2.00 0.00 0.00 55.36 52.60 3gqw s GLN 182 Cb -0.13 -3.29 0.31 0.00 0.80 0.00 0.00 33.01 30.70 3gqw s GLN 182 CO 0.03 -0.50 1.33 0.66 -0.50 0.00 0.00 175.29 176.31 3gqw n TYR 183 N 4.79 0.00 0.27 1.67 4.02 -1.26 -1.22 117.16 125.43 3gqw n TYR 183 Ca -0.14 -0.00 0.14 0.00 -0.01 0.00 0.00 57.90 57.89 3gqw n TYR 183 Cb 0.46 0.00 0.76 0.00 -0.02 0.00 0.00 39.34 40.54 3gqw n TYR 183 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 176.86 177.64 3gqw h THR 184 N 4.38 0.00 0.00 -0.72 1.35 -1.82 -2.73 112.91 113.37 3gqw h THR 184 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3gqw h THR 184 Cb 0.93 0.61 0.00 0.00 -1.73 0.00 0.00 68.15 67.96 3gqw h THR 184 CO 0.00 0.00 0.00 -1.20 -0.25 0.00 0.00 175.52 174.07 3gqw n SER 185 N -2.63 0.00 -4.81 5.36 7.64 -1.26 -3.17 113.62 114.75 3gqw n SER 185 Ca -0.02 0.19 -0.22 0.00 1.01 0.00 0.00 58.87 59.83 3gqw n SER 185 Cb 0.25 -0.39 -0.05 0.00 -1.01 0.00 0.00 64.21 63.01 3gqw n SER 185 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3gqw s GLY 186 N -2.78 1.96 0.56 0.23 0.00 -1.03 -4.64 107.32 101.63 3gqw s GLY 186 Ca 0.20 -1.80 0.04 0.00 0.00 0.00 0.00 44.72 43.15 3gqw s GLY 186 CO 0.45 -1.70 0.78 -1.35 0.00 0.00 0.00 173.10 171.29 3gqw s SER 187 N -3.97 5.12 0.51 1.64 1.04 -1.14 -4.48 113.70 112.43 3gqw s SER 187 Ca 0.41 -0.36 0.26 0.00 0.48 0.00 0.00 55.95 56.74 3gqw s SER 187 Cb -0.03 -0.39 1.38 0.00 0.10 0.00 0.00 66.02 67.08 3gqw s SER 187 CO 0.25 -1.25 2.05 0.00 0.98 0.00 0.00 173.24 175.27 3gqw h THR 188 N 0.09 0.62 0.14 2.02 1.03 -1.98 -2.82 112.91 112.01 3gqw h THR 188 Ca -0.38 -0.57 -0.29 0.00 -0.01 0.00 0.00 66.41 65.16 3gqw h THR 188 Cb 1.28 1.36 0.00 0.00 -1.07 0.00 0.00 68.15 69.73 3gqw h THR 188 CO 0.45 0.13 -1.47 -0.09 -0.01 0.00 0.00 175.52 174.53 3gqw h ARG 189 N 0.00 0.29 -2.47 0.00 9.65 -1.97 -3.43 114.38 116.46 3gqw h ARG 189 Ca -0.00 -0.50 -0.60 0.00 -1.10 0.00 0.00 59.98 57.78 3gqw h ARG 189 Cb 0.35 0.19 -0.42 0.00 -1.39 0.00 0.00 29.97 28.70 3gqw h ARG 189 CO 0.02 1.24 -0.64 1.19 2.80 0.00 0.00 179.97 184.58 3gqw n PHE 190 N -3.85 3.08 -1.88 2.20 3.72 -1.08 -5.08 117.46 114.56 3gqw n PHE 190 Ca -0.24 -4.14 -0.42 0.00 -0.05 0.00 0.00 57.45 52.60 3gqw n PHE 190 Cb 0.94 -0.53 -0.03 0.00 -0.94 0.00 0.00 39.48 38.92 3gqw n PHE 190 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 3gqw s PRO 191 N -1.97 4.17 -0.09 -1.08 0.02 -1.09 -2.86 135.00 132.10 3gqw s PRO 191 Ca 0.35 2.36 0.03 0.00 0.02 0.00 0.00 61.00 63.76 3gqw s PRO 191 Cb 0.09 -3.88 -0.02 0.00 0.02 0.00 0.00 34.50 30.71 3gqw s PRO 191 CO -0.08 -0.84 -0.17 1.03 -0.33 0.00 0.00 177.00 176.62 3gqw s ARG 192 N 3.61 2.89 -0.25 5.54 0.52 -1.26 -4.92 118.95 125.10 3gqw s ARG 192 Ca 0.78 -0.76 -0.06 0.00 -0.52 0.00 0.00 55.73 55.17 3gqw s ARG 192 Cb -0.38 -2.41 -0.01 0.00 0.52 0.00 0.00 34.95 32.66 3gqw s ARG 192 CO 0.34 0.37 0.02 0.20 0.02 0.00 0.00 175.30 176.25 3gqw s GLY 193 N -0.09 1.70 -0.11 -3.53 0.00 -1.26 -3.82 107.32 100.21 3gqw s GLY 193 Ca -0.03 -1.22 -0.30 0.00 0.00 0.00 0.00 44.72 43.18 3gqw s GLY 193 CO 0.04 0.51 1.21 0.14 0.00 0.00 0.00 173.10 175.00 3gqw s VAL 194 N 1.53 4.31 -0.15 1.40 1.01 -0.35 0.79 120.40 128.93 3gqw s VAL 194 Ca 0.05 1.61 -0.24 0.00 0.00 0.00 0.00 61.98 63.40 3gqw s VAL 194 Cb -0.15 -4.04 -0.02 0.00 0.00 0.00 0.00 36.38 32.17 3gqw s VAL 194 CO 0.00 -0.07 0.76 -0.63 0.00 0.00 0.00 175.10 175.17 3gqw s ILE 195 N 2.78 4.95 -0.22 2.22 1.01 -0.72 -1.41 121.20 129.81 3gqw s ILE 195 Ca 0.54 1.50 0.02 0.00 0.00 0.00 0.00 60.65 62.72 3gqw s ILE 195 Cb -0.23 -4.08 0.04 0.00 0.01 0.00 0.00 42.46 38.20 3gqw s ILE 195 CO 0.18 0.09 -0.16 -0.63 0.00 0.00 0.00 174.94 174.43 3gqw s ILE 196 N 1.80 2.12 0.70 2.92 -1.09 -0.90 -3.06 121.20 123.69 3gqw s ILE 196 Ca 0.36 -1.26 -0.09 0.00 -2.23 0.00 0.00 60.65 57.43 3gqw s ILE 196 Cb -0.17 -2.06 0.04 0.00 -1.58 0.00 0.00 42.46 38.69 3gqw s ILE 196 CO 0.13 0.27 1.04 0.42 -1.23 0.00 0.00 174.94 175.58 3gqw s THR 197 N 1.20 2.97 0.22 2.92 -4.23 -1.26 -0.20 115.64 117.26 3gqw s THR 197 Ca -0.01 0.10 -0.08 0.00 -1.18 0.00 0.00 61.69 60.51 3gqw s THR 197 Cb -0.16 -3.27 0.16 0.00 1.34 0.00 0.00 72.50 70.57 3gqw s THR 197 CO -0.09 -0.32 1.83 0.45 -0.54 0.00 0.00 174.62 175.95 3gqw h HIS 198 N -0.60 0.82 -0.67 3.99 3.86 -0.99 -1.86 115.15 119.70 3gqw h HIS 198 Ca -0.45 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 58.79 3gqw h HIS 198 Cb 1.28 -0.26 -0.03 0.00 1.06 0.00 0.00 27.41 29.46 3gqw h HIS 198 CO 0.42 0.43 0.44 -0.09 0.86 0.00 0.00 177.93 179.99 3gqw h ARG 199 N 0.83 0.88 0.03 2.45 2.43 -0.87 -3.09 114.38 117.05 3gqw h ARG 199 Ca 0.31 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.43 3gqw h ARG 199 Cb 0.12 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 3gqw h ARG 199 CO -0.15 0.59 -0.02 0.93 -1.51 0.00 0.00 179.97 179.81 3gqw h GLU 200 N 0.91 -0.04 -1.75 0.20 5.08 -1.67 0.23 114.58 117.54 3gqw h GLU 200 Ca 0.24 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 3gqw h GLU 200 Cb -0.10 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.16 3gqw h GLU 200 CO -0.05 0.31 0.00 1.55 -1.00 0.00 0.00 179.01 179.82 3gqw n VAL 201 N -4.94 0.28 0.00 3.13 3.14 -0.73 -1.89 118.33 117.31 3gqw n VAL 201 Ca -0.08 -0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.29 3gqw n VAL 201 Cb 0.20 -0.65 0.00 0.00 -1.06 0.00 0.00 33.84 32.32 3gqw n VAL 201 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3gqw n ALA 203 N 0.91 0.00 -0.03 1.55 0.00 0.07 -1.29 120.51 121.72 3gqw n ALA 203 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 3gqw n ALA 203 Cb 0.13 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.49 3gqw n ALA 203 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 3gqw h ASN 204 N 0.00 0.31 -0.63 0.00 -1.24 -1.64 -1.13 115.58 111.25 3gqw h ASN 204 Ca 0.00 -0.62 0.12 0.00 0.71 0.00 0.00 56.30 56.51 3gqw h ASN 204 Cb 0.00 -0.09 -0.09 0.00 0.73 0.00 0.00 38.32 38.87 3gqw h ASN 204 CO 0.00 0.88 0.14 -0.07 -1.29 0.00 0.00 177.43 177.09 3gqw h LEU 205 N -0.24 0.02 -0.29 0.34 4.07 -1.46 0.19 115.31 117.95 3gqw h LEU 205 Ca -0.01 0.12 0.03 0.00 0.08 0.00 0.00 57.88 58.10 3gqw h LEU 205 Cb 0.86 0.16 -0.03 0.00 1.08 0.00 0.00 40.66 42.72 3gqw h LEU 205 CO 0.05 0.01 0.08 -0.09 -1.08 0.00 0.00 178.44 177.41 3gqw h ARG 206 N 0.27 0.20 -0.00 1.13 9.65 -1.77 -1.09 114.38 122.77 3gqw h ARG 206 Ca 0.33 -0.01 0.02 0.00 -1.10 0.00 0.00 59.98 59.22 3gqw h ARG 206 Cb 0.50 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.02 3gqw h ARG 206 CO -0.42 0.13 -0.10 0.00 2.80 0.00 0.00 179.97 182.38 3gqw h ALA 207 N 1.19 -0.11 0.76 2.80 0.00 0.13 -1.04 119.26 122.99 3gqw h ALA 207 Ca 0.13 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 3gqw h ALA 207 Cb 0.11 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 3gqw h ALA 207 CO -0.14 -0.59 -0.45 0.82 0.00 0.00 0.00 179.25 178.88 3gqw h ILE 208 N -0.18 0.09 -0.70 0.00 2.04 -0.53 0.35 117.51 118.59 3gqw h ILE 208 Ca 0.04 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.83 3gqw h ILE 208 Cb 0.23 0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.36 3gqw h ILE 208 CO -0.11 0.00 0.16 0.77 0.00 0.00 0.00 178.15 178.97 3gqw h SER 209 N -1.13 1.07 0.16 1.72 4.64 -1.21 0.12 113.55 118.92 3gqw h SER 209 Ca -0.10 -0.24 -0.14 0.00 -0.47 0.00 0.00 61.79 60.84 3gqw h SER 209 Cb 0.91 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 62.69 3gqw h SER 209 CO 0.11 1.04 -1.97 1.57 -0.87 0.00 0.00 176.83 176.70 3gqw n HIS 210 N -4.24 0.20 0.00 4.77 -0.00 -0.40 -1.42 115.22 114.14 3gqw n HIS 210 Ca 0.05 0.06 0.00 0.00 -0.00 0.00 0.00 57.72 57.83 3gqw n HIS 210 Cb 0.27 -0.77 0.00 0.00 -0.00 0.00 0.00 29.99 29.49 3gqw n HIS 210 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 3gqw n ASP 211 N -2.53 3.26 0.00 0.26 10.43 0.42 -4.65 116.55 123.74 3gqw n ASP 211 Ca -0.14 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.22 3gqw n ASP 211 Cb 0.79 0.25 0.00 0.00 1.84 0.00 0.00 41.12 44.00 3gqw n ASP 211 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3gqw n GLY 212 N 2.39 0.24 0.24 0.44 0.00 0.95 -4.57 105.19 104.88 3gqw n GLY 212 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 3gqw n GLY 212 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3gqw h ILE 213 N 0.00 1.23 -4.86 -0.61 1.08 -1.01 -3.47 117.51 109.88 3gqw h ILE 213 Ca 0.00 -0.81 0.00 0.00 -0.39 0.00 0.00 64.86 63.66 3gqw h ILE 213 Cb 0.00 0.83 0.00 0.00 -3.07 0.00 0.00 36.82 34.58 3gqw h ILE 213 CO 0.00 0.29 -0.25 0.29 -0.69 0.00 0.00 178.15 177.79 3gqw n LYS 214 N -4.49 -1.59 -1.58 2.37 5.02 -1.18 -4.99 118.16 111.73 3gqw n LYS 214 Ca 0.01 1.62 -0.30 0.00 -2.02 0.00 0.00 58.31 57.62 3gqw n LYS 214 Cb 0.21 -4.89 0.08 0.00 -0.02 0.00 0.00 35.03 30.41 3gqw n LYS 214 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3gqw s LEU 215 N -2.79 2.72 0.14 -0.35 1.43 -0.51 -5.03 118.68 114.30 3gqw s LEU 215 Ca 0.12 1.36 0.02 0.00 -1.03 0.00 0.00 54.13 54.60 3gqw s LEU 215 Cb -0.03 -4.04 -0.04 0.00 0.03 0.00 0.00 46.19 42.10 3gqw s LEU 215 CO 0.61 -1.82 -0.03 -0.13 0.23 0.00 0.00 176.35 175.20 3gqw s ARG 216 N -5.15 0.98 0.28 1.70 0.52 -1.26 -4.96 118.95 111.06 3gqw s ARG 216 Ca 0.60 -1.44 -0.30 0.00 -0.52 0.00 0.00 55.73 54.07 3gqw s ARG 216 Cb -0.14 -0.25 -0.11 0.00 0.52 0.00 0.00 34.95 34.97 3gqw s ARG 216 CO 0.54 -0.07 1.48 -2.14 0.02 0.00 0.00 175.30 175.13 3gqw s PRO 217 N -3.87 4.22 0.00 3.54 0.02 -1.26 -2.26 135.00 135.38 3gqw s PRO 217 Ca 0.18 2.40 0.00 0.00 0.02 0.00 0.00 61.00 63.60 3gqw s PRO 217 Cb 0.06 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.51 3gqw s PRO 217 CO -0.00 -0.48 0.00 0.41 -0.33 0.00 0.00 177.00 176.60 3gqw n GLY 218 N 1.95 2.21 3.71 0.52 0.00 -1.26 -5.06 105.19 107.27 3gqw n GLY 218 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 3gqw n GLY 218 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3gqw n ASP 219 N 0.00 1.77 -3.69 1.61 8.00 -0.96 -5.00 116.55 118.28 3gqw n ASP 219 Ca 0.00 0.79 -0.13 0.00 0.71 0.00 0.00 54.79 56.16 3gqw n ASP 219 Cb 0.00 -1.53 -0.13 0.00 -0.02 0.00 0.00 41.12 39.44 3gqw n ASP 219 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3gqw s ARG 220 N -3.41 0.19 0.38 -1.24 3.52 -1.26 -4.52 118.95 112.61 3gqw s ARG 220 Ca 0.81 0.68 -0.12 0.00 -0.13 0.00 0.00 55.73 56.96 3gqw s ARG 220 Cb -0.37 -0.05 -0.07 0.00 -1.56 0.00 0.00 34.95 32.89 3gqw s ARG 220 CO 0.42 -0.23 0.77 0.00 -0.81 0.00 0.00 175.30 175.45 3gqw s VAL 222 N -2.24 0.09 0.01 0.00 1.01 -0.06 -1.06 120.40 118.15 3gqw s VAL 222 Ca 0.53 0.22 0.01 0.00 0.00 0.00 0.00 61.98 62.74 3gqw s VAL 222 Cb -0.10 -0.25 -0.01 0.00 0.00 0.00 0.00 36.38 36.02 3gqw s VAL 222 CO 0.26 0.17 -0.05 -0.55 0.00 0.00 0.00 175.10 174.93 3gqw s SER 223 N 1.55 0.56 0.00 3.32 0.15 -0.34 -4.30 113.70 114.63 3gqw s SER 223 Ca -0.03 -0.22 0.04 0.00 0.70 0.00 0.00 55.95 56.44 3gqw s SER 223 Cb -0.13 -0.02 0.08 0.00 -1.71 0.00 0.00 66.02 64.24 3gqw s SER 223 CO -0.03 -0.04 0.87 -2.67 1.20 0.00 0.00 173.24 172.58 3gqw n TRP 224 N 2.50 0.09 -2.32 3.44 4.27 -1.26 -0.92 117.44 123.23 3gqw n TRP 224 Ca -0.16 -0.26 -0.34 0.00 -3.89 0.00 0.00 57.50 52.85 3gqw n TRP 224 Cb 0.57 -0.02 -0.01 0.00 -1.36 0.00 0.00 31.31 30.49 3gqw n TRP 224 CO 0.00 0.00 0.00 -0.51 -2.29 0.00 0.00 177.69 174.89 3gqw s LEU 225 N -0.68 3.75 0.33 5.67 1.43 -1.26 -3.37 118.68 124.54 3gqw s LEU 225 Ca 0.07 2.06 -0.27 0.00 -1.03 0.00 0.00 54.13 54.96 3gqw s LEU 225 Cb 0.04 -4.57 -0.09 0.00 0.03 0.00 0.00 46.19 41.60 3gqw s LEU 225 CO 0.06 -1.08 1.05 -2.84 0.23 0.00 0.00 176.35 173.76 3gqw s PRO 226 N -3.36 4.46 0.21 1.29 0.02 -1.26 -4.79 135.00 131.57 3gqw s PRO 226 Ca 0.70 1.60 0.22 0.00 0.02 0.00 0.00 61.00 63.54 3gqw s PRO 226 Cb -0.20 -2.89 0.91 0.00 0.02 0.00 0.00 34.50 32.34 3gqw s PRO 226 CO 0.26 0.11 1.67 1.19 -0.33 0.00 0.00 177.00 179.90 3gqw n PHE 227 N 0.64 0.67 0.55 6.54 3.72 -1.26 -2.53 117.46 125.78 3gqw n PHE 227 Ca 0.02 0.26 0.12 0.00 -0.05 0.00 0.00 57.45 57.80 3gqw n PHE 227 Cb 0.48 -0.92 0.25 0.00 -0.94 0.00 0.00 39.48 38.35 3gqw n PHE 227 CO 0.00 0.00 0.00 0.10 -0.05 0.00 0.00 176.76 176.81 3gqw h TYR 228 N 0.00 0.00 -3.26 1.38 -0.00 -1.87 -3.37 116.97 109.84 3gqw h TYR 228 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 58.73 58.24 3gqw h TYR 228 Cb 0.36 0.00 0.02 0.00 0.00 0.00 0.00 36.73 37.12 3gqw h TYR 228 CO 0.00 0.00 -0.01 -1.01 -0.00 0.00 0.00 178.16 177.14 3gqw s HIS 229 N -3.15 3.54 -1.52 0.10 3.76 -1.05 -4.78 115.29 112.19 3gqw s HIS 229 Ca 0.08 0.63 0.00 0.00 -0.15 0.00 0.00 55.06 55.62 3gqw s HIS 229 Cb 0.12 -2.14 0.00 0.00 1.11 0.00 0.00 32.58 31.67 3gqw s HIS 229 CO 0.67 -0.11 0.00 -3.47 -0.85 0.00 0.00 174.74 170.98 3gqw n ASP 230 N -2.03 0.00 0.00 1.40 2.03 -1.26 -2.66 116.55 114.03 3gqw n ASP 230 Ca -0.02 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.29 3gqw n ASP 230 Cb 0.55 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.95 3gqw n ASP 230 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3gqw n GLY 232 N -0.06 0.00 0.23 0.27 0.00 -1.25 -1.90 105.19 102.47 3gqw n GLY 232 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.94 3gqw n GLY 232 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3gqw h LEU 233 N 0.00 -0.45 -0.20 0.99 5.85 -1.62 -0.31 115.31 119.56 3gqw h LEU 233 Ca 0.00 0.02 -0.22 0.00 0.84 0.00 0.00 57.88 58.51 3gqw h LEU 233 Cb 0.00 0.12 0.01 0.00 0.37 0.00 0.00 40.66 41.15 3gqw h LEU 233 CO 0.00 -0.13 -0.86 0.58 -0.34 0.00 0.00 178.44 177.69 3gqw h VAL 234 N -0.91 1.34 -0.11 1.05 2.07 -1.65 0.47 116.25 118.51 3gqw h VAL 234 Ca -0.05 -2.19 -0.21 0.00 0.82 0.00 0.00 66.70 65.06 3gqw h VAL 234 Cb 0.41 2.20 0.01 0.00 -1.52 0.00 0.00 31.29 32.38 3gqw h VAL 234 CO 0.09 0.67 -0.79 1.23 0.02 0.00 0.00 177.57 178.79 3gqw h GLY 235 N 0.91 0.72 0.00 2.17 0.00 -1.73 -2.70 103.07 102.43 3gqw h GLY 235 Ca -0.07 -1.04 0.00 0.00 0.00 0.00 0.00 47.33 46.22 3gqw h GLY 235 CO 0.16 0.92 0.00 0.69 0.00 0.00 0.00 176.54 178.31 3gqw n PHE 236 N -3.89 0.00 -0.09 5.60 3.72 -0.15 -4.02 117.46 118.63 3gqw n PHE 236 Ca -0.07 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.18 3gqw n PHE 236 Cb 0.75 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 39.24 3gqw n PHE 236 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 3gqw n LEU 237 N -0.06 1.81 -0.05 4.37 0.00 0.09 -4.68 117.00 118.47 3gqw n LEU 237 Ca 0.00 0.31 -0.13 0.00 0.00 0.00 0.00 56.01 56.19 3gqw n LEU 237 Cb 0.05 -0.71 -0.07 0.00 0.00 0.00 0.00 43.42 42.69 3gqw n LEU 237 CO 0.00 -0.01 0.66 -0.07 0.00 0.00 0.00 177.39 177.97 3gqw h LEU 238 N -0.89 0.31 -0.58 -1.96 3.38 -1.50 -3.19 115.31 110.88 3gqw h LEU 238 Ca -0.24 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.31 3gqw h LEU 238 Cb 1.14 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.77 3gqw h LEU 238 CO -0.14 0.66 0.32 0.74 0.09 0.00 0.00 178.44 180.10 3gqw h THR 239 N -0.04 1.19 0.00 0.22 2.02 -1.61 0.55 112.91 115.23 3gqw h THR 239 Ca 0.03 -0.48 -0.01 0.00 0.77 0.00 0.00 66.41 66.72 3gqw h THR 239 Cb 0.54 0.45 -0.00 0.00 -1.74 0.00 0.00 68.15 67.40 3gqw h THR 239 CO 0.02 0.21 -0.04 -0.65 0.37 0.00 0.00 175.52 175.43 3gqw h PRO 240 N 0.78 0.00 0.23 6.66 0.11 -1.77 -2.60 132.00 135.42 3gqw h PRO 240 Ca 0.20 0.00 -0.33 0.00 0.11 0.00 0.00 66.00 65.99 3gqw h PRO 240 Cb 0.05 0.00 0.03 0.00 0.11 0.00 0.00 31.00 31.19 3gqw h PRO 240 CO -0.03 0.04 -1.43 0.28 -0.21 0.00 0.00 178.00 176.64 3gqw h VAL 241 N 0.00 1.31 -0.00 3.15 2.07 -1.04 -1.27 116.25 120.47 3gqw h VAL 241 Ca -0.00 -2.73 0.00 0.00 0.82 0.00 0.00 66.70 64.79 3gqw h VAL 241 Cb 0.21 3.00 0.00 0.00 -1.52 0.00 0.00 31.29 32.98 3gqw h VAL 241 CO 0.00 0.82 -0.00 0.00 0.02 0.00 0.00 177.57 178.41 3gqw n ALA 242 N -2.69 2.67 -0.39 1.67 0.00 0.00 -3.11 120.51 118.66 3gqw n ALA 242 Ca -0.15 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.07 3gqw n ALA 242 Cb 1.09 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 19.05 3gqw n ALA 242 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3gqw n THR 243 N -0.93 0.15 -2.97 0.00 -1.04 -1.00 -1.85 114.28 106.65 3gqw n THR 243 Ca 0.23 -0.38 -0.18 0.00 -2.04 0.00 0.00 64.05 61.68 3gqw n THR 243 Cb 0.14 1.22 -0.00 0.00 -1.82 0.00 0.00 70.33 69.86 3gqw n THR 243 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3gqw n GLN 244 N -0.08 -3.01 -4.12 -2.82 3.00 -1.02 -4.67 117.38 104.65 3gqw n GLN 244 Ca 0.00 0.52 -0.35 0.00 -0.01 0.00 0.00 57.00 57.16 3gqw n GLN 244 Cb 0.16 -5.18 -0.07 0.00 0.00 0.00 0.00 30.24 25.14 3gqw n GLN 244 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 3gqw s LEU 245 N -6.10 3.95 0.78 1.08 1.43 -0.51 -4.73 118.68 114.58 3gqw s LEU 245 Ca 0.23 0.24 -0.11 0.00 -1.03 0.00 0.00 54.13 53.46 3gqw s LEU 245 Cb -0.12 -2.08 0.06 0.00 0.03 0.00 0.00 46.19 44.08 3gqw s LEU 245 CO 0.28 0.35 1.09 -0.44 0.23 0.00 0.00 176.35 177.85 3gqw s SER 246 N -1.26 4.60 -0.04 2.29 0.01 -1.26 -4.53 113.70 113.51 3gqw s SER 246 Ca 0.18 1.45 -0.14 0.00 1.31 0.00 0.00 55.95 58.74 3gqw s SER 246 Cb -0.12 -2.21 0.03 0.00 0.21 0.00 0.00 66.02 63.93 3gqw s SER 246 CO 0.07 -1.92 0.32 0.54 0.41 0.00 0.00 173.24 172.66 3gqw s VAL 247 N -3.08 0.04 -0.11 3.43 0.11 -1.00 -2.14 120.40 117.65 3gqw s VAL 247 Ca 0.60 -0.37 0.03 0.00 -2.93 0.00 0.00 61.98 59.31 3gqw s VAL 247 Cb -0.15 -0.58 -0.00 0.00 -1.53 0.00 0.00 36.38 34.11 3gqw s VAL 247 CO 0.55 -0.20 -0.20 -1.81 -3.33 0.00 0.00 175.10 170.10 3gqw s ASP 248 N -0.99 3.36 -0.03 3.54 1.01 -0.22 -1.10 116.67 122.24 3gqw s ASP 248 Ca -0.11 -0.50 0.01 0.00 0.71 0.00 0.00 52.55 52.66 3gqw s ASP 248 Cb -0.05 -1.47 -0.03 0.00 1.01 0.00 0.00 42.92 42.38 3gqw s ASP 248 CO 0.03 0.15 -0.01 -0.31 0.21 0.00 0.00 175.17 175.25 3gqw s TYR 249 N 0.41 3.07 0.25 4.23 1.51 -0.16 -1.20 117.35 125.47 3gqw s TYR 249 Ca -0.15 0.10 0.07 0.00 -1.01 0.00 0.00 57.07 56.08 3gqw s TYR 249 Cb -0.17 -1.70 -0.04 0.00 -0.11 0.00 0.00 41.96 39.94 3gqw s TYR 249 CO 0.07 0.45 0.20 -0.51 -1.11 0.00 0.00 175.55 174.64 3gqw s LEU 250 N -1.31 3.81 0.41 -1.29 1.43 -0.10 -1.50 118.68 120.12 3gqw s LEU 250 Ca 0.17 -0.26 -0.23 0.00 -1.03 0.00 0.00 54.13 52.79 3gqw s LEU 250 Cb -0.11 -2.34 -0.10 0.00 0.03 0.00 0.00 46.19 43.67 3gqw s LEU 250 CO 0.07 -0.04 0.98 -0.13 0.23 0.00 0.00 176.35 177.46 3gqw s ARG 251 N -3.84 4.23 0.19 1.70 0.52 -1.26 -4.46 118.95 116.03 3gqw s ARG 251 Ca 0.33 1.29 -0.10 0.00 -0.52 0.00 0.00 55.73 56.73 3gqw s ARG 251 Cb -0.08 -2.39 0.10 0.00 0.52 0.00 0.00 34.95 33.10 3gqw s ARG 251 CO 0.25 -0.04 1.73 1.15 0.02 0.00 0.00 175.30 178.41 3gqw h THR 252 N 2.08 1.25 -0.57 0.02 2.02 -1.87 -2.27 112.91 113.57 3gqw h THR 252 Ca -0.48 -0.81 -0.07 0.00 0.77 0.00 0.00 66.41 65.82 3gqw h THR 252 Cb 1.20 0.53 -0.02 0.00 -1.74 0.00 0.00 68.15 68.11 3gqw h THR 252 CO 0.62 0.32 0.09 0.06 0.37 0.00 0.00 175.52 176.98 3gqw h GLN 253 N 0.95 0.91 -0.71 6.66 -0.00 -1.93 -1.95 115.11 119.05 3gqw h GLN 253 Ca 0.22 -0.22 -0.06 0.00 -0.00 0.00 0.00 58.65 58.59 3gqw h GLN 253 Cb 0.26 -0.12 -0.03 0.00 -0.00 0.00 0.00 27.48 27.59 3gqw h GLN 253 CO -0.01 0.85 0.20 -0.44 -0.00 0.00 0.00 178.83 179.43 3gqw h ASP 254 N 0.86 1.06 -0.10 0.06 3.32 -1.85 -2.53 116.42 117.24 3gqw h ASP 254 Ca 0.18 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 3gqw h ASP 254 Cb 0.38 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 3gqw h ASP 254 CO 0.01 1.00 0.05 0.15 -1.72 0.00 0.00 179.24 178.73 3gqw h PHE 255 N 1.06 0.14 0.00 4.55 3.57 -1.26 -0.95 116.94 124.06 3gqw h PHE 255 Ca 0.23 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.72 3gqw h PHE 255 Cb 0.34 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.03 3gqw h PHE 255 CO 0.03 0.19 0.00 0.00 -2.23 0.00 0.00 178.31 176.29 3gqw n ALA 256 N -2.17 0.60 -1.05 2.41 0.00 -0.75 -0.45 120.51 119.10 3gqw n ALA 256 Ca -0.05 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.32 3gqw n ALA 256 Cb 0.08 -0.46 -0.03 0.00 0.00 0.00 0.00 19.45 19.04 3gqw n ALA 256 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3gqw n ARG 258 N -0.05 0.02 -0.37 0.00 1.74 -0.36 -5.10 116.66 112.52 3gqw n ARG 258 Ca 0.00 -0.39 -0.01 0.00 -0.77 0.00 0.00 57.85 56.69 3gqw n ARG 258 Cb 0.00 -1.65 0.05 0.00 -1.02 0.00 0.00 32.46 29.84 3gqw n ARG 258 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3gqw h PRO 259 N 9.03 -0.01 0.00 5.56 0.11 -1.00 -0.06 132.00 145.63 3gqw h PRO 259 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.14 3gqw h PRO 259 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 3gqw h PRO 259 CO 0.97 -0.00 0.06 -0.07 -0.21 0.00 0.00 178.00 178.74 3gqw h LEU 260 N -0.01 0.00 -2.37 2.35 -0.00 -1.90 0.30 115.31 113.68 3gqw h LEU 260 Ca 0.35 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 58.23 3gqw h LEU 260 Cb 0.61 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.26 3gqw h LEU 260 CO -0.98 0.00 -0.02 1.56 -0.00 0.00 0.00 178.44 178.99 3gqw h GLN 261 N 0.00 0.00 0.08 1.13 1.08 -1.36 0.03 115.11 116.07 3gqw h GLN 261 Ca 0.00 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3gqw h GLN 261 Cb 0.12 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.55 3gqw h GLN 261 CO 0.00 0.02 -0.04 2.35 -0.95 0.00 0.00 178.83 180.22 3gqw h TRP 262 N 0.00 -0.10 -0.19 2.96 7.01 -1.11 -1.18 115.95 123.34 3gqw h TRP 262 Ca -0.00 -0.00 -0.11 0.00 2.11 0.00 0.00 58.89 60.89 3gqw h TRP 262 Cb 0.19 0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.27 3gqw h TRP 262 CO 0.00 0.24 -0.36 -0.07 -2.79 0.00 0.00 178.44 175.46 3gqw h LEU 263 N -0.45 0.42 0.23 0.65 3.38 -1.58 -2.43 115.31 115.53 3gqw h LEU 263 Ca -0.01 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.80 3gqw h LEU 263 Cb 0.38 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.98 3gqw h LEU 263 CO 0.02 0.75 -0.49 0.11 0.09 0.00 0.00 178.44 178.91 3gqw h LYS 264 N 0.34 -0.78 -0.55 1.13 1.79 -0.93 -1.54 116.57 116.04 3gqw h LYS 264 Ca 0.04 0.05 0.10 0.00 -2.18 0.00 0.00 60.65 58.67 3gqw h LYS 264 Cb 0.79 0.18 -0.08 0.00 -1.58 0.00 0.00 32.23 31.53 3gqw h LYS 264 CO 0.06 -0.52 0.07 1.25 -1.08 0.00 0.00 179.45 179.24 3gqw h LEU 265 N -0.81 -0.09 0.21 2.94 7.12 -0.98 0.22 115.31 123.93 3gqw h LEU 265 Ca -0.02 0.11 0.01 0.00 0.13 0.00 0.00 57.88 58.12 3gqw h LEU 265 Cb 0.78 0.17 -0.04 0.00 -0.53 0.00 0.00 40.66 41.04 3gqw h LEU 265 CO -0.21 -0.02 -0.40 0.40 -0.13 0.00 0.00 178.44 178.07 3gqw h ILE 266 N 0.20 0.18 0.00 4.05 2.04 -1.19 -2.07 117.51 120.73 3gqw h ILE 266 Ca 0.28 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.13 3gqw h ILE 266 Cb 0.42 0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 36.68 3gqw h ILE 266 CO -0.40 0.00 -0.06 -1.28 0.00 0.00 0.00 178.15 176.41 3gqw h SER 267 N -0.70 0.00 -0.33 1.72 0.87 -0.28 0.48 113.55 115.32 3gqw h SER 267 Ca 0.00 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.52 3gqw h SER 267 Cb 0.69 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.63 3gqw h SER 267 CO -0.18 0.06 0.03 0.50 -0.53 0.00 0.00 176.83 176.71 3gqw h LYS 268 N 0.00 0.56 -0.35 2.24 3.64 0.10 -3.18 116.57 119.57 3gqw h LYS 268 Ca -0.00 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 3gqw h LYS 268 Cb 0.12 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 3gqw h LYS 268 CO 0.01 0.66 0.00 0.09 -2.27 0.00 0.00 179.45 177.94 3gqw n ASN 269 N -4.57 4.04 -3.87 4.20 5.03 -1.02 -4.93 115.26 114.12 3gqw n ASN 269 Ca -0.02 -2.79 -0.29 0.00 0.87 0.00 0.00 54.58 52.35 3gqw n ASN 269 Cb 0.24 -0.51 0.03 0.00 -1.02 0.00 0.00 39.78 38.51 3gqw n ASN 269 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 3gqw n ARG 270 N -0.07 -5.56 -1.08 3.52 5.12 -0.62 -4.91 116.66 113.06 3gqw n ARG 270 Ca 0.21 0.61 -0.35 0.00 -1.93 0.00 0.00 57.85 56.39 3gqw n ARG 270 Cb 0.86 -5.46 0.09 0.00 -1.16 0.00 0.00 32.46 26.78 3gqw n ARG 270 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3gqw n GLY 271 N -1.70 -1.70 0.37 -0.13 0.00 0.16 -4.87 105.19 97.32 3gqw n GLY 271 Ca -0.01 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.48 3gqw n GLY 271 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3gqw n THR 272 N -2.87 0.00 -4.82 2.61 -1.04 -0.03 -3.38 114.28 104.75 3gqw n THR 272 Ca 0.09 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.84 3gqw n THR 272 Cb 0.51 -0.57 -0.16 0.00 -1.82 0.00 0.00 70.33 68.30 3gqw n THR 272 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3gqw s VAL 273 N -1.76 1.40 -0.00 12.58 1.01 -0.91 -0.28 120.40 132.44 3gqw s VAL 273 Ca 0.00 -0.70 -0.27 0.00 0.00 0.00 0.00 61.98 61.00 3gqw s VAL 273 Cb 0.00 -1.21 0.06 0.00 0.00 0.00 0.00 36.38 35.23 3gqw s VAL 273 CO 0.00 0.41 0.62 -0.55 0.00 0.00 0.00 175.10 175.57 3gqw s SER 274 N 0.05 -0.58 -0.01 3.32 0.15 -0.83 -0.88 113.70 114.93 3gqw s SER 274 Ca -0.04 0.49 -0.01 0.00 0.70 0.00 0.00 55.95 57.09 3gqw s SER 274 Cb -0.11 0.52 -0.00 0.00 -1.71 0.00 0.00 66.02 64.72 3gqw s SER 274 CO 0.02 -0.66 0.03 -0.69 1.20 0.00 0.00 173.24 173.14 3gqw s VAL 275 N -1.75 0.02 0.17 4.45 1.01 -1.26 -1.30 120.40 121.75 3gqw s VAL 275 Ca -0.09 -0.20 -0.06 0.00 0.00 0.00 0.00 61.98 61.63 3gqw s VAL 275 Cb -0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 36.38 36.24 3gqw s VAL 275 CO 0.05 -0.11 0.23 0.00 0.00 0.00 0.00 175.10 175.27 3gqw s ALA 276 N -0.31 0.35 0.78 5.51 0.00 -0.92 -4.86 121.76 122.31 3gqw s ALA 276 Ca -0.04 -1.14 -0.11 0.00 0.00 0.00 0.00 51.96 50.67 3gqw s ALA 276 Cb -0.02 0.96 0.06 0.00 0.00 0.00 0.00 23.12 24.12 3gqw s ALA 276 CO -0.00 -0.62 1.09 -2.14 0.00 0.00 0.00 175.76 174.08 3gqw s PRO 277 N -4.02 2.21 0.29 0.00 0.02 -1.26 -3.19 135.00 129.05 3gqw s PRO 277 Ca 0.23 0.77 0.02 0.00 0.02 0.00 0.00 61.00 62.04 3gqw s PRO 277 Cb 0.04 -1.92 0.74 0.00 0.02 0.00 0.00 34.50 33.38 3gqw s PRO 277 CO 0.03 -1.56 1.62 -1.35 -0.33 0.00 0.00 177.00 175.41 3gqw h PRO 278 N -1.05 0.14 0.00 5.54 0.11 -1.88 0.03 132.00 134.89 3gqw h PRO 278 Ca -0.46 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 3gqw h PRO 278 Cb 1.25 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3gqw h PRO 278 CO 0.58 0.09 -0.32 0.27 -0.21 0.00 0.00 178.00 178.41 3gqw h PHE 279 N 0.14 0.00 -0.62 0.65 -5.15 -1.95 -2.47 116.94 107.54 3gqw h PHE 279 Ca 0.57 0.00 0.04 0.00 -0.20 0.00 0.00 57.97 58.38 3gqw h PHE 279 Cb 1.18 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 37.32 3gqw h PHE 279 CO -0.32 0.32 0.41 0.78 -2.00 0.00 0.00 178.31 177.51 3gqw h GLY 280 N 1.37 0.83 0.76 6.09 0.00 -1.33 0.22 103.07 111.01 3gqw h GLY 280 Ca -0.00 -0.29 -0.17 0.00 0.00 0.00 0.00 47.33 46.87 3gqw h GLY 280 CO 0.04 0.25 -0.72 -0.97 0.00 0.00 0.00 176.54 175.14 3gqw h TYR 281 N 0.73 0.60 -0.16 5.60 0.05 -1.49 -3.23 116.97 119.07 3gqw h TYR 281 Ca 0.25 -0.37 -0.01 0.00 0.05 0.00 0.00 58.73 58.65 3gqw h TYR 281 Cb 0.09 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 37.78 3gqw h TYR 281 CO -0.00 1.23 0.07 1.49 -1.05 0.00 0.00 178.16 179.90 3gqw h GLU 282 N -0.20 0.23 -0.73 4.88 4.22 -1.10 -2.64 114.58 119.23 3gqw h GLU 282 Ca -0.11 -0.04 0.15 0.00 0.08 0.00 0.00 59.36 59.44 3gqw h GLU 282 Cb 1.48 -0.04 -0.14 0.00 0.50 0.00 0.00 28.75 30.55 3gqw h GLU 282 CO 0.14 0.29 -0.17 1.25 -2.18 0.00 0.00 179.01 178.34 3gqw h LEU 283 N 0.12 -0.66 0.56 1.64 6.46 -0.69 -0.40 115.31 122.34 3gqw h LEU 283 Ca 0.05 0.22 -0.02 0.00 -0.12 0.00 0.00 57.88 58.01 3gqw h LEU 283 Cb 0.14 0.45 -0.02 0.00 -0.73 0.00 0.00 40.66 40.50 3gqw h LEU 283 CO -0.01 -0.24 -0.47 0.00 -0.62 0.00 0.00 178.44 177.10 3gqw h GLN 285 N -1.00 0.00 -0.13 0.00 -0.00 -1.25 -1.04 115.11 111.68 3gqw h GLN 285 Ca -0.07 0.00 -0.14 0.00 -0.00 0.00 0.00 58.65 58.44 3gqw h GLN 285 Cb 0.85 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.32 3gqw h GLN 285 CO -0.01 0.07 -0.53 -0.09 0.00 0.00 0.00 178.83 178.27 3gqw h ARG 286 N 0.00 0.37 -0.05 1.69 2.43 -0.79 -3.33 114.38 114.71 3gqw h ARG 286 Ca -0.00 -0.22 -0.01 0.00 -0.81 0.00 0.00 59.98 58.94 3gqw h ARG 286 Cb 0.15 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 3gqw h ARG 286 CO 0.01 0.81 -0.11 0.54 -1.51 0.00 0.00 179.97 179.71 3gqw n ARG 287 N -3.95 1.56 -2.53 0.20 1.74 -0.62 -5.03 116.66 108.04 3gqw n ARG 287 Ca -0.02 -2.80 -0.33 0.00 -0.77 0.00 0.00 57.85 53.93 3gqw n ARG 287 Cb 0.57 -1.58 -0.04 0.00 -1.02 0.00 0.00 32.46 30.39 3gqw n ARG 287 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3gqw s VAL 288 N -2.97 4.34 0.06 1.55 0.11 -0.49 -4.91 120.40 118.10 3gqw s VAL 288 Ca 0.35 1.27 -0.08 0.00 -2.93 0.00 0.00 61.98 60.59 3gqw s VAL 288 Cb 0.31 -3.62 -0.00 0.00 -1.53 0.00 0.00 36.38 31.54 3gqw s VAL 288 CO 0.01 -0.50 0.17 0.54 -3.33 0.00 0.00 175.10 171.99 3gqw s ASN 289 N -2.63 0.13 0.29 3.54 2.20 -1.26 -5.06 114.94 112.15 3gqw s ASN 289 Ca 0.61 -0.57 0.04 0.00 -0.94 0.00 0.00 52.86 52.00 3gqw s ASN 289 Cb -0.11 0.30 0.67 0.00 -2.00 0.00 0.00 41.25 40.11 3gqw s ASN 289 CO 0.24 -0.64 1.78 -0.33 -2.94 0.00 0.00 177.10 175.21 3gqw h GLU 290 N 3.10 0.74 -0.91 3.55 4.39 -1.99 0.47 114.58 123.93 3gqw h GLU 290 Ca -0.33 -0.04 0.17 0.00 0.34 0.00 0.00 59.36 59.50 3gqw h GLU 290 Cb 1.19 -0.17 -0.07 0.00 -0.10 0.00 0.00 28.75 29.60 3gqw h GLU 290 CO 0.54 0.49 0.59 -0.22 -1.16 0.00 0.00 179.01 179.24 3gqw h LYS 291 N 0.76 0.57 -0.31 2.33 3.64 -2.02 -1.25 116.57 120.29 3gqw h LYS 291 Ca 0.54 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.78 3gqw h LYS 291 Cb 0.79 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 3gqw h LYS 291 CO -0.37 0.38 -0.23 -0.44 -2.27 0.00 0.00 179.45 176.52 3gqw h ASP 292 N 0.59 0.74 0.36 4.20 3.32 -0.47 -3.11 116.42 122.05 3gqw h ASP 292 Ca 0.48 -0.44 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3gqw h ASP 292 Cb 0.93 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.27 3gqw h ASP 292 CO -0.22 1.03 0.00 0.18 -1.72 0.00 0.00 179.24 178.51 3gqw n LEU 293 N -4.30 0.00 0.25 1.55 4.77 -0.49 -3.31 117.00 115.47 3gqw n LEU 293 Ca -0.03 0.50 0.13 0.00 -0.03 0.00 0.00 56.01 56.58 3gqw n LEU 293 Cb 0.44 -0.50 0.59 0.00 -2.33 0.00 0.00 43.42 41.62 3gqw n LEU 293 CO 0.44 -0.32 0.90 0.00 -1.33 0.00 0.00 177.39 177.08 3gqw h ALA 294 N 2.36 1.04 0.00 -1.18 0.00 -1.43 -3.05 119.26 117.00 3gqw h ALA 294 Ca 0.00 -0.11 -0.28 0.00 0.00 0.00 0.00 54.91 54.52 3gqw h ALA 294 Cb 0.18 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 3gqw h ALA 294 CO 0.00 0.15 -2.29 0.39 0.00 0.00 0.00 179.25 177.50 3gqw n GLU 295 N -3.30 0.69 -2.11 0.00 4.71 -1.21 -5.02 120.64 114.40 3gqw n GLU 295 Ca 0.00 -0.06 -0.42 0.00 -0.01 0.00 0.00 57.16 56.67 3gqw n GLU 295 Cb 0.35 -1.52 -0.03 0.00 -1.01 0.00 0.00 31.44 29.24 3gqw n GLU 295 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 3gqw s LEU 296 N -5.25 4.34 -0.09 -4.62 1.43 -1.16 -4.99 118.68 108.35 3gqw s LEU 296 Ca -0.09 2.27 -0.00 0.00 -1.03 0.00 0.00 54.13 55.27 3gqw s LEU 296 Cb 0.08 -3.56 0.02 0.00 0.03 0.00 0.00 46.19 42.76 3gqw s LEU 296 CO 0.85 -0.77 -0.06 -0.62 0.23 0.00 0.00 176.35 175.97 3gqw s ASP 297 N 1.98 1.81 -0.07 2.29 2.15 -1.26 -4.78 116.67 118.79 3gqw s ASP 297 Ca 0.67 -0.23 0.11 0.00 0.43 0.00 0.00 52.55 53.53 3gqw s ASP 297 Cb -0.35 -0.69 0.23 0.00 -0.30 0.00 0.00 42.92 41.81 3gqw s ASP 297 CO 0.29 -0.10 1.16 0.18 -0.17 0.00 0.00 175.17 176.52 3gqw n LEU 298 N 4.70 2.55 0.26 -1.34 4.32 0.11 -4.40 117.00 123.20 3gqw n LEU 298 Ca -0.14 -2.52 0.10 0.00 -0.02 0.00 0.00 56.01 53.42 3gqw n LEU 298 Cb 0.50 -0.26 0.68 0.00 -1.62 0.00 0.00 43.42 42.72 3gqw n LEU 298 CO 0.17 0.63 0.98 0.77 -1.22 0.00 0.00 177.39 178.73 3gqw h SER 299 N 0.59 0.00 0.87 -1.43 4.64 -1.69 -1.95 113.55 114.59 3gqw h SER 299 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 3gqw h SER 299 Cb 0.85 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.93 3gqw h SER 299 CO 0.03 0.11 -0.24 0.00 -0.87 0.00 0.00 176.83 175.86 3gqw s TRP 301 N -3.68 1.58 -0.06 0.00 -0.11 -0.73 -4.27 118.94 111.65 3gqw s TRP 301 Ca 0.00 0.89 -0.07 0.00 1.22 0.00 0.00 56.10 58.14 3gqw s TRP 301 Cb 0.11 -4.00 -0.28 0.00 -1.50 0.00 0.00 33.47 27.79 3gqw s TRP 301 CO 0.64 -2.50 0.59 -0.09 -4.62 0.00 0.00 176.95 170.97 3gqw h ARG 302 N 15.39 0.31 -3.51 5.86 2.43 -0.89 -3.46 114.38 130.52 3gqw h ARG 302 Ca -0.27 -0.54 -0.49 0.00 -0.81 0.00 0.00 59.98 57.86 3gqw h ARG 302 Cb 1.18 0.20 -0.40 0.00 -0.42 0.00 0.00 29.97 30.54 3gqw h ARG 302 CO 1.17 1.22 -0.76 0.08 -1.51 0.00 0.00 179.97 180.16 3gqw s VAL 303 N -2.58 0.41 -0.45 0.20 1.01 -0.67 -4.62 120.40 113.71 3gqw s VAL 303 Ca -0.17 -0.38 -0.10 0.00 0.00 0.00 0.00 61.98 61.34 3gqw s VAL 303 Cb 0.06 -0.88 0.10 0.00 0.00 0.00 0.00 36.38 35.66 3gqw s VAL 303 CO 0.83 -0.13 0.31 0.00 0.00 0.00 0.00 175.10 176.11 3gqw s ALA 304 N 1.92 3.36 0.23 5.51 0.00 0.63 -1.96 121.76 131.45 3gqw s ALA 304 Ca 0.01 -2.32 -0.12 0.00 0.00 0.00 0.00 51.96 49.52 3gqw s ALA 304 Cb -0.16 -2.77 -0.08 0.00 0.00 0.00 0.00 23.12 20.11 3gqw s ALA 304 CO -0.08 -1.77 0.59 0.20 0.00 0.00 0.00 175.76 174.70 3gqw s GLY 305 N 2.43 2.34 -0.02 0.00 0.00 -0.42 -4.11 107.32 107.55 3gqw s GLY 305 Ca 0.04 -0.17 0.01 0.00 0.00 0.00 0.00 44.72 44.60 3gqw s GLY 305 CO 0.01 0.02 -0.04 -0.42 0.00 0.00 0.00 173.10 172.67 3gqw s ILE 306 N -1.77 0.40 0.00 0.90 1.09 -1.26 -2.16 121.20 118.40 3gqw s ILE 306 Ca 0.47 -0.12 -0.04 0.00 -1.10 0.00 0.00 60.65 59.85 3gqw s ILE 306 Cb -0.12 -0.40 0.01 0.00 -1.06 0.00 0.00 42.46 40.90 3gqw s ILE 306 CO 0.20 0.16 0.19 0.61 -0.10 0.00 0.00 174.94 176.00 3gqw n GLY 307 N 3.56 0.67 0.00 6.18 0.00 -1.19 0.05 105.19 114.45 3gqw n GLY 307 Ca -0.20 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 44.94 3gqw n GLY 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gqw n ALA 308 N -2.68 0.00 -2.76 4.61 0.00 -1.26 -4.00 120.51 114.42 3gqw n ALA 308 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.33 3gqw n ALA 308 Cb 0.09 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.48 3gqw n ALA 308 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3gqw s GLU 309 N 0.00 1.05 0.03 0.00 2.02 -1.26 -5.00 118.70 115.54 3gqw s GLU 309 Ca 0.00 -0.98 -0.36 0.00 0.02 0.00 0.00 54.97 53.65 3gqw s GLU 309 Cb 0.00 0.39 -0.15 0.00 0.10 0.00 0.00 34.13 34.48 3gqw s GLU 309 CO 0.00 -0.38 1.56 -2.30 0.02 0.00 0.00 175.26 174.16 3gqw n PRO 310 N -0.17 1.63 -2.86 0.39 -0.02 -1.26 -4.81 135.00 127.90 3gqw n PRO 310 Ca -0.12 0.59 -0.40 0.00 -2.02 0.00 0.00 63.50 61.55 3gqw n PRO 310 Cb 0.63 -2.31 -0.05 0.00 -0.02 0.00 0.00 33.50 31.74 3gqw n PRO 310 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3gqw s ILE 311 N 1.64 4.47 -0.48 4.25 1.01 -1.26 -4.92 121.20 125.91 3gqw s ILE 311 Ca 0.86 1.87 -0.19 0.00 0.00 0.00 0.00 60.65 63.18 3gqw s ILE 311 Cb -0.84 -4.22 0.05 0.00 0.01 0.00 0.00 42.46 37.45 3gqw s ILE 311 CO 0.47 0.40 0.61 -0.55 0.00 0.00 0.00 174.94 175.87 3gqw s SER 312 N -0.45 6.24 0.16 3.58 0.15 -1.26 -4.64 113.70 117.48 3gqw s SER 312 Ca 0.41 -0.79 -0.16 0.00 0.70 0.00 0.00 55.95 56.11 3gqw s SER 312 Cb -0.23 -2.29 0.09 0.00 -1.71 0.00 0.00 66.02 61.89 3gqw s SER 312 CO 0.27 -0.84 1.70 0.00 1.20 0.00 0.00 173.24 175.57 3gqw h ALA 313 N 8.94 0.33 -0.64 5.45 0.00 -1.95 -2.22 119.26 129.17 3gqw h ALA 313 Ca -0.27 0.11 0.13 0.00 0.00 0.00 0.00 54.91 54.89 3gqw h ALA 313 Cb 1.10 0.20 -0.12 0.00 0.00 0.00 0.00 17.79 18.97 3gqw h ALA 313 CO 0.93 -0.41 -0.11 1.49 0.00 0.00 0.00 179.25 181.16 3gqw h GLU 314 N 0.09 0.03 0.18 0.00 4.81 -1.98 -0.47 114.58 117.23 3gqw h GLU 314 Ca 0.18 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.40 3gqw h GLU 314 Cb 0.26 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.64 3gqw h GLU 314 CO -0.32 0.02 -0.08 1.96 -0.73 0.00 0.00 179.01 179.86 3gqw h GLN 315 N 0.03 -0.23 -0.83 1.92 4.20 -1.87 -1.69 115.11 116.64 3gqw h GLN 315 Ca 0.32 0.02 0.15 0.00 0.06 0.00 0.00 58.65 59.19 3gqw h GLN 315 Cb 0.50 0.05 -0.06 0.00 0.30 0.00 0.00 27.48 28.27 3gqw h GLN 315 CO -0.63 -0.00 0.54 -0.07 -0.67 0.00 0.00 178.83 178.00 3gqw h LEU 316 N -0.43 0.53 -0.15 1.46 3.38 -0.77 0.63 115.31 119.95 3gqw h LEU 316 Ca -0.02 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3gqw h LEU 316 Cb 0.33 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 3gqw h LEU 316 CO 0.04 0.27 0.05 -0.74 0.09 0.00 0.00 178.44 178.15 3gqw h HIS 317 N 0.56 0.24 -0.35 1.13 2.76 -0.88 -0.59 115.15 118.03 3gqw h HIS 317 Ca 0.41 -0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.63 3gqw h HIS 317 Cb 0.78 -0.07 -0.07 0.00 1.55 0.00 0.00 27.41 29.60 3gqw h HIS 317 CO -0.00 0.33 -0.10 1.96 -1.30 0.00 0.00 177.93 178.81 3gqw h GLN 318 N 0.08 -0.02 -0.63 5.26 4.20 0.10 0.04 115.11 124.13 3gqw h GLN 318 Ca 0.05 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.79 3gqw h GLN 318 Cb 0.20 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.94 3gqw h GLN 318 CO -0.00 -0.02 0.38 0.35 -0.67 0.00 0.00 178.83 178.87 3gqw h PHE 319 N -0.02 0.71 -0.61 2.96 3.04 -0.39 -0.34 116.94 122.29 3gqw h PHE 319 Ca 0.17 0.02 -0.06 0.00 3.98 0.00 0.00 57.97 62.08 3gqw h PHE 319 Cb 0.28 -0.23 -0.02 0.00 2.56 0.00 0.00 35.95 38.54 3gqw h PHE 319 CO -0.33 0.40 0.14 0.00 -2.02 0.00 0.00 178.31 176.50 3gqw h ALA 320 N 1.29 0.80 -0.76 2.41 0.00 -0.32 -1.56 119.26 121.12 3gqw h ALA 320 Ca 0.26 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3gqw h ALA 320 Cb 0.05 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 3gqw h ALA 320 CO -0.12 0.52 0.35 0.93 0.00 0.00 0.00 179.25 180.93 3gqw h GLU 321 N 0.89 1.08 -0.45 0.00 4.39 -0.59 -0.78 114.58 119.12 3gqw h GLU 321 Ca 0.19 -0.16 -0.07 0.00 0.34 0.00 0.00 59.36 59.66 3gqw h GLU 321 Cb 0.36 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 3gqw h GLU 321 CO 0.00 0.84 -0.03 0.00 -1.16 0.00 0.00 179.01 178.67 3gqw n PHE 323 N -4.21 0.61 -0.23 0.00 3.72 -0.70 -4.35 117.46 112.31 3gqw n PHE 323 Ca 0.02 -0.80 -0.04 0.00 -0.05 0.00 0.00 57.45 56.59 3gqw n PHE 323 Cb 0.31 -0.21 0.07 0.00 -0.94 0.00 0.00 39.48 38.71 3gqw n PHE 323 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 3gqw h ARG 324 N 1.40 0.78 -0.07 -1.08 2.43 -1.19 -0.34 114.38 116.31 3gqw h ARG 324 Ca 0.00 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.14 3gqw h ARG 324 Cb 1.15 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.53 3gqw h ARG 324 CO 0.12 0.52 0.18 -0.56 -1.51 0.00 0.00 179.97 178.72 3gqw h GLN 325 N 0.81 0.00 -0.34 0.20 3.07 -1.81 0.36 115.11 117.40 3gqw h GLN 325 Ca 0.26 0.00 -0.09 0.00 0.09 0.00 0.00 58.65 58.91 3gqw h GLN 325 Cb 0.01 0.00 -0.06 0.00 0.08 0.00 0.00 27.48 27.52 3gqw h GLN 325 CO -0.10 0.00 0.01 1.33 0.09 0.00 0.00 178.83 180.16 3gqw n VAL 326 N -3.27 2.44 -2.64 1.86 0.24 -1.10 -4.97 118.33 110.90 3gqw n VAL 326 Ca -0.01 -2.18 -0.08 0.00 -2.04 0.00 0.00 64.34 60.03 3gqw n VAL 326 Cb 0.26 -0.29 0.02 0.00 -1.47 0.00 0.00 33.84 32.36 3gqw n VAL 326 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3gqw n ASN 327 N -0.75 -3.34 -4.63 -1.34 4.13 0.13 -0.71 115.26 108.75 3gqw n ASN 327 Ca 0.28 -0.13 -0.43 0.00 1.68 0.00 0.00 54.58 55.98 3gqw n ASN 327 Cb 0.99 -2.15 -0.03 0.00 -1.54 0.00 0.00 39.78 37.05 3gqw n ASN 327 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 3gqw s PHE 328 N -2.86 3.18 -0.23 3.10 5.36 -0.16 -2.51 117.98 123.85 3gqw s PHE 328 Ca 0.14 1.07 -0.26 0.00 -0.96 0.00 0.00 56.93 56.92 3gqw s PHE 328 Cb -0.06 -3.50 -0.00 0.00 -0.34 0.00 0.00 43.02 39.11 3gqw s PHE 328 CO 0.18 -0.68 0.90 0.34 -1.46 0.00 0.00 175.22 174.49 3gqw s ASP 329 N 1.62 6.93 0.11 6.13 2.15 -1.26 -4.40 116.67 127.94 3gqw s ASP 329 Ca 0.41 1.15 0.17 0.00 0.43 0.00 0.00 52.55 54.71 3gqw s ASP 329 Cb -0.13 -2.47 0.72 0.00 -0.30 0.00 0.00 42.92 40.74 3gqw s ASP 329 CO 0.14 -0.56 1.52 -0.46 -0.17 0.00 0.00 175.17 175.64 3gqw n ASN 330 N 6.06 0.26 0.05 -0.34 0.23 -1.26 -1.69 115.26 118.57 3gqw n ASN 330 Ca 0.08 0.57 0.11 0.00 -0.53 0.00 0.00 54.58 54.81 3gqw n ASN 330 Cb 0.47 -0.63 0.45 0.00 -2.08 0.00 0.00 39.78 37.99 3gqw n ASN 330 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 3gqw n LYS 331 N -1.80 0.10 0.00 -3.83 4.76 -1.26 -2.51 118.16 113.62 3gqw n LYS 331 Ca 0.02 0.23 0.14 0.00 -2.87 0.00 0.00 58.31 55.84 3gqw n LYS 331 Cb 0.17 -1.66 0.64 0.00 -1.84 0.00 0.00 35.03 32.35 3gqw n LYS 331 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 3gqw n THR 332 N -1.84 0.00 -0.52 -0.18 -2.24 -0.68 -2.28 114.28 106.54 3gqw n THR 332 Ca 0.04 -0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.52 3gqw n THR 332 Cb 0.27 -0.47 0.28 0.00 -2.10 0.00 0.00 70.33 68.31 3gqw n THR 332 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3gqw n PHE 333 N -1.44 -3.83 -3.75 4.78 3.72 -1.04 -0.27 117.46 115.63 3gqw n PHE 333 Ca 0.09 -0.87 -0.12 0.00 -0.05 0.00 0.00 57.45 56.49 3gqw n PHE 333 Cb 0.32 -1.20 -0.11 0.00 -0.94 0.00 0.00 39.48 37.54 3gqw n PHE 333 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 3gqw s PRO 335 N -5.21 0.33 0.11 -1.08 0.02 -1.26 -3.21 135.00 124.71 3gqw s PRO 335 Ca 0.68 0.50 -0.05 0.00 0.02 0.00 0.00 61.00 62.15 3gqw s PRO 335 Cb -0.10 0.09 -0.02 0.00 0.02 0.00 0.00 34.50 34.49 3gqw s PRO 335 CO 0.55 -0.08 0.14 0.00 -0.33 0.00 0.00 177.00 177.28 3gqw s TYR 337 N -3.95 1.20 0.09 0.00 5.04 -0.12 -4.16 117.35 115.45 3gqw s TYR 337 Ca 0.14 -0.38 -0.26 0.00 -2.44 0.00 0.00 57.07 54.13 3gqw s TYR 337 Cb 0.06 -0.71 0.09 0.00 0.35 0.00 0.00 41.96 41.75 3gqw s TYR 337 CO -0.04 0.04 1.15 0.20 -1.34 0.00 0.00 175.55 175.55 3gqw s GLY 338 N -1.28 -0.07 0.24 8.97 0.00 -1.26 -0.51 107.32 113.42 3gqw s GLY 338 Ca 0.00 -0.03 -0.22 0.00 0.00 0.00 0.00 44.72 44.47 3gqw s GLY 338 CO 0.01 3.01 0.72 0.48 0.00 0.00 0.00 173.10 177.32 3gqw s LEU 339 N -3.45 -0.32 0.26 0.66 2.34 -0.18 -4.90 118.68 113.09 3gqw s LEU 339 Ca 0.23 -0.46 0.01 0.00 0.06 0.00 0.00 54.13 53.97 3gqw s LEU 339 Cb -0.01 2.64 0.33 0.00 -0.56 0.00 0.00 46.19 48.59 3gqw s LEU 339 CO 0.02 -1.22 1.66 0.00 -1.06 0.00 0.00 176.35 175.75 3gqw h ALA 340 N 2.00 0.99 0.00 1.48 0.00 -1.83 -2.69 119.26 119.21 3gqw h ALA 340 Ca -0.22 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.29 3gqw h ALA 340 Cb 1.26 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3gqw h ALA 340 CO 0.26 0.60 0.00 0.39 0.00 0.00 0.00 179.25 180.51 3gqw n GLU 341 N -4.06 0.09 -1.19 0.00 4.71 -1.26 0.39 120.64 119.31 3gqw n GLU 341 Ca -0.01 0.21 -0.00 0.00 -0.01 0.00 0.00 57.16 57.35 3gqw n GLU 341 Cb 0.47 -1.50 0.13 0.00 -1.01 0.00 0.00 31.44 29.52 3gqw n GLU 341 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 3gqw n ASN 342 N -1.26 2.12 0.00 1.62 2.85 -1.03 -4.64 115.26 114.93 3gqw n ASN 342 Ca 0.03 -3.36 0.00 0.00 -0.11 0.00 0.00 54.58 51.14 3gqw n ASN 342 Cb 0.04 -0.45 0.00 0.00 1.24 0.00 0.00 39.78 40.62 3gqw n ASN 342 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3gqw n ALA 343 N -0.68 0.00 -0.10 5.20 0.00 0.16 -4.08 120.51 121.02 3gqw n ALA 343 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.64 3gqw n ALA 343 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.29 3gqw n ALA 343 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3gqw n LEU 344 N 0.00 0.00 -4.88 0.00 0.00 -1.15 -4.49 117.00 106.49 3gqw n LEU 344 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 56.01 55.68 3gqw n LEU 344 Cb 0.00 0.43 -0.05 0.00 0.00 0.00 0.00 43.42 43.80 3gqw n LEU 344 CO 0.00 -0.45 0.06 0.00 0.00 0.00 0.00 177.39 177.00 3gqw s ALA 345 N -1.04 3.75 0.00 1.96 0.00 -1.26 -1.01 121.76 124.16 3gqw s ALA 345 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.50 3gqw s ALA 345 Cb 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 23.12 20.91 3gqw s ALA 345 CO 0.00 0.61 0.00 0.28 0.00 0.00 0.00 175.76 176.65 3gqw n VAL 346 N 0.51 0.00 -3.46 0.00 0.31 0.34 -4.86 118.33 111.17 3gqw n VAL 346 Ca -0.05 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.14 3gqw n VAL 346 Cb 0.52 -0.44 -0.03 0.00 -0.91 0.00 0.00 33.84 32.98 3gqw n VAL 346 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3gqw s SER 347 N -2.70 -0.57 0.01 4.52 1.04 -0.92 -4.00 113.70 111.09 3gqw s SER 347 Ca 0.00 0.23 0.02 0.00 0.48 0.00 0.00 55.95 56.67 3gqw s SER 347 Cb 0.00 0.55 -0.01 0.00 0.10 0.00 0.00 66.02 66.66 3gqw s SER 347 CO 0.00 -0.81 -0.06 -0.36 0.98 0.00 0.00 173.24 173.00 3gqw s PHE 348 N -2.84 0.48 0.91 5.02 0.40 -1.06 -0.95 117.98 119.95 3gqw s PHE 348 Ca -0.02 -0.23 -0.11 0.00 -0.60 0.00 0.00 56.93 55.97 3gqw s PHE 348 Cb -0.01 -0.30 0.14 0.00 0.51 0.00 0.00 43.02 43.36 3gqw s PHE 348 CO -0.05 -0.04 1.10 0.45 0.70 0.00 0.00 175.22 177.38 3gqw s SER 349 N -0.61 3.15 0.96 1.36 0.15 0.09 -3.71 113.70 115.08 3gqw s SER 349 Ca -0.03 1.78 -0.10 0.00 0.70 0.00 0.00 55.95 58.30 3gqw s SER 349 Cb -0.05 -2.39 0.17 0.00 -1.71 0.00 0.00 66.02 62.04 3gqw s SER 349 CO -0.00 -2.89 1.13 -1.81 1.20 0.00 0.00 173.24 170.87 3gqw s ASP 350 N -3.05 2.58 0.39 5.45 1.01 -1.26 -4.91 116.67 116.88 3gqw s ASP 350 Ca 0.65 2.10 -0.26 0.00 0.71 0.00 0.00 52.55 55.75 3gqw s ASP 350 Cb -0.20 -2.54 -0.09 0.00 1.01 0.00 0.00 42.92 41.10 3gqw s ASP 350 CO 0.58 -3.31 1.25 -0.70 0.21 0.00 0.00 175.17 173.21 3gqw s GLU 351 N -4.61 4.06 -1.66 8.23 2.12 -1.26 -3.05 118.70 122.52 3gqw s GLU 351 Ca 0.67 2.05 -0.15 0.00 0.36 0.00 0.00 54.97 57.90 3gqw s GLU 351 Cb -0.23 -2.78 0.13 0.00 0.26 0.00 0.00 34.13 31.51 3gqw s GLU 351 CO 0.59 -0.38 0.65 0.00 -0.54 0.00 0.00 175.26 175.58 3gqw n ALA 352 N 0.22 -1.43 -0.01 6.30 0.00 -1.26 -4.86 120.51 119.47 3gqw n ALA 352 Ca 0.03 -0.10 -0.05 0.00 0.00 0.00 0.00 53.44 53.32 3gqw n ALA 352 Cb 0.44 -2.88 -0.12 0.00 0.00 0.00 0.00 19.45 16.89 3gqw n ALA 352 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3gqw n SER 353 N -2.71 0.77 -1.19 0.00 3.41 -1.17 -4.93 113.62 107.81 3gqw n SER 353 Ca -0.01 0.36 0.16 0.00 -0.26 0.00 0.00 58.87 59.11 3gqw n SER 353 Cb 0.53 0.16 -0.04 0.00 -0.26 0.00 0.00 64.21 64.60 3gqw n SER 353 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gqw n GLY 354 N 1.50 -1.90 3.70 5.00 0.00 -0.97 -4.65 105.19 107.87 3gqw n GLY 354 Ca -0.15 -1.22 -0.42 0.00 0.00 0.00 0.00 46.02 44.23 3gqw n GLY 354 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gqw s VAL 355 N -2.17 3.71 -0.14 1.61 1.01 -1.26 -4.82 120.40 118.35 3gqw s VAL 355 Ca 0.00 1.16 -0.03 0.00 0.00 0.00 0.00 61.98 63.11 3gqw s VAL 355 Cb 0.00 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 3gqw s VAL 355 CO 0.00 0.03 -0.05 -0.69 0.00 0.00 0.00 175.10 174.39 3gqw s VAL 356 N 1.88 3.76 0.19 2.92 1.01 -1.26 -5.04 120.40 123.85 3gqw s VAL 356 Ca 0.63 -0.41 0.10 0.00 0.00 0.00 0.00 61.98 62.29 3gqw s VAL 356 Cb -0.32 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.39 3gqw s VAL 356 CO 0.27 0.51 -0.16 0.68 0.00 0.00 0.00 175.10 176.40 3gqw s VAL 357 N 0.24 2.82 -0.13 2.92 -7.23 -1.26 0.32 120.40 118.08 3gqw s VAL 357 Ca -0.04 -1.82 0.01 0.00 -1.81 0.00 0.00 61.98 58.33 3gqw s VAL 357 Cb -0.14 -2.38 0.02 0.00 0.56 0.00 0.00 36.38 34.43 3gqw s VAL 357 CO 0.03 -0.11 -0.16 0.21 -0.31 0.00 0.00 175.10 174.76 3gqw s ASN 358 N -2.75 2.69 0.13 4.85 3.84 0.12 -4.90 114.94 118.92 3gqw s ASN 358 Ca 0.23 -0.50 -0.13 0.00 0.21 0.00 0.00 52.86 52.68 3gqw s ASN 358 Cb -0.08 -1.21 -0.07 0.00 -0.55 0.00 0.00 41.25 39.34 3gqw s ASN 358 CO 0.13 0.00 0.50 -1.61 -2.79 0.00 0.00 177.10 173.34 3gqw s GLU 359 N 1.13 3.91 0.03 0.43 2.02 -1.26 -1.16 118.70 123.80 3gqw s GLU 359 Ca -0.02 0.39 0.02 0.00 0.02 0.00 0.00 54.97 55.38 3gqw s GLU 359 Cb -0.14 -2.95 -0.02 0.00 0.10 0.00 0.00 34.13 31.12 3gqw s GLU 359 CO -0.05 0.50 -0.07 0.14 0.02 0.00 0.00 175.26 175.79 3gqw s VAL 360 N -1.45 0.52 0.03 2.63 -7.23 0.03 -4.27 120.40 110.66 3gqw s VAL 360 Ca 0.36 -0.94 -0.30 0.00 -1.81 0.00 0.00 61.98 59.30 3gqw s VAL 360 Cb -0.15 -0.57 -0.09 0.00 0.56 0.00 0.00 36.38 36.14 3gqw s VAL 360 CO 0.19 -0.30 1.98 -0.62 -0.31 0.00 0.00 175.10 176.04 3gqw s ASP 361 N -1.34 6.42 0.16 4.85 -1.08 -0.70 -1.71 116.67 123.28 3gqw s ASP 361 Ca -0.08 2.67 -0.10 0.00 -0.52 0.00 0.00 52.55 54.52 3gqw s ASP 361 Cb -0.09 -2.53 0.01 0.00 -1.46 0.00 0.00 42.92 38.85 3gqw s ASP 361 CO 0.00 -1.08 1.55 -0.09 0.52 0.00 0.00 175.17 176.08 3gqw h ARG 362 N 10.71 1.01 -0.31 4.34 2.43 -0.85 -2.94 114.38 128.77 3gqw h ARG 362 Ca -0.50 -0.43 -0.05 0.00 -0.81 0.00 0.00 59.98 58.19 3gqw h ARG 362 Cb 1.24 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.74 3gqw h ARG 362 CO 0.94 1.11 -0.02 -0.44 -1.51 0.00 0.00 179.97 180.05 3gqw h ASP 363 N 0.87 0.45 0.48 -3.80 3.32 -1.90 -0.62 116.42 115.21 3gqw h ASP 363 Ca 0.11 -0.09 -0.10 0.00 0.02 0.00 0.00 57.03 56.97 3gqw h ASP 363 Cb 0.80 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 3gqw h ASP 363 CO 0.07 0.53 -0.48 0.40 -1.72 0.00 0.00 179.24 178.04 3gqw h ILE 364 N 0.46 1.35 -0.03 0.35 2.04 -1.83 -1.36 117.51 118.48 3gqw h ILE 364 Ca 0.10 -1.67 -0.07 0.00 1.00 0.00 0.00 64.86 64.22 3gqw h ILE 364 Cb 0.34 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.32 3gqw h ILE 364 CO 0.01 0.48 -0.25 0.25 0.00 0.00 0.00 178.15 178.64 3gqw h LEU 365 N 0.01 0.28 -0.54 1.44 5.85 -1.22 -1.86 115.31 119.27 3gqw h LEU 365 Ca -0.00 -0.69 -0.07 0.00 0.84 0.00 0.00 57.88 57.96 3gqw h LEU 365 Cb 0.86 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.79 3gqw h LEU 365 CO 0.06 0.92 0.06 -0.33 -0.34 0.00 0.00 178.44 178.81 3gqw h GLU 366 N -0.35 0.91 0.00 1.25 5.08 -1.08 -2.00 114.58 118.38 3gqw h GLU 366 Ca -0.02 -0.26 -0.15 0.00 -1.00 0.00 0.00 59.36 57.93 3gqw h GLU 366 Cb 0.93 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.05 3gqw h GLU 366 CO 0.05 0.89 -1.72 0.66 -1.00 0.00 0.00 179.01 177.90 3gqw n TYR 367 N -4.34 0.53 -0.52 4.33 4.02 -0.52 -1.01 117.16 119.65 3gqw n TYR 367 Ca 0.02 0.17 0.00 0.00 -0.01 0.00 0.00 57.90 58.08 3gqw n TYR 367 Cb 0.28 -0.90 0.00 0.00 -0.02 0.00 0.00 39.34 38.70 3gqw n TYR 367 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 176.86 176.89 3gqw n GLN 368 N -2.67 1.37 -4.28 -0.72 6.02 -0.71 -4.87 117.38 111.52 3gqw n GLN 368 Ca -0.12 -0.95 -0.37 0.00 -0.01 0.00 0.00 57.00 55.55 3gqw n GLN 368 Cb 0.80 -0.74 -0.04 0.00 1.02 0.00 0.00 30.24 31.28 3gqw n GLN 368 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3gqw n GLY 369 N -0.23 -0.41 3.06 1.08 0.00 -0.75 -4.93 105.19 103.00 3gqw n GLY 369 Ca 0.00 0.12 -0.22 0.00 0.00 0.00 0.00 46.02 45.92 3gqw n GLY 369 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gqw s LYS 370 N -6.99 1.19 -0.62 1.61 1.02 -1.17 -2.27 119.74 112.51 3gqw s LYS 370 Ca 0.69 -0.43 -0.22 0.00 0.02 0.00 0.00 55.97 56.04 3gqw s LYS 370 Cb -0.38 -1.10 0.07 0.00 -0.52 0.00 0.00 37.83 35.90 3gqw s LYS 370 CO 0.95 0.20 0.89 0.00 -0.92 0.00 0.00 175.35 176.46 3gqw s ALA 371 N 0.00 3.20 0.25 5.17 0.00 0.16 -3.15 121.76 127.40 3gqw s ALA 371 Ca -0.01 -1.84 0.11 0.00 0.00 0.00 0.00 51.96 50.22 3gqw s ALA 371 Cb -0.08 -3.75 -0.05 0.00 0.00 0.00 0.00 23.12 19.25 3gqw s ALA 371 CO 0.01 -2.60 -0.13 0.14 0.00 0.00 0.00 175.76 173.18 3gqw s VAL 372 N 3.68 2.88 0.21 0.00 -7.23 -1.26 -4.71 120.40 113.98 3gqw s VAL 372 Ca 0.20 -2.11 -0.30 0.00 -1.81 0.00 0.00 61.98 57.96 3gqw s VAL 372 Cb -0.18 -2.50 -0.08 0.00 0.56 0.00 0.00 36.38 34.18 3gqw s VAL 372 CO 0.10 -0.33 1.00 0.00 -0.31 0.00 0.00 175.10 175.57 3gqw s ALA 373 N -2.27 3.34 0.09 1.32 0.00 -1.26 -1.73 121.76 121.26 3gqw s ALA 373 Ca 0.29 0.70 -0.35 0.00 0.00 0.00 0.00 51.96 52.61 3gqw s ALA 373 Cb -0.06 -3.27 -0.14 0.00 0.00 0.00 0.00 23.12 19.65 3gqw s ALA 373 CO 0.16 0.02 1.61 -2.30 0.00 0.00 0.00 175.76 175.25 3gqw n PRO 374 N 1.81 1.99 -0.37 0.00 -0.02 -1.26 -4.64 135.00 132.50 3gqw n PRO 374 Ca -0.00 0.72 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 3gqw n PRO 374 Cb 0.47 -2.48 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 3gqw n PRO 374 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gqw n GLY 375 N 3.51 3.46 0.25 -1.23 0.00 -1.26 -4.96 105.19 104.95 3gqw n GLY 375 Ca 0.19 -2.07 0.13 0.00 0.00 0.00 0.00 46.02 44.26 3gqw n GLY 375 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gqw h ALA 376 N -0.08 1.04 -0.11 4.61 0.00 -2.07 -2.97 119.26 119.69 3gqw h ALA 376 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3gqw h ALA 376 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3gqw h ALA 376 CO 0.00 0.17 0.00 0.39 0.00 0.00 0.00 179.25 179.81 3gqw n GLU 377 N -3.31 1.60 -1.90 0.00 1.02 -1.26 -4.97 120.64 111.82 3gqw n GLU 377 Ca 0.00 -1.65 -0.42 0.00 -0.02 0.00 0.00 57.16 55.07 3gqw n GLU 377 Cb 0.36 -1.34 -0.03 0.00 -0.02 0.00 0.00 31.44 30.41 3gqw n GLU 377 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3gqw s THR 378 N -1.32 2.57 -0.03 2.62 2.01 -1.12 -4.91 115.64 115.45 3gqw s THR 378 Ca 0.22 0.38 0.11 0.00 0.31 0.00 0.00 61.69 62.71 3gqw s THR 378 Cb 0.15 -3.24 -0.17 0.00 0.01 0.00 0.00 72.50 69.25 3gqw s THR 378 CO 0.21 0.03 0.24 0.54 -0.69 0.00 0.00 174.62 174.95 3gqw n ARG 379 N 4.14 0.41 -4.00 4.92 1.74 -1.26 -4.91 116.66 117.70 3gqw n ARG 379 Ca 0.14 -0.10 -0.11 0.00 -0.77 0.00 0.00 57.85 57.02 3gqw n ARG 379 Cb 0.38 -1.25 -0.11 0.00 -1.02 0.00 0.00 32.46 30.46 3gqw n ARG 379 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3gqw s ALA 380 N -2.72 0.25 -0.02 7.54 0.00 -1.26 -5.06 121.76 120.49 3gqw s ALA 380 Ca -0.04 -0.60 0.01 0.00 0.00 0.00 0.00 51.96 51.34 3gqw s ALA 380 Cb 0.07 0.10 0.01 0.00 0.00 0.00 0.00 23.12 23.31 3gqw s ALA 380 CO 0.45 -0.10 -0.03 0.08 0.00 0.00 0.00 175.76 176.15 3gqw s VAL 381 N -1.32 0.37 0.01 0.00 1.01 -1.26 -0.15 120.40 119.07 3gqw s VAL 381 Ca -0.13 -0.10 0.03 0.00 0.00 0.00 0.00 61.98 61.79 3gqw s VAL 381 Cb -0.09 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 3gqw s VAL 381 CO -0.01 0.16 -0.05 -0.44 0.00 0.00 0.00 175.10 174.77 3gqw s SER 382 N 0.55 4.78 -0.17 3.32 0.01 -0.69 -4.80 113.70 116.69 3gqw s SER 382 Ca -0.06 -0.12 -0.04 0.00 1.31 0.00 0.00 55.95 57.04 3gqw s SER 382 Cb -0.10 -1.15 -0.02 0.00 0.21 0.00 0.00 66.02 64.97 3gqw s SER 382 CO -0.00 0.27 -0.04 -0.89 0.41 0.00 0.00 173.24 172.98 3gqw s THR 383 N -1.05 3.73 0.04 1.44 2.01 -1.26 -0.79 115.64 119.75 3gqw s THR 383 Ca 0.18 -0.41 0.08 0.00 0.31 0.00 0.00 61.69 61.86 3gqw s THR 383 Cb -0.11 -2.65 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 3gqw s THR 383 CO 0.09 0.47 -0.20 -0.36 -0.69 0.00 0.00 174.62 173.93 3gqw s PHE 384 N 0.65 2.49 -0.05 4.92 0.08 -0.31 -4.90 117.98 120.86 3gqw s PHE 384 Ca -0.03 -0.30 -0.19 0.00 0.12 0.00 0.00 56.93 56.54 3gqw s PHE 384 Cb -0.14 -1.45 -0.05 0.00 -0.57 0.00 0.00 43.02 40.81 3gqw s PHE 384 CO 0.02 0.21 0.52 0.08 -0.10 0.00 0.00 175.22 175.95 3gqw s VAL 385 N -0.88 5.03 -0.05 -0.44 1.01 -1.26 -0.70 120.40 123.11 3gqw s VAL 385 Ca 0.14 1.07 -0.30 0.00 0.00 0.00 0.00 61.98 62.88 3gqw s VAL 385 Cb -0.10 -3.85 -0.06 0.00 0.00 0.00 0.00 36.38 32.37 3gqw s VAL 385 CO 0.04 0.41 1.70 0.21 0.00 0.00 0.00 175.10 177.46 3gqw s ASN 386 N -0.05 6.63 -0.06 3.32 3.84 0.15 -4.31 114.94 124.46 3gqw s ASN 386 Ca 0.28 2.28 0.15 0.00 0.21 0.00 0.00 52.86 55.78 3gqw s ASN 386 Cb -0.17 -2.53 0.48 0.00 -0.55 0.00 0.00 41.25 38.48 3gqw s ASN 386 CO 0.14 -0.95 1.40 0.00 -2.79 0.00 0.00 177.10 174.89 3gqw n GLY 388 N 0.56 0.46 3.87 0.00 0.00 -1.24 -2.58 105.19 106.26 3gqw n GLY 388 Ca 0.18 -2.11 -0.21 0.00 0.00 0.00 0.00 46.02 43.88 3gqw n GLY 388 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gqw s LYS 389 N -1.05 2.58 0.57 1.61 1.02 -1.25 0.15 119.74 123.36 3gqw s LYS 389 Ca 0.00 -1.47 -0.20 0.00 0.02 0.00 0.00 55.97 54.32 3gqw s LYS 389 Cb 0.00 -2.40 -0.06 0.00 -0.52 0.00 0.00 37.83 34.85 3gqw s LYS 389 CO 0.00 -0.11 0.99 0.00 -0.92 0.00 0.00 175.35 175.31 3gqw n ALA 390 N -1.49 0.26 -1.74 5.17 0.00 -1.26 -4.38 120.51 117.06 3gqw n ALA 390 Ca 0.02 0.05 -0.32 0.00 0.00 0.00 0.00 53.44 53.19 3gqw n ALA 390 Cb 0.61 -2.12 -0.00 0.00 0.00 0.00 0.00 19.45 17.94 3gqw n ALA 390 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3gqw s LEU 391 N -1.80 3.49 0.04 0.00 1.43 -1.26 -4.95 118.68 115.64 3gqw s LEU 391 Ca 0.73 1.67 -0.37 0.00 -1.03 0.00 0.00 54.13 55.13 3gqw s LEU 391 Cb -0.44 -4.51 -0.16 0.00 0.03 0.00 0.00 46.19 41.10 3gqw s LEU 391 CO 0.49 -0.94 1.40 -2.65 0.23 0.00 0.00 176.35 174.88 3gqw n PRO 392 N -2.02 1.20 -0.67 1.29 -0.02 -1.26 -0.99 135.00 132.52 3gqw n PRO 392 Ca 0.08 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 3gqw n PRO 392 Cb 0.53 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 3gqw n PRO 392 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3gqw n GLU 393 N 2.93 0.00 -4.30 -0.52 1.02 -1.26 -5.00 120.64 113.50 3gqw n GLU 393 Ca 0.19 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 57.03 3gqw n GLU 393 Cb 0.19 -2.47 -0.10 0.00 -0.02 0.00 0.00 31.44 29.04 3gqw n GLU 393 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 3gqw s HIS 394 N -3.40 2.85 0.05 -0.32 3.76 -0.16 -4.46 115.29 113.61 3gqw s HIS 394 Ca 0.00 -0.08 0.05 0.00 -0.15 0.00 0.00 55.06 54.87 3gqw s HIS 394 Cb 0.00 -1.52 -0.04 0.00 1.11 0.00 0.00 32.58 32.13 3gqw s HIS 394 CO 0.00 0.41 -0.06 0.20 -0.85 0.00 0.00 174.74 174.44 3gqw s GLY 395 N -1.91 1.81 -0.07 -2.22 0.00 0.27 -4.29 107.32 100.90 3gqw s GLY 395 Ca 0.21 -1.11 0.01 0.00 0.00 0.00 0.00 44.72 43.83 3gqw s GLY 395 CO 0.12 -1.03 -0.08 -0.42 0.00 0.00 0.00 173.10 171.69 3gqw s ILE 396 N -1.14 0.88 -0.00 0.90 1.01 -1.26 -2.06 121.20 119.52 3gqw s ILE 396 Ca 0.20 -0.28 0.00 0.00 0.00 0.00 0.00 60.65 60.58 3gqw s ILE 396 Cb -0.11 -0.87 0.00 0.00 0.01 0.00 0.00 42.46 41.49 3gqw s ILE 396 CO 0.12 0.32 -0.00 -0.70 0.00 0.00 0.00 174.94 174.67 3gqw s GLU 397 N 1.13 0.07 -0.27 2.79 2.12 -0.19 -4.98 118.70 119.37 3gqw s GLU 397 Ca -0.07 -0.00 -0.13 0.00 0.36 0.00 0.00 54.97 55.13 3gqw s GLU 397 Cb -0.14 -0.11 -0.04 0.00 0.26 0.00 0.00 34.13 34.10 3gqw s GLU 397 CO -0.01 -0.01 0.31 0.42 -0.54 0.00 0.00 175.26 175.43 3gqw s ILE 398 N 0.14 5.22 0.20 -3.70 -1.09 -1.26 -0.80 121.20 119.91 3gqw s ILE 398 Ca -0.01 0.43 0.11 0.00 -2.23 0.00 0.00 60.65 58.95 3gqw s ILE 398 Cb -0.02 -3.64 -0.04 0.00 -1.58 0.00 0.00 42.46 37.18 3gqw s ILE 398 CO -0.00 0.19 -0.23 -0.13 -1.23 0.00 0.00 174.94 173.54 3gqw s ARG 399 N 1.95 1.52 0.19 2.79 0.52 -0.60 -1.36 118.95 123.95 3gqw s ARG 399 Ca 0.12 -1.54 -0.01 0.00 -0.52 0.00 0.00 55.73 53.78 3gqw s ARG 399 Cb -0.16 -1.80 0.04 0.00 0.52 0.00 0.00 34.95 33.55 3gqw s ARG 399 CO 0.10 0.38 0.25 0.27 0.02 0.00 0.00 175.30 176.33 3gqw n ASN 400 N 0.17 0.25 -0.11 0.23 0.23 -1.26 0.50 115.26 115.28 3gqw n ASN 400 Ca -0.12 -1.23 -0.11 0.00 -0.53 0.00 0.00 54.58 52.59 3gqw n ASN 400 Cb 0.56 -0.17 -0.06 0.00 -2.08 0.00 0.00 39.78 38.03 3gqw n ASN 400 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 3gqw h GLU 401 N 0.00 -0.36 0.00 -3.83 4.57 -2.00 -2.25 114.58 110.71 3gqw h GLU 401 Ca -0.08 0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.11 3gqw h GLU 401 Cb 0.29 0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 28.96 3gqw h GLU 401 CO 0.08 -0.24 -0.07 0.00 -1.18 0.00 0.00 179.01 177.60 3gqw h ALA 402 N 0.27 1.20 0.00 2.92 0.00 -2.06 -3.52 119.26 118.07 3gqw h ALA 402 Ca 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3gqw h ALA 402 Cb 0.60 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3gqw h ALA 402 CO -0.55 0.09 0.00 0.41 0.00 0.00 0.00 179.25 179.20 3gqw n GLY 403 N -0.69 0.76 3.25 0.00 0.00 -0.85 -5.23 105.19 102.43 3gqw n GLY 403 Ca -0.02 -0.68 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 3gqw n GLY 403 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3gqw s PRO 405 N -1.01 2.61 0.43 1.61 0.02 -1.26 -4.81 135.00 132.58 3gqw s PRO 405 Ca 0.00 -0.88 0.07 0.00 0.02 0.00 0.00 61.00 60.21 3gqw s PRO 405 Cb 0.00 -2.15 -0.02 0.00 0.02 0.00 0.00 34.50 32.35 3gqw s PRO 405 CO 0.00 0.33 0.35 0.14 -0.33 0.00 0.00 177.00 177.49 3gqw s VAL 406 N -0.04 2.47 0.90 3.83 -7.23 -0.47 -4.92 120.40 114.95 3gqw s VAL 406 Ca -0.07 -1.42 -0.13 0.00 -1.81 0.00 0.00 61.98 58.55 3gqw s VAL 406 Cb -0.15 -2.89 0.17 0.00 0.56 0.00 0.00 36.38 34.07 3gqw s VAL 406 CO 0.05 0.00 1.25 0.00 -0.31 0.00 0.00 175.10 176.09 3gqw s ALA 407 N -2.53 2.49 0.54 1.32 0.00 -1.26 -4.79 121.76 117.52 3gqw s ALA 407 Ca 0.46 -1.14 -0.22 0.00 0.00 0.00 0.00 51.96 51.05 3gqw s ALA 407 Cb -0.02 -2.73 -0.05 0.00 0.00 0.00 0.00 23.12 20.33 3gqw s ALA 407 CO 0.26 -2.16 1.37 -1.21 0.00 0.00 0.00 175.76 174.02 3gqw s GLU 408 N -5.74 3.16 0.00 0.00 2.02 -1.26 -2.63 118.70 114.25 3gqw s GLU 408 Ca 0.71 2.26 0.00 0.00 0.02 0.00 0.00 54.97 57.95 3gqw s GLU 408 Cb -0.06 -2.28 0.00 0.00 0.10 0.00 0.00 34.13 31.90 3gqw s GLU 408 CO 0.51 -1.18 0.00 0.54 0.02 0.00 0.00 175.26 175.15 3gqw n ARG 409 N -0.99 -0.01 -3.42 1.61 1.74 -0.88 -4.98 116.66 109.73 3gqw n ARG 409 Ca 0.10 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.80 3gqw n ARG 409 Cb 0.45 -2.80 -0.09 0.00 -1.02 0.00 0.00 32.46 28.99 3gqw n ARG 409 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3gqw s VAL 410 N -3.51 5.20 0.21 1.55 1.01 -1.08 0.36 120.40 124.15 3gqw s VAL 410 Ca 0.00 0.54 -0.30 0.00 0.00 0.00 0.00 61.98 62.22 3gqw s VAL 410 Cb 0.00 -3.68 -0.08 0.00 0.00 0.00 0.00 36.38 32.62 3gqw s VAL 410 CO 0.00 0.20 1.00 -0.69 0.00 0.00 0.00 175.10 175.61 3gqw s VAL 411 N 1.82 3.99 0.00 2.92 1.01 -0.96 -4.53 120.40 124.65 3gqw s VAL 411 Ca 0.15 1.88 0.00 0.00 0.00 0.00 0.00 61.98 64.01 3gqw s VAL 411 Cb -0.15 -4.20 0.00 0.00 0.00 0.00 0.00 36.38 32.03 3gqw s VAL 411 CO 0.09 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.20 3gqw n GLY 412 N 1.66 1.43 3.66 4.51 0.00 -0.54 -4.93 105.19 110.99 3gqw n GLY 412 Ca -0.00 -0.90 -0.42 0.00 0.00 0.00 0.00 46.02 44.69 3gqw n GLY 412 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3gqw s HIS 413 N -5.83 2.25 -0.25 1.61 3.76 0.18 -1.80 115.29 115.21 3gqw s HIS 413 Ca 0.00 0.41 -0.29 0.00 -0.15 0.00 0.00 55.06 55.03 3gqw s HIS 413 Cb 0.00 -3.82 -0.01 0.00 1.11 0.00 0.00 32.58 29.86 3gqw s HIS 413 CO 0.00 -3.31 1.39 0.42 -0.85 0.00 0.00 174.74 172.39 3gqw s ILE 414 N 3.68 4.02 -0.06 0.60 1.01 0.87 -1.56 121.20 129.76 3gqw s ILE 414 Ca 0.69 1.17 0.02 0.00 0.00 0.00 0.00 60.65 62.53 3gqw s ILE 414 Cb -0.31 -3.99 -0.03 0.00 0.01 0.00 0.00 42.46 38.14 3gqw s ILE 414 CO 0.27 -0.36 -0.12 0.00 0.00 0.00 0.00 174.94 174.73 3gqw s ILE 416 N -0.66 2.19 0.12 0.00 -4.36 -0.41 -1.03 121.20 117.06 3gqw s ILE 416 Ca 0.10 -2.29 -0.24 0.00 -0.26 0.00 0.00 60.65 57.96 3gqw s ILE 416 Cb -0.11 -2.17 0.08 0.00 1.25 0.00 0.00 42.46 41.50 3gqw s ILE 416 CO 0.01 -0.43 0.69 -0.94 0.24 0.00 0.00 174.94 174.51 3gqw s SER 417 N -3.33 -0.48 0.00 4.36 1.04 -0.88 -1.60 113.70 112.81 3gqw s SER 417 Ca 0.26 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.64 3gqw s SER 417 Cb -0.04 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.63 3gqw s SER 417 CO 0.11 -0.90 0.00 0.61 0.98 0.00 0.00 173.24 174.04 3gqw n GLY 418 N -0.35 1.47 0.35 7.32 0.00 -1.26 -0.57 105.19 112.15 3gqw n GLY 418 Ca -0.14 -2.19 0.13 0.00 0.00 0.00 0.00 46.02 43.83 3gqw n GLY 418 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3gqw h PRO 419 N 0.00 0.29 0.00 1.61 0.11 -1.96 -1.30 132.00 130.75 3gqw h PRO 419 Ca 0.00 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.04 3gqw h PRO 419 Cb 0.00 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.04 3gqw h PRO 419 CO 0.00 0.19 -0.27 0.77 -0.21 0.00 0.00 178.00 178.48 3gqw h SER 420 N 0.30 0.00 -0.12 -2.05 0.02 -1.88 -3.38 113.55 106.44 3gqw h SER 420 Ca 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 3gqw h SER 420 Cb 0.58 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.12 3gqw h SER 420 CO -0.06 0.27 0.00 -0.11 -1.14 0.00 0.00 176.83 175.80 3gqw n LEU 421 N -3.59 0.00 -0.01 5.07 0.00 -0.49 -3.97 117.00 114.01 3gqw n LEU 421 Ca -0.01 0.00 0.02 0.00 0.00 0.00 0.00 56.01 56.03 3gqw n LEU 421 Cb 0.41 0.00 -0.05 0.00 0.00 0.00 0.00 43.42 43.78 3gqw n LEU 421 CO 0.34 -0.69 -0.61 -1.20 0.00 0.00 0.00 177.39 175.24 3gqw n SER 423 N -0.35 3.40 0.00 1.96 7.64 -1.17 -4.89 113.62 120.20 3gqw n SER 423 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 3gqw n SER 423 Cb 0.00 1.20 0.00 0.00 -1.01 0.00 0.00 64.21 64.40 3gqw n SER 423 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3gqw n GLY 424 N 2.19 0.96 3.73 0.23 0.00 -1.26 -4.20 105.19 106.84 3gqw n GLY 424 Ca -0.03 -1.93 -0.40 0.00 0.00 0.00 0.00 46.02 43.66 3gqw n GLY 424 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gqw s TYR 425 N -1.24 3.71 -0.18 1.61 2.02 -1.26 -1.76 117.35 120.26 3gqw s TYR 425 Ca 0.00 1.50 -0.34 0.00 -0.37 0.00 0.00 57.07 57.86 3gqw s TYR 425 Cb 0.00 -2.88 -0.11 0.00 -0.40 0.00 0.00 41.96 38.57 3gqw s TYR 425 CO 0.00 0.21 1.99 0.34 -1.57 0.00 0.00 175.55 176.51 3gqw n PHE 426 N 3.07 2.10 0.00 2.71 7.35 0.24 -0.55 117.46 132.37 3gqw n PHE 426 Ca -0.01 0.08 0.00 0.00 -0.76 0.00 0.00 57.45 56.77 3gqw n PHE 426 Cb 0.50 -2.63 0.00 0.00 0.35 0.00 0.00 39.48 37.71 3gqw n PHE 426 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3gqw n GLY 427 N 5.06 3.05 3.59 7.13 0.00 -1.26 -4.67 105.19 118.09 3gqw n GLY 427 Ca 0.28 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.88 3gqw n GLY 427 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3gqw s ASP 428 N 0.17 6.12 0.05 1.61 -1.08 0.29 -4.89 116.67 118.94 3gqw s ASP 428 Ca 0.00 0.58 -0.18 0.00 -0.52 0.00 0.00 52.55 52.43 3gqw s ASP 428 Cb 0.00 -2.54 -0.14 0.00 -1.46 0.00 0.00 42.92 38.77 3gqw s ASP 428 CO 0.00 -1.66 1.31 -0.61 0.52 0.00 0.00 175.17 174.73 3gqw h GLN 429 N 11.37 0.50 -0.14 4.34 5.75 -1.95 -3.03 115.11 131.95 3gqw h GLN 429 Ca -0.28 -0.32 0.05 0.00 -0.15 0.00 0.00 58.65 57.95 3gqw h GLN 429 Cb 1.11 0.04 -0.06 0.00 1.07 0.00 0.00 27.48 29.64 3gqw h GLN 429 CO 1.13 0.93 -0.26 0.28 -2.65 0.00 0.00 178.83 178.26 3gqw h VAL 430 N 0.13 0.38 -0.71 2.39 2.07 -1.96 0.13 116.25 118.69 3gqw h VAL 430 Ca 0.01 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.64 3gqw h VAL 430 Cb 0.91 0.38 -0.08 0.00 -1.52 0.00 0.00 31.29 30.97 3gqw h VAL 430 CO 0.07 0.00 0.30 -1.28 0.02 0.00 0.00 177.57 176.68 3gqw h SER 431 N -0.33 0.32 -0.11 0.57 0.87 -1.92 -1.00 113.55 111.95 3gqw h SER 431 Ca 0.10 0.09 -0.21 0.00 -1.23 0.00 0.00 61.79 60.54 3gqw h SER 431 Cb 0.48 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 3gqw h SER 431 CO -0.32 0.16 -0.71 1.56 -0.53 0.00 0.00 176.83 176.99 3gqw h GLN 432 N 0.48 0.74 -0.10 2.24 4.20 -1.33 -3.03 115.11 118.31 3gqw h GLN 432 Ca 0.37 -0.56 -0.00 0.00 0.06 0.00 0.00 58.65 58.52 3gqw h GLN 432 Cb 0.50 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.38 3gqw h GLN 432 CO -0.34 1.18 0.06 -0.44 -0.67 0.00 0.00 178.83 178.61 3gqw h ASP 433 N 0.53 0.12 -0.48 1.46 5.19 -0.13 -0.81 116.42 122.30 3gqw h ASP 433 Ca -0.03 -0.07 0.01 0.00 -0.62 0.00 0.00 57.03 56.33 3gqw h ASP 433 Cb 1.32 -0.03 -0.03 0.00 0.18 0.00 0.00 39.33 40.77 3gqw h ASP 433 CO 0.14 0.15 0.30 -0.33 -3.12 0.00 0.00 179.24 176.38 3gqw h GLU 434 N 0.08 0.58 -0.32 3.56 5.08 -1.26 -0.37 114.58 121.92 3gqw h GLU 434 Ca 0.03 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 3gqw h GLU 434 Cb 0.06 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 3gqw h GLU 434 CO -0.01 0.39 0.04 0.82 -1.00 0.00 0.00 179.01 179.25 3gqw h ILE 435 N 0.60 1.24 -0.81 3.13 2.04 -1.42 0.65 117.51 122.93 3gqw h ILE 435 Ca 0.18 -0.84 0.08 0.00 1.00 0.00 0.00 64.86 65.28 3gqw h ILE 435 Cb -0.02 1.16 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 3gqw h ILE 435 CO -0.07 0.28 0.53 0.00 0.00 0.00 0.00 178.15 178.89 3gqw h ALA 436 N 0.88 1.67 0.10 1.87 0.00 -0.87 0.40 119.26 123.32 3gqw h ALA 436 Ca 0.10 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3gqw h ALA 436 Cb 0.36 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3gqw h ALA 436 CO 0.01 0.19 -0.05 0.00 0.00 0.00 0.00 179.25 179.40 3gqw h ALA 437 N 1.57 -0.14 0.11 0.00 0.00 -0.60 -3.41 119.26 116.80 3gqw h ALA 437 Ca 0.36 -0.12 -0.33 0.00 0.00 0.00 0.00 54.91 54.82 3gqw h ALA 437 Cb 0.33 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3gqw h ALA 437 CO -0.14 -0.14 -1.76 1.79 0.00 0.00 0.00 179.25 179.00 3gqw h THR 438 N -1.01 0.87 0.00 0.00 1.35 -0.93 -3.48 112.91 109.71 3gqw h THR 438 Ca -0.01 -2.58 0.00 0.00 -0.55 0.00 0.00 66.41 63.27 3gqw h THR 438 Cb 0.29 2.60 0.00 0.00 -1.73 0.00 0.00 68.15 69.31 3gqw h THR 438 CO 0.02 0.79 0.00 0.61 -0.25 0.00 0.00 175.52 176.69 3gqw n GLY 439 N 1.79 0.80 3.56 5.82 0.00 0.13 -5.03 105.19 112.26 3gqw n GLY 439 Ca -0.23 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 3gqw n GLY 439 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3gqw s TRP 440 N -3.04 2.70 -0.04 1.61 0.52 -1.26 -4.34 118.94 115.08 3gqw s TRP 440 Ca 0.00 -0.18 0.03 0.00 0.02 0.00 0.00 56.10 55.97 3gqw s TRP 440 Cb 0.00 -1.41 0.00 0.00 -1.15 0.00 0.00 33.47 30.92 3gqw s TRP 440 CO 0.00 0.43 -0.11 -1.17 0.02 0.00 0.00 176.95 176.11 3gqw s LEU 441 N -2.24 1.78 -0.35 2.99 2.96 -0.63 -4.61 118.68 118.58 3gqw s LEU 441 Ca 0.21 -0.24 -0.24 0.00 -0.22 0.00 0.00 54.13 53.64 3gqw s LEU 441 Cb -0.11 -0.69 0.01 0.00 0.50 0.00 0.00 46.19 45.90 3gqw s LEU 441 CO 0.13 0.08 0.82 -0.62 -1.32 0.00 0.00 176.35 175.44 3gqw s ASP 442 N 0.25 6.61 0.34 3.68 -1.08 -1.26 -1.29 116.67 123.92 3gqw s ASP 442 Ca -0.05 0.48 0.26 0.00 -0.52 0.00 0.00 52.55 52.72 3gqw s ASP 442 Cb -0.11 -2.41 0.88 0.00 -1.46 0.00 0.00 42.92 39.82 3gqw s ASP 442 CO 0.01 -0.73 1.77 0.71 0.52 0.00 0.00 175.17 177.45 3gqw h THR 443 N 5.73 0.00 -0.01 1.71 1.35 -1.67 -3.46 112.91 116.55 3gqw h THR 443 Ca -0.24 -0.52 -0.00 0.00 -0.55 0.00 0.00 66.41 65.10 3gqw h THR 443 Cb 1.09 1.44 -0.00 0.00 -1.73 0.00 0.00 68.15 68.95 3gqw h THR 443 CO 0.92 0.00 -0.00 0.61 -0.25 0.00 0.00 175.52 176.80 3gqw n GLY 444 N 0.64 0.44 3.65 5.82 0.00 -1.26 -5.03 105.19 109.45 3gqw n GLY 444 Ca 0.03 -0.63 -0.33 0.00 0.00 0.00 0.00 46.02 45.10 3gqw n GLY 444 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3gqw s ASP 445 N -2.58 4.93 0.03 1.61 1.01 -1.26 -1.37 116.67 119.05 3gqw s ASP 445 Ca 0.00 -0.03 -0.14 0.00 0.71 0.00 0.00 52.55 53.09 3gqw s ASP 445 Cb 0.00 -1.26 -0.06 0.00 1.01 0.00 0.00 42.92 42.62 3gqw s ASP 445 CO 0.00 0.30 0.42 -0.76 0.21 0.00 0.00 175.17 175.34 3gqw s LEU 446 N -1.37 4.44 0.00 1.23 1.43 0.17 -0.09 118.68 124.50 3gqw s LEU 446 Ca 0.17 0.94 -0.02 0.00 -1.03 0.00 0.00 54.13 54.19 3gqw s LEU 446 Cb -0.11 -2.72 0.01 0.00 0.03 0.00 0.00 46.19 43.40 3gqw s LEU 446 CO 0.08 0.28 0.08 0.61 0.23 0.00 0.00 176.35 177.63 3gqw n GLY 447 N 1.55 0.99 3.49 -3.19 0.00 -0.75 -0.73 105.19 106.56 3gqw n GLY 447 Ca -0.12 -0.90 -0.11 0.00 0.00 0.00 0.00 46.02 44.89 3gqw n GLY 447 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3gqw s TYR 448 N -4.62 -0.39 0.09 1.61 1.13 -0.99 -1.47 117.35 112.70 3gqw s TYR 448 Ca 0.02 0.12 0.02 0.00 -1.41 0.00 0.00 57.07 55.81 3gqw s TYR 448 Cb -0.00 0.53 -0.04 0.00 -1.10 0.00 0.00 41.96 41.35 3gqw s TYR 448 CO 0.00 -0.91 0.17 -0.51 -2.51 0.00 0.00 175.55 171.80 3gqw s LEU 449 N -2.80 4.12 -0.09 -3.49 2.01 -1.26 -0.99 118.68 116.18 3gqw s LEU 449 Ca 0.04 0.12 -0.04 0.00 0.01 0.00 0.00 54.13 54.26 3gqw s LEU 449 Cb -0.01 -2.74 0.05 0.00 0.01 0.00 0.00 46.19 43.50 3gqw s LEU 449 CO -0.08 0.14 0.19 -0.22 1.01 0.00 0.00 176.35 177.38 3gqw s LEU 450 N -2.64 0.06 -1.58 1.79 0.20 -0.61 -2.07 118.68 113.83 3gqw s LEU 450 Ca 0.33 0.40 -0.07 0.00 0.69 0.00 0.00 54.13 55.47 3gqw s LEU 450 Cb -0.12 0.42 0.07 0.00 -0.43 0.00 0.00 46.19 46.12 3gqw s LEU 450 CO 0.26 -0.22 0.41 0.47 -0.29 0.00 0.00 176.35 176.97 3gqw n ASP 451 N 5.03 -0.84 0.00 3.68 8.00 -1.26 -1.23 116.55 129.94 3gqw n ASP 451 Ca -0.11 -1.11 0.00 0.00 0.71 0.00 0.00 54.79 54.28 3gqw n ASP 451 Cb 0.50 -2.39 0.00 0.00 -0.02 0.00 0.00 41.12 39.21 3gqw n ASP 451 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gqw n GLY 452 N -1.91 1.67 3.83 0.44 0.00 -1.26 -4.98 105.19 102.97 3gqw n GLY 452 Ca -0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 3gqw n GLY 452 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gqw s TYR 453 N -3.11 3.70 -0.07 1.61 2.02 -0.36 -4.27 117.35 116.87 3gqw s TYR 453 Ca 0.00 1.15 -0.18 0.00 -0.37 0.00 0.00 57.07 57.67 3gqw s TYR 453 Cb 0.00 -2.42 -0.05 0.00 -0.40 0.00 0.00 41.96 39.09 3gqw s TYR 453 CO 0.00 0.51 0.51 -1.17 -1.57 0.00 0.00 175.55 173.82 3gqw s LEU 454 N -1.55 4.35 -0.31 -1.29 2.96 0.12 -1.58 118.68 121.37 3gqw s LEU 454 Ca 0.33 0.95 -0.01 0.00 -0.22 0.00 0.00 54.13 55.18 3gqw s LEU 454 Cb -0.17 -2.76 0.06 0.00 0.50 0.00 0.00 46.19 43.83 3gqw s LEU 454 CO 0.19 0.07 0.02 -0.31 -1.32 0.00 0.00 176.35 175.00 3gqw s TYR 455 N 0.14 3.34 -0.22 5.38 1.51 -0.16 -1.33 117.35 126.02 3gqw s TYR 455 Ca 0.27 -2.05 -0.22 0.00 -1.01 0.00 0.00 57.07 54.07 3gqw s TYR 455 Cb -0.16 -2.30 -0.02 0.00 -0.11 0.00 0.00 41.96 39.37 3gqw s TYR 455 CO 0.13 -0.84 0.71 0.08 -1.11 0.00 0.00 175.55 174.52 3gqw s VAL 456 N 1.21 4.94 -0.15 0.71 1.01 -1.26 -2.36 120.40 124.49 3gqw s VAL 456 Ca -0.03 1.34 0.19 0.00 0.00 0.00 0.00 61.98 63.49 3gqw s VAL 456 Cb -0.20 -4.02 -0.27 0.00 0.00 0.00 0.00 36.38 31.89 3gqw s VAL 456 CO -0.02 0.03 0.18 0.35 0.00 0.00 0.00 175.10 175.64 3gqw n THR 457 N 4.97 1.01 -1.91 3.92 -2.24 0.10 -4.75 114.28 115.37 3gqw n THR 457 Ca 0.02 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 3gqw n THR 457 Cb 0.49 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 3gqw n THR 457 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gqw n GLY 458 N 1.62 -1.79 3.82 3.38 0.00 -1.19 -4.97 105.19 106.06 3gqw n GLY 458 Ca -0.25 -1.35 -0.38 0.00 0.00 0.00 0.00 46.02 44.04 3gqw n GLY 458 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gqw s ARG 459 N -1.95 4.10 0.21 1.61 0.52 -1.26 0.44 118.95 122.62 3gqw s ARG 459 Ca 0.00 0.62 -0.09 0.00 -0.52 0.00 0.00 55.73 55.74 3gqw s ARG 459 Cb 0.00 -3.22 0.26 0.00 0.52 0.00 0.00 34.95 32.51 3gqw s ARG 459 CO 0.00 0.65 1.77 0.82 0.02 0.00 0.00 175.30 178.56 3gqw h ILE 460 N 3.57 0.85 -0.83 1.52 2.04 -1.54 -1.68 117.51 121.45 3gqw h ILE 460 Ca -0.50 -0.18 0.15 0.00 1.00 0.00 0.00 64.86 65.33 3gqw h ILE 460 Cb 1.22 0.29 -0.10 0.00 -0.74 0.00 0.00 36.82 37.49 3gqw h ILE 460 CO 0.63 0.09 0.39 0.50 0.00 0.00 0.00 178.15 179.76 3gqw h LYS 461 N 0.51 0.53 0.00 2.37 3.64 -1.94 -2.57 116.57 119.11 3gqw h LYS 461 Ca 0.30 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.64 3gqw h LYS 461 Cb 0.30 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.00 3gqw h LYS 461 CO -0.25 0.35 -0.05 -0.44 -2.27 0.00 0.00 179.45 176.79 3gqw h ASP 462 N 0.55 0.00 -3.16 4.20 3.32 -1.70 -3.45 116.42 116.16 3gqw h ASP 462 Ca 0.46 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.98 3gqw h ASP 462 Cb 0.69 0.00 0.08 0.00 0.22 0.00 0.00 39.33 40.32 3gqw h ASP 462 CO -0.39 0.05 0.92 -0.22 -1.72 0.00 0.00 179.24 177.87 3gqw s LEU 463 N -6.24 4.35 -0.55 1.55 2.96 -0.95 -4.53 118.68 115.26 3gqw s LEU 463 Ca 0.06 2.93 -0.24 0.00 -0.22 0.00 0.00 54.13 56.65 3gqw s LEU 463 Cb 0.06 -3.63 0.04 0.00 0.50 0.00 0.00 46.19 43.17 3gqw s LEU 463 CO 0.65 -0.93 0.97 -0.63 -1.32 0.00 0.00 176.35 175.09 3gqw s ILE 464 N 0.29 4.35 -0.35 6.68 1.01 -0.69 -4.93 121.20 127.56 3gqw s ILE 464 Ca 0.66 0.33 -0.10 0.00 0.00 0.00 0.00 60.65 61.54 3gqw s ILE 464 Cb -0.48 -4.56 0.02 0.00 0.01 0.00 0.00 42.46 37.44 3gqw s ILE 464 CO 0.44 -1.14 0.18 -0.63 0.00 0.00 0.00 174.94 173.79 3gqw s ILE 465 N 4.04 4.53 0.35 2.92 1.01 -1.26 -0.82 121.20 131.97 3gqw s ILE 465 Ca 0.31 -0.72 0.00 0.00 0.00 0.00 0.00 60.65 60.25 3gqw s ILE 465 Cb -0.12 -3.45 0.00 0.00 0.01 0.00 0.00 42.46 38.90 3gqw s ILE 465 CO 0.20 -0.12 0.02 2.30 0.00 0.00 0.00 174.94 177.33 3gqw n ILE 466 N 4.98 0.00 -1.55 2.92 -5.35 -1.00 -5.03 119.36 114.32 3gqw n ILE 466 Ca -0.13 -1.61 -0.47 0.00 -0.27 0.00 0.00 62.75 60.28 3gqw n ILE 466 Cb 0.47 0.29 -0.05 0.00 -1.74 0.00 0.00 39.64 38.61 3gqw n ILE 466 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 3gqw n ARG 467 N -0.89 1.69 -0.76 6.28 1.74 -1.26 -2.91 116.66 120.55 3gqw n ARG 467 Ca -0.13 0.49 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 3gqw n ARG 467 Cb 0.43 -2.87 0.00 0.00 -1.02 0.00 0.00 32.46 29.00 3gqw n ARG 467 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gqw n GLY 468 N 5.85 0.49 3.36 -0.13 0.00 -1.26 -4.95 105.19 108.55 3gqw n GLY 468 Ca 0.33 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.20 3gqw n GLY 468 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3gqw s ARG 469 N -0.52 0.80 -0.10 1.61 1.04 -1.15 -4.73 118.95 115.91 3gqw s ARG 469 Ca 0.00 0.07 -0.04 0.00 -1.04 0.00 0.00 55.73 54.72 3gqw s ARG 469 Cb 0.00 0.37 -0.04 0.00 -2.04 0.00 0.00 34.95 33.24 3gqw s ARG 469 CO 0.00 -0.22 0.06 -0.80 -0.04 0.00 0.00 175.30 174.29 3gqw s ASN 470 N -1.10 5.69 -0.07 -2.89 0.01 -0.18 -2.38 114.94 114.02 3gqw s ASN 470 Ca -0.11 0.27 0.05 0.00 -0.71 0.00 0.00 52.86 52.36 3gqw s ASN 470 Cb -0.03 -1.72 -0.00 0.00 0.41 0.00 0.00 41.25 39.91 3gqw s ASN 470 CO 0.06 0.39 -0.23 -0.63 -1.51 0.00 0.00 177.10 175.18 3gqw s ILE 471 N -0.91 1.91 -0.43 0.60 1.01 -0.00 -4.34 121.20 119.04 3gqw s ILE 471 Ca 0.14 -0.96 -0.29 0.00 0.00 0.00 0.00 60.65 59.54 3gqw s ILE 471 Cb -0.12 -1.63 0.02 0.00 0.01 0.00 0.00 42.46 40.74 3gqw s ILE 471 CO 0.03 0.53 1.25 0.26 0.00 0.00 0.00 174.94 177.01 3gqw s TRP 472 N 0.10 2.68 0.45 3.97 0.51 -1.26 -1.71 118.94 123.68 3gqw s TRP 472 Ca -0.10 0.75 0.30 0.00 -2.12 0.00 0.00 56.10 54.93 3gqw s TRP 472 Cb -0.15 -4.29 1.39 0.00 -0.81 0.00 0.00 33.47 29.61 3gqw s TRP 472 CO 0.05 -1.53 1.68 -1.00 -0.51 0.00 0.00 176.95 175.64 3gqw h PRO 473 N 9.67 0.14 0.00 4.98 0.13 -1.88 0.75 132.00 145.80 3gqw h PRO 473 Ca -0.25 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.85 3gqw h PRO 473 Cb 1.08 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.17 3gqw h PRO 473 CO 1.10 0.09 -0.13 -0.56 -0.23 0.00 0.00 178.00 178.27 3gqw h GLN 474 N 0.15 0.00 -0.10 0.86 -0.00 -1.92 -0.64 115.11 113.45 3gqw h GLN 474 Ca 0.74 0.00 -0.13 0.00 -0.00 0.00 0.00 58.65 59.26 3gqw h GLN 474 Cb 2.37 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 29.84 3gqw h GLN 474 CO -0.30 0.13 -0.53 -0.44 -0.00 0.00 0.00 178.83 177.69 3gqw h ASP 475 N 0.00 0.32 0.13 0.06 3.32 0.14 -1.88 116.42 118.51 3gqw h ASP 475 Ca -0.00 -0.16 -0.17 0.00 0.02 0.00 0.00 57.03 56.72 3gqw h ASP 475 Cb 0.57 -0.09 0.02 0.00 0.22 0.00 0.00 39.33 40.05 3gqw h ASP 475 CO 0.02 0.79 -0.74 0.40 -1.72 0.00 0.00 179.24 177.98 3gqw h ILE 476 N 0.22 1.54 -0.22 0.35 2.04 -1.48 -3.31 117.51 116.66 3gqw h ILE 476 Ca 0.01 -2.52 0.03 0.00 1.00 0.00 0.00 64.86 63.38 3gqw h ILE 476 Cb 1.01 3.22 -0.01 0.00 -0.74 0.00 0.00 36.82 40.30 3gqw h ILE 476 CO 0.08 0.71 0.15 -0.33 0.00 0.00 0.00 178.15 178.76 3gqw h GLU 477 N -0.43 0.14 -0.64 2.37 5.08 -1.15 -1.94 114.58 118.00 3gqw h GLU 477 Ca -0.13 -0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.32 3gqw h GLU 477 Cb 1.58 -0.03 -0.08 0.00 0.50 0.00 0.00 28.75 30.72 3gqw h GLU 477 CO 0.14 0.09 0.24 -0.92 -1.00 0.00 0.00 179.01 177.56 3gqw h TYR 478 N 0.15 0.42 -0.85 4.33 3.20 -1.42 -0.76 116.97 122.03 3gqw h TYR 478 Ca 0.09 0.03 0.08 0.00 3.14 0.00 0.00 58.73 62.07 3gqw h TYR 478 Cb 0.19 -0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.31 3gqw h TYR 478 CO -0.00 0.09 0.55 0.82 -1.64 0.00 0.00 178.16 177.99 3gqw h ILE 479 N 0.42 1.01 -0.39 1.81 2.04 -1.49 -1.20 117.51 119.71 3gqw h ILE 479 Ca 0.33 -0.31 -0.12 0.00 1.00 0.00 0.00 64.86 65.77 3gqw h ILE 479 Cb 0.43 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 3gqw h ILE 479 CO -0.33 0.16 -0.23 0.00 0.00 0.00 0.00 178.15 177.75 3gqw h ALA 480 N 1.55 0.85 0.00 1.87 0.00 -1.24 -3.05 119.26 119.24 3gqw h ALA 480 Ca 0.38 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3gqw h ALA 480 Cb 0.31 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3gqw h ALA 480 CO -0.15 0.64 0.00 0.39 0.00 0.00 0.00 179.25 180.13 3gqw n GLU 481 N -4.11 0.55 0.13 0.00 1.02 -0.47 -2.42 120.64 115.33 3gqw n GLU 481 Ca -0.00 0.03 -0.00 0.00 -0.02 0.00 0.00 57.16 57.17 3gqw n GLU 481 Cb 0.44 -1.50 0.08 0.00 -0.02 0.00 0.00 31.44 30.44 3gqw n GLU 481 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 3gqw h GLN 482 N 0.00 0.00 -6.99 3.49 1.08 -1.40 -3.45 115.11 107.85 3gqw h GLN 482 Ca 0.00 0.00 -0.51 0.00 -1.45 0.00 0.00 58.65 56.69 3gqw h GLN 482 Cb 0.05 0.00 0.07 0.00 -0.05 0.00 0.00 27.48 27.55 3gqw h GLN 482 CO 0.00 0.64 0.51 -1.21 -0.95 0.00 0.00 178.83 177.82 3gqw s GLU 483 N -3.14 3.80 0.35 1.46 0.41 -1.02 -4.91 118.70 115.65 3gqw s GLU 483 Ca 0.01 1.86 0.06 0.00 -0.41 0.00 0.00 54.97 56.50 3gqw s GLU 483 Cb 0.10 -2.49 0.65 0.00 -1.78 0.00 0.00 34.13 30.61 3gqw s GLU 483 CO 0.76 -0.54 1.88 -1.35 -0.49 0.00 0.00 175.26 175.51 3gqw h PRO 484 N 2.20 0.43 0.00 0.39 0.11 -1.90 -2.84 132.00 130.39 3gqw h PRO 484 Ca -0.49 -0.10 -0.16 0.00 0.11 0.00 0.00 66.00 65.36 3gqw h PRO 484 Cb 1.25 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 3gqw h PRO 484 CO 0.61 0.50 -0.74 0.93 -0.21 0.00 0.00 178.00 179.09 3gqw h GLU 485 N 0.41 0.00 -5.84 1.05 3.07 -1.93 -3.44 114.58 107.89 3gqw h GLU 485 Ca 0.09 0.00 -0.58 0.00 -0.50 0.00 0.00 59.36 58.37 3gqw h GLU 485 Cb 0.36 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.20 3gqw h GLU 485 CO 0.02 0.74 -0.10 0.42 -1.40 0.00 0.00 179.01 178.69 3gqw s ILE 486 N -3.00 5.12 0.49 3.13 1.01 -1.07 -4.84 121.20 122.03 3gqw s ILE 486 Ca 0.01 1.04 0.06 0.00 0.00 0.00 0.00 60.65 61.77 3gqw s ILE 486 Cb 0.10 -3.85 0.00 0.00 0.01 0.00 0.00 42.46 38.72 3gqw s ILE 486 CO 0.78 0.35 0.34 -1.00 0.00 0.00 0.00 174.94 175.41 3gqw s HIS 487 N 0.37 2.09 -0.02 3.97 3.76 -1.26 -4.63 115.29 119.57 3gqw s HIS 487 Ca 0.28 -0.71 -0.30 0.00 -0.15 0.00 0.00 55.06 54.18 3gqw s HIS 487 Cb -0.16 -1.98 -0.05 0.00 1.11 0.00 0.00 32.58 31.50 3gqw s HIS 487 CO 0.12 -0.24 1.32 0.45 -0.85 0.00 0.00 174.74 175.55 3gqw s SER 488 N -4.16 6.93 0.00 1.40 0.15 -1.26 -2.21 113.70 114.55 3gqw s SER 488 Ca 0.38 2.01 0.00 0.00 0.70 0.00 0.00 55.95 59.04 3gqw s SER 488 Cb -0.01 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 3gqw s SER 488 CO 0.23 -0.66 0.00 0.61 1.20 0.00 0.00 173.24 174.61 3gqw n GLY 489 N 3.53 3.01 0.24 9.45 0.00 -1.26 -4.89 105.19 115.26 3gqw n GLY 489 Ca 0.12 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.25 3gqw n GLY 489 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3gqw h ASP 490 N 0.11 0.00 -3.45 1.61 3.32 -1.76 -3.44 116.42 112.81 3gqw h ASP 490 Ca 0.00 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 56.38 3gqw h ASP 490 Cb 0.00 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 39.26 3gqw h ASP 490 CO 0.00 0.19 -0.82 0.00 -1.72 0.00 0.00 179.24 176.89 3gqw s ALA 491 N -3.80 2.41 -0.07 3.45 0.00 -1.26 -1.59 121.76 120.90 3gqw s ALA 491 Ca -0.00 -0.94 0.04 0.00 0.00 0.00 0.00 51.96 51.06 3gqw s ALA 491 Cb 0.11 -0.99 -0.00 0.00 0.00 0.00 0.00 23.12 22.24 3gqw s ALA 491 CO 0.62 0.30 -0.20 0.42 0.00 0.00 0.00 175.76 176.90 3gqw s ILE 492 N 0.21 1.72 -0.03 0.00 1.01 0.15 -4.92 121.20 119.34 3gqw s ILE 492 Ca -0.11 -0.85 0.07 0.00 0.00 0.00 0.00 60.65 59.76 3gqw s ILE 492 Cb -0.16 -1.49 -0.02 0.00 0.01 0.00 0.00 42.46 40.80 3gqw s ILE 492 CO 0.06 0.48 -0.25 0.00 0.00 0.00 0.00 174.94 175.24 3gqw s ALA 493 N 0.23 2.21 0.23 9.38 0.00 -1.26 -0.08 121.76 132.47 3gqw s ALA 493 Ca -0.11 -1.10 -0.21 0.00 0.00 0.00 0.00 51.96 50.53 3gqw s ALA 493 Cb -0.15 -0.60 0.04 0.00 0.00 0.00 0.00 23.12 22.41 3gqw s ALA 493 CO 0.05 0.53 0.66 -0.59 0.00 0.00 0.00 175.76 176.40 3gqw s PHE 494 N -0.60 -0.30 -0.16 0.00 -0.71 -0.79 -4.83 117.98 110.59 3gqw s PHE 494 Ca 0.09 -0.05 -0.05 0.00 -1.04 0.00 0.00 56.93 55.88 3gqw s PHE 494 Cb -0.10 0.62 -0.03 0.00 -1.21 0.00 0.00 43.02 42.29 3gqw s PHE 494 CO -0.01 -1.07 0.01 0.54 -1.34 0.00 0.00 175.22 173.36 3gqw s VAL 495 N -3.86 4.30 0.84 -2.49 0.11 -1.26 -0.78 120.40 117.27 3gqw s VAL 495 Ca 0.07 -0.21 -0.12 0.00 -2.93 0.00 0.00 61.98 58.80 3gqw s VAL 495 Cb -0.04 -2.91 0.10 0.00 -1.53 0.00 0.00 36.38 32.00 3gqw s VAL 495 CO -0.01 0.49 1.10 0.28 -3.33 0.00 0.00 175.10 173.62 3gqw s THR 496 N 0.29 2.86 -0.10 5.04 -1.32 0.63 -4.90 115.64 118.14 3gqw s THR 496 Ca -0.00 0.28 0.30 0.00 -1.21 0.00 0.00 61.69 61.05 3gqw s THR 496 Cb -0.13 -2.91 0.33 0.00 -1.51 0.00 0.00 72.50 68.27 3gqw s THR 496 CO 0.02 -0.36 1.89 0.00 -2.21 0.00 0.00 174.62 173.95 3gqw h ALA 497 N -1.30 1.00 -0.30 11.08 0.00 -1.93 -0.18 119.26 127.63 3gqw h ALA 497 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3gqw h ALA 497 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3gqw h ALA 497 CO 0.57 0.00 0.00 1.04 0.00 0.00 0.00 179.25 180.86 3gqw n GLN 498 N -2.68 1.98 -2.01 0.00 3.00 -1.26 -4.90 117.38 111.51 3gqw n GLN 498 Ca 0.01 -1.20 -0.15 0.00 -0.01 0.00 0.00 57.00 55.64 3gqw n GLN 498 Cb 0.22 -1.40 -0.03 0.00 0.00 0.00 0.00 30.24 29.04 3gqw n GLN 498 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 3gqw n GLU 499 N 0.39 -1.18 -3.74 -1.09 1.02 -0.08 -5.01 120.64 110.95 3gqw n GLU 499 Ca 0.11 0.85 -0.35 0.00 -0.02 0.00 0.00 57.16 57.75 3gqw n GLU 499 Cb 0.37 -5.14 -0.08 0.00 -0.02 0.00 0.00 31.44 26.57 3gqw n GLU 499 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3gqw s LYS 500 N -4.29 4.16 -0.28 3.49 -0.14 -1.25 -4.84 119.74 116.59 3gqw s LYS 500 Ca 0.00 -0.23 -0.25 0.00 -1.36 0.00 0.00 55.97 54.12 3gqw s LYS 500 Cb 0.00 -3.42 0.00 0.00 -1.68 0.00 0.00 37.83 32.73 3gqw s LYS 500 CO 0.00 0.27 0.88 0.42 -0.76 0.00 0.00 175.35 176.16 3gqw s ILE 501 N 0.45 4.73 -0.11 2.17 1.01 -1.26 -0.27 121.20 127.91 3gqw s ILE 501 Ca 0.08 1.49 -0.04 0.00 0.00 0.00 0.00 60.65 62.18 3gqw s ILE 501 Cb -0.11 -4.21 -0.03 0.00 0.01 0.00 0.00 42.46 38.11 3gqw s ILE 501 CO -0.01 -0.24 0.02 -0.63 0.00 0.00 0.00 174.94 174.08 3gqw s ILE 502 N 3.09 4.48 -0.28 2.92 1.09 0.04 -1.27 121.20 131.29 3gqw s ILE 502 Ca 0.37 -0.17 -0.01 0.00 -1.10 0.00 0.00 60.65 59.74 3gqw s ILE 502 Cb -0.14 -2.93 0.05 0.00 -1.06 0.00 0.00 42.46 38.38 3gqw s ILE 502 CO 0.11 0.57 -0.05 -0.22 -0.10 0.00 0.00 174.94 175.25 3gqw s LEU 503 N -0.55 3.57 -0.08 2.97 2.96 -0.68 -1.88 118.68 124.99 3gqw s LEU 503 Ca 0.10 -1.19 -0.14 0.00 -0.22 0.00 0.00 54.13 52.68 3gqw s LEU 503 Cb -0.12 -1.66 -0.05 0.00 0.50 0.00 0.00 46.19 44.87 3gqw s LEU 503 CO 0.02 -0.21 0.35 -1.10 -1.32 0.00 0.00 176.35 174.10 3gqw s GLN 504 N 1.23 4.04 -0.13 1.98 -0.21 0.89 -0.17 119.66 127.29 3gqw s GLN 504 Ca -0.05 0.26 -0.01 0.00 0.02 0.00 0.00 55.36 55.59 3gqw s GLN 504 Cb -0.19 -3.32 0.03 0.00 1.00 0.00 0.00 33.01 30.54 3gqw s GLN 504 CO -0.03 0.47 -0.05 0.42 -2.12 0.00 0.00 175.29 173.98 3gqw s ILE 505 N -0.32 0.93 -0.17 1.08 1.01 0.89 -0.67 121.20 123.95 3gqw s ILE 505 Ca 0.21 -0.35 -0.19 0.00 0.00 0.00 0.00 60.65 60.33 3gqw s ILE 505 Cb -0.15 -1.04 -0.04 0.00 0.01 0.00 0.00 42.46 41.24 3gqw s ILE 505 CO 0.09 0.25 0.52 0.00 0.00 0.00 0.00 174.94 175.79 3gqw s GLN 506 N 1.73 4.25 0.16 2.79 -2.07 -0.62 0.88 119.66 126.78 3gqw s GLN 506 Ca 0.03 0.46 -0.17 0.00 -1.82 0.00 0.00 55.36 53.86 3gqw s GLN 506 Cb -0.14 -3.52 0.04 0.00 -1.09 0.00 0.00 33.01 28.30 3gqw s GLN 506 CO -0.08 -0.04 0.46 0.00 -1.32 0.00 0.00 175.29 174.31 3gqw n ARG 508 N -0.28 3.74 -2.46 0.00 1.74 -1.26 -4.01 116.66 114.13 3gqw n ARG 508 Ca -0.14 -3.09 -0.43 0.00 -0.77 0.00 0.00 57.85 53.42 3gqw n ARG 508 Cb 0.63 -2.18 -0.02 0.00 -1.02 0.00 0.00 32.46 29.87 3gqw n ARG 508 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3gqw s ILE 509 N -2.97 3.97 -0.12 0.55 1.01 -1.26 -4.87 121.20 117.51 3gqw s ILE 509 Ca 0.54 0.94 -0.13 0.00 0.00 0.00 0.00 60.65 62.00 3gqw s ILE 509 Cb 0.43 -4.45 -0.26 0.00 0.01 0.00 0.00 42.46 38.20 3gqw s ILE 509 CO 0.13 -1.01 0.44 0.28 0.00 0.00 0.00 174.94 174.77 3gqw h SER 510 N 10.24 0.36 -1.76 3.58 0.02 -2.02 -3.46 113.55 120.51 3gqw h SER 510 Ca -0.26 -0.85 -0.67 0.00 -0.84 0.00 0.00 61.79 59.18 3gqw h SER 510 Cb 1.08 -0.12 0.01 0.00 0.14 0.00 0.00 62.40 63.52 3gqw h SER 510 CO 1.13 1.71 1.05 -0.67 -1.14 0.00 0.00 176.83 178.92 3gqw n ASP 511 N -3.80 2.92 0.13 3.07 2.03 -1.26 -4.84 116.55 114.80 3gqw n ASP 511 Ca -0.29 0.97 -0.01 0.00 0.52 0.00 0.00 54.79 55.97 3gqw n ASP 511 Cb 0.94 -1.27 0.20 0.00 -0.72 0.00 0.00 41.12 40.27 3gqw n ASP 511 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 3gqw h GLU 512 N 8.70 0.07 -0.33 -0.67 4.57 -2.00 -2.33 114.58 122.59 3gqw h GLU 512 Ca -0.46 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 57.67 3gqw h GLU 512 Cb 1.29 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.87 3gqw h GLU 512 CO 0.96 0.61 0.18 1.49 -1.18 0.00 0.00 179.01 181.06 3gqw h GLU 513 N 0.05 0.46 -0.56 1.92 4.81 -2.00 -2.71 114.58 116.54 3gqw h GLU 513 Ca -0.00 -0.05 -0.09 0.00 -0.13 0.00 0.00 59.36 59.08 3gqw h GLU 513 Cb 1.00 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.27 3gqw h GLU 513 CO 0.08 0.39 -0.01 -0.09 -0.73 0.00 0.00 179.01 178.65 3gqw h ARG 514 N 0.40 1.00 0.26 1.92 9.65 -1.90 -1.60 114.38 124.11 3gqw h ARG 514 Ca 0.11 -0.32 0.01 0.00 -1.10 0.00 0.00 59.98 58.68 3gqw h ARG 514 Cb 0.07 -0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 28.52 3gqw h ARG 514 CO -0.02 1.00 -0.43 0.00 2.80 0.00 0.00 179.97 183.32 3gqw h ARG 515 N 0.88 -0.73 -1.00 0.20 3.08 -1.36 0.27 114.38 115.72 3gqw h ARG 515 Ca 0.16 0.05 0.06 0.00 0.07 0.00 0.00 59.98 60.32 3gqw h ARG 515 Cb 0.55 0.17 -0.07 0.00 0.08 0.00 0.00 29.97 30.70 3gqw h ARG 515 CO 0.03 -0.49 0.65 0.78 -1.07 0.00 0.00 179.97 179.87 3gqw h GLY 516 N -0.76 1.52 0.97 0.04 0.00 -1.47 -0.57 103.07 102.80 3gqw h GLY 516 Ca -0.01 -0.48 -0.00 0.00 0.00 0.00 0.00 47.33 46.85 3gqw h GLY 516 CO -0.17 0.34 0.02 -1.61 0.00 0.00 0.00 176.54 175.12 3gqw h GLN 517 N 1.18 0.04 -0.10 4.80 4.15 -0.60 -2.12 115.11 122.46 3gqw h GLN 517 Ca 0.43 -0.00 -0.16 0.00 0.77 0.00 0.00 58.65 59.69 3gqw h GLN 517 Cb 0.16 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.83 3gqw h GLN 517 CO -0.17 0.06 -0.61 1.25 -1.93 0.00 0.00 178.83 177.43 3gqw h LEU 518 N 0.00 0.41 -0.20 -2.39 6.46 -0.13 -1.73 115.31 117.73 3gqw h LEU 518 Ca 0.01 -0.24 -0.00 0.00 -0.12 0.00 0.00 57.88 57.53 3gqw h LEU 518 Cb 0.03 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 39.83 3gqw h LEU 518 CO -0.00 0.92 0.12 0.40 -0.62 0.00 0.00 178.44 179.26 3gqw h ILE 519 N 0.27 1.09 -0.49 4.05 2.04 -1.04 -0.25 117.51 123.18 3gqw h ILE 519 Ca -0.01 -0.23 -0.11 0.00 1.00 0.00 0.00 64.86 65.51 3gqw h ILE 519 Cb 1.14 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 38.08 3gqw h ILE 519 CO 0.10 0.09 -0.13 -0.74 0.00 0.00 0.00 178.15 177.47 3gqw h HIS 520 N 0.24 1.08 -0.61 1.37 2.76 -1.33 -1.66 115.15 116.99 3gqw h HIS 520 Ca 0.07 -0.24 -0.08 0.00 -2.20 0.00 0.00 60.37 57.93 3gqw h HIS 520 Cb 0.04 -0.26 -0.02 0.00 1.55 0.00 0.00 27.41 28.71 3gqw h HIS 520 CO -0.05 1.04 0.08 0.00 -1.30 0.00 0.00 177.93 177.70 3gqw h ALA 521 N 0.89 0.82 -0.23 5.26 0.00 -1.25 -2.51 119.26 122.24 3gqw h ALA 521 Ca 0.12 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 3gqw h ALA 521 Cb 0.70 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3gqw h ALA 521 CO 0.05 0.59 -0.11 1.25 0.00 0.00 0.00 179.25 181.03 3gqw h LEU 522 N 0.94 0.49 -0.11 0.00 5.85 -0.97 -0.46 115.31 121.04 3gqw h LEU 522 Ca 0.18 -0.41 0.04 0.00 0.84 0.00 0.00 57.88 58.53 3gqw h LEU 522 Cb 0.46 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.30 3gqw h LEU 522 CO 0.02 0.79 -0.22 0.00 -0.34 0.00 0.00 178.44 178.69 3gqw h ALA 523 N 0.71 -0.20 -0.09 1.25 0.00 -1.28 -1.60 119.26 118.06 3gqw h ALA 523 Ca 0.05 0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3gqw h ALA 523 Cb 0.61 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 3gqw h ALA 523 CO 0.03 -0.68 -0.05 0.00 0.00 0.00 0.00 179.25 178.55 3gqw h ALA 524 N 0.68 0.03 -0.69 0.00 0.00 -1.39 -1.97 119.26 115.91 3gqw h ALA 524 Ca 0.09 0.04 0.02 0.00 0.00 0.00 0.00 54.91 55.06 3gqw h ALA 524 Cb 0.43 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 3gqw h ALA 524 CO -0.28 -0.52 0.46 -0.09 0.00 0.00 0.00 179.25 178.82 3gqw h ARG 525 N -0.05 0.86 0.02 0.00 2.43 -0.73 -0.31 114.38 116.60 3gqw h ARG 525 Ca 0.05 -0.05 -0.21 0.00 -0.81 0.00 0.00 59.98 58.96 3gqw h ARG 525 Cb 0.13 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 3gqw h ARG 525 CO -0.12 0.57 -0.93 0.82 -1.51 0.00 0.00 179.97 178.79 3gqw h ILE 526 N 0.88 1.49 0.00 1.20 2.04 -1.13 -1.46 117.51 120.54 3gqw h ILE 526 Ca 0.26 -2.69 -0.10 0.00 1.00 0.00 0.00 64.86 63.34 3gqw h ILE 526 Cb -0.02 2.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.58 3gqw h ILE 526 CO -0.07 0.79 -0.47 -0.61 0.00 0.00 0.00 178.15 177.79 3gqw h GLN 527 N 0.12 0.00 0.40 2.37 4.15 -0.64 0.88 115.11 122.39 3gqw h GLN 527 Ca -0.06 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.34 3gqw h GLN 527 Cb 1.58 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.28 3gqw h GLN 527 CO 0.15 0.47 -0.19 1.03 -1.93 0.00 0.00 178.83 178.35 3gqw h SER 528 N 0.00 -0.46 -0.43 -0.69 0.87 -1.05 -2.59 113.55 109.21 3gqw h SER 528 Ca -0.00 -0.07 -0.05 0.00 -1.23 0.00 0.00 61.79 60.44 3gqw h SER 528 Cb 1.10 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 63.16 3gqw h SER 528 CO 0.06 -0.02 0.11 -0.33 -0.53 0.00 0.00 176.83 176.12 3gqw h GLU 529 N -1.07 0.75 0.00 2.24 4.39 -1.23 -3.36 114.58 116.31 3gqw h GLU 529 Ca -0.06 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.49 3gqw h GLU 529 Cb 0.50 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.04 3gqw h GLU 529 CO 0.09 0.69 -0.53 1.19 -1.16 0.00 0.00 179.01 179.29 3gqw n PHE 530 N -4.28 0.00 -1.67 4.33 3.01 0.30 -5.01 117.46 114.14 3gqw n PHE 530 Ca 0.03 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.43 3gqw n PHE 530 Cb 0.22 -0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.68 3gqw n PHE 530 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3gqw n GLY 531 N 1.78 0.48 2.96 1.37 0.00 -0.98 -5.01 105.19 105.80 3gqw n GLY 531 Ca -0.00 -0.69 -0.15 0.00 0.00 0.00 0.00 46.02 45.19 3gqw n GLY 531 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gqw s VAL 532 N -2.28 0.37 -0.25 1.61 0.11 -1.26 -5.04 120.40 113.65 3gqw s VAL 532 Ca 0.00 -0.28 -0.12 0.00 -2.93 0.00 0.00 61.98 58.65 3gqw s VAL 532 Cb 0.00 -0.33 -0.05 0.00 -1.53 0.00 0.00 36.38 34.48 3gqw s VAL 532 CO 0.00 0.05 0.24 0.42 -3.33 0.00 0.00 175.10 172.48 3gqw s THR 533 N -0.23 5.29 -0.00 5.04 -4.23 -1.26 -3.36 115.64 116.89 3gqw s THR 533 Ca 0.00 0.31 0.02 0.00 -1.18 0.00 0.00 61.69 60.84 3gqw s THR 533 Cb -0.03 -3.57 -0.04 0.00 1.34 0.00 0.00 72.50 70.21 3gqw s THR 533 CO -0.00 0.27 -0.01 0.00 -0.54 0.00 0.00 174.62 174.34 3gqw s ALA 534 N 1.51 3.24 -0.49 3.99 0.00 -1.26 -4.39 121.76 124.37 3gqw s ALA 534 Ca 0.10 -0.96 -0.19 0.00 0.00 0.00 0.00 51.96 50.92 3gqw s ALA 534 Cb -0.15 -1.31 0.05 0.00 0.00 0.00 0.00 23.12 21.71 3gqw s ALA 534 CO 0.08 0.64 0.58 0.00 0.00 0.00 0.00 175.76 177.06 3gqw s ALA 535 N -1.07 3.41 -0.05 0.00 0.00 -0.39 -4.80 121.76 118.86 3gqw s ALA 535 Ca 0.19 -1.71 -0.30 0.00 0.00 0.00 0.00 51.96 50.15 3gqw s ALA 535 Cb -0.11 -3.28 -0.05 0.00 0.00 0.00 0.00 23.12 19.68 3gqw s ALA 535 CO 0.10 -1.91 1.42 0.42 0.00 0.00 0.00 175.76 175.79 3gqw s ILE 536 N 2.48 3.82 -0.39 0.00 -1.09 -1.26 -1.69 121.20 123.07 3gqw s ILE 536 Ca 0.14 1.12 -0.01 0.00 -2.23 0.00 0.00 60.65 59.66 3gqw s ILE 536 Cb -0.19 -3.72 0.10 0.00 -1.58 0.00 0.00 42.46 37.08 3gqw s ILE 536 CO 0.12 -0.04 0.16 -1.81 -1.23 0.00 0.00 174.94 172.14 3gqw s ASP 537 N 2.22 5.14 -0.23 3.58 1.11 0.76 -4.97 116.67 124.28 3gqw s ASP 537 Ca 0.64 -2.01 -0.29 0.00 0.18 0.00 0.00 52.55 51.07 3gqw s ASP 537 Cb -0.30 -1.78 0.01 0.00 1.07 0.00 0.00 42.92 41.92 3gqw s ASP 537 CO 0.24 -0.49 1.03 -0.76 1.18 0.00 0.00 175.17 176.37 3gqw s LEU 538 N 1.10 4.10 0.39 1.23 1.02 -1.26 -0.07 118.68 125.18 3gqw s LEU 538 Ca 0.08 1.35 0.08 0.00 0.02 0.00 0.00 54.13 55.66 3gqw s LEU 538 Cb -0.22 -3.52 -0.05 0.00 0.02 0.00 0.00 46.19 42.43 3gqw s LEU 538 CO -0.05 -0.67 0.18 -0.76 0.02 0.00 0.00 176.35 175.08 3gqw s LEU 539 N 3.19 3.16 0.55 1.79 1.43 0.26 -4.94 118.68 124.12 3gqw s LEU 539 Ca 0.43 -0.97 -0.15 0.00 -1.03 0.00 0.00 54.13 52.41 3gqw s LEU 539 Cb -0.15 -1.56 -0.06 0.00 0.03 0.00 0.00 46.19 44.45 3gqw s LEU 539 CO 0.06 -0.48 1.00 -2.84 0.23 0.00 0.00 176.35 174.33 3gqw s PRO 540 N -3.90 3.82 0.07 1.29 0.02 -1.26 -2.18 135.00 132.86 3gqw s PRO 540 Ca 0.41 0.89 -0.00 0.00 0.02 0.00 0.00 61.00 62.31 3gqw s PRO 540 Cb 0.02 -2.11 -0.04 0.00 0.02 0.00 0.00 34.50 32.38 3gqw s PRO 540 CO 0.23 -0.38 0.23 -1.25 -0.33 0.00 0.00 177.00 175.50 3gqw s PRO 541 N -4.44 3.46 -0.15 5.54 0.04 -1.26 -2.50 135.00 135.70 3gqw s PRO 541 Ca 0.58 -0.41 -0.15 0.00 0.04 0.00 0.00 61.00 61.06 3gqw s PRO 541 Cb -0.10 -3.01 -0.05 0.00 0.04 0.00 0.00 34.50 31.38 3gqw s PRO 541 CO 0.39 0.59 0.32 -3.38 0.04 0.00 0.00 177.00 174.96 3gqw s HIS 542 N -1.54 3.47 0.00 0.56 -3.43 -1.26 -5.05 115.29 108.05 3gqw s HIS 542 Ca 0.36 0.65 0.00 0.00 -0.80 0.00 0.00 55.06 55.26 3gqw s HIS 542 Cb -0.13 -2.37 0.00 0.00 -1.43 0.00 0.00 32.58 28.65 3gqw s HIS 542 CO 0.28 0.23 0.18 0.45 -2.00 0.00 0.00 174.74 173.88 3gqw n SER 543 N 3.56 0.36 -0.24 7.38 2.88 -1.04 -4.79 113.62 121.73 3gqw n SER 543 Ca -0.11 -0.69 0.02 0.00 -1.33 0.00 0.00 58.87 56.77 3gqw n SER 543 Cb 0.52 0.33 0.05 0.00 -0.75 0.00 0.00 64.21 64.36 3gqw n SER 543 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 3gqw n ILE 544 N -0.33 0.66 0.00 2.46 -5.35 -1.26 -5.03 119.36 110.51 3gqw n ILE 544 Ca 0.00 -0.83 0.00 0.00 -0.27 0.00 0.00 62.75 61.65 3gqw n ILE 544 Cb 0.04 0.70 0.00 0.00 -1.74 0.00 0.00 39.64 38.65 3gqw n ILE 544 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 3gqw n PRO 545 N 0.05 0.00 -2.95 6.28 -0.02 -1.26 -4.69 135.00 132.40 3gqw n PRO 545 Ca 0.04 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.33 3gqw n PRO 545 Cb 0.25 0.00 0.05 0.00 -0.02 0.00 0.00 33.50 33.79 3gqw n PRO 545 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3gqw n ARG 546 N 0.00 0.65 -1.97 -0.52 1.74 -1.26 -3.82 116.66 111.47 3gqw n ARG 546 Ca 0.00 -2.93 -0.20 0.00 -0.77 0.00 0.00 57.85 53.95 3gqw n ARG 546 Cb 0.00 -0.13 0.12 0.00 -1.02 0.00 0.00 32.46 31.43 3gqw n ARG 546 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3gqw n THR 547 N -2.09 0.00 0.28 0.55 -2.24 -0.35 -4.69 114.28 105.74 3gqw n THR 547 Ca 0.12 -1.11 0.14 0.00 -2.27 0.00 0.00 64.05 60.93 3gqw n THR 547 Cb 0.56 -1.19 0.41 0.00 -2.10 0.00 0.00 70.33 68.01 3gqw n THR 547 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 3gqw h SER 548 N -0.78 0.00 0.04 3.42 0.87 -1.78 -2.63 113.55 112.69 3gqw h SER 548 Ca -0.29 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 3gqw h SER 548 Cb 0.97 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.93 3gqw h SER 548 CO 0.27 0.00 -0.03 -1.54 -0.53 0.00 0.00 176.83 175.00 3gqw n SER 549 N -3.00 1.02 0.00 6.23 3.41 -1.19 -4.64 113.62 115.45 3gqw n SER 549 Ca 0.03 -1.25 0.00 0.00 -0.26 0.00 0.00 58.87 57.39 3gqw n SER 549 Cb 0.42 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 3gqw n SER 549 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gqw n GLY 550 N 1.16 0.64 3.80 5.00 0.00 -0.99 -4.91 105.19 109.88 3gqw n GLY 550 Ca 0.19 -0.76 -0.28 0.00 0.00 0.00 0.00 46.02 45.16 3gqw n GLY 550 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gqw s LYS 551 N -2.42 2.21 -0.11 1.61 -2.85 -1.26 -4.88 119.74 112.05 3gqw s LYS 551 Ca 0.00 -2.11 -0.30 0.00 -1.00 0.00 0.00 55.97 52.56 3gqw s LYS 551 Cb 0.00 -1.85 -0.03 0.00 -2.06 0.00 0.00 37.83 33.89 3gqw s LYS 551 CO 0.00 -0.38 1.40 -2.14 0.10 0.00 0.00 175.35 174.33 3gqw s PRO 552 N -4.02 4.23 -1.00 1.78 0.02 -1.26 -1.22 135.00 133.53 3gqw s PRO 552 Ca 0.26 1.87 -0.14 0.00 0.02 0.00 0.00 61.00 63.00 3gqw s PRO 552 Cb 0.01 -3.81 -0.09 0.00 0.02 0.00 0.00 34.50 30.64 3gqw s PRO 552 CO 0.15 -0.73 2.13 0.00 -0.33 0.00 0.00 177.00 178.22 3gqw n ALA 553 N 6.58 4.51 0.11 -1.55 0.00 -1.25 -4.65 120.51 124.27 3gqw n ALA 553 Ca 0.15 -2.96 -0.13 0.00 0.00 0.00 0.00 53.44 50.50 3gqw n ALA 553 Cb 0.44 -3.38 -0.06 0.00 0.00 0.00 0.00 19.45 16.45 3gqw n ALA 553 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gqw h ARG 554 N 6.81 -0.45 -0.43 0.00 3.08 -1.91 0.20 114.38 121.67 3gqw h ARG 554 Ca 0.51 0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.57 3gqw h ARG 554 Cb 0.45 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.58 3gqw h ARG 554 CO 1.76 -0.30 0.16 0.00 -1.07 0.00 0.00 179.97 180.52 3gqw h ALA 555 N 0.27 1.48 -0.27 0.04 0.00 -1.87 -0.17 119.26 118.74 3gqw h ALA 555 Ca 0.03 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 3gqw h ALA 555 Cb 0.49 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3gqw h ALA 555 CO -0.15 0.40 -0.14 1.49 0.00 0.00 0.00 179.25 180.85 3gqw h GLU 556 N 0.61 0.58 -0.37 0.00 4.57 -1.81 -2.52 114.58 115.65 3gqw h GLU 556 Ca 0.15 -0.26 -0.02 0.00 -1.18 0.00 0.00 59.36 58.06 3gqw h GLU 556 Cb 0.14 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 3gqw h GLU 556 CO -0.01 0.83 0.16 0.00 -1.18 0.00 0.00 179.01 178.81 3gqw h ALA 557 N 0.73 1.59 -0.76 2.92 0.00 -0.12 -1.21 119.26 122.41 3gqw h ALA 557 Ca 0.06 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3gqw h ALA 557 Cb 0.66 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3gqw h ALA 557 CO 0.04 0.33 0.29 -0.22 0.00 0.00 0.00 179.25 179.69 3gqw h LYS 558 N 0.52 1.15 0.17 0.00 3.64 -0.76 -1.91 116.57 119.38 3gqw h LYS 558 Ca 0.13 -0.22 -0.27 0.00 -1.27 0.00 0.00 60.65 59.02 3gqw h LYS 558 Cb 0.08 -0.18 0.03 0.00 -0.41 0.00 0.00 32.23 31.75 3gqw h LYS 558 CO -0.02 0.94 -1.18 0.87 -2.27 0.00 0.00 179.45 177.80 3gqw h LYS 559 N 1.11 0.49 -0.62 1.90 6.56 -1.06 -1.97 116.57 122.98 3gqw h LYS 559 Ca 0.25 -0.76 0.13 0.00 -1.06 0.00 0.00 60.65 59.21 3gqw h LYS 559 Cb 0.23 0.27 -0.12 0.00 -0.57 0.00 0.00 32.23 32.05 3gqw h LYS 559 CO -0.02 1.35 -0.13 0.00 -2.06 0.00 0.00 179.45 178.60 3gqw h ARG 560 N 0.02 0.02 -0.22 3.15 3.08 -1.20 0.43 114.38 119.65 3gqw h ARG 560 Ca -0.20 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.84 3gqw h ARG 560 Cb 1.90 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.94 3gqw h ARG 560 CO 0.22 0.01 0.11 -0.92 -1.07 0.00 0.00 179.97 178.32 3gqw h TYR 561 N 0.02 0.32 0.44 3.04 5.03 -1.37 0.02 116.97 124.47 3gqw h TYR 561 Ca 0.30 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.59 3gqw h TYR 561 Cb 0.47 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.64 3gqw h TYR 561 CO -0.48 0.32 -0.32 0.37 -1.32 0.00 0.00 178.16 176.73 3gqw h GLN 562 N 0.23 -0.72 -0.69 1.82 5.75 -0.47 0.14 115.11 121.17 3gqw h GLN 562 Ca 0.08 0.05 0.13 0.00 -0.15 0.00 0.00 58.65 58.76 3gqw h GLN 562 Cb 0.12 0.16 -0.09 0.00 1.07 0.00 0.00 27.48 28.74 3gqw h GLN 562 CO -0.01 -0.48 0.23 -0.22 -2.65 0.00 0.00 178.83 175.71 3gqw h LYS 563 N -0.75 0.37 0.20 1.69 3.64 -0.20 -1.64 116.57 119.88 3gqw h LYS 563 Ca -0.04 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3gqw h LYS 563 Cb 0.63 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 3gqw h LYS 563 CO 0.01 0.24 -0.15 0.00 -2.27 0.00 0.00 179.45 177.28 3gqw h ALA 564 N 1.52 -0.33 0.00 5.00 0.00 -0.58 -3.02 119.26 121.84 3gqw h ALA 564 Ca 0.37 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 3gqw h ALA 564 Cb 0.56 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3gqw h ALA 564 CO -0.40 -0.70 -0.09 -0.92 0.00 0.00 0.00 179.25 177.14 3gqw h TYR 565 N -0.35 0.00 0.00 0.00 5.03 -0.33 0.03 116.97 121.35 3gqw h TYR 565 Ca -0.01 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.30 3gqw h TYR 565 Cb 0.31 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.59 3gqw h TYR 565 CO -0.11 0.09 0.00 0.00 -1.32 0.00 0.00 178.16 176.82 3gqw n ALA 566 N -2.48 1.54 -1.35 1.82 0.00 -0.66 -2.81 120.51 116.57 3gqw n ALA 566 Ca -0.03 0.03 -0.34 0.00 0.00 0.00 0.00 53.44 53.11 3gqw n ALA 566 Cb 0.17 -1.28 -0.05 0.00 0.00 0.00 0.00 19.45 18.29 3gqw n ALA 566 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gqw n ALA 567 N -1.63 7.21 -0.52 0.00 0.00 -0.01 -5.12 120.51 120.44 3gqw n ALA 567 Ca 0.02 -3.26 0.00 0.00 0.00 0.00 0.00 53.44 50.20 3gqw n ALA 567 Cb 0.16 -3.05 0.00 0.00 0.00 0.00 0.00 19.45 16.57 3gqw n ALA 567 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37