#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f3u s ILE 13 N 0.00 4.34 0.07 1.69 -4.36 -1.26 -5.06 121.20 116.61 2f3u s ILE 13 Ca 0.00 -1.01 -0.22 0.00 -0.26 0.00 0.00 60.65 59.17 2f3u s ILE 13 Cb 0.00 -3.15 -0.09 0.00 1.25 0.00 0.00 42.46 40.47 2f3u s ILE 13 CO 0.00 0.00 1.35 -1.28 0.24 0.00 0.00 174.94 175.25 2f3u h SER 14 N 2.89 -1.02 0.00 4.36 0.87 -1.96 -2.84 113.55 115.84 2f3u h SER 14 Ca -0.47 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 2f3u h SER 14 Cb 1.18 0.38 0.00 0.00 -0.44 0.00 0.00 62.40 63.52 2f3u h SER 14 CO 0.63 -0.34 0.28 1.33 -0.53 0.00 0.00 176.83 178.20 2f3u n VAL 15 N -4.35 0.84 1.23 2.23 0.24 -1.26 -1.44 118.33 115.83 2f3u n VAL 15 Ca -0.05 0.61 0.07 0.00 -2.04 0.00 0.00 64.34 62.93 2f3u n VAL 15 Cb 0.25 -1.61 0.25 0.00 -1.47 0.00 0.00 33.84 31.26 2f3u n VAL 15 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2f3u n ARG 16 N -1.62 1.61 0.00 7.34 1.74 -1.07 -5.04 116.66 119.63 2f3u n ARG 16 Ca -0.00 -0.94 0.00 0.00 -0.77 0.00 0.00 57.85 56.14 2f3u n ARG 16 Cb 0.29 -1.28 0.00 0.00 -1.02 0.00 0.00 32.46 30.44 2f3u n ARG 16 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2f3u n GLY 17 N 0.99 -0.76 3.86 -0.13 0.00 -0.52 -1.16 105.19 107.48 2f3u n GLY 17 Ca 0.12 -1.72 -0.34 0.00 0.00 0.00 0.00 46.02 44.09 2f3u n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2f3u s LEU 18 N -1.46 4.24 -0.78 0.99 2.01 -1.26 -4.62 118.68 117.80 2f3u s LEU 18 Ca 0.00 1.03 0.03 0.00 0.01 0.00 0.00 54.13 55.19 2f3u s LEU 18 Cb 0.00 -3.53 0.30 0.00 0.01 0.00 0.00 46.19 42.97 2f3u s LEU 18 CO 0.00 -0.00 1.13 0.00 1.01 0.00 0.00 176.35 178.48 2f3u n ALA 19 N 0.28 4.79 -1.33 4.21 0.00 -1.26 -3.83 120.51 123.37 2f3u n ALA 19 Ca -0.02 -4.74 -0.35 0.00 0.00 0.00 0.00 53.44 48.33 2f3u n ALA 19 Cb 0.52 -1.36 0.10 0.00 0.00 0.00 0.00 19.45 18.72 2f3u n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2f3u n GLY 20 N 0.50 -0.01 0.06 0.00 0.00 -1.26 -4.84 105.19 99.64 2f3u n GLY 20 Ca 0.32 -0.36 -0.12 0.00 0.00 0.00 0.00 46.02 45.85 2f3u n GLY 20 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2f3u h VAL 21 N -0.36 0.98 -0.21 1.61 2.07 -2.00 -1.92 116.25 116.42 2f3u h VAL 21 Ca -0.48 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 66.95 2f3u h VAL 21 Cb 1.32 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 2f3u h VAL 21 CO 0.48 0.02 0.08 -0.33 0.02 0.00 0.00 177.57 177.84 2f3u h GLU 22 N -0.10 0.32 -0.71 1.57 3.07 -2.00 -2.70 114.58 114.04 2f3u h GLU 22 Ca -0.01 -0.06 -0.06 0.00 -0.50 0.00 0.00 59.36 58.74 2f3u h GLU 22 Cb 0.08 -0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 27.91 2f3u h GLU 22 CO 0.01 0.39 0.23 -0.91 -1.40 0.00 0.00 179.01 177.32 2f3u h ASN 23 N 0.18 1.03 -0.43 1.42 4.21 -1.94 0.08 115.58 120.14 2f3u h ASN 23 Ca 0.07 -0.21 -0.06 0.00 1.21 0.00 0.00 56.30 57.31 2f3u h ASN 23 Cb 0.19 -0.27 -0.02 0.00 -1.12 0.00 0.00 38.32 37.10 2f3u h ASN 23 CO -0.00 0.96 0.06 0.58 -1.29 0.00 0.00 177.43 177.73 2f3u h VAL 24 N 1.04 1.23 -0.36 2.81 2.07 -1.36 0.11 116.25 121.80 2f3u h VAL 24 Ca 0.23 -0.91 -0.10 0.00 0.82 0.00 0.00 66.70 66.74 2f3u h VAL 24 Cb 0.30 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.85 2f3u h VAL 24 CO -0.01 0.33 -0.16 0.74 0.02 0.00 0.00 177.57 178.49 2f3u h THR 25 N 0.75 1.28 -0.33 2.57 2.02 -1.13 -2.17 112.91 115.92 2f3u h THR 25 Ca 0.16 -1.28 -0.03 0.00 0.77 0.00 0.00 66.41 66.02 2f3u h THR 25 Cb 0.38 1.35 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 2f3u h THR 25 CO 0.01 0.42 0.08 -0.08 0.37 0.00 0.00 175.52 176.32 2f3u h GLU 26 N 0.53 0.52 -0.25 6.66 4.57 -0.62 -2.60 114.58 123.39 2f3u h GLU 26 Ca 0.08 -0.13 0.03 0.00 -1.18 0.00 0.00 59.36 58.16 2f3u h GLU 26 Cb 0.70 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.20 2f3u h GLU 26 CO 0.05 0.59 0.09 -0.07 -1.18 0.00 0.00 179.01 178.48 2f3u h LEU 27 N 0.37 0.10 -0.74 1.64 3.38 -0.75 -2.03 115.31 117.27 2f3u h LEU 27 Ca 0.10 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.16 2f3u h LEU 27 Cb 0.30 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.01 2f3u h LEU 27 CO 0.00 0.09 0.43 0.11 0.09 0.00 0.00 178.44 179.16 2f3u h LYS 28 N 0.20 0.75 -0.21 1.13 1.57 -1.30 0.42 116.57 119.13 2f3u h LYS 28 Ca 0.11 -0.05 -0.15 0.00 -1.87 0.00 0.00 60.65 58.70 2f3u h LYS 28 Cb 0.08 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 2f3u h LYS 28 CO -0.11 0.50 -0.48 1.57 -0.57 0.00 0.00 179.45 180.35 2f3u h LYS 29 N 0.77 0.55 0.00 3.15 2.10 -1.20 -2.14 116.57 119.79 2f3u h LYS 29 Ca 0.33 -0.31 -0.13 0.00 -2.00 0.00 0.00 60.65 58.55 2f3u h LYS 29 Cb 0.21 0.02 -0.02 0.00 -0.90 0.00 0.00 32.23 31.55 2f3u h LYS 29 CO -0.19 0.91 -0.60 -0.91 -2.00 0.00 0.00 179.45 176.65 2f3u h ASN 30 N 0.43 0.00 -0.11 7.07 2.35 -0.93 -0.76 115.58 123.63 2f3u h ASN 30 Ca 0.02 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.76 2f3u h ASN 30 Cb 1.00 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.36 2f3u h ASN 30 CO 0.09 0.60 0.03 0.15 -1.65 0.00 0.00 177.43 176.66 2f3u h PHE 31 N 0.00 0.18 -0.19 1.19 3.57 -0.73 -0.97 116.94 119.99 2f3u h PHE 31 Ca -0.01 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.40 2f3u h PHE 31 Cb 1.11 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.78 2f3u h PHE 31 CO 0.00 0.32 -0.21 -0.91 -2.23 0.00 0.00 178.31 175.28 2f3u h ASN 32 N -0.00 0.32 0.04 0.41 2.35 -1.24 -1.42 115.58 116.04 2f3u h ASN 32 Ca 0.04 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.69 2f3u h ASN 32 Cb 0.22 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.51 2f3u h ASN 32 CO -0.00 0.55 -0.02 -0.09 -1.65 0.00 0.00 177.43 176.22 2f3u h ARG 33 N 0.30 -0.06 -0.62 0.81 2.43 -0.83 -2.29 114.38 114.13 2f3u h ARG 33 Ca 0.05 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.17 2f3u h ARG 33 Cb 0.54 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 2f3u h ARG 33 CO 0.04 0.15 0.17 0.45 -1.51 0.00 0.00 179.97 179.27 2f3u h HIS 34 N -0.26 0.99 -0.75 2.20 3.86 -1.00 0.14 115.15 120.32 2f3u h HIS 34 Ca -0.01 -0.09 -0.00 0.00 -1.16 0.00 0.00 60.37 59.11 2f3u h HIS 34 Cb 0.23 -0.29 -0.04 0.00 1.06 0.00 0.00 27.41 28.38 2f3u h HIS 34 CO -0.01 0.80 0.47 1.25 0.86 0.00 0.00 177.93 181.30 2f3u h LEU 35 N 0.92 0.88 0.00 2.43 5.85 -1.17 0.10 115.31 124.33 2f3u h LEU 35 Ca 0.20 -0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.88 2f3u h LEU 35 Cb 0.30 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.10 2f3u h LEU 35 CO -0.00 0.67 -0.00 -0.74 -0.34 0.00 0.00 178.44 178.02 2f3u h HIS 36 N 1.03 -0.01 -0.02 1.25 2.76 -0.92 -1.53 115.15 117.71 2f3u h HIS 36 Ca 0.27 -0.00 -0.26 0.00 -2.20 0.00 0.00 60.37 58.18 2f3u h HIS 36 Cb -0.07 0.00 0.02 0.00 1.55 0.00 0.00 27.41 28.91 2f3u h HIS 36 CO 0.00 -0.00 -1.00 0.74 -1.30 0.00 0.00 177.93 176.37 2f3u h PHE 37 N -0.56 1.04 0.06 5.26 0.04 -0.83 -1.83 116.94 120.11 2f3u h PHE 37 Ca -0.00 -0.55 -0.14 0.00 2.80 0.00 0.00 57.97 60.08 2f3u h PHE 37 Cb 0.00 -0.12 -0.00 0.00 2.20 0.00 0.00 35.95 38.03 2f3u h PHE 37 CO 0.00 1.39 -0.67 1.15 -0.60 0.00 0.00 178.31 179.57 2f3u h THR 38 N 0.42 1.44 0.00 -1.55 2.02 -1.10 -3.37 112.91 110.76 2f3u h THR 38 Ca -0.12 -2.38 0.00 0.00 0.77 0.00 0.00 66.41 64.69 2f3u h THR 38 Cb 1.65 3.03 0.00 0.00 -1.74 0.00 0.00 68.15 71.09 2f3u h THR 38 CO 0.20 0.60 -0.82 0.18 0.37 0.00 0.00 175.52 176.05 2f3u n LEU 39 N -4.33 0.63 -3.42 2.58 4.77 0.15 -4.99 117.00 112.38 2f3u n LEU 39 Ca -0.17 0.04 -0.21 0.00 -0.03 0.00 0.00 56.01 55.64 2f3u n LEU 39 Cb 0.68 -0.14 0.05 0.00 -2.33 0.00 0.00 43.42 41.67 2f3u n LEU 39 CO 0.36 0.03 0.01 0.52 -1.33 0.00 0.00 177.39 176.98 2f3u n VAL 40 N -1.92 -7.82 -4.14 4.08 0.31 -0.69 -4.98 118.33 103.17 2f3u n VAL 40 Ca 0.03 -1.09 -0.12 0.00 -0.01 0.00 0.00 64.34 63.15 2f3u n VAL 40 Cb 0.42 -5.62 -0.08 0.00 -0.91 0.00 0.00 33.84 27.65 2f3u n VAL 40 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2f3u s LYS 41 N -4.94 1.39 0.14 5.55 -0.14 -0.60 -5.02 119.74 116.13 2f3u s LYS 41 Ca 0.42 -1.56 0.04 0.00 -1.36 0.00 0.00 55.97 53.52 2f3u s LYS 41 Cb -0.10 0.34 -0.04 0.00 -1.68 0.00 0.00 37.83 36.35 2f3u s LYS 41 CO 0.79 -0.51 -0.10 0.16 -0.76 0.00 0.00 175.35 174.93 2f3u s ASP 42 N -3.14 1.77 0.24 2.83 1.47 -1.26 -4.05 116.67 114.53 2f3u s ASP 42 Ca 0.34 -1.00 0.13 0.00 1.18 0.00 0.00 52.55 53.20 2f3u s ASP 42 Cb 0.04 -0.01 0.69 0.00 -0.34 0.00 0.00 42.92 43.30 2f3u s ASP 42 CO 0.13 -0.32 1.31 0.54 0.68 0.00 0.00 175.17 177.51 2f3u n ARG 43 N -0.13 0.08 0.13 2.11 5.12 -1.26 -1.71 116.66 120.99 2f3u n ARG 43 Ca -0.11 0.55 0.09 0.00 -1.93 0.00 0.00 57.85 56.45 2f3u n ARG 43 Cb 0.60 -1.93 0.04 0.00 -1.16 0.00 0.00 32.46 30.01 2f3u n ARG 43 CO 0.00 0.00 0.00 -0.91 -1.93 0.00 0.00 177.63 174.79 2f3u h ASN 44 N 0.00 0.00 0.00 0.55 2.35 -2.05 -3.37 115.58 113.06 2f3u h ASN 44 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2f3u h ASN 44 Cb 0.31 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.68 2f3u h ASN 44 CO 0.00 0.13 0.00 1.33 -1.65 0.00 0.00 177.43 177.24 2f3u n VAL 45 N -2.88 0.00 -2.35 2.81 0.24 -0.70 -5.04 118.33 110.42 2f3u n VAL 45 Ca -0.00 -0.45 -0.41 0.00 -2.04 0.00 0.00 64.34 61.44 2f3u n VAL 45 Cb 0.60 1.09 -0.03 0.00 -1.47 0.00 0.00 33.84 34.03 2f3u n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2f3u s ALA 46 N -0.10 3.45 0.43 2.33 0.00 -0.73 -4.93 121.76 122.20 2f3u s ALA 46 Ca 0.00 0.99 0.08 0.00 0.00 0.00 0.00 51.96 53.02 2f3u s ALA 46 Cb 0.00 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.70 2f3u s ALA 46 CO 0.00 -0.39 0.45 0.95 0.00 0.00 0.00 175.76 176.78 2f3u s THR 47 N -0.24 2.72 0.39 0.00 -4.23 -1.26 -4.96 115.64 108.06 2f3u s THR 47 Ca 0.52 -1.23 0.12 0.00 -1.18 0.00 0.00 61.69 59.93 2f3u s THR 47 Cb -0.34 -2.95 0.34 0.00 1.34 0.00 0.00 72.50 70.89 2f3u s THR 47 CO 0.38 0.00 1.90 -0.65 -0.54 0.00 0.00 174.62 175.71 2f3u h PRO 48 N 0.87 0.53 -0.55 3.99 0.11 -2.00 0.44 132.00 135.39 2f3u h PRO 48 Ca -0.40 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.62 2f3u h PRO 48 Cb 1.27 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 2f3u h PRO 48 CO 0.53 0.35 0.11 -0.09 -0.21 0.00 0.00 178.00 178.69 2f3u h ARG 49 N 0.55 0.87 -0.64 1.05 2.43 -1.97 -0.64 114.38 116.03 2f3u h ARG 49 Ca 0.40 -0.19 -0.03 0.00 -0.81 0.00 0.00 59.98 59.34 2f3u h ARG 49 Cb 0.77 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 30.17 2f3u h ARG 49 CO -0.15 0.80 0.27 -0.44 -1.51 0.00 0.00 179.97 178.93 2f3u h ASP 50 N 0.83 0.87 -0.54 -3.80 3.45 -1.31 -1.91 116.42 114.01 2f3u h ASP 50 Ca 0.18 -0.16 -0.08 0.00 0.43 0.00 0.00 57.03 57.39 2f3u h ASP 50 Cb 0.34 -0.22 -0.02 0.00 -0.56 0.00 0.00 39.33 38.86 2f3u h ASP 50 CO 0.00 0.79 0.03 1.88 -1.57 0.00 0.00 179.24 180.37 2f3u h TYR 51 N 0.89 1.05 -0.27 4.55 0.05 -0.73 -1.23 116.97 121.28 2f3u h TYR 51 Ca 0.21 -0.16 0.00 0.00 0.05 0.00 0.00 58.73 58.83 2f3u h TYR 51 Cb 0.19 -0.28 -0.01 0.00 1.01 0.00 0.00 36.73 37.63 2f3u h TYR 51 CO 0.01 0.93 0.17 -0.92 -1.05 0.00 0.00 178.16 177.30 2f3u h TYR 52 N 0.91 0.35 -0.53 4.88 3.20 -0.83 -0.86 116.97 124.09 2f3u h TYR 52 Ca 0.17 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.99 2f3u h TYR 52 Cb 0.49 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 2f3u h TYR 52 CO 0.03 0.24 0.10 0.74 -1.64 0.00 0.00 178.16 177.63 2f3u h PHE 53 N 0.36 0.86 -0.71 -3.82 -1.00 -1.07 0.18 116.94 111.73 2f3u h PHE 53 Ca 0.10 -0.09 -0.04 0.00 2.81 0.00 0.00 57.97 60.74 2f3u h PHE 53 Cb -0.02 -0.25 -0.03 0.00 3.61 0.00 0.00 35.95 39.26 2f3u h PHE 53 CO -0.05 0.74 0.27 0.00 -1.61 0.00 0.00 178.31 177.66 2f3u h ALA 54 N 1.32 0.93 -0.36 2.45 0.00 -0.91 -0.13 119.26 122.57 2f3u h ALA 54 Ca 0.17 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2f3u h ALA 54 Cb 0.33 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2f3u h ALA 54 CO 0.00 0.57 -0.12 1.25 0.00 0.00 0.00 179.25 180.95 2f3u h LEU 55 N 1.03 0.73 -0.45 0.00 5.85 -0.54 -2.13 115.31 119.80 2f3u h LEU 55 Ca 0.24 -0.38 -0.00 0.00 0.84 0.00 0.00 57.88 58.58 2f3u h LEU 55 Cb 0.23 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 2f3u h LEU 55 CO -0.02 0.94 0.28 0.00 -0.34 0.00 0.00 178.44 179.31 2f3u h ALA 56 N 0.81 0.57 -0.19 1.25 0.00 -0.29 -1.20 119.26 120.20 2f3u h ALA 56 Ca 0.09 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2f3u h ALA 56 Cb 0.64 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2f3u h ALA 56 CO 0.04 0.05 -0.14 0.45 0.00 0.00 0.00 179.25 179.65 2f3u h HIS 57 N 0.60 0.33 -0.39 0.00 3.86 -1.00 0.10 115.15 118.66 2f3u h HIS 57 Ca 0.16 -0.04 -0.07 0.00 -1.16 0.00 0.00 60.37 59.26 2f3u h HIS 57 Cb -0.02 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 2f3u h HIS 57 CO -0.04 0.45 -0.04 1.15 0.86 0.00 0.00 177.93 180.32 2f3u h THR 58 N 0.30 1.27 -0.31 2.45 2.02 -0.72 -1.91 112.91 116.00 2f3u h THR 58 Ca 0.06 -1.08 -0.18 0.00 0.77 0.00 0.00 66.41 65.98 2f3u h THR 58 Cb 0.43 1.19 -0.00 0.00 -1.74 0.00 0.00 68.15 68.03 2f3u h THR 58 CO 0.03 0.36 -0.51 0.58 0.37 0.00 0.00 175.52 176.35 2f3u h VAL 59 N 0.52 1.27 -0.86 3.16 2.07 -0.99 -3.09 116.25 118.35 2f3u h VAL 59 Ca 0.10 -1.69 0.09 0.00 0.82 0.00 0.00 66.70 66.02 2f3u h VAL 59 Cb 0.53 1.57 -0.07 0.00 -1.52 0.00 0.00 31.29 31.80 2f3u h VAL 59 CO 0.03 0.55 0.51 -0.09 0.02 0.00 0.00 177.57 178.59 2f3u h ARG 60 N 0.69 0.85 -0.99 1.57 2.43 -0.67 -1.56 114.38 116.70 2f3u h ARG 60 Ca 0.03 -0.05 0.16 0.00 -0.81 0.00 0.00 59.98 59.30 2f3u h ARG 60 Cb 1.11 -0.19 -0.10 0.00 -0.42 0.00 0.00 29.97 30.37 2f3u h ARG 60 CO 0.11 0.57 0.61 -0.44 -1.51 0.00 0.00 179.97 179.31 2f3u h ASP 61 N 0.88 0.83 0.61 -3.80 3.45 -1.26 0.56 116.42 117.69 2f3u h ASP 61 Ca 0.40 0.08 0.00 0.00 0.43 0.00 0.00 57.03 57.94 2f3u h ASP 61 Cb 0.31 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 39.00 2f3u h ASP 61 CO -0.22 0.37 0.00 0.45 -1.57 0.00 0.00 179.24 178.27 2f3u h HIS 62 N 0.86 0.00 0.23 4.55 3.86 -1.35 -3.08 115.15 120.22 2f3u h HIS 62 Ca 0.54 0.00 -0.34 0.00 -1.16 0.00 0.00 60.37 59.40 2f3u h HIS 62 Cb 0.70 0.00 0.03 0.00 1.06 0.00 0.00 27.41 29.20 2f3u h HIS 62 CO -0.01 0.00 -1.57 -0.07 0.86 0.00 0.00 177.93 177.14 2f3u h LEU 63 N 0.00 0.78 -0.57 2.43 3.38 -0.87 -3.39 115.31 117.07 2f3u h LEU 63 Ca 0.00 -0.93 0.10 0.00 0.09 0.00 0.00 57.88 57.14 2f3u h LEU 63 Cb 0.30 -0.25 -0.08 0.00 0.09 0.00 0.00 40.66 40.72 2f3u h LEU 63 CO 0.00 1.74 0.13 -0.37 0.09 0.00 0.00 178.44 180.03 2f3u h VAL 64 N 0.13 0.68 -0.14 1.22 -1.51 -1.42 0.20 116.25 115.40 2f3u h VAL 64 Ca -0.29 -0.09 0.04 0.00 -1.23 0.00 0.00 66.70 65.13 2f3u h VAL 64 Cb 2.15 0.39 -0.04 0.00 -2.13 0.00 0.00 31.29 31.66 2f3u h VAL 64 CO 0.24 0.05 -0.08 1.23 -1.23 0.00 0.00 177.57 177.78 2f3u h GLY 65 N 0.26 0.04 1.33 5.19 0.00 -1.76 0.84 103.07 108.99 2f3u h GLY 65 Ca 0.29 0.10 -0.08 0.00 0.00 0.00 0.00 47.33 47.64 2f3u h GLY 65 CO -0.37 -0.10 -0.04 3.21 0.00 0.00 0.00 176.54 179.24 2f3u h ARG 66 N -0.08 0.80 -0.20 4.80 3.08 -1.64 -2.43 114.38 118.72 2f3u h ARG 66 Ca 0.08 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 2f3u h ARG 66 Cb 0.20 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 2f3u h ARG 66 CO -0.19 0.83 0.10 2.35 -1.07 0.00 0.00 179.97 181.99 2f3u h TRP 67 N 0.74 0.29 -0.54 3.04 7.01 -0.03 0.02 115.95 126.48 2f3u h TRP 67 Ca 0.14 -0.01 -0.05 0.00 2.11 0.00 0.00 58.89 61.07 2f3u h TRP 67 Cb 0.51 -0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.45 2f3u h TRP 67 CO 0.03 0.29 0.14 0.82 -2.79 0.00 0.00 178.44 176.93 2f3u h ILE 68 N 0.20 1.24 0.00 2.65 2.04 -0.73 -2.51 117.51 120.40 2f3u h ILE 68 Ca 0.07 -0.86 -0.10 0.00 1.00 0.00 0.00 64.86 64.97 2f3u h ILE 68 Cb 0.11 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 2f3u h ILE 68 CO -0.01 0.31 -0.48 0.08 0.00 0.00 0.00 178.15 178.06 2f3u h ARG 69 N 0.76 0.00 0.09 2.37 0.11 -1.35 -1.48 114.38 114.89 2f3u h ARG 69 Ca 0.17 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.25 2f3u h ARG 69 Cb 0.33 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.41 2f3u h ARG 69 CO 0.00 0.48 -0.04 1.15 0.10 0.00 0.00 179.97 181.65 2f3u h THR 70 N 0.00 1.06 -0.42 0.08 2.02 -0.84 0.15 112.91 114.95 2f3u h THR 70 Ca -0.00 -0.56 -0.03 0.00 0.77 0.00 0.00 66.41 66.59 2f3u h THR 70 Cb 1.17 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 68.97 2f3u h THR 70 CO 0.06 0.14 0.14 1.56 0.37 0.00 0.00 175.52 177.78 2f3u h GLN 71 N -0.38 0.61 -0.51 6.66 1.08 -1.41 -1.22 115.11 119.95 2f3u h GLN 71 Ca -0.01 -0.09 -0.12 0.00 -1.45 0.00 0.00 58.65 56.98 2f3u h GLN 71 Cb 0.32 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.62 2f3u h GLN 71 CO 0.02 0.54 -0.14 0.37 -0.95 0.00 0.00 178.83 178.66 2f3u h GLN 72 N 0.61 0.98 -0.20 1.46 5.75 -1.08 -2.50 115.11 120.13 2f3u h GLN 72 Ca 0.14 -0.37 0.03 0.00 -0.15 0.00 0.00 58.65 58.31 2f3u h GLN 72 Cb 0.18 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.64 2f3u h GLN 72 CO -0.01 1.04 -0.01 1.25 -2.65 0.00 0.00 178.83 178.45 2f3u h HIS 73 N 0.86 -0.03 -0.20 3.99 2.76 0.40 -1.28 115.15 121.65 2f3u h HIS 73 Ca 0.13 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.29 2f3u h HIS 73 Cb 0.70 0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.69 2f3u h HIS 73 CO 0.04 -0.04 -0.00 1.88 -1.30 0.00 0.00 177.93 178.51 2f3u h TYR 74 N 0.05 0.30 -0.42 5.26 0.05 -1.16 -0.42 116.97 120.63 2f3u h TYR 74 Ca 0.09 -0.02 -0.13 0.00 0.05 0.00 0.00 58.73 58.73 2f3u h TYR 74 Cb 0.12 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 37.76 2f3u h TYR 74 CO -0.18 0.31 -0.25 -0.92 -1.05 0.00 0.00 178.16 176.07 2f3u h TYR 75 N 0.29 1.00 0.18 4.88 3.20 -0.91 0.23 116.97 125.83 2f3u h TYR 75 Ca 0.07 -0.24 -0.01 0.00 3.14 0.00 0.00 58.73 61.69 2f3u h TYR 75 Cb 0.20 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.24 2f3u h TYR 75 CO 0.00 1.02 -0.08 0.93 -1.64 0.00 0.00 178.16 178.39 2f3u h GLU 76 N 0.75 -0.23 0.00 1.82 4.39 -0.52 -3.31 114.58 117.47 2f3u h GLU 76 Ca 0.09 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.81 2f3u h GLU 76 Cb 0.79 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.49 2f3u h GLU 76 CO 0.07 0.19 0.00 0.87 -1.16 0.00 0.00 179.01 178.97 2f3u h LYS 77 N -0.81 0.00 -6.69 2.33 1.57 -1.17 -3.48 116.57 108.32 2f3u h LYS 77 Ca -0.02 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.22 2f3u h LYS 77 Cb 0.52 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.81 2f3u h LYS 77 CO 0.04 0.00 -0.97 -3.47 -0.57 0.00 0.00 179.45 174.48 2f3u n ASP 78 N -2.76 -3.12 -4.60 0.86 2.03 0.80 -4.95 116.55 104.81 2f3u n ASP 78 Ca 0.04 -1.17 -0.29 0.00 0.52 0.00 0.00 54.79 53.89 2f3u n ASP 78 Cb 0.46 -2.37 0.14 0.00 -0.72 0.00 0.00 41.12 38.64 2f3u n ASP 78 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2f3u s PRO 79 N -6.88 1.03 0.18 -0.67 0.04 -1.26 -4.97 135.00 122.48 2f3u s PRO 79 Ca 0.34 0.08 -0.30 0.00 0.04 0.00 0.00 61.00 61.15 2f3u s PRO 79 Cb -0.16 -1.84 -0.09 0.00 0.04 0.00 0.00 34.50 32.45 2f3u s PRO 79 CO 0.93 -2.23 1.38 0.21 0.04 0.00 0.00 177.00 177.33 2f3u s LYS 80 N -5.48 4.33 -0.06 4.56 2.20 -1.26 -4.97 119.74 119.06 2f3u s LYS 80 Ca 0.66 2.13 -0.13 0.00 -0.36 0.00 0.00 55.97 58.27 2f3u s LYS 80 Cb -0.11 -3.19 -0.05 0.00 -1.51 0.00 0.00 37.83 32.97 2f3u s LYS 80 CO 0.52 -0.37 0.34 1.03 -0.36 0.00 0.00 175.35 176.52 2f3u s ARG 81 N 0.27 3.90 -0.22 4.03 3.00 -0.18 -4.53 118.95 125.22 2f3u s ARG 81 Ca 0.60 0.25 -0.06 0.00 0.00 0.00 0.00 55.73 56.52 2f3u s ARG 81 Cb -0.38 -3.26 -0.03 0.00 0.00 0.00 0.00 34.95 31.28 2f3u s ARG 81 CO 0.36 0.60 0.03 0.42 0.00 0.00 0.00 175.30 176.72 2f3u s ILE 82 N -0.70 4.16 -0.28 1.52 -1.09 -0.42 -1.34 121.20 123.05 2f3u s ILE 82 Ca 0.21 -0.23 -0.03 0.00 -2.23 0.00 0.00 60.65 58.36 2f3u s ILE 82 Cb -0.15 -2.91 0.03 0.00 -1.58 0.00 0.00 42.46 37.85 2f3u s ILE 82 CO 0.10 0.40 -0.00 -0.31 -1.23 0.00 0.00 174.94 173.89 2f3u s TYR 83 N 1.19 3.14 -0.47 3.97 2.02 0.51 -0.50 117.35 127.21 2f3u s TYR 83 Ca 0.04 -1.46 -0.15 0.00 -0.37 0.00 0.00 57.07 55.13 2f3u s TYR 83 Cb -0.14 -2.13 0.08 0.00 -0.40 0.00 0.00 41.96 39.36 2f3u s TYR 83 CO 0.02 -0.71 0.39 -0.47 -1.57 0.00 0.00 175.55 173.22 2f3u s TYR 84 N 1.36 3.25 -0.21 2.71 5.04 -0.31 -0.72 117.35 128.47 2f3u s TYR 84 Ca -0.00 -0.99 -0.18 0.00 -2.44 0.00 0.00 57.07 53.46 2f3u s TYR 84 Cb -0.18 -3.18 -0.03 0.00 0.35 0.00 0.00 41.96 38.93 2f3u s TYR 84 CO -0.01 -0.81 0.51 -0.51 -1.34 0.00 0.00 175.55 173.39 2f3u s LEU 85 N 1.62 4.13 -0.06 6.97 1.02 -0.61 -1.63 118.68 130.12 2f3u s LEU 85 Ca 0.04 0.63 -0.14 0.00 0.02 0.00 0.00 54.13 54.68 2f3u s LEU 85 Cb -0.24 -2.69 0.03 0.00 0.02 0.00 0.00 46.19 43.31 2f3u s LEU 85 CO 0.06 -0.20 0.33 -0.55 0.02 0.00 0.00 176.35 176.01 2f3u s SER 86 N 1.23 -0.26 0.00 2.29 0.15 -0.94 -1.87 113.70 114.29 2f3u s SER 86 Ca 0.23 0.33 0.26 0.00 0.70 0.00 0.00 55.95 57.47 2f3u s SER 86 Cb -0.15 0.47 0.95 0.00 -1.71 0.00 0.00 66.02 65.57 2f3u s SER 86 CO 0.09 -0.33 1.68 0.18 1.20 0.00 0.00 173.24 176.07 2f3u n LEU 87 N 1.88 1.60 -3.81 3.45 4.32 -1.26 -4.13 117.00 119.04 2f3u n LEU 87 Ca -0.18 -0.57 -0.13 0.00 -0.02 0.00 0.00 56.01 55.10 2f3u n LEU 87 Cb 0.57 -0.03 -0.14 0.00 -1.62 0.00 0.00 43.42 42.19 2f3u n LEU 87 CO 0.19 0.29 -0.30 -1.61 -1.22 0.00 0.00 177.39 174.74 2f3u s GLU 88 N -1.94 0.04 -0.30 3.23 2.02 -1.26 -4.72 118.70 115.77 2f3u s GLU 88 Ca 0.36 0.15 -0.03 0.00 0.02 0.00 0.00 54.97 55.48 2f3u s GLU 88 Cb 0.20 -0.08 0.11 0.00 0.10 0.00 0.00 34.13 34.46 2f3u s GLU 88 CO 0.32 -0.08 0.15 -0.06 0.02 0.00 0.00 175.26 175.61 2f3u s PHE 89 N 0.50 0.36 -1.16 1.61 0.40 0.15 -4.62 117.98 115.22 2f3u s PHE 89 Ca -0.04 -0.98 -0.15 0.00 -0.60 0.00 0.00 56.93 55.16 2f3u s PHE 89 Cb -0.06 -0.89 0.15 0.00 0.51 0.00 0.00 43.02 42.74 2f3u s PHE 89 CO -0.02 -0.83 1.41 -0.47 0.70 0.00 0.00 175.22 176.01 2f3u s TYR 90 N 1.94 3.34 0.18 0.36 6.14 -0.40 -3.44 117.35 125.47 2f3u s TYR 90 Ca 0.10 -1.92 0.06 0.00 0.64 0.00 0.00 57.07 55.95 2f3u s TYR 90 Cb -0.17 -4.37 0.04 0.00 0.42 0.00 0.00 41.96 37.88 2f3u s TYR 90 CO -0.31 -1.47 1.41 0.52 0.64 0.00 0.00 175.55 176.35 2f3u h MET 91 N 7.55 0.09 0.00 4.97 2.86 -1.77 -3.41 114.93 125.22 2f3u h MET 91 Ca 0.30 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 2f3u h MET 91 Cb 0.90 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.59 2f3u h MET 91 CO 1.25 0.87 0.00 0.41 1.06 0.00 0.00 176.91 180.50 2f3u n GLY 92 N 0.84 -0.18 3.84 8.32 0.00 -0.88 -4.79 105.19 112.34 2f3u n GLY 92 Ca -0.02 -1.02 -0.32 0.00 0.00 0.00 0.00 46.02 44.67 2f3u n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2f3u s ARG 93 N 0.00 3.93 -0.05 1.61 0.52 -1.26 -1.59 118.95 122.12 2f3u s ARG 93 Ca 0.00 0.92 0.09 0.00 -0.52 0.00 0.00 55.73 56.21 2f3u s ARG 93 Cb 0.00 -2.15 -0.13 0.00 0.52 0.00 0.00 34.95 33.19 2f3u s ARG 93 CO 0.00 -0.26 0.12 2.41 0.02 0.00 0.00 175.30 177.60 2f3u n THR 94 N -1.57 0.28 0.31 0.02 -1.04 -1.26 -4.67 114.28 106.34 2f3u n THR 94 Ca 0.06 -0.28 -0.18 0.00 -2.04 0.00 0.00 64.05 61.61 2f3u n THR 94 Cb 0.54 -0.21 -0.09 0.00 -1.82 0.00 0.00 70.33 68.75 2f3u n THR 94 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 2f3u h LEU 95 N 0.00 -1.31 -0.75 -4.42 5.85 -1.96 -1.41 115.31 111.31 2f3u h LEU 95 Ca -0.11 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 2f3u h LEU 95 Cb 0.94 0.42 -0.04 0.00 0.37 0.00 0.00 40.66 42.36 2f3u h LEU 95 CO 0.01 -0.66 0.41 -0.61 -0.34 0.00 0.00 178.44 177.24 2f3u h GLN 96 N -1.01 1.05 -0.91 1.25 4.15 -1.96 -2.13 115.11 115.54 2f3u h GLN 96 Ca -0.07 -0.12 0.02 0.00 0.77 0.00 0.00 58.65 59.25 2f3u h GLN 96 Cb 0.86 -0.20 -0.05 0.00 0.21 0.00 0.00 27.48 28.30 2f3u h GLN 96 CO -0.03 0.78 0.60 -0.97 -1.93 0.00 0.00 178.83 177.28 2f3u h ASN 97 N 1.03 1.01 -0.45 -0.69 -0.73 -1.81 -0.04 115.58 113.91 2f3u h ASN 97 Ca 0.26 -0.02 -0.10 0.00 1.87 0.00 0.00 56.30 58.31 2f3u h ASN 97 Cb 0.04 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.37 2f3u h ASN 97 CO -0.04 0.71 -0.12 0.74 -0.37 0.00 0.00 177.43 178.35 2f3u h THR 98 N 1.19 1.27 -0.57 -3.57 2.02 -0.83 -1.77 112.91 110.65 2f3u h THR 98 Ca 0.35 -1.24 -0.04 0.00 0.77 0.00 0.00 66.41 66.24 2f3u h THR 98 Cb -0.05 1.14 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 2f3u h THR 98 CO -0.09 0.43 0.19 0.24 0.37 0.00 0.00 175.52 176.65 2f3u h MET 99 N 0.72 0.88 -0.03 6.66 2.86 -0.74 -1.56 114.93 123.71 2f3u h MET 99 Ca 0.11 -0.18 -0.00 0.00 -2.06 0.00 0.00 59.70 57.57 2f3u h MET 99 Cb 0.67 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.20 2f3u h MET 99 CO 0.05 0.79 0.02 0.28 1.06 0.00 0.00 176.91 179.10 2f3u h VAL 100 N 0.80 1.04 0.00 -2.22 2.07 -0.90 0.21 116.25 117.24 2f3u h VAL 100 Ca 0.19 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.58 2f3u h VAL 100 Cb 0.27 1.07 -0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2f3u h VAL 100 CO -0.01 0.04 -0.02 0.78 0.02 0.00 0.00 177.57 178.38 2f3u h ASN 101 N 0.00 0.00 -0.21 0.57 4.21 -1.19 -2.57 115.58 116.39 2f3u h ASN 101 Ca 0.01 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.52 2f3u h ASN 101 Cb 0.04 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.24 2f3u h ASN 101 CO -0.00 0.02 0.00 0.18 -1.29 0.00 0.00 177.43 176.34 2f3u n LEU 102 N -3.13 2.96 -3.41 1.61 4.32 -0.60 -0.65 117.00 118.10 2f3u n LEU 102 Ca -0.00 -1.31 -0.24 0.00 -0.02 0.00 0.00 56.01 54.45 2f3u n LEU 102 Cb 0.27 -0.13 0.06 0.00 -1.62 0.00 0.00 43.42 42.01 2f3u n LEU 102 CO 0.27 0.60 0.17 0.00 -1.22 0.00 0.00 177.39 177.20 2f3u n ALA 103 N 1.18 -1.20 0.36 -1.18 0.00 -0.19 -4.91 120.51 114.57 2f3u n ALA 103 Ca 0.14 0.37 0.06 0.00 0.00 0.00 0.00 53.44 54.01 2f3u n ALA 103 Cb 0.52 -5.00 0.07 0.00 0.00 0.00 0.00 19.45 15.03 2f3u n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2f3u n LEU 104 N -4.70 2.16 0.04 0.00 4.77 0.55 -4.54 117.00 115.29 2f3u n LEU 104 Ca -0.03 -1.19 -0.11 0.00 -0.03 0.00 0.00 56.01 54.65 2f3u n LEU 104 Cb 0.58 -0.05 -0.05 0.00 -2.33 0.00 0.00 43.42 41.57 2f3u n LEU 104 CO 0.59 0.44 0.80 -0.08 -1.33 0.00 0.00 177.39 177.82 2f3u h GLU 105 N 2.26 -0.15 -0.54 3.23 4.81 -1.61 -1.06 114.58 121.52 2f3u h GLU 105 Ca 0.00 0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.13 2f3u h GLU 105 Cb 0.53 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.93 2f3u h GLU 105 CO 0.00 -0.10 -0.10 -0.91 -0.73 0.00 0.00 179.01 177.18 2f3u h ASN 106 N -0.15 1.02 -0.39 1.04 2.35 -1.39 -0.67 115.58 117.38 2f3u h ASN 106 Ca 0.04 -0.33 -0.00 0.00 -0.55 0.00 0.00 56.30 55.46 2f3u h ASN 106 Cb 0.20 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 2f3u h ASN 106 CO -0.10 1.12 0.23 0.00 -1.65 0.00 0.00 177.43 177.03 2f3u h ALA 107 N 0.97 0.50 -0.19 -0.83 0.00 -1.63 0.12 119.26 118.20 2f3u h ALA 107 Ca 0.14 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 2f3u h ALA 107 Cb 0.66 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2f3u h ALA 107 CO 0.05 0.01 -0.34 0.00 0.00 0.00 0.00 179.25 178.96 2f3u h ASP 109 N 0.35 0.36 -0.10 0.00 3.58 -0.54 -0.89 116.42 119.17 2f3u h ASP 109 Ca 0.04 -0.15 -0.02 0.00 0.42 0.00 0.00 57.03 57.32 2f3u h ASP 109 Cb 0.77 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.72 2f3u h ASP 109 CO 0.06 0.41 -0.03 -0.08 -2.88 0.00 0.00 179.24 176.72 2f3u h GLU 110 N 0.28 0.19 -0.64 0.28 4.57 -0.52 -1.42 114.58 117.32 2f3u h GLU 110 Ca 0.09 -0.07 0.06 0.00 -1.18 0.00 0.00 59.36 58.26 2f3u h GLU 110 Cb 0.16 -0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 28.68 2f3u h GLU 110 CO -0.01 0.51 0.34 0.00 -1.18 0.00 0.00 179.01 178.67 2f3u h ALA 111 N 0.68 0.85 -0.12 2.92 0.00 -0.69 -0.02 119.26 122.88 2f3u h ALA 111 Ca 0.02 0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 2f3u h ALA 111 Cb 0.44 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2f3u h ALA 111 CO 0.01 -0.00 -0.60 1.79 0.00 0.00 0.00 179.25 180.45 2f3u h THR 112 N 0.63 1.35 -0.30 0.00 1.35 -1.18 -2.69 112.91 112.07 2f3u h THR 112 Ca 0.29 -1.92 0.01 0.00 -0.55 0.00 0.00 66.41 64.25 2f3u h THR 112 Cb 0.21 1.91 -0.02 0.00 -1.73 0.00 0.00 68.15 68.52 2f3u h THR 112 CO -0.19 0.58 0.18 0.22 -0.25 0.00 0.00 175.52 176.05 2f3u h TYR 113 N 0.31 0.33 0.00 4.73 3.20 -0.46 0.11 116.97 125.20 2f3u h TYR 113 Ca -0.00 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 2f3u h TYR 113 Cb 1.13 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 39.30 2f3u h TYR 113 CO 0.04 0.20 -0.07 1.96 -1.64 0.00 0.00 178.16 178.64 2f3u h GLN 114 N 0.36 0.00 -0.05 1.82 4.20 -0.93 0.06 115.11 120.58 2f3u h GLN 114 Ca 0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.83 2f3u h GLN 114 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2f3u h GLN 114 CO -0.06 0.07 0.00 1.28 -0.67 0.00 0.00 178.83 179.46 2f3u n LEU 115 N -3.49 1.27 -0.13 1.46 4.32 -0.63 -4.91 117.00 114.89 2f3u n LEU 115 Ca -0.02 -0.46 -0.01 0.00 -0.02 0.00 0.00 56.01 55.50 2f3u n LEU 115 Cb 0.21 -0.03 -0.00 0.00 -1.62 0.00 0.00 43.42 41.98 2f3u n LEU 115 CO 0.28 0.23 -0.02 0.61 -1.22 0.00 0.00 177.39 177.27 2f3u n GLY 116 N 1.12 0.33 3.27 -0.72 0.00 0.01 -5.06 105.19 104.15 2f3u n GLY 116 Ca 0.19 -0.86 -0.25 0.00 0.00 0.00 0.00 46.02 45.10 2f3u n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2f3u s LEU 117 N -0.34 2.23 -0.43 0.99 1.43 0.30 -5.01 118.68 117.85 2f3u s LEU 117 Ca 0.00 -0.60 -0.16 0.00 -1.03 0.00 0.00 54.13 52.34 2f3u s LEU 117 Cb 0.00 -0.95 0.03 0.00 0.03 0.00 0.00 46.19 45.30 2f3u s LEU 117 CO 0.00 0.12 0.38 -0.62 0.23 0.00 0.00 176.35 176.46 2f3u s ASP 118 N -1.53 6.15 0.35 2.29 3.68 -1.26 -3.28 116.67 123.07 2f3u s ASP 118 Ca 0.07 -0.87 0.05 0.00 2.13 0.00 0.00 52.55 53.93 2f3u s ASP 118 Cb -0.09 -2.19 0.72 0.00 -1.45 0.00 0.00 42.92 39.90 2f3u s ASP 118 CO 0.03 -0.54 1.95 -0.03 0.13 0.00 0.00 175.17 176.71 2f3u h MET 119 N 8.70 0.76 -0.34 4.34 1.85 -1.91 -1.62 114.93 126.72 2f3u h MET 119 Ca -0.27 -0.05 -0.03 0.00 -0.61 0.00 0.00 59.70 58.75 2f3u h MET 119 Cb 1.11 -0.17 -0.02 0.00 0.43 0.00 0.00 31.60 32.95 2f3u h MET 119 CO 0.78 0.51 0.10 0.93 -0.40 0.00 0.00 176.91 178.83 2f3u h GLU 120 N 0.79 0.48 -0.46 0.39 5.08 -1.99 -0.09 114.58 118.78 2f3u h GLU 120 Ca 0.33 -0.07 -0.14 0.00 -1.00 0.00 0.00 59.36 58.48 2f3u h GLU 120 Cb 0.27 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 2f3u h GLU 120 CO -0.11 0.44 -0.25 1.49 -1.00 0.00 0.00 179.01 179.58 2f3u h GLU 121 N 0.48 0.98 -0.23 2.33 4.81 -1.73 -2.92 114.58 118.30 2f3u h GLU 121 Ca 0.12 -0.44 -0.12 0.00 -0.13 0.00 0.00 59.36 58.79 2f3u h GLU 121 Cb 0.16 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 2f3u h GLU 121 CO -0.01 1.11 -0.37 -0.07 -0.73 0.00 0.00 179.01 178.94 2f3u h LEU 122 N 0.84 0.53 -1.47 1.64 4.07 -0.98 -3.00 115.31 116.95 2f3u h LEU 122 Ca 0.10 -0.22 -0.05 0.00 0.08 0.00 0.00 57.88 57.79 2f3u h LEU 122 Cb 0.83 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 42.41 2f3u h LEU 122 CO 0.07 0.86 -0.19 -0.33 -1.08 0.00 0.00 178.44 177.77 2f3u h GLU 123 N 0.43 0.11 0.00 1.13 5.08 -0.90 -2.26 114.58 118.17 2f3u h GLU 123 Ca 0.04 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2f3u h GLU 123 Cb 0.84 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.08 2f3u h GLU 123 CO 0.07 0.30 0.00 0.39 -1.00 0.00 0.00 179.01 178.77 2f3u n GLU 124 N -4.27 0.05 0.10 2.33 -0.58 -1.12 -2.88 120.64 114.27 2f3u n GLU 124 Ca -0.02 0.27 -0.01 0.00 -0.42 0.00 0.00 57.16 56.99 2f3u n GLU 124 Cb 0.28 -1.59 -0.03 0.00 -0.57 0.00 0.00 31.44 29.53 2f3u n GLU 124 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 2f3u h ILE 125 N 0.00 1.02 -3.54 -3.67 2.04 -1.49 -3.46 117.51 108.40 2f3u h ILE 125 Ca 0.00 -2.49 -0.53 0.00 1.00 0.00 0.00 64.86 62.84 2f3u h ILE 125 Cb 0.31 2.47 0.06 0.00 -0.74 0.00 0.00 36.82 38.92 2f3u h ILE 125 CO 0.00 0.58 0.73 -0.70 0.00 0.00 0.00 178.15 178.77 2f3u s GLU 126 N -2.88 4.27 0.33 2.37 2.12 -1.14 -5.00 118.70 118.77 2f3u s GLU 126 Ca 0.02 2.31 -0.24 0.00 0.36 0.00 0.00 54.97 57.42 2f3u s GLU 126 Cb 0.08 -3.09 -0.10 0.00 0.26 0.00 0.00 34.13 31.29 2f3u s GLU 126 CO 0.78 -0.38 0.91 -1.21 -0.54 0.00 0.00 175.26 174.82 2f3u s GLU 127 N -0.84 4.48 0.42 4.30 0.41 -1.26 -4.97 118.70 121.24 2f3u s GLU 127 Ca 0.56 1.23 -0.24 0.00 -0.41 0.00 0.00 54.97 56.11 2f3u s GLU 127 Cb -0.42 -2.70 -0.08 0.00 -1.78 0.00 0.00 34.13 29.15 2f3u s GLU 127 CO 0.47 0.24 1.10 -0.51 -0.49 0.00 0.00 175.26 176.07 2f3u s ASP 128 N -1.72 6.54 -0.82 -0.19 1.11 -1.26 -4.60 116.67 115.73 2f3u s ASP 128 Ca 0.51 2.15 -0.18 0.00 0.18 0.00 0.00 52.55 55.21 2f3u s ASP 128 Cb -0.17 -2.59 0.14 0.00 1.07 0.00 0.00 42.92 41.37 2f3u s ASP 128 CO 0.22 -0.65 0.95 0.00 1.18 0.00 0.00 175.17 176.87 2f3u s ALA 129 N -1.60 3.51 -1.09 5.23 0.00 -0.62 -4.89 121.76 122.30 2f3u s ALA 129 Ca 0.60 -2.71 -0.03 0.00 0.00 0.00 0.00 51.96 49.82 2f3u s ALA 129 Cb -0.25 -3.82 0.21 0.00 0.00 0.00 0.00 23.12 19.26 2f3u s ALA 129 CO 0.31 -2.69 2.17 0.41 0.00 0.00 0.00 175.76 175.96 2f3u n GLY 130 N 5.11 5.53 1.91 0.00 0.00 -1.26 -2.07 105.19 114.41 2f3u n GLY 130 Ca 0.13 -2.28 -0.16 0.00 0.00 0.00 0.00 46.02 43.71 2f3u n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2f3u n LEU 131 N 0.77 6.33 -3.72 0.99 4.77 -1.22 -0.79 117.00 124.13 2f3u n LEU 131 Ca 0.55 -3.27 -0.08 0.00 -0.03 0.00 0.00 56.01 53.17 2f3u n LEU 131 Cb 0.28 -1.09 -0.02 0.00 -2.33 0.00 0.00 43.42 40.26 2f3u n LEU 131 CO 0.58 1.26 0.48 -0.83 -1.33 0.00 0.00 177.39 177.55 2f3u s GLY 132 N 0.43 -0.26 -0.20 -0.72 0.00 -1.26 -0.67 107.32 104.64 2f3u s GLY 132 Ca 0.31 -0.01 -0.01 0.00 0.00 0.00 0.00 44.72 45.01 2f3u s GLY 132 CO -0.02 0.00 0.03 0.70 0.00 0.00 0.00 173.10 173.81 2f3u n ASN 133 N -0.43 1.97 0.00 1.64 3.02 -1.26 -4.45 115.26 115.75 2f3u n ASN 133 Ca -0.08 0.01 0.00 0.00 -0.03 0.00 0.00 54.58 54.48 2f3u n ASN 133 Cb 0.61 -0.55 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 2f3u n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2f3u n GLY 134 N 2.13 0.84 0.22 7.41 0.00 -1.26 -4.92 105.19 109.61 2f3u n GLY 134 Ca -0.40 0.40 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 2f3u n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2f3u h GLY 135 N 0.00 0.76 0.93 -0.02 0.00 -1.98 -0.46 103.07 102.30 2f3u h GLY 135 Ca 0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 2f3u h GLY 135 CO 0.00 -0.01 0.09 -2.00 0.00 0.00 0.00 176.54 174.62 2f3u h LEU 136 N 0.37 0.22 -0.76 3.11 5.85 -1.98 -0.16 115.31 121.96 2f3u h LEU 136 Ca 0.28 -0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.80 2f3u h LEU 136 Cb 0.33 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 2f3u h LEU 136 CO -0.29 0.25 -0.15 1.23 -0.34 0.00 0.00 178.44 179.14 2f3u h GLY 137 N 0.17 0.85 1.47 3.75 0.00 -1.77 -2.83 103.07 104.71 2f3u h GLY 137 Ca 0.06 -0.67 -0.14 0.00 0.00 0.00 0.00 47.33 46.58 2f3u h GLY 137 CO -0.01 0.62 -0.41 -0.09 0.00 0.00 0.00 176.54 176.65 2f3u h ARG 138 N 0.70 0.59 -0.82 4.80 1.12 -0.94 -0.99 114.38 118.83 2f3u h ARG 138 Ca 0.11 -0.30 0.00 0.00 -1.11 0.00 0.00 59.98 58.68 2f3u h ARG 138 Cb 0.65 0.01 -0.04 0.00 -0.01 0.00 0.00 29.97 30.57 2f3u h ARG 138 CO 0.05 0.89 0.53 1.25 -3.11 0.00 0.00 179.97 179.57 2f3u h LEU 139 N 0.48 0.96 -0.95 3.80 5.85 -0.89 -0.22 115.31 124.34 2f3u h LEU 139 Ca 0.04 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 2f3u h LEU 139 Cb 0.91 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.66 2f3u h LEU 139 CO 0.08 0.71 0.56 0.00 -0.34 0.00 0.00 178.44 179.46 2f3u h ALA 140 N 1.29 1.21 -0.29 1.25 0.00 -1.29 0.75 119.26 122.18 2f3u h ALA 140 Ca 0.30 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 2f3u h ALA 140 Cb -0.10 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.30 2f3u h ALA 140 CO -0.06 0.67 -0.03 0.00 0.00 0.00 0.00 179.25 179.83 2f3u h ALA 141 N 1.31 0.40 -0.75 0.00 0.00 -1.04 -1.63 119.26 117.56 2f3u h ALA 141 Ca 0.34 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 2f3u h ALA 141 Cb -0.05 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2f3u h ALA 141 CO -0.06 0.17 0.26 0.00 0.00 0.00 0.00 179.25 179.63 2f3u h PHE 143 N 1.10 1.09 -0.76 0.00 -1.00 -0.69 -1.33 116.94 115.36 2f3u h PHE 143 Ca 0.25 -0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.99 2f3u h PHE 143 Cb 0.27 -0.35 -0.04 0.00 3.61 0.00 0.00 35.95 39.44 2f3u h PHE 143 CO 0.02 0.75 0.41 -0.07 -1.61 0.00 0.00 178.31 177.81 2f3u h LEU 144 N 1.12 0.95 -0.19 1.54 3.38 -1.03 0.75 115.31 121.82 2f3u h LEU 144 Ca 0.29 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 2f3u h LEU 144 Cb -0.00 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2f3u h LEU 144 CO -0.05 0.78 0.12 -0.78 0.09 0.00 0.00 178.44 178.60 2f3u h ASP 145 N 1.05 0.23 -0.49 -0.43 3.58 -1.17 -2.30 116.42 116.90 2f3u h ASP 145 Ca 0.27 -0.05 -0.09 0.00 0.42 0.00 0.00 57.03 57.58 2f3u h ASP 145 Cb 0.04 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.01 2f3u h ASP 145 CO -0.04 0.21 -0.04 0.28 -2.88 0.00 0.00 179.24 176.77 2f3u h SER 146 N 0.23 0.91 -0.29 2.28 0.02 -0.88 -1.45 113.55 114.38 2f3u h SER 146 Ca 0.07 -0.26 -0.06 0.00 -0.84 0.00 0.00 61.79 60.70 2f3u h SER 146 Cb 0.02 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 2f3u h SER 146 CO -0.01 0.99 -0.00 0.24 -1.14 0.00 0.00 176.83 176.90 2f3u h MET 147 N 0.85 0.62 -0.20 3.45 2.86 -0.71 0.26 114.93 122.06 2f3u h MET 147 Ca 0.15 -0.15 -0.21 0.00 -2.06 0.00 0.00 59.70 57.44 2f3u h MET 147 Cb 0.55 -0.08 0.01 0.00 0.06 0.00 0.00 31.60 32.14 2f3u h MET 147 CO 0.03 0.65 -0.69 0.00 1.06 0.00 0.00 176.91 177.96 2f3u h ALA 148 N 1.41 0.40 0.00 6.32 0.00 -1.24 -0.96 119.26 125.19 2f3u h ALA 148 Ca 0.12 -0.57 -0.06 0.00 0.00 0.00 0.00 54.91 54.40 2f3u h ALA 148 Cb 0.38 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2f3u h ALA 148 CO 0.01 0.69 -0.30 1.15 0.00 0.00 0.00 179.25 180.80 2f3u h THR 149 N 0.57 1.02 -0.56 0.00 2.02 -0.84 -2.58 112.91 112.54 2f3u h THR 149 Ca -0.03 -1.10 0.00 0.00 0.77 0.00 0.00 66.41 66.06 2f3u h THR 149 Cb 1.30 1.62 0.00 0.00 -1.74 0.00 0.00 68.15 69.34 2f3u h THR 149 CO 0.14 0.29 0.00 0.18 0.37 0.00 0.00 175.52 176.51 2f3u n LEU 150 N -3.90 4.72 -2.64 2.58 4.77 0.04 -4.73 117.00 117.84 2f3u n LEU 150 Ca -0.02 -2.39 -0.20 0.00 -0.03 0.00 0.00 56.01 53.38 2f3u n LEU 150 Cb 0.37 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.87 2f3u n LEU 150 CO 0.36 0.67 -0.16 0.61 -1.33 0.00 0.00 177.39 177.54 2f3u n GLY 151 N 0.85 -0.51 3.82 -0.72 0.00 -0.97 -0.06 105.19 107.60 2f3u n GLY 151 Ca 0.24 0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.93 2f3u n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2f3u s LEU 152 N -6.17 4.45 -1.33 0.99 1.43 -0.38 -4.69 118.68 112.97 2f3u s LEU 152 Ca 0.11 1.24 -0.17 0.00 -1.03 0.00 0.00 54.13 54.27 2f3u s LEU 152 Cb -0.05 -3.11 0.05 0.00 0.03 0.00 0.00 46.19 43.11 2f3u s LEU 152 CO 0.13 0.19 1.87 0.00 0.23 0.00 0.00 176.35 178.77 2f3u n ALA 153 N 1.30 3.99 -2.59 4.21 0.00 -1.26 -4.66 120.51 121.49 2f3u n ALA 153 Ca -0.08 -3.82 -0.30 0.00 0.00 0.00 0.00 53.44 49.24 2f3u n ALA 153 Cb 0.51 -3.59 -0.10 0.00 0.00 0.00 0.00 19.45 16.27 2f3u n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2f3u s ALA 154 N 4.22 3.01 -0.05 0.00 0.00 -1.26 -1.30 121.76 126.37 2f3u s ALA 154 Ca 0.53 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 51.33 2f3u s ALA 154 Cb 0.07 -0.98 0.01 0.00 0.00 0.00 0.00 23.12 22.22 2f3u s ALA 154 CO 0.04 0.64 -0.09 0.71 0.00 0.00 0.00 175.76 177.06 2f3u s TYR 155 N -1.17 1.14 -0.15 0.00 2.02 0.34 -4.07 117.35 115.46 2f3u s TYR 155 Ca 0.21 -0.38 -0.14 0.00 -0.37 0.00 0.00 57.07 56.39 2f3u s TYR 155 Cb -0.11 -0.87 -0.05 0.00 -0.40 0.00 0.00 41.96 40.53 2f3u s TYR 155 CO 0.13 -0.22 0.30 0.20 -1.57 0.00 0.00 175.55 174.39 2f3u s GLY 156 N 0.67 2.22 -0.10 0.71 0.00 -0.84 -1.16 107.32 108.82 2f3u s GLY 156 Ca -0.12 -0.44 0.02 0.00 0.00 0.00 0.00 44.72 44.18 2f3u s GLY 156 CO 0.02 0.42 -0.17 -0.19 0.00 0.00 0.00 173.10 173.19 2f3u s TYR 157 N 0.41 2.00 0.00 1.90 2.02 -0.64 0.12 117.35 123.15 2f3u s TYR 157 Ca 0.17 -0.87 0.00 0.00 -0.37 0.00 0.00 57.07 56.00 2f3u s TYR 157 Cb -0.13 -1.41 0.00 0.00 -0.40 0.00 0.00 41.96 40.02 2f3u s TYR 157 CO 0.04 -0.42 0.00 0.41 -1.57 0.00 0.00 175.55 174.01 2f3u n GLY 158 N 3.96 3.61 3.39 0.71 0.00 -0.80 -2.22 105.19 113.84 2f3u n GLY 158 Ca -0.20 -0.71 -0.32 0.00 0.00 0.00 0.00 46.02 44.79 2f3u n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2f3u s ILE 159 N -1.49 2.66 -0.95 -0.61 1.01 -1.26 -0.97 121.20 119.58 2f3u s ILE 159 Ca 0.00 -0.86 -0.19 0.00 0.00 0.00 0.00 60.65 59.60 2f3u s ILE 159 Cb 0.00 -2.02 0.13 0.00 0.01 0.00 0.00 42.46 40.58 2f3u s ILE 159 CO 0.00 0.58 1.17 -0.60 0.00 0.00 0.00 174.94 176.09 2f3u s ARG 160 N -0.49 3.63 0.28 2.79 3.52 -0.12 -4.75 118.95 123.81 2f3u s ARG 160 Ca 0.06 -1.76 -0.29 0.00 -0.13 0.00 0.00 55.73 53.60 2f3u s ARG 160 Cb -0.12 -4.96 -0.10 0.00 -1.56 0.00 0.00 34.95 28.22 2f3u s ARG 160 CO 0.01 -1.80 1.24 0.71 -0.81 0.00 0.00 175.30 174.65 2f3u s TYR 161 N 2.79 3.28 0.21 5.12 2.02 -1.26 -4.76 117.35 124.75 2f3u s TYR 161 Ca 0.34 1.46 0.04 0.00 -0.37 0.00 0.00 57.07 58.54 2f3u s TYR 161 Cb -0.04 -3.53 0.17 0.00 -0.40 0.00 0.00 41.96 38.16 2f3u s TYR 161 CO -0.09 -1.42 1.50 1.49 -1.57 0.00 0.00 175.55 175.46 2f3u h GLU 162 N 4.05 0.23 -4.53 -0.62 4.81 -0.81 -3.41 114.58 114.31 2f3u h GLU 162 Ca -0.47 -0.18 -0.58 0.00 -0.13 0.00 0.00 59.36 58.00 2f3u h GLU 162 Cb 1.22 0.04 -0.36 0.00 0.63 0.00 0.00 28.75 30.27 2f3u h GLU 162 CO 0.69 0.83 -0.82 -0.06 -0.73 0.00 0.00 179.01 178.92 2f3u s PHE 163 N -3.59 1.92 0.00 0.92 0.40 -0.10 -4.37 117.98 113.17 2f3u s PHE 163 Ca -0.04 -1.04 0.00 0.00 -0.60 0.00 0.00 56.93 55.26 2f3u s PHE 163 Cb 0.11 -1.46 0.00 0.00 0.51 0.00 0.00 43.02 42.18 2f3u s PHE 163 CO 0.81 -0.60 0.00 0.41 0.70 0.00 0.00 175.22 176.53 2f3u n GLY 164 N 4.78 0.45 3.72 4.36 0.00 -1.22 -2.04 105.19 115.24 2f3u n GLY 164 Ca -0.16 -1.72 -0.43 0.00 0.00 0.00 0.00 46.02 43.72 2f3u n GLY 164 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2f3u n ILE 165 N 0.00 1.02 -1.65 -0.61 0.13 0.03 -4.57 119.36 113.70 2f3u n ILE 165 Ca 0.00 -0.26 -0.37 0.00 -1.10 0.00 0.00 62.75 61.02 2f3u n ILE 165 Cb 0.00 -1.79 0.06 0.00 -0.84 0.00 0.00 39.64 37.07 2f3u n ILE 165 CO 0.00 0.00 0.00 2.22 2.80 0.00 0.00 176.55 181.57 2f3u n PHE 166 N 2.02 1.21 -2.87 9.51 1.16 -1.26 -4.56 117.46 122.67 2f3u n PHE 166 Ca 0.09 0.43 -0.41 0.00 -1.87 0.00 0.00 57.45 55.70 2f3u n PHE 166 Cb 0.35 -2.18 -0.04 0.00 -1.61 0.00 0.00 39.48 35.99 2f3u n PHE 166 CO 0.00 0.00 0.00 -0.80 -1.87 0.00 0.00 176.76 174.09 2f3u s ASN 167 N -1.29 7.30 -0.19 5.98 0.01 -0.24 -4.88 114.94 121.62 2f3u s ASN 167 Ca 0.78 1.55 -0.14 0.00 -0.71 0.00 0.00 52.86 54.34 2f3u s ASN 167 Cb -0.40 -2.51 -0.04 0.00 0.41 0.00 0.00 41.25 38.70 2f3u s ASN 167 CO 0.45 -0.07 0.33 -1.58 -1.51 0.00 0.00 177.10 174.72 2f3u s GLN 168 N 0.24 4.19 0.02 -0.60 0.74 -1.26 -1.86 119.66 121.13 2f3u s GLN 168 Ca 0.43 0.10 0.07 0.00 0.05 0.00 0.00 55.36 56.01 2f3u s GLN 168 Cb -0.21 -3.50 -0.03 0.00 1.10 0.00 0.00 33.01 30.37 2f3u s GLN 168 CO 0.25 0.07 -0.19 0.15 -0.55 0.00 0.00 175.29 175.02 2f3u s LYS 169 N 1.00 2.12 -0.28 1.67 -0.14 -0.23 -3.81 119.74 120.07 2f3u s LYS 169 Ca 0.17 -0.94 -0.06 0.00 -1.36 0.00 0.00 55.97 53.78 2f3u s LYS 169 Cb -0.14 -2.19 0.01 0.00 -1.68 0.00 0.00 37.83 33.83 2f3u s LYS 169 CO 0.06 0.55 0.05 0.42 -0.76 0.00 0.00 175.35 175.67 2f3u s ILE 170 N -0.86 3.75 -0.17 2.17 -1.09 -1.26 0.30 121.20 124.05 2f3u s ILE 170 Ca 0.13 -0.71 0.01 0.00 -2.23 0.00 0.00 60.65 57.85 2f3u s ILE 170 Cb -0.10 -2.90 0.02 0.00 -1.58 0.00 0.00 42.46 37.89 2f3u s ILE 170 CO 0.04 0.14 -0.16 0.00 -1.23 0.00 0.00 174.94 173.72 2f3u n GLY 172 N 4.70 -0.43 2.55 0.00 0.00 -1.26 -0.90 105.19 109.84 2f3u n GLY 172 Ca -0.18 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2f3u n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f3u n GLY 173 N -1.02 0.85 3.68 -0.02 0.00 -1.26 -5.03 105.19 102.39 2f3u n GLY 173 Ca -0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 2f3u n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2f3u s TRP 174 N -3.35 2.98 0.07 1.61 0.52 -0.08 -3.70 118.94 116.99 2f3u s TRP 174 Ca 0.00 -0.03 -0.30 0.00 0.02 0.00 0.00 56.10 55.79 2f3u s TRP 174 Cb 0.00 -1.53 -0.05 0.00 -1.15 0.00 0.00 33.47 30.74 2f3u s TRP 174 CO 0.00 0.48 1.05 -1.14 0.02 0.00 0.00 176.95 177.36 2f3u s GLN 175 N -2.32 4.57 -0.03 4.98 0.74 -1.26 -0.10 119.66 126.25 2f3u s GLN 175 Ca 0.26 1.56 0.07 0.00 0.05 0.00 0.00 55.36 57.30 2f3u s GLN 175 Cb -0.12 -3.38 -0.02 0.00 1.10 0.00 0.00 33.01 30.60 2f3u s GLN 175 CO 0.18 -0.01 -0.24 -1.64 -0.55 0.00 0.00 175.29 173.04 2f3u s MET 176 N 0.52 2.03 -0.07 1.67 -1.94 0.15 -4.91 119.30 116.76 2f3u s MET 176 Ca 0.52 -0.84 -0.02 0.00 -1.71 0.00 0.00 55.69 53.64 2f3u s MET 176 Cb -0.25 -1.90 -0.03 0.00 2.01 0.00 0.00 34.83 34.66 2f3u s MET 176 CO 0.30 0.47 0.02 -1.21 -0.01 0.00 0.00 175.02 174.59 2f3u s GLU 177 N -0.44 3.00 0.01 2.03 8.01 -1.26 -1.06 118.70 128.99 2f3u s GLU 177 Ca 0.06 -0.42 0.00 0.00 0.01 0.00 0.00 54.97 54.62 2f3u s GLU 177 Cb -0.10 -2.82 -0.01 0.00 -4.31 0.00 0.00 34.13 26.89 2f3u s GLU 177 CO 0.00 0.69 -0.03 -1.83 0.01 0.00 0.00 175.26 174.11 2f3u s GLU 178 N -1.10 0.22 0.25 1.61 -1.05 -0.78 -4.99 118.70 112.86 2f3u s GLU 178 Ca 0.16 -0.34 -0.31 0.00 -0.15 0.00 0.00 54.97 54.33 2f3u s GLU 178 Cb -0.11 -0.03 -0.14 0.00 -0.44 0.00 0.00 34.13 33.41 2f3u s GLU 178 CO 0.05 -0.00 1.33 0.00 0.95 0.00 0.00 175.26 177.58 2f3u n ALA 179 N 2.32 0.77 -3.09 -0.84 0.00 -1.26 -1.08 120.51 117.33 2f3u n ALA 179 Ca -0.18 0.41 -0.45 0.00 0.00 0.00 0.00 53.44 53.23 2f3u n ALA 179 Cb 0.57 -2.22 -0.01 0.00 0.00 0.00 0.00 19.45 17.80 2f3u n ALA 179 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2f3u s ASP 180 N 0.11 6.98 -1.50 0.00 3.68 -1.26 -4.66 116.67 120.01 2f3u s ASP 180 Ca 0.66 -2.86 -0.09 0.00 2.13 0.00 0.00 52.55 52.40 2f3u s ASP 180 Cb -0.67 -2.33 0.00 0.00 -1.45 0.00 0.00 42.92 38.47 2f3u s ASP 180 CO 0.52 -0.69 2.64 -0.67 0.13 0.00 0.00 175.17 177.10 2f3u n ASP 181 N 4.95 7.68 0.21 -0.34 2.03 -1.26 -3.45 116.55 126.37 2f3u n ASP 181 Ca 0.27 -2.80 0.15 0.00 0.52 0.00 0.00 54.79 52.93 2f3u n ASP 181 Cb 0.44 -1.51 0.73 0.00 -0.72 0.00 0.00 41.12 40.06 2f3u n ASP 181 CO 0.00 0.00 0.00 4.11 -1.92 0.00 0.00 177.20 179.39 2f3u h TRP 182 N 5.07 0.00 -0.02 -0.67 5.08 -1.91 -2.38 115.95 121.12 2f3u h TRP 182 Ca 0.76 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.73 2f3u h TRP 182 Cb 0.36 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.52 2f3u h TRP 182 CO 1.71 0.00 -0.05 1.28 -1.28 0.00 0.00 178.44 180.10 2f3u n LEU 183 N -2.55 2.30 -0.35 0.11 4.77 -1.26 -4.60 117.00 115.42 2f3u n LEU 183 Ca -0.01 -0.77 -0.02 0.00 -0.03 0.00 0.00 56.01 55.18 2f3u n LEU 183 Cb 0.11 -0.01 0.03 0.00 -2.33 0.00 0.00 43.42 41.23 2f3u n LEU 183 CO 0.16 0.39 0.59 -0.09 -1.33 0.00 0.00 177.39 177.11 2f3u h ARG 184 N 3.54 -0.03 -0.30 3.23 2.43 -1.81 0.86 114.38 122.30 2f3u h ARG 184 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2f3u h ARG 184 Cb 0.78 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 2f3u h ARG 184 CO 0.00 -0.02 0.00 0.66 -1.51 0.00 0.00 179.97 179.10 2f3u n TYR 185 N -5.46 0.39 0.00 2.20 4.01 -1.26 -5.04 117.16 112.00 2f3u n TYR 185 Ca 0.09 -0.20 0.00 0.00 -0.16 0.00 0.00 57.90 57.63 2f3u n TYR 185 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.42 2f3u n TYR 185 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2f3u n GLY 186 N 1.20 0.86 2.90 2.72 0.00 0.29 -4.95 105.19 108.21 2f3u n GLY 186 Ca 0.16 -1.79 -0.30 0.00 0.00 0.00 0.00 46.02 44.08 2f3u n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2f3u s ASN 187 N -1.12 4.22 0.43 1.61 2.47 -1.26 -4.86 114.94 116.43 2f3u s ASN 187 Ca 0.00 -1.66 0.30 0.00 0.42 0.00 0.00 52.86 51.91 2f3u s ASN 187 Cb 0.00 -1.22 1.29 0.00 -1.45 0.00 0.00 41.25 39.87 2f3u s ASN 187 CO 0.00 -0.35 1.89 1.55 -3.72 0.00 0.00 177.10 176.47 2f3u h PRO 188 N 7.88 0.00 0.03 0.43 0.13 -1.99 -3.22 132.00 135.27 2f3u h PRO 188 Ca -0.12 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.79 2f3u h PRO 188 Cb 1.04 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.14 2f3u h PRO 188 CO 0.47 0.00 -1.07 -1.49 -0.23 0.00 0.00 178.00 175.68 2f3u h TRP 189 N 0.00 0.10 -3.91 1.56 4.06 -1.95 -3.47 115.95 112.35 2f3u h TRP 189 Ca 0.00 -0.07 -0.49 0.00 2.06 0.00 0.00 58.89 60.38 2f3u h TRP 189 Cb 0.38 -0.00 0.02 0.00 -1.00 0.00 0.00 29.16 28.55 2f3u h TRP 189 CO 0.00 1.06 0.23 -1.83 -3.56 0.00 0.00 178.44 174.34 2f3u s GLU 190 N -2.70 3.76 -0.20 0.49 -1.05 -1.22 -4.33 118.70 113.46 2f3u s GLU 190 Ca -0.00 0.60 -0.02 0.00 -0.15 0.00 0.00 54.97 55.40 2f3u s GLU 190 Cb 0.09 -2.28 0.06 0.00 -0.44 0.00 0.00 34.13 31.56 2f3u s GLU 190 CO 0.83 -0.20 -0.00 0.21 0.95 0.00 0.00 175.26 177.05 2f3u s LYS 191 N -4.22 1.01 0.33 -4.83 2.47 0.48 -4.94 119.74 110.04 2f3u s LYS 191 Ca 0.53 -0.58 -0.29 0.00 -1.56 0.00 0.00 55.97 54.08 2f3u s LYS 191 Cb -0.10 -2.20 -0.11 0.00 -1.46 0.00 0.00 37.83 33.96 2f3u s LYS 191 CO 0.36 -0.60 1.42 0.00 0.16 0.00 0.00 175.35 176.70 2f3u s ALA 192 N 1.71 3.57 -0.51 3.13 0.00 -1.26 -1.24 121.76 127.15 2f3u s ALA 192 Ca -0.02 1.41 0.07 0.00 0.00 0.00 0.00 51.96 53.42 2f3u s ALA 192 Cb -0.17 -3.55 0.35 0.00 0.00 0.00 0.00 23.12 19.74 2f3u s ALA 192 CO -0.07 -0.83 0.89 0.54 0.00 0.00 0.00 175.76 176.29 2f3u n ARG 193 N 1.05 2.56 0.24 0.00 5.12 0.01 -4.92 116.66 120.72 2f3u n ARG 193 Ca 0.02 -4.39 0.17 0.00 -1.93 0.00 0.00 57.85 51.72 2f3u n ARG 193 Cb 0.40 -2.07 0.74 0.00 -1.16 0.00 0.00 32.46 30.38 2f3u n ARG 193 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2f3u h PRO 194 N 2.97 0.00 0.00 5.56 0.13 -1.93 -0.08 132.00 138.64 2f3u h PRO 194 Ca 0.12 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2f3u h PRO 194 Cb 0.67 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.80 2f3u h PRO 194 CO 0.72 0.00 -0.02 1.05 -0.23 0.00 0.00 178.00 179.52 2f3u h GLU 195 N 0.00 0.00 -0.51 0.86 9.09 -1.94 -2.81 114.58 119.27 2f3u h GLU 195 Ca 0.08 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.47 2f3u h GLU 195 Cb 0.93 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.02 2f3u h GLU 195 CO -0.00 0.02 0.02 1.19 0.05 0.00 0.00 179.01 180.29 2f3u n PHE 196 N -3.13 1.84 -1.81 2.06 3.72 -0.04 -5.00 117.46 115.10 2f3u n PHE 196 Ca 0.00 -0.81 -0.41 0.00 -0.05 0.00 0.00 57.45 56.18 2f3u n PHE 196 Cb 0.28 -0.48 -0.01 0.00 -0.94 0.00 0.00 39.48 38.33 2f3u n PHE 196 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2f3u s THR 197 N -2.81 2.13 0.10 4.37 2.01 -1.06 -4.68 115.64 115.69 2f3u s THR 197 Ca 0.52 0.11 0.08 0.00 0.31 0.00 0.00 61.69 62.71 2f3u s THR 197 Cb 0.40 -3.07 -0.03 0.00 0.01 0.00 0.00 72.50 69.81 2f3u s THR 197 CO 0.14 0.02 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.12 2f3u s LEU 198 N -0.67 2.29 0.14 4.42 1.02 -0.28 -4.92 118.68 120.67 2f3u s LEU 198 Ca 0.62 -0.67 -0.18 0.00 0.02 0.00 0.00 54.13 53.91 2f3u s LEU 198 Cb -0.47 -0.91 -0.07 0.00 0.02 0.00 0.00 46.19 44.75 2f3u s LEU 198 CO 0.49 0.08 0.62 -2.16 0.02 0.00 0.00 176.35 175.40 2f3u s PRO 199 N -1.84 4.18 -0.04 1.29 0.04 -1.26 0.68 135.00 138.04 2f3u s PRO 199 Ca 0.07 0.73 0.05 0.00 0.04 0.00 0.00 61.00 61.89 2f3u s PRO 199 Cb -0.10 -3.05 -0.01 0.00 0.04 0.00 0.00 34.50 31.38 2f3u s PRO 199 CO 0.04 0.52 -0.19 0.08 0.04 0.00 0.00 177.00 177.50 2f3u s VAL 200 N -1.33 1.54 0.01 -0.36 1.01 0.75 -4.85 120.40 117.16 2f3u s VAL 200 Ca 0.36 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 2f3u s VAL 200 Cb -0.18 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 2f3u s VAL 200 CO 0.20 0.44 0.11 -1.00 0.00 0.00 0.00 175.10 174.85 2f3u s HIS 201 N -0.03 3.35 0.04 5.22 3.76 -1.26 -0.95 115.29 125.41 2f3u s HIS 201 Ca -0.03 0.23 -0.01 0.00 -0.15 0.00 0.00 55.06 55.10 2f3u s HIS 201 Cb -0.12 -1.75 -0.03 0.00 1.11 0.00 0.00 32.58 31.80 2f3u s HIS 201 CO 0.02 0.57 -0.02 -0.06 -0.85 0.00 0.00 174.74 174.41 2f3u s PHE 202 N -1.26 0.39 0.00 1.40 0.40 -0.32 -4.96 117.98 113.62 2f3u s PHE 202 Ca 0.25 -0.81 0.00 0.00 -0.60 0.00 0.00 56.93 55.77 2f3u s PHE 202 Cb -0.12 -0.29 0.00 0.00 0.51 0.00 0.00 43.02 43.12 2f3u s PHE 202 CO 0.17 -0.31 0.00 0.66 0.70 0.00 0.00 175.22 176.44 2f3u n TYR 203 N 0.72 0.00 -4.33 0.36 4.01 0.01 -0.57 117.16 117.38 2f3u n TYR 203 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 2f3u n TYR 203 Cb 0.59 0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.64 2f3u n TYR 203 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2f3u n GLY 204 N 0.00 -0.68 3.46 2.72 0.00 -1.19 -4.61 105.19 104.88 2f3u n GLY 204 Ca 0.00 -1.15 -0.09 0.00 0.00 0.00 0.00 46.02 44.78 2f3u n GLY 204 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2f3u s ARG 205 N 0.00 1.31 -0.17 1.61 1.70 0.02 -4.87 118.95 118.55 2f3u s ARG 205 Ca 0.00 -0.99 -0.10 0.00 -0.47 0.00 0.00 55.73 54.17 2f3u s ARG 205 Cb 0.00 0.47 -0.05 0.00 -0.57 0.00 0.00 34.95 34.80 2f3u s ARG 205 CO 0.00 -0.53 0.16 0.08 -1.08 0.00 0.00 175.30 173.93 2f3u s VAL 206 N -3.91 5.41 -0.17 4.99 1.01 -1.26 -1.06 120.40 125.40 2f3u s VAL 206 Ca 0.12 0.26 -0.00 0.00 0.00 0.00 0.00 61.98 62.36 2f3u s VAL 206 Cb 0.01 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.90 2f3u s VAL 206 CO -0.01 0.47 -0.15 -0.70 0.00 0.00 0.00 175.10 174.71 2f3u s GLU 207 N 0.08 3.18 -0.44 2.72 2.12 0.14 -4.95 118.70 121.56 2f3u s GLU 207 Ca 0.11 -0.75 -0.17 0.00 0.36 0.00 0.00 54.97 54.52 2f3u s GLU 207 Cb -0.12 -2.67 0.03 0.00 0.26 0.00 0.00 34.13 31.64 2f3u s GLU 207 CO 0.00 -0.07 0.43 -1.01 -0.54 0.00 0.00 175.26 174.08 2f3u s HIS 208 N 1.04 3.18 0.19 5.30 3.76 -1.26 0.27 115.29 127.76 2f3u s HIS 208 Ca -0.01 -0.51 0.03 0.00 -0.15 0.00 0.00 55.06 54.42 2f3u s HIS 208 Cb -0.15 -2.97 0.03 0.00 1.11 0.00 0.00 32.58 30.60 2f3u s HIS 208 CO -0.04 -0.74 0.23 0.25 -0.85 0.00 0.00 174.74 173.60 2f3u n THR 209 N 5.38 0.00 0.01 1.30 -2.24 -0.99 -5.01 114.28 112.73 2f3u n THR 209 Ca -0.08 -0.69 -0.15 0.00 -2.27 0.00 0.00 64.05 60.86 2f3u n THR 209 Cb 0.46 -0.69 -0.09 0.00 -2.10 0.00 0.00 70.33 67.92 2f3u n THR 209 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2f3u h SER 210 N 0.09 -1.60 -3.51 3.42 0.02 -2.02 -3.34 113.55 106.60 2f3u h SER 210 Ca -0.10 0.19 -0.70 0.00 -0.84 0.00 0.00 61.79 60.34 2f3u h SER 210 Cb 0.43 0.63 -0.34 0.00 0.14 0.00 0.00 62.40 63.26 2f3u h SER 210 CO 0.15 -0.48 -0.52 -1.58 -1.14 0.00 0.00 176.83 173.26 2f3u s GLN 211 N -5.77 2.09 0.01 3.45 2.00 -1.26 -5.03 119.66 115.15 2f3u s GLN 211 Ca -0.16 -1.87 0.00 0.00 -2.00 0.00 0.00 55.36 51.34 2f3u s GLN 211 Cb 0.08 -3.63 0.00 0.00 0.80 0.00 0.00 33.01 30.25 2f3u s GLN 211 CO 0.62 -1.09 0.00 0.41 -0.50 0.00 0.00 175.29 174.73 2f3u n GLY 212 N 4.55 -2.39 3.89 2.59 0.00 -1.26 -4.98 105.19 107.59 2f3u n GLY 212 Ca -0.02 -1.46 -0.29 0.00 0.00 0.00 0.00 46.02 44.25 2f3u n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f3u s ALA 213 N -2.66 3.42 -0.02 4.61 0.00 -1.26 -2.34 121.76 123.51 2f3u s ALA 213 Ca 0.00 -0.38 0.02 0.00 0.00 0.00 0.00 51.96 51.60 2f3u s ALA 213 Cb 0.00 -2.58 0.00 0.00 0.00 0.00 0.00 23.12 20.54 2f3u s ALA 213 CO 0.00 -0.08 -0.06 0.15 0.00 0.00 0.00 175.76 175.77 2f3u s LYS 214 N -4.10 0.62 -0.41 0.00 1.02 0.14 -4.88 119.74 112.13 2f3u s LYS 214 Ca 0.48 -0.19 -0.16 0.00 0.02 0.00 0.00 55.97 56.13 2f3u s LYS 214 Cb -0.10 -0.61 0.02 0.00 -0.52 0.00 0.00 37.83 36.61 2f3u s LYS 214 CO 0.36 0.07 0.34 -0.46 -0.92 0.00 0.00 175.35 174.74 2f3u s TRP 215 N 0.19 3.22 0.44 3.18 -0.00 -1.26 0.25 118.94 124.96 2f3u s TRP 215 Ca -0.02 -0.51 0.03 0.00 -0.00 0.00 0.00 56.10 55.61 2f3u s TRP 215 Cb -0.06 -2.67 -0.04 0.00 -0.00 0.00 0.00 33.47 30.69 2f3u s TRP 215 CO -0.00 -0.61 0.03 0.14 -0.00 0.00 0.00 176.95 176.51 2f3u s VAL 216 N 1.82 1.28 -1.51 5.86 -7.23 -0.23 -4.81 120.40 115.58 2f3u s VAL 216 Ca 0.07 -2.00 -0.13 0.00 -1.81 0.00 0.00 61.98 58.11 2f3u s VAL 216 Cb -0.18 -2.49 0.07 0.00 0.56 0.00 0.00 36.38 34.34 2f3u s VAL 216 CO 0.11 0.00 0.96 0.47 -0.31 0.00 0.00 175.10 176.33 2f3u n ASP 217 N -1.12 -5.02 -4.92 4.85 8.00 -1.26 -0.80 116.55 116.28 2f3u n ASP 217 Ca -0.11 -0.71 -0.26 0.00 0.71 0.00 0.00 54.79 54.43 2f3u n ASP 217 Cb 0.67 -4.01 -0.00 0.00 -0.02 0.00 0.00 41.12 37.76 2f3u n ASP 217 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2f3u s THR 218 N -3.27 4.78 -0.14 -3.53 -4.23 -1.26 -3.17 115.64 104.81 2f3u s THR 218 Ca 0.63 -0.12 -0.11 0.00 -1.18 0.00 0.00 61.69 60.92 2f3u s THR 218 Cb -0.31 -3.79 -0.05 0.00 1.34 0.00 0.00 72.50 69.69 2f3u s THR 218 CO 0.78 -0.67 0.21 -1.10 -0.54 0.00 0.00 174.62 173.30 2f3u s GLN 219 N -4.60 3.95 -0.13 3.99 -0.21 0.27 -4.90 119.66 118.03 2f3u s GLN 219 Ca 0.45 -0.04 -0.05 0.00 0.02 0.00 0.00 55.36 55.74 2f3u s GLN 219 Cb -0.10 -3.33 -0.04 0.00 1.00 0.00 0.00 33.01 30.54 2f3u s GLN 219 CO 0.41 0.47 0.06 0.08 -2.12 0.00 0.00 175.29 174.19 2f3u s VAL 220 N -0.20 4.80 -0.05 1.09 1.01 -1.26 -1.17 120.40 124.62 2f3u s VAL 220 Ca 0.14 -0.05 0.04 0.00 0.00 0.00 0.00 61.98 62.11 2f3u s VAL 220 Cb -0.12 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.16 2f3u s VAL 220 CO 0.03 0.55 -0.16 -0.69 0.00 0.00 0.00 175.10 174.84 2f3u s VAL 221 N -0.44 1.35 0.20 2.92 1.01 -0.13 -4.50 120.40 120.80 2f3u s VAL 221 Ca 0.10 -0.65 -0.16 0.00 0.00 0.00 0.00 61.98 61.27 2f3u s VAL 221 Cb -0.12 -1.17 -0.08 0.00 0.00 0.00 0.00 36.38 35.01 2f3u s VAL 221 CO 0.02 0.39 0.63 -0.76 0.00 0.00 0.00 175.10 175.38 2f3u s LEU 222 N 0.21 4.30 -0.29 3.92 1.43 0.10 -0.18 118.68 128.18 2f3u s LEU 222 Ca -0.07 1.20 -0.04 0.00 -1.03 0.00 0.00 54.13 54.19 2f3u s LEU 222 Cb -0.13 -3.49 0.03 0.00 0.03 0.00 0.00 46.19 42.64 2f3u s LEU 222 CO 0.03 0.04 0.02 0.00 0.23 0.00 0.00 176.35 176.66 2f3u s ALA 223 N -1.56 2.88 -0.24 4.21 0.00 0.21 -0.67 121.76 126.59 2f3u s ALA 223 Ca 0.42 -1.58 -0.09 0.00 0.00 0.00 0.00 51.96 50.71 2f3u s ALA 223 Cb -0.15 -1.96 -0.04 0.00 0.00 0.00 0.00 23.12 20.97 2f3u s ALA 223 CO 0.20 -1.04 0.12 1.41 0.00 0.00 0.00 175.76 176.44 2f3u s MET 224 N 1.36 3.90 0.25 0.00 1.75 0.52 -1.12 119.30 125.96 2f3u s MET 224 Ca -0.01 -0.36 -0.14 0.00 -1.25 0.00 0.00 55.69 53.93 2f3u s MET 224 Cb -0.18 -3.44 -0.08 0.00 2.84 0.00 0.00 34.83 33.97 2f3u s MET 224 CO -0.01 -0.03 0.66 -1.25 -0.65 0.00 0.00 175.02 173.74 2f3u s PRO 225 N 1.25 4.00 -0.11 4.11 0.04 -1.26 -0.34 135.00 142.68 2f3u s PRO 225 Ca 0.06 0.58 0.01 0.00 0.04 0.00 0.00 61.00 61.69 2f3u s PRO 225 Cb -0.14 -2.65 0.02 0.00 0.04 0.00 0.00 34.50 31.76 2f3u s PRO 225 CO 0.05 0.29 -0.13 0.71 0.04 0.00 0.00 177.00 177.96 2f3u s TYR 226 N -1.77 1.85 -0.14 0.56 1.51 -0.28 -0.81 117.35 118.28 2f3u s TYR 226 Ca 0.48 -0.90 -0.07 0.00 -1.01 0.00 0.00 57.07 55.56 2f3u s TYR 226 Cb -0.12 -1.38 -0.04 0.00 -0.11 0.00 0.00 41.96 40.31 2f3u s TYR 226 CO 0.19 -0.50 0.11 -0.51 -1.11 0.00 0.00 175.55 173.74 2f3u s ASP 227 N 1.18 6.12 -0.08 2.29 -0.00 -0.37 -1.32 116.67 124.50 2f3u s ASP 227 Ca -0.03 0.33 0.04 0.00 -0.00 0.00 0.00 52.55 52.88 2f3u s ASP 227 Cb -0.14 -1.99 0.00 0.00 -0.00 0.00 0.00 42.92 40.79 2f3u s ASP 227 CO -0.04 0.32 -0.19 -0.89 -0.00 0.00 0.00 175.17 174.38 2f3u s THR 228 N -0.51 1.63 0.38 -1.27 2.01 -0.10 -0.38 115.64 117.39 2f3u s THR 228 Ca 0.12 -0.78 -0.25 0.00 0.31 0.00 0.00 61.69 61.08 2f3u s THR 228 Cb -0.12 -1.43 -0.09 0.00 0.01 0.00 0.00 72.50 70.88 2f3u s THR 228 CO 0.02 0.46 1.10 -2.16 -0.69 0.00 0.00 174.62 173.35 2f3u s PRO 229 N 0.39 4.22 -0.38 4.92 0.04 -1.26 -0.98 135.00 141.95 2f3u s PRO 229 Ca -0.14 1.67 0.02 0.00 0.04 0.00 0.00 61.00 62.59 2f3u s PRO 229 Cb -0.16 -2.71 0.11 0.00 0.04 0.00 0.00 34.50 31.78 2f3u s PRO 229 CO 0.06 -0.13 0.14 0.08 0.04 0.00 0.00 177.00 177.18 2f3u s VAL 230 N -1.48 1.68 0.16 -0.36 1.01 0.84 -4.89 120.40 117.36 2f3u s VAL 230 Ca 0.55 -2.22 -0.30 0.00 0.00 0.00 0.00 61.98 60.01 2f3u s VAL 230 Cb -0.27 -2.22 -0.07 0.00 0.00 0.00 0.00 36.38 33.82 2f3u s VAL 230 CO 0.34 -0.72 1.05 -2.16 0.00 0.00 0.00 175.10 173.61 2f3u s PRO 231 N 0.85 4.64 0.72 2.72 0.04 -1.26 -0.62 135.00 142.08 2f3u s PRO 231 Ca 0.13 1.63 -0.10 0.00 0.04 0.00 0.00 61.00 62.70 2f3u s PRO 231 Cb -0.21 -3.31 0.04 0.00 0.04 0.00 0.00 34.50 31.07 2f3u s PRO 231 CO -0.11 0.14 1.08 0.20 0.04 0.00 0.00 177.00 178.35 2f3u s GLY 232 N -0.12 1.62 -0.52 0.56 0.00 0.49 -4.77 107.32 104.57 2f3u s GLY 232 Ca 0.48 -0.57 -0.28 0.00 0.00 0.00 0.00 44.72 44.35 2f3u s GLY 232 CO 0.33 -0.17 1.45 -0.47 0.00 0.00 0.00 173.10 174.24 2f3u s TYR 233 N -3.36 2.26 -1.05 1.90 6.14 -1.26 -4.16 117.35 117.81 2f3u s TYR 233 Ca 0.59 0.54 -0.09 0.00 0.64 0.00 0.00 57.07 58.75 2f3u s TYR 233 Cb -0.11 -4.35 0.08 0.00 0.42 0.00 0.00 41.96 38.00 2f3u s TYR 233 CO 0.49 -2.03 0.34 0.54 0.64 0.00 0.00 175.55 175.54 2f3u n ARG 234 N 8.55 -2.67 0.00 4.97 3.00 0.18 -4.78 116.66 125.91 2f3u n ARG 234 Ca 0.14 0.30 0.00 0.00 -0.01 0.00 0.00 57.85 58.28 2f3u n ARG 234 Cb 0.49 -4.92 0.00 0.00 0.00 0.00 0.00 32.46 28.03 2f3u n ARG 234 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 2f3u n ASN 235 N -2.08 1.72 -0.78 0.55 2.04 -1.26 -4.94 115.26 110.50 2f3u n ASN 235 Ca 0.00 -1.73 -0.10 0.00 -0.44 0.00 0.00 54.58 52.32 2f3u n ASN 235 Cb 0.52 0.00 -0.04 0.00 -2.53 0.00 0.00 39.78 37.73 2f3u n ASN 235 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 2f3u n ASN 236 N -0.36 -5.25 -4.80 0.53 3.02 -1.26 -0.96 115.26 106.17 2f3u n ASN 236 Ca 0.00 0.25 -0.38 0.00 -0.03 0.00 0.00 54.58 54.43 2f3u n ASN 236 Cb 0.19 -3.65 -0.06 0.00 -0.61 0.00 0.00 39.78 35.64 2f3u n ASN 236 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2f3u s VAL 237 N -2.04 5.11 -0.23 2.41 1.01 -1.26 -4.77 120.40 120.63 2f3u s VAL 237 Ca 0.00 0.82 -0.03 0.00 0.00 0.00 0.00 61.98 62.77 2f3u s VAL 237 Cb 0.00 -3.72 0.07 0.00 0.00 0.00 0.00 36.38 32.73 2f3u s VAL 237 CO 0.00 0.50 0.07 -0.69 0.00 0.00 0.00 175.10 174.98 2f3u s VAL 238 N -0.49 0.39 0.81 2.92 1.01 -1.26 -0.38 120.40 123.39 2f3u s VAL 238 Ca 0.23 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.48 2f3u s VAL 238 Cb -0.16 -1.07 0.17 0.00 0.00 0.00 0.00 36.38 35.32 2f3u s VAL 238 CO 0.11 -0.40 1.10 0.59 0.00 0.00 0.00 175.10 176.51 2f3u n ASN 239 N 5.08 1.07 -4.28 3.32 3.02 0.21 -4.65 115.26 119.04 2f3u n ASN 239 Ca -0.07 -2.00 -0.29 0.00 -0.03 0.00 0.00 54.58 52.19 2f3u n ASN 239 Cb 0.46 -0.75 -0.16 0.00 -0.61 0.00 0.00 39.78 38.72 2f3u n ASN 239 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2f3u s THR 240 N -3.36 1.91 -0.24 3.41 2.01 -1.26 -0.11 115.64 117.99 2f3u s THR 240 Ca 0.70 -1.07 -0.01 0.00 0.31 0.00 0.00 61.69 61.62 2f3u s THR 240 Cb -0.03 -1.59 0.03 0.00 0.01 0.00 0.00 72.50 70.91 2f3u s THR 240 CO 0.47 0.50 -0.08 -0.32 -0.69 0.00 0.00 174.62 174.51 2f3u s MET 241 N -0.66 2.82 -0.25 4.92 1.75 -0.15 -1.99 119.30 125.74 2f3u s MET 241 Ca 0.09 -0.98 -0.07 0.00 -1.25 0.00 0.00 55.69 53.49 2f3u s MET 241 Cb -0.09 -2.94 -0.02 0.00 2.84 0.00 0.00 34.83 34.62 2f3u s MET 241 CO -0.00 -0.39 0.06 0.50 -0.65 0.00 0.00 175.02 174.53 2f3u s ARG 242 N 1.31 3.57 -0.12 4.11 3.52 0.12 -0.92 118.95 130.53 2f3u s ARG 242 Ca 0.00 -0.53 0.00 0.00 -0.13 0.00 0.00 55.73 55.07 2f3u s ARG 242 Cb -0.16 -3.29 -0.02 0.00 -1.56 0.00 0.00 34.95 29.92 2f3u s ARG 242 CO -0.05 -0.21 -0.13 -0.51 -0.81 0.00 0.00 175.30 173.58 2f3u s LEU 243 N 1.59 2.72 0.13 -0.88 1.43 -0.44 -1.90 118.68 121.33 2f3u s LEU 243 Ca 0.06 -0.32 -0.18 0.00 -1.03 0.00 0.00 54.13 52.67 2f3u s LEU 243 Cb -0.15 -1.61 -0.07 0.00 0.03 0.00 0.00 46.19 44.39 2f3u s LEU 243 CO 0.03 0.18 0.59 0.26 0.23 0.00 0.00 176.35 177.64 2f3u s TRP 244 N 0.26 3.71 -0.04 0.29 0.52 -0.15 -1.12 118.94 122.41 2f3u s TRP 244 Ca -0.09 1.22 0.06 0.00 0.02 0.00 0.00 56.10 57.31 2f3u s TRP 244 Cb -0.16 -2.47 -0.01 0.00 -1.15 0.00 0.00 33.47 29.68 2f3u s TRP 244 CO 0.05 0.49 -0.24 0.45 0.02 0.00 0.00 176.95 177.72 2f3u s SER 245 N -1.43 2.87 0.04 2.95 0.15 0.54 -0.95 113.70 117.86 2f3u s SER 245 Ca 0.35 -0.46 -0.27 0.00 0.70 0.00 0.00 55.95 56.26 2f3u s SER 245 Cb -0.17 -0.62 -0.05 0.00 -1.71 0.00 0.00 66.02 63.47 2f3u s SER 245 CO 0.20 0.25 0.87 0.00 1.20 0.00 0.00 173.24 175.75 2f3u s ALA 246 N -0.28 3.27 -0.01 5.45 0.00 -1.26 -0.36 121.76 128.57 2f3u s ALA 246 Ca 0.01 0.41 0.02 0.00 0.00 0.00 0.00 51.96 52.40 2f3u s ALA 246 Cb -0.12 -3.16 -0.00 0.00 0.00 0.00 0.00 23.12 19.84 2f3u s ALA 246 CO 0.02 -0.06 -0.08 0.15 0.00 0.00 0.00 175.76 175.79 2f3u s LYS 247 N 0.36 0.69 0.29 0.00 -0.14 0.15 -4.63 119.74 116.46 2f3u s LYS 247 Ca 0.44 -0.27 -0.21 0.00 -1.36 0.00 0.00 55.97 54.57 2f3u s LYS 247 Cb -0.21 -0.67 -0.09 0.00 -1.68 0.00 0.00 37.83 35.18 2f3u s LYS 247 CO 0.26 0.15 0.81 0.00 -0.76 0.00 0.00 175.35 175.80 2f3u s ALA 248 N -0.06 3.30 0.70 5.17 0.00 -1.26 0.02 121.76 129.63 2f3u s ALA 248 Ca 0.01 0.28 -0.14 0.00 0.00 0.00 0.00 51.96 52.11 2f3u s ALA 248 Cb -0.05 -2.95 0.02 0.00 0.00 0.00 0.00 23.12 20.14 2f3u s ALA 248 CO -0.00 0.26 1.11 -1.25 0.00 0.00 0.00 175.76 175.88 2f3u s PRO 249 N -2.25 2.59 0.44 0.00 0.04 -1.26 -4.86 135.00 129.70 2f3u s PRO 249 Ca 0.48 1.34 0.30 0.00 0.04 0.00 0.00 61.00 63.16 2f3u s PRO 249 Cb -0.16 -1.93 1.22 0.00 0.04 0.00 0.00 34.50 33.68 2f3u s PRO 249 CO 0.20 -1.41 1.88 -0.91 0.04 0.00 0.00 177.00 176.81 2f3u h ASN 250 N -0.35 0.00 -0.32 6.66 2.35 -2.00 -1.93 115.58 119.99 2f3u h ASN 250 Ca -0.46 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 2f3u h ASN 250 Cb 1.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.61 2f3u h ASN 250 CO 0.53 0.00 0.00 -0.90 -1.65 0.00 0.00 177.43 175.41 2f3u n ASP 251 N -2.76 2.64 -4.65 5.81 5.75 -1.26 -4.86 116.55 117.21 2f3u n ASP 251 Ca 0.01 -1.88 -0.48 0.00 -0.01 0.00 0.00 54.79 52.42 2f3u n ASP 251 Cb 0.28 -0.20 -0.05 0.00 -1.03 0.00 0.00 41.12 40.12 2f3u n ASP 251 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 2f3u n PHE 252 N 0.95 2.09 -0.80 2.11 7.35 -0.73 -0.53 117.46 127.91 2f3u n PHE 252 Ca 0.18 0.33 0.00 0.00 -0.76 0.00 0.00 57.45 57.20 2f3u n PHE 252 Cb 0.47 -2.51 0.00 0.00 0.35 0.00 0.00 39.48 37.79 2f3u n PHE 252 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 2f3u n ASN 253 N 3.77 -4.44 -4.04 -2.13 4.13 -1.26 -4.82 115.26 106.47 2f3u n ASN 253 Ca 0.19 0.00 -0.32 0.00 1.68 0.00 0.00 54.58 56.13 2f3u n ASN 253 Cb 0.26 -2.94 -0.15 0.00 -1.54 0.00 0.00 39.78 35.41 2f3u n ASN 253 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2f3u s LEU 254 N 0.00 3.15 0.00 3.41 1.43 0.31 -4.85 118.68 122.13 2f3u s LEU 254 Ca 0.00 -1.29 -0.05 0.00 -1.03 0.00 0.00 54.13 51.76 2f3u s LEU 254 Cb 0.00 -1.46 0.08 0.00 0.03 0.00 0.00 46.19 44.84 2f3u s LEU 254 CO 0.00 -0.19 0.18 0.61 0.23 0.00 0.00 176.35 177.18 2f3u n GLY 261 N 4.50 -2.01 0.21 -3.19 0.00 -1.26 -4.89 105.19 98.55 2f3u n GLY 261 Ca -0.14 -0.66 -0.12 0.00 0.00 0.00 0.00 46.02 45.10 2f3u n GLY 261 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2f3u h TYR 262 N -2.06 -0.44 -0.28 1.61 3.20 -2.00 -1.93 116.97 115.07 2f3u h TYR 262 Ca -0.08 0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.85 2f3u h TYR 262 Cb 0.28 0.18 -0.05 0.00 1.54 0.00 0.00 36.73 38.68 2f3u h TYR 262 CO 0.00 -0.25 -0.01 0.82 -1.64 0.00 0.00 178.16 177.08 2f3u h ILE 263 N -0.33 0.78 -0.92 1.81 1.08 -2.02 -2.29 117.51 115.62 2f3u h ILE 263 Ca 0.03 -0.02 0.04 0.00 -0.39 0.00 0.00 64.86 64.51 2f3u h ILE 263 Cb 0.35 0.71 -0.06 0.00 -3.07 0.00 0.00 36.82 34.75 2f3u h ILE 263 CO -0.10 0.01 0.59 1.56 -0.69 0.00 0.00 178.15 179.53 2f3u h GLN 264 N 0.07 1.09 -0.82 2.37 1.08 -1.96 -1.00 115.11 115.94 2f3u h GLN 264 Ca 0.14 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 2f3u h GLN 264 Cb 0.19 -0.25 -0.04 0.00 -0.05 0.00 0.00 27.48 27.33 2f3u h GLN 264 CO -0.24 0.72 0.51 0.00 -0.95 0.00 0.00 178.83 178.88 2f3u h ALA 265 N 1.39 1.04 -0.39 3.87 0.00 -0.82 0.89 119.26 125.24 2f3u h ALA 265 Ca 0.37 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 55.07 2f3u h ALA 265 Cb 0.05 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2f3u h ALA 265 CO -0.13 0.49 -0.28 0.28 0.00 0.00 0.00 179.25 179.60 2f3u h VAL 266 N 1.12 1.28 -0.10 0.00 2.07 -0.92 -3.06 116.25 116.64 2f3u h VAL 266 Ca 0.30 -1.44 -0.08 0.00 0.82 0.00 0.00 66.70 66.30 2f3u h VAL 266 Cb -0.07 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 2f3u h VAL 266 CO -0.06 0.48 -0.29 -0.07 0.02 0.00 0.00 177.57 177.66 2f3u h LEU 267 N 0.69 0.17 0.00 2.57 3.38 -0.69 -2.63 115.31 118.80 2f3u h LEU 267 Ca 0.08 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2f3u h LEU 267 Cb 0.86 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2f3u h LEU 267 CO 0.08 0.47 0.00 0.47 0.09 0.00 0.00 178.44 179.54 2f3u n ASP 268 N -4.15 0.00 0.28 -0.43 8.00 0.26 -2.83 116.55 117.69 2f3u n ASP 268 Ca -0.01 -0.73 0.15 0.00 0.71 0.00 0.00 54.79 54.90 2f3u n ASP 268 Cb 0.37 0.00 0.83 0.00 -0.02 0.00 0.00 41.12 42.30 2f3u n ASP 268 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2f3u h ARG 269 N 0.00 0.00 -0.71 -1.24 3.08 -1.51 -1.85 114.38 112.15 2f3u h ARG 269 Ca 0.00 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.14 2f3u h ARG 269 Cb 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.00 2f3u h ARG 269 CO 0.00 0.07 0.47 -0.91 -1.07 0.00 0.00 179.97 178.53 2f3u h ASN 270 N 0.00 0.57 -0.50 7.04 -0.26 -1.76 -2.08 115.58 118.58 2f3u h ASN 270 Ca -0.00 0.01 0.09 0.00 -0.56 0.00 0.00 56.30 55.84 2f3u h ASN 270 Cb 0.22 -0.11 -0.07 0.00 -1.06 0.00 0.00 38.32 37.30 2f3u h ASN 270 CO 0.01 0.35 0.08 -0.07 -1.06 0.00 0.00 177.43 176.74 2f3u h LEU 271 N 0.63 -0.04 -0.23 1.61 4.07 -1.60 0.13 115.31 119.89 2f3u h LEU 271 Ca 0.32 0.10 -0.21 0.00 0.08 0.00 0.00 57.88 58.17 2f3u h LEU 271 Cb 0.43 0.14 0.01 0.00 1.08 0.00 0.00 40.66 42.31 2f3u h LEU 271 CO -0.11 0.01 -0.75 0.00 -1.08 0.00 0.00 178.44 176.51 2f3u h ALA 272 N 1.40 0.39 0.00 1.53 0.00 -1.56 -3.20 119.26 117.81 2f3u h ALA 272 Ca 0.25 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2f3u h ALA 272 Cb 0.35 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2f3u h ALA 272 CO -0.35 0.70 0.00 0.39 0.00 0.00 0.00 179.25 179.99 2f3u n GLU 273 N -3.92 0.04 0.17 0.00 1.02 -0.93 -3.03 120.64 113.98 2f3u n GLU 273 Ca -0.06 0.09 0.13 0.00 -0.02 0.00 0.00 57.16 57.30 2f3u n GLU 273 Cb 0.73 -1.50 0.58 0.00 -0.02 0.00 0.00 31.44 31.22 2f3u n GLU 273 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2f3u h ASN 274 N 0.00 0.00 -0.98 1.62 2.35 -0.98 -3.14 115.58 114.45 2f3u h ASN 274 Ca 0.00 0.00 0.09 0.00 -0.55 0.00 0.00 56.30 55.84 2f3u h ASN 274 Cb 0.39 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 38.68 2f3u h ASN 274 CO 0.00 0.00 0.62 0.40 -1.65 0.00 0.00 177.43 176.80 2f3u h ILE 275 N 0.00 0.99 -0.45 2.81 2.04 -1.75 -2.01 117.51 119.14 2f3u h ILE 275 Ca 0.00 -0.36 -0.00 0.00 1.00 0.00 0.00 64.86 65.50 2f3u h ILE 275 Cb 0.30 -0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.23 2f3u h ILE 275 CO 0.00 0.19 0.00 -1.54 0.00 0.00 0.00 178.15 176.80 2f3u n SER 276 N -4.59 5.01 -0.04 1.72 3.41 -1.19 -4.65 113.62 113.30 2f3u n SER 276 Ca 0.17 -2.98 -0.14 0.00 -0.26 0.00 0.00 58.87 55.66 2f3u n SER 276 Cb 0.28 -0.63 -0.09 0.00 -0.26 0.00 0.00 64.21 63.51 2f3u n SER 276 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2f3u h ARG 277 N 3.11 0.33 -3.20 4.33 9.65 -1.47 -1.82 114.38 125.32 2f3u h ARG 277 Ca 0.00 -0.24 -0.14 0.00 -1.10 0.00 0.00 59.98 58.50 2f3u h ARG 277 Cb 1.78 0.04 -0.22 0.00 -1.39 0.00 0.00 29.97 30.17 2f3u h ARG 277 CO 0.39 0.87 -0.39 0.54 2.80 0.00 0.00 179.97 184.18 2f3u s VAL 278 N -3.79 0.04 0.08 0.20 0.11 -1.26 -0.92 120.40 114.86 2f3u s VAL 278 Ca -0.14 -0.35 -0.30 0.00 -2.93 0.00 0.00 61.98 58.25 2f3u s VAL 278 Cb 0.04 -0.47 -0.05 0.00 -1.53 0.00 0.00 36.38 34.37 2f3u s VAL 278 CO 0.77 -0.19 1.01 -0.22 -3.33 0.00 0.00 175.10 173.13 2f3u s LEU 279 N -0.78 4.44 -0.02 2.54 2.96 -0.86 -4.99 118.68 121.96 2f3u s LEU 279 Ca -0.09 1.81 -0.30 0.00 -0.22 0.00 0.00 54.13 55.33 2f3u s LEU 279 Cb -0.05 -3.58 -0.05 0.00 0.50 0.00 0.00 46.19 43.01 2f3u s LEU 279 CO 0.02 -0.19 1.41 -0.31 -1.32 0.00 0.00 176.35 175.96 2f3u s TYR 280 N 0.41 2.76 -0.02 5.38 1.51 -1.26 -4.85 117.35 121.28 2f3u s TYR 280 Ca 0.50 0.77 0.00 0.00 -1.01 0.00 0.00 57.07 57.34 2f3u s TYR 280 Cb -0.24 -3.67 0.02 0.00 -0.11 0.00 0.00 41.96 37.96 2f3u s TYR 280 CO 0.30 -2.51 1.16 -0.35 -1.11 0.00 0.00 175.55 173.04 2f3u n PRO 281 N 5.70 1.05 -3.70 -1.71 -0.04 -1.26 -4.91 135.00 130.12 2f3u n PRO 281 Ca 0.14 -0.11 -0.37 0.00 -0.04 0.00 0.00 63.50 63.11 2f3u n PRO 281 Cb 0.44 -1.04 -0.06 0.00 -0.04 0.00 0.00 33.50 32.79 2f3u n PRO 281 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2f3u s ASN 282 N 1.04 6.49 -0.21 3.54 0.01 -1.26 -4.43 114.94 120.12 2f3u s ASN 282 Ca 0.02 0.58 -0.01 0.00 -0.71 0.00 0.00 52.86 52.73 2f3u s ASN 282 Cb 0.02 -2.14 0.01 0.00 0.41 0.00 0.00 41.25 39.55 2f3u s ASN 282 CO 0.00 0.31 -0.11 -0.62 -1.51 0.00 0.00 177.10 175.16 2f3u s ASP 283 N -0.61 3.80 -1.25 -1.22 2.15 -1.26 -4.69 116.67 113.58 2f3u s ASP 283 Ca 0.17 -0.60 -0.03 0.00 0.43 0.00 0.00 52.55 52.52 2f3u s ASP 283 Cb -0.13 -1.61 -0.01 0.00 -0.30 0.00 0.00 42.92 40.87 2f3u s ASP 283 CO 0.06 -0.03 0.76 0.59 -0.17 0.00 0.00 175.17 176.38 2f3u n ASN 284 N 4.69 -2.28 -3.62 -0.34 3.02 -1.26 -4.99 115.26 110.48 2f3u n ASN 284 Ca -0.19 -0.81 -0.04 0.00 -0.03 0.00 0.00 54.58 53.51 2f3u n ASN 284 Cb 0.50 -4.21 -0.06 0.00 -0.61 0.00 0.00 39.78 35.40 2f3u n ASN 284 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2f3u s PHE 285 N -3.59 -0.98 -0.18 3.10 5.36 -1.26 -4.44 117.98 115.99 2f3u s PHE 285 Ca 0.10 1.86 -0.16 0.00 -0.96 0.00 0.00 56.93 57.77 2f3u s PHE 285 Cb -0.03 0.58 -0.04 0.00 -0.34 0.00 0.00 43.02 43.20 2f3u s PHE 285 CO 0.80 -0.48 0.38 0.12 -1.46 0.00 0.00 175.22 174.58 2f3u s PHE 286 N 1.92 3.41 -0.26 10.12 2.19 -0.13 -4.86 117.98 130.38 2f3u s PHE 286 Ca -0.08 0.63 0.03 0.00 0.33 0.00 0.00 56.93 57.83 2f3u s PHE 286 Cb -0.06 -2.48 0.06 0.00 -1.31 0.00 0.00 43.02 39.23 2f3u s PHE 286 CO -0.18 0.06 -0.09 -2.00 1.83 0.00 0.00 175.22 174.84 2f3u s GLU 287 N 1.05 2.08 -1.37 10.12 2.12 -1.26 -4.96 118.70 126.48 2f3u s GLU 287 Ca 0.19 -1.31 -0.12 0.00 0.36 0.00 0.00 54.97 54.08 2f3u s GLU 287 Cb -0.14 -2.85 -0.05 0.00 0.26 0.00 0.00 34.13 31.35 2f3u s GLU 287 CO 0.07 -0.60 2.47 0.41 -0.54 0.00 0.00 175.26 177.07 2f3u n GLY 288 N 4.47 3.96 3.87 -1.50 0.00 -1.26 -4.93 105.19 109.80 2f3u n GLY 288 Ca -0.13 -1.41 -0.36 0.00 0.00 0.00 0.00 46.02 44.12 2f3u n GLY 288 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f3u s LYS 289 N 3.03 3.62 0.23 1.61 -0.14 -1.26 -5.01 119.74 121.82 2f3u s LYS 289 Ca 0.56 0.01 -0.07 0.00 -1.36 0.00 0.00 55.97 55.11 2f3u s LYS 289 Cb 0.15 -3.12 0.32 0.00 -1.68 0.00 0.00 37.83 33.50 2f3u s LYS 289 CO -0.05 0.68 1.81 1.49 -0.76 0.00 0.00 175.35 178.52 2f3u h GLU 290 N 4.30 0.74 -0.73 1.68 4.81 -2.00 -1.95 114.58 121.43 2f3u h GLU 290 Ca -0.51 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 58.71 2f3u h GLU 290 Cb 1.21 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 30.38 2f3u h GLU 290 CO 0.64 0.49 0.48 1.25 -0.73 0.00 0.00 179.01 181.14 2f3u h LEU 291 N 0.76 0.76 -0.79 1.64 5.85 -1.99 -0.96 115.31 120.58 2f3u h LEU 291 Ca 0.35 -0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.96 2f3u h LEU 291 Cb 0.26 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 2f3u h LEU 291 CO -0.21 0.53 -0.18 -0.09 -0.34 0.00 0.00 178.44 178.15 2f3u h ARG 292 N 0.89 0.72 -0.51 1.25 9.65 -1.73 -1.60 114.38 123.05 2f3u h ARG 292 Ca 0.29 -0.26 -0.11 0.00 -1.10 0.00 0.00 59.98 58.80 2f3u h ARG 292 Cb 0.05 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.57 2f3u h ARG 292 CO -0.08 0.85 -0.10 1.25 2.80 0.00 0.00 179.97 184.69 2f3u h LEU 293 N 0.64 0.94 -0.75 3.80 5.85 -0.95 -1.56 115.31 123.28 2f3u h LEU 293 Ca 0.10 -0.30 -0.04 0.00 0.84 0.00 0.00 57.88 58.48 2f3u h LEU 293 Cb 0.65 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 2f3u h LEU 293 CO 0.05 1.05 0.30 0.11 -0.34 0.00 0.00 178.44 179.61 2f3u h LYS 294 N 0.85 1.12 -0.59 1.25 1.57 -0.89 -1.09 116.57 118.79 2f3u h LYS 294 Ca 0.14 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 2f3u h LYS 294 Cb 0.64 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.74 2f3u h LYS 294 CO 0.04 0.91 0.29 1.96 -0.57 0.00 0.00 179.45 182.09 2f3u h GLN 295 N 1.08 0.84 -0.71 3.15 4.20 -0.99 0.15 115.11 122.84 2f3u h GLN 295 Ca 0.25 -0.12 -0.05 0.00 0.06 0.00 0.00 58.65 58.79 2f3u h GLN 295 Cb 0.21 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 2f3u h GLN 295 CO -0.02 0.68 0.26 0.93 -0.67 0.00 0.00 178.83 180.01 2f3u h GLU 296 N 0.80 1.08 -0.03 1.46 5.08 -0.81 -2.10 114.58 120.06 2f3u h GLU 296 Ca 0.20 -0.21 -0.23 0.00 -1.00 0.00 0.00 59.36 58.12 2f3u h GLU 296 Cb 0.11 -0.17 0.01 0.00 0.50 0.00 0.00 28.75 29.20 2f3u h GLU 296 CO -0.03 0.90 -0.92 -0.92 -1.00 0.00 0.00 179.01 177.05 2f3u h TYR 297 N 1.03 0.79 -0.28 4.33 3.20 -1.00 -2.99 116.97 122.05 2f3u h TYR 297 Ca 0.23 -0.41 0.06 0.00 3.14 0.00 0.00 58.73 61.75 2f3u h TYR 297 Cb 0.25 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.37 2f3u h TYR 297 CO 0.02 1.22 -0.06 0.35 -1.64 0.00 0.00 178.16 178.05 2f3u h PHE 298 N 0.33 -0.14 -0.53 -3.82 3.57 -0.51 0.31 116.94 116.15 2f3u h PHE 298 Ca -0.08 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.33 2f3u h PHE 298 Cb 1.55 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 40.38 2f3u h PHE 298 CO 0.07 -0.12 -0.11 -0.24 -2.23 0.00 0.00 178.31 175.69 2f3u h VAL 299 N 0.01 1.27 -0.18 1.41 3.04 -1.44 -2.64 116.25 117.71 2f3u h VAL 299 Ca 0.14 -1.25 -0.03 0.00 -1.01 0.00 0.00 66.70 64.54 2f3u h VAL 299 Cb 0.21 0.97 -0.01 0.00 -2.01 0.00 0.00 31.29 30.45 2f3u h VAL 299 CO -0.29 0.44 -0.01 0.58 -1.01 0.00 0.00 177.57 177.29 2f3u h VAL 300 N 0.89 1.26 -0.22 1.51 2.07 -1.28 -1.77 116.25 118.71 2f3u h VAL 300 Ca 0.14 -0.89 -0.01 0.00 0.82 0.00 0.00 66.70 66.75 2f3u h VAL 300 Cb 0.66 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 2f3u h VAL 300 CO 0.05 0.27 0.09 0.00 0.02 0.00 0.00 177.57 177.99 2f3u h ALA 301 N 0.76 0.28 -0.32 1.67 0.00 -0.41 -1.26 119.26 119.98 2f3u h ALA 301 Ca 0.05 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 2f3u h ALA 301 Cb 0.41 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2f3u h ALA 301 CO 0.01 -0.13 -0.02 0.00 0.00 0.00 0.00 179.25 179.12 2f3u h ALA 302 N 0.93 0.43 -0.21 0.00 0.00 -1.53 -2.99 119.26 115.90 2f3u h ALA 302 Ca 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2f3u h ALA 302 Cb 0.17 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2f3u h ALA 302 CO -0.01 0.21 0.13 1.15 0.00 0.00 0.00 179.25 180.73 2f3u h THR 303 N 0.37 1.07 -0.67 0.00 2.02 -1.26 -2.52 112.91 111.92 2f3u h THR 303 Ca 0.09 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 2f3u h THR 303 Cb 0.47 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 2f3u h THR 303 CO 0.02 0.07 0.41 -0.07 0.37 0.00 0.00 175.52 176.32 2f3u h LEU 304 N 0.26 0.78 -0.82 2.58 3.38 -1.25 0.25 115.31 120.50 2f3u h LEU 304 Ca 0.07 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 2f3u h LEU 304 Cb -0.00 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 2f3u h LEU 304 CO -0.01 0.59 0.00 1.56 0.09 0.00 0.00 178.44 180.67 2f3u h GLN 305 N 0.91 0.89 -0.36 1.13 4.20 -1.36 -0.54 115.11 119.98 2f3u h GLN 305 Ca 0.24 -0.25 -0.04 0.00 0.06 0.00 0.00 58.65 58.66 2f3u h GLN 305 Cb -0.06 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.61 2f3u h GLN 305 CO -0.05 0.88 0.07 0.22 -0.67 0.00 0.00 178.83 179.28 2f3u h ASP 306 N 0.82 0.57 -0.28 1.46 -0.00 -0.88 0.15 116.42 118.25 2f3u h ASP 306 Ca 0.16 -0.25 -0.00 0.00 -0.00 0.00 0.00 57.03 56.93 2f3u h ASP 306 Cb 0.48 -0.15 -0.01 0.00 -0.00 0.00 0.00 39.33 39.65 2f3u h ASP 306 CO 0.02 0.67 0.18 0.40 -0.00 0.00 0.00 179.24 180.51 2f3u h ILE 307 N 0.44 1.09 -0.48 2.25 2.04 -0.71 -0.84 117.51 121.29 2f3u h ILE 307 Ca 0.11 -0.21 -0.12 0.00 1.00 0.00 0.00 64.86 65.64 2f3u h ILE 307 Cb 0.34 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 2f3u h ILE 307 CO 0.01 0.09 -0.15 0.40 0.00 0.00 0.00 178.15 178.49 2f3u h ILE 308 N 0.37 1.27 0.13 -0.67 2.04 -1.01 -0.82 117.51 118.82 2f3u h ILE 308 Ca 0.10 -1.31 0.01 0.00 1.00 0.00 0.00 64.86 64.67 2f3u h ILE 308 Cb -0.00 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 2f3u h ILE 308 CO -0.02 0.45 -0.20 -0.09 0.00 0.00 0.00 178.15 178.29 2f3u h ARG 309 N 0.81 -0.38 -0.62 2.37 2.43 -0.77 -0.02 114.38 118.21 2f3u h ARG 309 Ca 0.12 0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.32 2f3u h ARG 309 Cb 0.72 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.33 2f3u h ARG 309 CO 0.06 -0.25 0.41 -0.09 -1.51 0.00 0.00 179.97 178.58 2f3u h ARG 310 N -0.39 0.80 -0.42 0.20 2.43 -1.05 -1.54 114.38 114.41 2f3u h ARG 310 Ca 0.02 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.07 2f3u h ARG 310 Cb 0.40 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 2f3u h ARG 310 CO -0.09 0.53 -0.01 0.35 -1.51 0.00 0.00 179.97 179.24 2f3u h PHE 311 N 0.83 0.81 0.00 2.20 3.57 -0.40 -2.98 116.94 120.96 2f3u h PHE 311 Ca 0.23 -0.14 -0.10 0.00 3.53 0.00 0.00 57.97 61.48 2f3u h PHE 311 Cb -0.08 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 38.43 2f3u h PHE 311 CO -0.00 0.81 -0.48 0.87 -2.23 0.00 0.00 178.31 177.27 2f3u h LYS 312 N 0.57 0.00 -1.60 1.11 1.57 -0.57 -3.10 116.57 114.55 2f3u h LYS 312 Ca 0.12 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.52 2f3u h LYS 312 Cb 0.49 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 32.65 2f3u h LYS 312 CO 0.02 0.48 0.42 0.43 -0.57 0.00 0.00 179.45 180.24 2f3u n SER 313 N -3.84 6.52 -0.10 0.86 7.64 -0.62 -4.98 113.62 119.09 2f3u n SER 313 Ca -0.01 -3.12 -0.16 0.00 1.01 0.00 0.00 58.87 56.59 2f3u n SER 313 Cb 0.52 -1.09 -0.05 0.00 -1.01 0.00 0.00 64.21 62.57 2f3u n SER 313 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2f3u n SER 314 N 0.42 1.86 0.00 6.43 7.64 -1.17 -4.97 113.62 123.84 2f3u n SER 314 Ca 0.35 0.32 0.00 0.00 1.01 0.00 0.00 58.87 60.55 2f3u n SER 314 Cb 0.58 -0.73 0.00 0.00 -1.01 0.00 0.00 64.21 63.04 2f3u n SER 314 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2f3u n THR 324 N -4.31 0.00 -3.32 0.44 -1.04 -1.26 -5.08 114.28 99.71 2f3u n THR 324 Ca -0.28 0.00 -0.45 0.00 -2.04 0.00 0.00 64.05 61.28 2f3u n THR 324 Cb 0.63 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.14 2f3u n THR 324 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2f3u n ASN 325 N 1.44 5.53 0.00 8.00 4.05 -1.26 -4.84 115.26 128.19 2f3u n ASN 325 Ca 0.00 -3.04 0.09 0.00 0.45 0.00 0.00 54.58 52.08 2f3u n ASN 325 Cb 0.00 -1.39 0.46 0.00 1.23 0.00 0.00 39.78 40.08 2f3u n ASN 325 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 2f3u n PHE 326 N 2.79 0.00 0.19 1.20 3.72 -1.26 -2.48 117.46 121.61 2f3u n PHE 326 Ca 0.25 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.67 2f3u n PHE 326 Cb 0.39 -0.25 0.36 0.00 -0.94 0.00 0.00 39.48 39.04 2f3u n PHE 326 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2f3u h ASP 327 N 0.00 0.00 -0.05 4.37 5.19 -1.98 -1.94 116.42 122.01 2f3u h ASP 327 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2f3u h ASP 327 Cb 0.15 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.66 2f3u h ASP 327 CO 0.00 0.37 0.00 0.00 -3.12 0.00 0.00 179.24 176.49 2f3u n ALA 328 N -2.46 2.54 -0.13 3.45 0.00 -1.04 -4.35 120.51 118.52 2f3u n ALA 328 Ca -0.02 -0.52 -0.04 0.00 0.00 0.00 0.00 53.44 52.87 2f3u n ALA 328 Cb 0.41 -1.08 0.04 0.00 0.00 0.00 0.00 19.45 18.82 2f3u n ALA 328 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2f3u h PHE 329 N 2.81 0.04 0.00 0.00 3.04 -1.46 -0.15 116.94 121.21 2f3u h PHE 329 Ca 0.00 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.98 2f3u h PHE 329 Cb 0.60 0.05 0.00 0.00 2.56 0.00 0.00 35.95 39.16 2f3u h PHE 329 CO 0.02 -0.05 0.00 -1.35 -2.02 0.00 0.00 178.31 174.91 2f3u h PRO 330 N 0.15 0.00 0.00 6.41 0.11 -1.77 0.11 132.00 137.01 2f3u h PRO 330 Ca 0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 2f3u h PRO 330 Cb 0.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.41 2f3u h PRO 330 CO -0.33 0.00 -0.33 -0.44 -0.21 0.00 0.00 178.00 176.69 2f3u h ASP 331 N 0.00 0.00 -0.00 -2.05 3.32 -1.32 -3.34 116.42 113.04 2f3u h ASP 331 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2f3u h ASP 331 Cb 0.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.85 2f3u h ASP 331 CO 0.00 0.01 -0.28 0.29 -1.72 0.00 0.00 179.24 177.54 2f3u n LYS 332 N -2.86 4.02 -4.02 3.56 4.76 -0.73 -4.58 118.16 118.31 2f3u n LYS 332 Ca 0.03 -0.15 -0.15 0.00 -2.87 0.00 0.00 58.31 55.17 2f3u n LYS 332 Cb 0.52 -0.87 -0.15 0.00 -1.84 0.00 0.00 35.03 32.69 2f3u n LYS 332 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2f3u s VAL 333 N -1.50 0.24 -0.06 -0.18 1.01 0.31 -1.01 120.40 119.21 2f3u s VAL 333 Ca 0.04 -0.08 0.01 0.00 0.00 0.00 0.00 61.98 61.94 2f3u s VAL 333 Cb 0.05 -0.23 0.02 0.00 0.00 0.00 0.00 36.38 36.22 2f3u s VAL 333 CO 0.25 0.09 -0.07 0.00 0.00 0.00 0.00 175.10 175.37 2f3u s ALA 334 N 0.19 0.90 -0.21 5.51 0.00 -0.45 -4.51 121.76 123.19 2f3u s ALA 334 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 51.74 2f3u s ALA 334 Cb -0.04 -0.50 0.02 0.00 0.00 0.00 0.00 23.12 22.60 2f3u s ALA 334 CO -0.00 -0.00 -0.14 0.42 0.00 0.00 0.00 175.76 176.03 2f3u s ILE 335 N 0.90 2.37 -0.25 0.00 1.01 -0.12 -0.36 121.20 124.74 2f3u s ILE 335 Ca -0.11 -1.01 -0.09 0.00 0.00 0.00 0.00 60.65 59.44 2f3u s ILE 335 Cb -0.15 -2.11 -0.04 0.00 0.01 0.00 0.00 42.46 40.18 2f3u s ILE 335 CO 0.01 0.38 0.12 -1.58 0.00 0.00 0.00 174.94 173.87 2f3u s GLN 336 N 1.29 3.83 -0.34 2.79 2.00 0.10 -1.55 119.66 127.77 2f3u s GLN 336 Ca 0.02 -0.39 -0.18 0.00 -2.00 0.00 0.00 55.36 52.81 2f3u s GLN 336 Cb -0.15 -3.45 -0.01 0.00 0.80 0.00 0.00 33.01 30.21 2f3u s GLN 336 CO -0.09 -0.12 0.51 -0.51 -0.50 0.00 0.00 175.29 174.58 2f3u s LEU 337 N 1.49 4.33 -0.90 3.68 1.43 0.09 -1.58 118.68 127.22 2f3u s LEU 337 Ca 0.06 -0.00 -0.23 0.00 -1.03 0.00 0.00 54.13 52.93 2f3u s LEU 337 Cb -0.15 -2.58 0.06 0.00 0.03 0.00 0.00 46.19 43.55 2f3u s LEU 337 CO 0.06 -0.47 1.31 0.21 0.23 0.00 0.00 176.35 177.70 2f3u s ASN 338 N 1.75 6.40 0.47 2.29 2.47 -0.78 -1.91 114.94 125.62 2f3u s ASN 338 Ca 0.19 -1.24 0.00 0.00 0.42 0.00 0.00 52.86 52.22 2f3u s ASN 338 Cb -0.15 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.12 2f3u s ASN 338 CO 0.13 -1.52 0.00 -0.67 -3.72 0.00 0.00 177.10 171.32 2f3u n ASP 339 N 8.54 -2.16 -0.14 -4.21 2.03 -0.39 -4.18 116.55 116.05 2f3u n ASP 339 Ca 0.20 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.65 2f3u n ASP 339 Cb 0.50 0.00 0.49 0.00 -0.72 0.00 0.00 41.12 41.38 2f3u n ASP 339 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2f3u n THR 340 N -0.49 0.00 -0.34 5.18 -2.24 -1.26 -4.30 114.28 110.82 2f3u n THR 340 Ca 0.00 -0.07 0.16 0.00 -2.27 0.00 0.00 64.05 61.87 2f3u n THR 340 Cb 0.00 0.09 0.37 0.00 -2.10 0.00 0.00 70.33 68.70 2f3u n THR 340 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2f3u h HIS 341 N 0.69 1.00 -0.59 4.78 3.86 -1.97 0.16 115.15 123.09 2f3u h HIS 341 Ca 0.00 0.03 -0.13 0.00 -1.16 0.00 0.00 60.37 59.11 2f3u h HIS 341 Cb 0.43 -0.29 -0.08 0.00 1.06 0.00 0.00 27.41 28.53 2f3u h HIS 341 CO 0.00 0.13 0.14 -0.35 0.86 0.00 0.00 177.93 178.71 2f3u n PRO 342 N -4.81 3.66 0.21 2.45 -0.04 -1.26 -4.64 135.00 130.57 2f3u n PRO 342 Ca 0.25 -3.07 0.18 0.00 -0.04 0.00 0.00 63.50 60.82 2f3u n PRO 342 Cb 0.69 -2.13 0.83 0.00 -0.04 0.00 0.00 33.50 32.85 2f3u n PRO 342 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2f3u h SER 343 N 2.63 0.00 0.19 3.54 4.64 -0.92 -0.86 113.55 122.77 2f3u h SER 343 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 2f3u h SER 343 Cb 2.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.14 2f3u h SER 343 CO 0.57 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.71 2f3u n LEU 344 N -3.54 0.00 0.14 5.97 4.77 -1.26 -1.95 117.00 121.12 2f3u n LEU 344 Ca 0.02 0.31 0.03 0.00 -0.03 0.00 0.00 56.01 56.35 2f3u n LEU 344 Cb 0.40 -0.31 0.42 0.00 -2.33 0.00 0.00 43.42 41.60 2f3u n LEU 344 CO 0.24 -0.22 0.90 0.00 -1.33 0.00 0.00 177.39 176.98 2f3u h ALA 345 N 2.41 1.56 0.55 -1.18 0.00 -1.52 -0.83 119.26 120.26 2f3u h ALA 345 Ca 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 2f3u h ALA 345 Cb 0.10 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.82 2f3u h ALA 345 CO 0.00 0.32 -0.27 0.82 0.00 0.00 0.00 179.25 180.12 2f3u h ILE 346 N 0.18 0.32 0.00 0.00 2.04 -1.63 -0.12 117.51 118.30 2f3u h ILE 346 Ca 0.04 -0.36 -0.06 0.00 1.00 0.00 0.00 64.86 65.48 2f3u h ILE 346 Cb 0.34 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 2f3u h ILE 346 CO 0.02 0.04 -0.26 1.55 0.00 0.00 0.00 178.15 179.50 2f3u h PRO 347 N -1.01 0.00 -0.34 2.37 0.13 -1.74 -2.28 132.00 129.13 2f3u h PRO 347 Ca -0.08 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.90 2f3u h PRO 347 Cb 0.64 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.76 2f3u h PRO 347 CO 0.12 0.26 -0.41 1.49 -0.23 0.00 0.00 178.00 179.23 2f3u h GLU 348 N 0.00 0.85 -0.59 0.86 4.57 -1.11 0.41 114.58 119.57 2f3u h GLU 348 Ca -0.00 -0.46 -0.09 0.00 -1.18 0.00 0.00 59.36 57.63 2f3u h GLU 348 Cb 0.77 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.36 2f3u h GLU 348 CO 0.03 1.10 0.01 1.25 -1.18 0.00 0.00 179.01 180.23 2f3u h LEU 349 N 0.69 1.01 -0.58 1.64 5.85 -0.79 -1.36 115.31 121.77 2f3u h LEU 349 Ca 0.05 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.44 2f3u h LEU 349 Cb 0.99 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.73 2f3u h LEU 349 CO 0.10 1.06 0.24 0.24 -0.34 0.00 0.00 178.44 179.74 2f3u h MET 350 N 0.93 0.86 -0.29 1.25 2.86 -1.24 -1.44 114.93 117.85 2f3u h MET 350 Ca 0.17 -0.15 0.03 0.00 -2.06 0.00 0.00 59.70 57.69 2f3u h MET 350 Cb 0.54 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.03 2f3u h MET 350 CO 0.03 0.73 0.12 -0.09 1.06 0.00 0.00 176.91 178.75 2f3u h ARG 351 N 0.79 0.26 -0.07 1.72 2.43 -0.59 0.11 114.38 119.04 2f3u h ARG 351 Ca 0.19 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.34 2f3u h ARG 351 Cb 0.18 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.67 2f3u h ARG 351 CO -0.02 0.17 0.03 0.28 -1.51 0.00 0.00 179.97 178.92 2f3u h VAL 352 N 0.26 1.15 -0.64 0.20 2.07 -1.08 0.14 116.25 118.35 2f3u h VAL 352 Ca 0.12 -0.45 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 2f3u h VAL 352 Cb 0.07 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 2f3u h VAL 352 CO -0.11 0.13 0.27 -0.07 0.02 0.00 0.00 177.57 177.81 2f3u h LEU 353 N -0.06 0.87 0.00 2.57 3.38 -1.07 0.39 115.31 121.40 2f3u h LEU 353 Ca 0.02 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2f3u h LEU 353 Cb 0.18 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 2f3u h LEU 353 CO -0.00 0.80 -0.14 0.58 0.09 0.00 0.00 178.44 179.76 2f3u h VAL 354 N 0.90 0.78 -0.18 1.22 2.07 -0.76 0.11 116.25 120.38 2f3u h VAL 354 Ca 0.22 -1.62 -0.21 0.00 0.82 0.00 0.00 66.70 65.91 2f3u h VAL 354 Cb 0.19 1.50 0.01 0.00 -1.52 0.00 0.00 31.29 31.46 2f3u h VAL 354 CO -0.02 0.26 -0.70 0.44 0.02 0.00 0.00 177.57 177.57 2f3u h ASP 355 N -1.00 0.88 0.01 0.57 3.45 -0.85 -2.93 116.42 116.55 2f3u h ASP 355 Ca -0.03 -0.54 -0.40 0.00 0.43 0.00 0.00 57.03 56.48 2f3u h ASP 355 Cb 0.54 -0.26 -0.07 0.00 -0.56 0.00 0.00 39.33 38.98 2f3u h ASP 355 CO -0.02 1.33 -2.43 0.18 -1.57 0.00 0.00 179.24 176.74 2f3u n LEU 356 N -3.94 2.65 0.01 1.55 4.77 -0.62 -4.50 117.00 116.91 2f3u n LEU 356 Ca -0.06 0.03 0.12 0.00 -0.03 0.00 0.00 56.01 56.07 2f3u n LEU 356 Cb 0.70 -0.90 0.27 0.00 -2.33 0.00 0.00 43.42 41.16 2f3u n LEU 356 CO 0.51 0.82 0.48 -0.62 -1.33 0.00 0.00 177.39 177.25 2f3u n GLU 357 N -3.57 0.06 -2.24 3.23 -0.58 0.03 -4.97 120.64 112.60 2f3u n GLU 357 Ca -0.47 0.02 -0.14 0.00 -0.42 0.00 0.00 57.16 56.14 2f3u n GLU 357 Cb 0.96 -1.54 -0.01 0.00 -0.57 0.00 0.00 31.44 30.28 2f3u n GLU 357 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2f3u n ARG 358 N -1.62 -1.14 -2.54 3.49 5.12 -0.60 -4.95 116.66 114.42 2f3u n ARG 358 Ca 0.05 0.71 -0.32 0.00 -1.93 0.00 0.00 57.85 56.36 2f3u n ARG 358 Cb 0.36 -5.00 -0.04 0.00 -1.16 0.00 0.00 32.46 26.61 2f3u n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2f3u s LEU 359 N -4.09 3.72 0.57 0.55 1.02 0.28 -4.97 118.68 115.77 2f3u s LEU 359 Ca 0.00 1.59 -0.17 0.00 0.02 0.00 0.00 54.13 55.57 2f3u s LEU 359 Cb 0.00 -4.50 -0.05 0.00 0.02 0.00 0.00 46.19 41.66 2f3u s LEU 359 CO 0.00 -0.51 1.08 1.51 0.02 0.00 0.00 176.35 178.44 2f3u s ASP 360 N -2.81 5.79 0.14 2.29 -4.77 -1.26 -4.37 116.67 111.69 2f3u s ASP 360 Ca 0.60 1.94 -0.29 0.00 -3.30 0.00 0.00 52.55 51.50 2f3u s ASP 360 Cb -0.10 -2.55 -0.03 0.00 -1.09 0.00 0.00 42.92 39.15 2f3u s ASP 360 CO 0.26 -1.16 1.57 -0.25 0.70 0.00 0.00 175.17 176.29 2f3u h TRP 361 N 0.79 -1.33 -0.84 2.11 2.91 -1.97 -1.27 115.95 116.35 2f3u h TRP 361 Ca -0.48 0.07 0.14 0.00 1.13 0.00 0.00 58.89 59.75 2f3u h TRP 361 Cb 1.23 0.63 -0.09 0.00 -0.51 0.00 0.00 29.16 30.42 2f3u h TRP 361 CO 0.56 -0.46 0.43 -0.44 -1.03 0.00 0.00 178.44 177.50 2f3u h ASP 362 N -0.39 0.53 -0.22 2.65 3.45 -1.99 0.13 116.42 120.58 2f3u h ASP 362 Ca 0.11 0.09 -0.06 0.00 0.43 0.00 0.00 57.03 57.60 2f3u h ASP 362 Cb 0.60 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.37 2f3u h ASP 362 CO -0.53 0.23 -0.08 0.50 -1.57 0.00 0.00 179.24 177.78 2f3u h LYS 363 N 0.63 0.44 -0.78 3.56 1.63 -1.82 -2.22 116.57 118.01 2f3u h LYS 363 Ca 0.46 -0.18 0.03 0.00 -0.85 0.00 0.00 60.65 60.10 2f3u h LYS 363 Cb 0.63 -0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 32.20 2f3u h LYS 363 CO -0.35 0.70 0.50 0.00 -3.45 0.00 0.00 179.45 176.85 2f3u h ALA 364 N 0.73 1.02 -0.62 5.00 0.00 -0.40 -1.99 119.26 122.98 2f3u h ALA 364 Ca 0.05 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2f3u h ALA 364 Cb 0.56 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 2f3u h ALA 364 CO 0.03 0.33 0.22 2.35 0.00 0.00 0.00 179.25 182.18 2f3u h TRP 365 N 0.99 0.98 -0.28 0.00 2.91 -0.70 -0.46 115.95 119.38 2f3u h TRP 365 Ca 0.31 -0.09 0.02 0.00 1.13 0.00 0.00 58.89 60.26 2f3u h TRP 365 Cb -0.02 -0.29 -0.02 0.00 -0.51 0.00 0.00 29.16 28.32 2f3u h TRP 365 CO -0.03 0.79 0.13 1.49 -1.03 0.00 0.00 178.44 179.79 2f3u h GLU 366 N 0.88 0.28 -0.41 2.65 4.81 -0.97 -0.67 114.58 121.15 2f3u h GLU 366 Ca 0.20 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.40 2f3u h GLU 366 Cb 0.25 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 2f3u h GLU 366 CO -0.01 0.18 0.18 0.28 -0.73 0.00 0.00 179.01 178.91 2f3u h VAL 367 N 0.29 1.19 -0.03 0.32 2.07 -1.14 -2.28 116.25 116.66 2f3u h VAL 367 Ca 0.11 -0.56 0.01 0.00 0.82 0.00 0.00 66.70 67.08 2f3u h VAL 367 Cb 0.04 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 2f3u h VAL 367 CO -0.08 0.21 -0.01 0.74 0.02 0.00 0.00 177.57 178.45 2f3u h THR 368 N 0.53 0.97 -0.66 2.57 2.02 -0.74 -1.64 112.91 115.95 2f3u h THR 368 Ca 0.14 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.32 2f3u h THR 368 Cb 0.16 0.97 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 2f3u h THR 368 CO -0.01 0.00 0.42 0.58 0.37 0.00 0.00 175.52 176.88 2f3u h VAL 369 N 0.00 1.18 0.00 3.16 2.07 -1.09 -1.34 116.25 120.23 2f3u h VAL 369 Ca 0.02 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.18 2f3u h VAL 369 Cb 0.02 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.03 2f3u h VAL 369 CO -0.03 0.18 0.00 0.11 0.02 0.00 0.00 177.57 177.85 2f3u h LYS 370 N 0.90 0.00 0.13 1.57 1.57 -1.24 -2.04 116.57 117.46 2f3u h LYS 370 Ca 0.24 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.67 2f3u h LYS 370 Cb -0.07 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 2f3u h LYS 370 CO -0.05 0.00 -1.91 1.15 -0.57 0.00 0.00 179.45 178.07 2f3u h THR 371 N 0.00 0.72 -3.22 -0.16 2.02 -0.67 -3.47 112.91 108.13 2f3u h THR 371 Ca 0.00 -2.42 -0.57 0.00 0.77 0.00 0.00 66.41 64.18 2f3u h THR 371 Cb 0.48 2.56 -0.04 0.00 -1.74 0.00 0.00 68.15 69.41 2f3u h THR 371 CO 0.00 0.86 -0.16 0.00 0.37 0.00 0.00 175.52 176.59 2f3u s ALA 373 N -1.43 0.06 -0.06 0.00 0.00 -0.60 -1.48 121.76 118.26 2f3u s ALA 373 Ca 0.35 -0.20 0.04 0.00 0.00 0.00 0.00 51.96 52.16 2f3u s ALA 373 Cb -0.15 0.04 -0.00 0.00 0.00 0.00 0.00 23.12 23.02 2f3u s ALA 373 CO 0.19 -0.05 -0.20 -0.47 0.00 0.00 0.00 175.76 175.23 2f3u s TYR 374 N -0.48 2.01 -0.19 0.00 6.14 -0.06 -0.73 117.35 124.05 2f3u s TYR 374 Ca -0.05 -0.65 -0.03 0.00 0.64 0.00 0.00 57.07 56.98 2f3u s TYR 374 Cb -0.03 -1.35 -0.01 0.00 0.42 0.00 0.00 41.96 40.98 2f3u s TYR 374 CO -0.00 -0.24 -0.06 0.99 0.64 0.00 0.00 175.55 176.88 2f3u s THR 375 N 0.12 3.41 -0.06 4.34 2.01 -0.80 -1.55 115.64 123.11 2f3u s THR 375 Ca -0.08 -0.50 -0.12 0.00 0.31 0.00 0.00 61.69 61.30 2f3u s THR 375 Cb -0.14 -2.51 -0.05 0.00 0.01 0.00 0.00 72.50 69.81 2f3u s THR 375 CO 0.04 0.46 0.31 0.21 -0.69 0.00 0.00 174.62 174.95 2f3u s ASN 376 N 0.98 6.62 0.00 3.53 3.84 -0.59 -1.26 114.94 128.06 2f3u s ASN 376 Ca -0.00 0.74 0.02 0.00 0.21 0.00 0.00 52.86 53.83 2f3u s ASN 376 Cb -0.15 -2.19 0.03 0.00 -0.55 0.00 0.00 41.25 38.40 2f3u s ASN 376 CO 0.00 0.31 0.84 1.41 -2.79 0.00 0.00 177.10 176.87 2f3u n HIS 377 N 2.19 0.04 -3.55 0.43 8.25 -1.26 -4.11 115.22 117.21 2f3u n HIS 377 Ca -0.15 -0.29 -0.08 0.00 -0.26 0.00 0.00 57.72 56.93 2f3u n HIS 377 Cb 0.53 -0.03 -0.03 0.00 1.12 0.00 0.00 29.99 31.58 2f3u n HIS 377 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2f3u s THR 378 N -0.64 0.00 -0.47 1.59 -1.32 -1.26 -4.60 115.64 108.94 2f3u s THR 378 Ca 0.03 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.55 2f3u s THR 378 Cb 0.02 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 70.03 2f3u s THR 378 CO 0.02 0.00 0.57 1.33 -2.21 0.00 0.00 174.62 174.33 2f3u n VAL 379 N 0.16 0.00 -1.99 5.08 0.24 -1.26 -4.99 118.33 115.57 2f3u n VAL 379 Ca -0.07 -0.49 -0.42 0.00 -2.04 0.00 0.00 64.34 61.32 2f3u n VAL 379 Cb 0.60 1.07 -0.03 0.00 -1.47 0.00 0.00 33.84 34.01 2f3u n VAL 379 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2f3u s LEU 380 N -0.57 4.35 0.30 1.34 1.43 -1.26 -4.91 118.68 119.36 2f3u s LEU 380 Ca 0.04 2.41 0.01 0.00 -1.03 0.00 0.00 54.13 55.57 2f3u s LEU 380 Cb 0.03 -3.56 0.55 0.00 0.03 0.00 0.00 46.19 43.24 2f3u s LEU 380 CO 0.06 -0.85 1.89 1.55 0.23 0.00 0.00 176.35 179.23 2f3u h PRO 381 N 8.16 0.98 0.00 1.29 0.13 -1.98 -2.03 132.00 138.55 2f3u h PRO 381 Ca -0.42 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2f3u h PRO 381 Cb 1.20 -0.22 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2f3u h PRO 381 CO 0.92 0.65 0.00 -0.85 -0.23 0.00 0.00 178.00 178.49 2f3u n GLU 382 N -4.53 0.04 0.04 0.86 0.00 -1.26 -2.65 120.64 113.14 2f3u n GLU 382 Ca 0.16 0.30 0.11 0.00 0.00 0.00 0.00 57.16 57.73 2f3u n GLU 382 Cb 0.26 -1.59 -0.04 0.00 0.00 0.00 0.00 31.44 30.08 2f3u n GLU 382 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2f3u n ALA 383 N -1.56 3.04 -1.94 -1.84 0.00 -0.77 -0.95 120.51 116.49 2f3u n ALA 383 Ca 0.03 -0.39 -0.41 0.00 0.00 0.00 0.00 53.44 52.67 2f3u n ALA 383 Cb 0.17 -0.95 -0.03 0.00 0.00 0.00 0.00 19.45 18.64 2f3u n ALA 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2f3u s LEU 384 N -4.45 4.45 -0.21 0.00 1.43 -1.09 -4.21 118.68 114.60 2f3u s LEU 384 Ca -0.00 2.40 -0.28 0.00 -1.03 0.00 0.00 54.13 55.21 2f3u s LEU 384 Cb 0.13 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.73 2f3u s LEU 384 CO 0.83 -0.44 1.00 -1.61 0.23 0.00 0.00 176.35 176.36 2f3u s GLU 385 N -0.64 4.28 -0.36 1.70 2.02 -1.26 -4.78 118.70 119.66 2f3u s GLU 385 Ca 0.53 1.29 0.00 0.00 0.02 0.00 0.00 54.97 56.81 2f3u s GLU 385 Cb -0.36 -3.62 0.13 0.00 0.10 0.00 0.00 34.13 30.39 2f3u s GLU 385 CO 0.41 -0.54 0.20 1.03 0.02 0.00 0.00 175.26 176.37 2f3u s ARG 386 N 2.88 0.73 0.07 1.61 0.52 -1.26 -1.96 118.95 121.54 2f3u s ARG 386 Ca 0.43 -1.40 -0.30 0.00 -0.52 0.00 0.00 55.73 53.95 2f3u s ARG 386 Cb -0.16 -1.64 -0.05 0.00 0.52 0.00 0.00 34.95 33.62 2f3u s ARG 386 CO 0.09 -1.15 0.98 -1.58 0.02 0.00 0.00 175.30 173.66 2f3u s TRP 387 N 1.05 3.74 0.25 -0.53 0.52 -0.92 -4.70 118.94 118.35 2f3u s TRP 387 Ca 0.16 1.74 -0.31 0.00 0.02 0.00 0.00 56.10 57.72 2f3u s TRP 387 Cb -0.22 -3.10 -0.11 0.00 -1.15 0.00 0.00 33.47 28.89 2f3u s TRP 387 CO -0.06 0.06 1.62 -2.14 0.02 0.00 0.00 176.95 176.45 2f3u s PRO 388 N 0.39 4.14 0.40 4.98 0.02 -1.26 -0.63 135.00 143.04 2f3u s PRO 388 Ca 0.49 2.55 0.09 0.00 0.02 0.00 0.00 61.00 64.16 2f3u s PRO 388 Cb -0.23 -3.06 0.88 0.00 0.02 0.00 0.00 34.50 32.12 2f3u s PRO 388 CO 0.29 -0.66 1.99 0.28 -0.33 0.00 0.00 177.00 178.58 2f3u h VAL 389 N 3.59 0.99 0.00 3.83 2.07 -1.47 -1.57 116.25 123.70 2f3u h VAL 389 Ca -0.45 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 2f3u h VAL 389 Cb 1.21 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2f3u h VAL 389 CO 0.86 0.10 -0.10 1.12 0.02 0.00 0.00 177.57 179.57 2f3u h HIS 390 N 0.57 0.00 -0.01 1.57 2.07 -1.90 0.18 115.15 117.63 2f3u h HIS 390 Ca 0.26 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.74 2f3u h HIS 390 Cb 0.29 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.27 2f3u h HIS 390 CO -0.00 0.10 -0.15 -0.07 -3.07 0.00 0.00 177.93 174.73 2f3u h LEU 391 N 0.00 0.15 -0.92 6.12 3.38 -1.66 -2.93 115.31 119.45 2f3u h LEU 391 Ca -0.00 -0.75 -0.06 0.00 0.09 0.00 0.00 57.88 57.16 2f3u h LEU 391 Cb 0.26 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 2f3u h LEU 391 CO 0.01 0.88 0.13 -0.07 0.09 0.00 0.00 178.44 179.48 2f3u h LEU 392 N -0.57 0.87 -0.79 1.67 3.38 -1.39 -0.12 115.31 118.36 2f3u h LEU 392 Ca -0.02 -0.17 0.07 0.00 0.09 0.00 0.00 57.88 57.85 2f3u h LEU 392 Cb 0.90 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.36 2f3u h LEU 392 CO 0.03 0.86 0.46 -0.08 0.09 0.00 0.00 178.44 179.80 2f3u h GLU 393 N 0.88 0.79 0.15 1.13 4.81 -0.70 0.18 114.58 121.83 2f3u h GLU 393 Ca 0.19 -0.05 -0.29 0.00 -0.13 0.00 0.00 59.36 59.08 2f3u h GLU 393 Cb 0.34 -0.18 0.01 0.00 0.63 0.00 0.00 28.75 29.55 2f3u h GLU 393 CO 0.00 0.53 -1.45 1.15 -0.73 0.00 0.00 179.01 178.51 2f3u h THR 394 N 0.82 1.08 0.24 0.32 2.02 -1.29 -3.30 112.91 112.80 2f3u h THR 394 Ca 0.36 -2.48 -0.33 0.00 0.77 0.00 0.00 66.41 64.73 2f3u h THR 394 Cb 0.24 2.82 0.03 0.00 -1.74 0.00 0.00 68.15 69.51 2f3u h THR 394 CO -0.20 0.76 -1.47 0.25 0.37 0.00 0.00 175.52 175.23 2f3u h LEU 395 N -0.15 0.78 -5.98 2.58 5.85 -0.97 -3.38 115.31 114.05 2f3u h LEU 395 Ca -0.29 -0.93 -0.54 0.00 0.84 0.00 0.00 57.88 56.96 2f3u h LEU 395 Cb 1.89 -0.25 -0.40 0.00 0.37 0.00 0.00 40.66 42.27 2f3u h LEU 395 CO 0.13 1.70 -1.06 0.18 -0.34 0.00 0.00 178.44 179.04 2f3u n LEU 396 N -3.74 0.94 -0.35 2.25 4.77 0.63 -0.80 117.00 120.70 2f3u n LEU 396 Ca -0.18 -4.91 0.11 0.00 -0.03 0.00 0.00 56.01 51.00 2f3u n LEU 396 Cb 1.08 0.48 0.31 0.00 -2.33 0.00 0.00 43.42 42.95 2f3u n LEU 396 CO 0.58 2.15 1.21 1.55 -1.33 0.00 0.00 177.39 181.55 2f3u h PRO 397 N 3.65 0.80 -0.37 3.23 0.13 -1.60 -1.85 132.00 135.99 2f3u h PRO 397 Ca 0.09 -0.05 -0.15 0.00 -0.87 0.00 0.00 66.00 65.03 2f3u h PRO 397 Cb 0.87 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 31.81 2f3u h PRO 397 CO 0.53 0.53 -0.36 -0.09 -0.23 0.00 0.00 178.00 178.38 2f3u h ARG 398 N 0.82 0.87 -0.38 0.86 9.65 -1.91 -2.87 114.38 121.41 2f3u h ARG 398 Ca 0.54 -0.43 -0.07 0.00 -1.10 0.00 0.00 59.98 58.92 2f3u h ARG 398 Cb 0.77 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 29.33 2f3u h ARG 398 CO -0.33 1.08 -0.04 0.45 2.80 0.00 0.00 179.97 183.93 2f3u h HIS 399 N 0.72 0.67 -0.40 2.20 3.86 -1.72 -1.78 115.15 118.70 2f3u h HIS 399 Ca 0.07 -0.09 -0.02 0.00 -1.16 0.00 0.00 60.37 59.17 2f3u h HIS 399 Cb 0.93 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 29.19 2f3u h HIS 399 CO 0.05 0.67 0.19 1.25 0.86 0.00 0.00 177.93 180.95 2f3u h LEU 400 N 0.59 0.52 -0.66 2.43 6.46 -1.29 0.56 115.31 123.93 2f3u h LEU 400 Ca 0.12 -0.13 0.01 0.00 -0.12 0.00 0.00 57.88 57.76 2f3u h LEU 400 Cb 0.44 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 40.20 2f3u h LEU 400 CO 0.02 0.51 0.43 1.56 -0.62 0.00 0.00 178.44 180.34 2f3u h GLN 401 N 0.50 0.86 -0.56 1.25 4.20 -1.25 -1.02 115.11 119.09 2f3u h GLN 401 Ca 0.14 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.72 2f3u h GLN 401 Cb 0.12 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 2f3u h GLN 401 CO -0.02 0.57 0.05 0.82 -0.67 0.00 0.00 178.83 179.59 2f3u h ILE 402 N 0.88 1.25 -0.62 2.54 2.04 -0.96 -2.24 117.51 120.41 2f3u h ILE 402 Ca 0.24 -1.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.02 2f3u h ILE 402 Cb -0.09 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 2f3u h ILE 402 CO -0.06 0.36 0.07 0.40 0.00 0.00 0.00 178.15 178.93 2f3u h ILE 403 N 0.86 1.26 -0.62 -0.67 2.04 -0.24 -0.88 117.51 119.27 2f3u h ILE 403 Ca 0.17 -1.04 -0.06 0.00 1.00 0.00 0.00 64.86 64.93 2f3u h ILE 403 Cb 0.43 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 2f3u h ILE 403 CO 0.01 0.39 0.17 1.88 0.00 0.00 0.00 178.15 180.60 2f3u h TYR 404 N 0.96 1.02 -0.67 1.37 0.05 -0.95 -0.56 116.97 118.19 2f3u h TYR 404 Ca 0.19 -0.11 -0.06 0.00 0.05 0.00 0.00 58.73 58.79 2f3u h TYR 404 Cb 0.46 -0.29 -0.03 0.00 1.01 0.00 0.00 36.73 37.88 2f3u h TYR 404 CO 0.03 0.85 0.20 1.49 -1.05 0.00 0.00 178.16 179.68 2f3u h GLU 405 N 0.90 1.05 -0.33 4.88 4.57 -1.16 0.09 114.58 124.59 2f3u h GLU 405 Ca 0.20 -0.24 -0.01 0.00 -1.18 0.00 0.00 59.36 58.13 2f3u h GLU 405 Cb 0.33 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.76 2f3u h GLU 405 CO -0.00 0.92 0.15 0.82 -1.18 0.00 0.00 179.01 179.73 2f3u h ILE 406 N 0.99 1.17 -0.59 2.32 2.04 -0.89 -1.91 117.51 120.63 2f3u h ILE 406 Ca 0.21 -0.48 0.02 0.00 1.00 0.00 0.00 64.86 65.61 2f3u h ILE 406 Cb 0.32 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 2f3u h ILE 406 CO -0.00 0.17 0.38 -1.13 0.00 0.00 0.00 178.15 177.57 2f3u h ASN 407 N 0.40 0.63 -0.02 1.72 -1.24 -0.74 -0.23 115.58 116.10 2f3u h ASN 407 Ca 0.11 -0.01 0.01 0.00 0.71 0.00 0.00 56.30 57.12 2f3u h ASN 407 Cb 0.13 -0.14 -0.01 0.00 0.73 0.00 0.00 38.32 39.03 2f3u h ASN 407 CO -0.01 0.45 -0.02 -0.61 -1.29 0.00 0.00 177.43 175.95 2f3u h GLN 408 N 0.75 -0.02 -0.13 6.67 4.15 -0.76 0.30 115.11 126.08 2f3u h GLN 408 Ca 0.23 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 59.54 2f3u h GLN 408 Cb -0.03 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.66 2f3u h GLN 408 CO -0.08 -0.01 -0.41 0.00 -1.93 0.00 0.00 178.83 176.40 2f3u h ARG 409 N -0.02 0.29 -0.08 1.69 3.08 -1.18 -2.32 114.38 115.84 2f3u h ARG 409 Ca 0.02 -0.14 -0.02 0.00 0.07 0.00 0.00 59.98 59.90 2f3u h ARG 409 Cb 0.04 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 2f3u h ARG 409 CO -0.03 0.65 -0.04 0.35 -1.07 0.00 0.00 179.97 179.82 2f3u h PHE 410 N 0.24 0.20 0.00 3.04 3.57 -0.75 -2.87 116.94 120.37 2f3u h PHE 410 Ca 0.02 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 2f3u h PHE 410 Cb 0.83 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.51 2f3u h PHE 410 CO 0.02 0.55 -0.13 -0.07 -2.23 0.00 0.00 178.31 176.44 2f3u h LEU 411 N -0.20 0.00 -0.76 0.59 3.38 -0.89 -0.94 115.31 116.49 2f3u h LEU 411 Ca 0.02 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 2f3u h LEU 411 Cb 0.49 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2f3u h LEU 411 CO 0.01 0.13 -0.36 0.78 0.09 0.00 0.00 178.44 179.09 2f3u h ASN 412 N 0.00 0.55 -0.36 -0.43 -0.26 -1.30 0.05 115.58 113.83 2f3u h ASN 412 Ca -0.00 -0.23 -0.14 0.00 -0.56 0.00 0.00 56.30 55.38 2f3u h ASN 412 Cb 0.36 -0.15 -0.01 0.00 -1.06 0.00 0.00 38.32 37.45 2f3u h ASN 412 CO 0.02 0.86 -0.29 0.03 -1.06 0.00 0.00 177.43 176.99 2f3u h ARG 413 N 0.44 0.88 -0.22 0.81 3.08 -0.98 -1.97 114.38 116.42 2f3u h ARG 413 Ca 0.05 -0.41 -0.04 0.00 0.07 0.00 0.00 59.98 59.65 2f3u h ARG 413 Cb 0.83 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.86 2f3u h ARG 413 CO 0.07 1.05 -0.01 0.28 -1.07 0.00 0.00 179.97 180.29 2f3u h VAL 414 N 0.75 1.26 -0.71 2.04 2.07 -1.08 -2.19 116.25 118.39 2f3u h VAL 414 Ca 0.08 -0.91 0.05 0.00 0.82 0.00 0.00 66.70 66.74 2f3u h VAL 414 Cb 0.85 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 32.01 2f3u h VAL 414 CO 0.07 0.28 0.47 0.00 0.02 0.00 0.00 177.57 178.41 2f3u h ALA 415 N 0.79 1.65 0.00 1.67 0.00 -0.91 0.16 119.26 122.63 2f3u h ALA 415 Ca 0.06 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 2f3u h ALA 415 Cb 0.42 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2f3u h ALA 415 CO 0.01 0.26 -0.53 0.00 0.00 0.00 0.00 179.25 178.99 2f3u h ALA 416 N 1.60 0.82 0.01 0.00 0.00 -1.20 -2.42 119.26 118.08 2f3u h ALA 416 Ca 0.29 -0.48 -0.27 0.00 0.00 0.00 0.00 54.91 54.45 2f3u h ALA 416 Cb 0.16 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 2f3u h ALA 416 CO -0.09 0.66 -1.53 0.00 0.00 0.00 0.00 179.25 178.29 2f3u h ALA 417 N 1.47 0.63 -2.09 0.00 0.00 -0.65 -3.40 119.26 115.22 2f3u h ALA 417 Ca -0.01 -1.31 -0.57 0.00 0.00 0.00 0.00 54.91 53.03 2f3u h ALA 417 Cb 1.17 0.32 -0.40 0.00 0.00 0.00 0.00 17.79 18.88 2f3u h ALA 417 CO 0.07 1.47 -0.90 1.19 0.00 0.00 0.00 179.25 181.08 2f3u n PHE 418 N -3.16 1.52 -1.63 0.00 3.72 0.48 -5.10 117.46 113.30 2f3u n PHE 418 Ca -0.13 -3.84 -0.50 0.00 -0.05 0.00 0.00 57.45 52.93 2f3u n PHE 418 Cb 1.02 -0.44 -0.05 0.00 -0.94 0.00 0.00 39.48 39.07 2f3u n PHE 418 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 2f3u n PRO 419 N 0.90 1.58 0.00 -1.08 -0.02 -0.91 -1.95 135.00 133.52 2f3u n PRO 419 Ca 0.26 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 2f3u n PRO 419 Cb 0.49 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 2f3u n PRO 419 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2f3u n GLY 420 N 2.94 2.74 3.38 -1.23 0.00 -1.26 -4.94 105.19 106.82 2f3u n GLY 420 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 2f3u n GLY 420 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2f3u n ASP 421 N 0.00 4.72 0.10 1.61 4.64 -0.82 -4.77 116.55 122.03 2f3u n ASP 421 Ca 0.00 -2.91 0.02 0.00 -1.38 0.00 0.00 54.79 50.52 2f3u n ASP 421 Cb 0.00 -1.72 0.37 0.00 -1.04 0.00 0.00 41.12 38.73 2f3u n ASP 421 CO 0.00 0.00 0.00 -0.37 -0.82 0.00 0.00 177.20 176.01 2f3u h VAL 422 N 5.16 1.19 -0.21 5.18 -1.51 -1.92 -2.83 116.25 121.31 2f3u h VAL 422 Ca 0.47 -0.84 -0.13 0.00 -1.23 0.00 0.00 66.70 64.98 2f3u h VAL 422 Cb 0.82 1.21 -0.01 0.00 -2.13 0.00 0.00 31.29 31.18 2f3u h VAL 422 CO 1.55 0.26 -0.40 -0.78 -1.23 0.00 0.00 177.57 176.97 2f3u h ASP 423 N 0.26 0.51 -0.90 4.19 3.58 -2.00 -2.67 116.42 119.39 2f3u h ASP 423 Ca 0.05 -0.22 -0.02 0.00 0.42 0.00 0.00 57.03 57.26 2f3u h ASP 423 Cb 0.40 -0.14 -0.04 0.00 1.72 0.00 0.00 39.33 41.26 2f3u h ASP 423 CO 0.02 0.86 0.50 -0.09 -2.88 0.00 0.00 179.24 177.66 2f3u h ARG 424 N 0.40 1.25 -0.46 0.28 2.43 -1.91 -0.38 114.38 116.00 2f3u h ARG 424 Ca 0.04 -0.14 0.02 0.00 -0.81 0.00 0.00 59.98 59.08 2f3u h ARG 424 Cb 0.88 -0.25 -0.03 0.00 -0.42 0.00 0.00 29.97 30.15 2f3u h ARG 424 CO 0.07 0.91 0.27 -0.07 -1.51 0.00 0.00 179.97 179.65 2f3u h LEU 425 N 1.26 0.44 -0.76 3.80 3.38 -1.36 0.11 115.31 122.17 2f3u h LEU 425 Ca 0.32 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 58.16 2f3u h LEU 425 Cb 0.02 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2f3u h LEU 425 CO -0.05 0.31 -0.62 0.08 0.09 0.00 0.00 178.44 178.25 2f3u h ARG 426 N 0.54 0.00 -0.10 1.13 -0.00 -1.21 -2.17 114.38 112.58 2f3u h ARG 426 Ca 0.19 -0.00 -0.16 0.00 -0.00 0.00 0.00 59.98 60.00 2f3u h ARG 426 Cb 0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 29.98 2f3u h ARG 426 CO -0.09 0.62 -0.64 0.00 -0.00 0.00 0.00 179.97 179.87 2f3u h ARG 427 N 0.00 0.38 -0.00 0.08 3.08 -0.45 -3.26 114.38 114.21 2f3u h ARG 427 Ca -0.01 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2f3u h ARG 427 Cb 1.10 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.19 2f3u h ARG 427 CO 0.08 0.89 -0.53 -1.33 -1.07 0.00 0.00 179.97 178.01 2f3u n MET 428 N -3.88 0.25 -1.66 0.04 2.81 0.31 -4.96 117.12 110.03 2f3u n MET 428 Ca -0.03 -0.17 -0.39 0.00 -1.81 0.00 0.00 57.70 55.30 2f3u n MET 428 Cb 0.65 -1.50 0.04 0.00 -0.71 0.00 0.00 33.22 31.70 2f3u n MET 428 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2f3u n SER 429 N -1.23 1.64 0.21 7.83 2.88 -0.82 -4.87 113.62 119.26 2f3u n SER 429 Ca 0.07 0.93 0.12 0.00 -1.33 0.00 0.00 58.87 58.66 2f3u n SER 429 Cb 0.34 -1.45 0.19 0.00 -0.75 0.00 0.00 64.21 62.54 2f3u n SER 429 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2f3u h LEU 430 N 1.12 0.00 -8.88 2.46 3.38 -1.91 -3.43 115.31 108.06 2f3u h LEU 430 Ca -0.48 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 56.85 2f3u h LEU 430 Cb 1.33 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.91 2f3u h LEU 430 CO 0.55 0.00 -0.53 -0.69 0.09 0.00 0.00 178.44 177.85 2f3u s VAL 431 N -3.20 5.19 -0.17 1.22 1.01 -1.26 0.06 120.40 123.24 2f3u s VAL 431 Ca 0.07 0.13 -0.11 0.00 0.00 0.00 0.00 61.98 62.07 2f3u s VAL 431 Cb 0.06 -3.46 -0.05 0.00 0.00 0.00 0.00 36.38 32.93 2f3u s VAL 431 CO 0.66 0.27 0.20 -1.61 0.00 0.00 0.00 175.10 174.62 2f3u s GLU 432 N 1.71 4.12 0.47 2.72 2.02 0.91 -4.96 118.70 125.68 2f3u s GLU 432 Ca 0.07 -0.07 0.00 0.00 0.02 0.00 0.00 54.97 54.99 2f3u s GLU 432 Cb -0.16 -3.39 0.00 0.00 0.10 0.00 0.00 34.13 30.69 2f3u s GLU 432 CO 0.10 0.35 0.70 -2.00 0.02 0.00 0.00 175.26 174.42 2f3u s GLU 433 N 0.19 3.00 0.00 1.61 2.56 -1.26 -1.75 118.70 123.04 2f3u s GLU 433 Ca 0.13 -0.49 0.00 0.00 0.00 0.00 0.00 54.97 54.60 2f3u s GLU 433 Cb -0.12 -2.53 0.00 0.00 2.00 0.00 0.00 34.13 33.48 2f3u s GLU 433 CO 0.01 -0.34 0.00 0.41 -0.56 0.00 0.00 175.26 174.78 2f3u n GLY 434 N -2.14 0.93 0.16 -1.50 0.00 -1.26 -4.90 105.19 96.49 2f3u n GLY 434 Ca 0.02 -1.84 -0.04 0.00 0.00 0.00 0.00 46.02 44.16 2f3u n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f3u n ALA 435 N -1.00 -0.24 -3.01 4.61 0.00 -1.26 -4.22 120.51 115.39 2f3u n ALA 435 Ca 0.00 0.33 -0.29 0.00 0.00 0.00 0.00 53.44 53.48 2f3u n ALA 435 Cb 0.00 0.19 -0.16 0.00 0.00 0.00 0.00 19.45 19.48 2f3u n ALA 435 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2f3u s VAL 436 N -4.07 1.68 0.34 0.00 -7.23 -1.26 -5.11 120.40 104.75 2f3u s VAL 436 Ca -0.05 -0.84 -0.28 0.00 -1.81 0.00 0.00 61.98 59.00 2f3u s VAL 436 Cb 0.04 -1.45 -0.10 0.00 0.56 0.00 0.00 36.38 35.43 2f3u s VAL 436 CO 0.24 0.48 1.29 -0.54 -0.31 0.00 0.00 175.10 176.26 2f3u s LYS 437 N 0.14 4.33 0.12 4.82 1.02 -1.26 -4.83 119.74 124.07 2f3u s LYS 437 Ca -0.09 2.18 0.02 0.00 0.02 0.00 0.00 55.97 58.11 2f3u s LYS 437 Cb -0.14 -3.04 -0.04 0.00 -0.52 0.00 0.00 37.83 34.08 2f3u s LYS 437 CO 0.04 -0.19 -0.06 1.03 -0.92 0.00 0.00 175.35 175.25 2f3u s ARG 438 N -1.83 0.91 -0.19 1.68 0.52 -0.72 -1.15 118.95 118.17 2f3u s ARG 438 Ca 0.49 -1.38 -0.05 0.00 -0.52 0.00 0.00 55.73 54.27 2f3u s ARG 438 Cb -0.39 -0.26 -0.03 0.00 0.52 0.00 0.00 34.95 34.79 2f3u s ARG 438 CO 0.52 -0.03 0.00 0.42 0.02 0.00 0.00 175.30 176.23 2f3u s ILE 439 N -3.60 4.06 -0.48 1.52 -1.09 0.20 -0.06 121.20 121.74 2f3u s ILE 439 Ca 0.15 -0.28 -0.25 0.00 -2.23 0.00 0.00 60.65 58.03 2f3u s ILE 439 Cb 0.05 -2.83 0.03 0.00 -1.58 0.00 0.00 42.46 38.13 2f3u s ILE 439 CO -0.03 0.44 0.94 0.21 -1.23 0.00 0.00 174.94 175.27 2f3u s ASN 440 N 0.84 6.47 0.41 3.58 3.84 0.11 -2.17 114.94 128.02 2f3u s ASN 440 Ca 0.01 0.03 0.19 0.00 0.21 0.00 0.00 52.86 53.30 2f3u s ASN 440 Cb -0.14 -2.45 0.88 0.00 -0.55 0.00 0.00 41.25 38.99 2f3u s ASN 440 CO 0.02 -1.11 1.85 0.24 -2.79 0.00 0.00 177.10 175.31 2f3u h MET 441 N 9.15 0.00 -0.47 0.43 2.86 -1.70 -2.53 114.93 122.67 2f3u h MET 441 Ca -0.24 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.28 2f3u h MET 441 Cb 1.07 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.72 2f3u h MET 441 CO 1.05 0.31 -0.18 0.00 1.06 0.00 0.00 176.91 179.15 2f3u h ALA 442 N 1.69 0.79 -0.40 6.32 0.00 -1.91 -1.24 119.26 124.52 2f3u h ALA 442 Ca -0.00 -0.37 -0.11 0.00 0.00 0.00 0.00 54.91 54.43 2f3u h ALA 442 Cb 0.68 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2f3u h ALA 442 CO 0.04 0.66 -0.21 0.45 0.00 0.00 0.00 179.25 180.19 2f3u h HIS 443 N 0.81 0.88 -0.51 0.00 3.86 -1.87 -1.90 115.15 116.42 2f3u h HIS 443 Ca 0.12 -0.19 -0.00 0.00 -1.16 0.00 0.00 60.37 59.13 2f3u h HIS 443 Cb 0.73 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.96 2f3u h HIS 443 CO 0.04 0.92 0.32 1.25 0.86 0.00 0.00 177.93 181.32 2f3u h LEU 444 N 0.68 0.60 -0.58 2.43 6.46 -1.17 -2.05 115.31 121.69 2f3u h LEU 444 Ca 0.10 -0.04 -0.05 0.00 -0.12 0.00 0.00 57.88 57.77 2f3u h LEU 444 Cb 0.71 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.47 2f3u h LEU 444 CO 0.05 0.47 0.19 0.00 -0.62 0.00 0.00 178.44 178.53 2f3u h ILE 446 N 0.82 1.25 -0.85 0.00 2.04 -1.20 -2.03 117.51 117.52 2f3u h ILE 446 Ca 0.19 -0.89 -0.01 0.00 1.00 0.00 0.00 64.86 65.14 2f3u h ILE 446 Cb 0.28 1.17 -0.04 0.00 -0.74 0.00 0.00 36.82 37.48 2f3u h ILE 446 CO -0.01 0.30 0.50 0.00 0.00 0.00 0.00 178.15 178.94 2f3u h ALA 447 N 0.88 1.26 -0.64 1.87 0.00 -1.30 -3.10 119.26 118.23 2f3u h ALA 447 Ca 0.10 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2f3u h ALA 447 Cb 0.40 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2f3u h ALA 447 CO 0.01 0.62 0.00 0.41 0.00 0.00 0.00 179.25 180.29 2f3u n GLY 448 N -1.22 2.61 3.29 0.00 0.00 -0.72 -4.94 105.19 104.20 2f3u n GLY 448 Ca 0.09 -0.82 -0.27 0.00 0.00 0.00 0.00 46.02 45.02 2f3u n GLY 448 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2f3u s SER 449 N -0.89 2.71 0.01 1.61 0.01 -0.78 -3.95 113.70 112.43 2f3u s SER 449 Ca 0.50 -0.58 0.27 0.00 1.31 0.00 0.00 55.95 57.44 2f3u s SER 449 Cb 0.32 -0.22 0.80 0.00 0.21 0.00 0.00 66.02 67.13 2f3u s SER 449 CO 0.25 0.17 1.63 0.00 0.41 0.00 0.00 173.24 175.69 2f3u n HIS 450 N 1.64 0.03 -3.79 2.43 1.44 -0.55 -4.83 115.22 111.60 2f3u n HIS 450 Ca -0.18 0.01 -0.13 0.00 -2.01 0.00 0.00 57.72 55.42 2f3u n HIS 450 Cb 0.53 -0.37 -0.12 0.00 0.12 0.00 0.00 29.99 30.15 2f3u n HIS 450 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2f3u s ALA 451 N -3.01 -0.55 -0.07 1.59 0.00 -1.26 -4.54 121.76 113.92 2f3u s ALA 451 Ca 0.12 0.67 -0.00 0.00 0.00 0.00 0.00 51.96 52.75 2f3u s ALA 451 Cb 0.18 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.92 2f3u s ALA 451 CO 0.63 -0.12 -0.04 0.08 0.00 0.00 0.00 175.76 176.31 2f3u s VAL 452 N 0.27 0.67 0.09 0.00 1.01 0.34 -0.88 120.40 121.91 2f3u s VAL 452 Ca -0.01 -0.12 0.05 0.00 0.00 0.00 0.00 61.98 61.90 2f3u s VAL 452 Cb -0.03 -0.73 -0.03 0.00 0.00 0.00 0.00 36.38 35.59 2f3u s VAL 452 CO -0.01 0.29 -0.13 0.54 0.00 0.00 0.00 175.10 175.79 2f3u s ASN 453 N 1.48 1.71 0.58 3.32 4.22 -0.59 -0.64 114.94 125.01 2f3u s ASN 453 Ca -0.01 -0.70 0.05 0.00 -2.14 0.00 0.00 52.86 50.05 2f3u s ASN 453 Cb -0.13 -0.04 0.07 0.00 1.28 0.00 0.00 41.25 42.43 2f3u s ASN 453 CO -0.04 -0.13 0.80 -0.83 -2.04 0.00 0.00 177.10 174.87 2f3u s GLY 454 N -2.05 1.80 0.00 0.45 0.00 -1.01 -1.54 107.32 104.98 2f3u s GLY 454 Ca 0.02 -1.76 0.12 0.00 0.00 0.00 0.00 44.72 43.09 2f3u s GLY 454 CO 0.02 -1.37 1.27 3.33 0.00 0.00 0.00 173.10 176.36 2f3u n VAL 455 N -2.35 0.98 -3.55 1.40 0.24 -1.26 -2.29 118.33 111.50 2f3u n VAL 455 Ca 0.12 -0.99 -0.14 0.00 -2.04 0.00 0.00 64.34 61.29 2f3u n VAL 455 Cb 0.60 0.51 -0.06 0.00 -1.47 0.00 0.00 33.84 33.43 2f3u n VAL 455 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2f3u s ALA 456 N -1.00 -1.84 0.20 2.33 0.00 -1.26 -0.86 121.76 119.33 2f3u s ALA 456 Ca 0.25 1.47 -0.12 0.00 0.00 0.00 0.00 51.96 53.56 2f3u s ALA 456 Cb 0.13 -0.38 0.25 0.00 0.00 0.00 0.00 23.12 23.13 2f3u s ALA 456 CO 0.17 -0.34 1.67 -0.09 0.00 0.00 0.00 175.76 177.17 2f3u h ARG 457 N 2.91 0.12 -0.30 0.00 2.43 -1.90 -0.10 114.38 117.53 2f3u h ARG 457 Ca -0.23 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 58.85 2f3u h ARG 457 Cb 1.15 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.66 2f3u h ARG 457 CO 0.34 0.08 -0.13 0.97 -1.51 0.00 0.00 179.97 179.71 2f3u h ILE 458 N 0.12 1.23 -0.17 1.20 2.10 -1.91 -1.62 117.51 118.46 2f3u h ILE 458 Ca 0.29 -1.05 -0.07 0.00 1.08 0.00 0.00 64.86 65.12 2f3u h ILE 458 Cb 0.46 1.16 -0.00 0.00 -1.09 0.00 0.00 36.82 37.34 2f3u h ILE 458 CO -0.48 0.34 -0.16 -0.74 -1.08 0.00 0.00 178.15 176.03 2f3u h HIS 459 N 0.47 0.49 -0.32 2.19 2.76 -1.52 -1.41 115.15 117.81 2f3u h HIS 459 Ca 0.09 -0.14 -0.04 0.00 -2.20 0.00 0.00 60.37 58.07 2f3u h HIS 459 Cb 0.51 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 29.35 2f3u h HIS 459 CO 0.02 0.78 0.02 0.77 -1.30 0.00 0.00 177.93 178.22 2f3u h SER 460 N 0.06 0.44 -0.34 3.26 0.02 -0.89 -0.67 113.55 115.43 2f3u h SER 460 Ca 0.03 -0.07 -0.13 0.00 -0.84 0.00 0.00 61.79 60.78 2f3u h SER 460 Cb 0.69 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.11 2f3u h SER 460 CO 0.04 0.49 -0.28 -0.33 -1.14 0.00 0.00 176.83 175.60 2f3u h GLU 461 N 0.46 0.79 -0.81 3.45 4.39 -1.19 -2.81 114.58 118.85 2f3u h GLU 461 Ca 0.10 -0.40 -0.01 0.00 0.34 0.00 0.00 59.36 59.40 2f3u h GLU 461 Cb 0.26 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.88 2f3u h GLU 461 CO 0.00 1.02 0.48 0.82 -1.16 0.00 0.00 179.01 180.18 2f3u h ILE 462 N 0.57 1.23 -0.91 3.13 2.04 -0.62 -0.87 117.51 122.07 2f3u h ILE 462 Ca 0.06 -0.51 0.01 0.00 1.00 0.00 0.00 64.86 65.42 2f3u h ILE 462 Cb 0.85 0.09 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 2f3u h ILE 462 CO 0.07 0.24 0.59 -0.07 0.00 0.00 0.00 178.15 178.98 2f3u h LEU 463 N 1.12 1.06 -0.17 1.44 3.38 -0.95 0.18 115.31 121.36 2f3u h LEU 463 Ca 0.29 -0.04 -0.17 0.00 0.09 0.00 0.00 57.88 58.05 2f3u h LEU 463 Cb -0.03 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 2f3u h LEU 463 CO -0.05 0.78 -0.82 0.11 0.09 0.00 0.00 178.44 178.54 2f3u h LYS 464 N 1.24 0.00 0.00 1.13 1.57 -1.14 -0.92 116.57 118.45 2f3u h LYS 464 Ca 0.33 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.02 2f3u h LYS 464 Cb -0.12 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 2f3u h LYS 464 CO -0.07 0.82 -1.15 0.87 -0.57 0.00 0.00 179.45 179.35 2f3u h LYS 465 N 0.00 0.00 0.00 3.15 1.57 -0.78 -3.30 116.57 117.21 2f3u h LYS 465 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2f3u h LYS 465 Cb 1.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.86 2f3u h LYS 465 CO 0.11 0.17 0.00 0.25 -0.57 0.00 0.00 179.45 179.41 2f3u n THR 466 N -2.83 0.00 -0.13 -0.16 -2.24 0.58 -4.74 114.28 104.77 2f3u n THR 466 Ca -0.05 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.89 2f3u n THR 466 Cb 0.70 0.00 0.53 0.00 -2.10 0.00 0.00 70.33 69.47 2f3u n THR 466 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 2f3u h ILE 467 N 0.00 0.81 -0.15 2.28 3.07 -1.71 -2.47 117.51 119.34 2f3u h ILE 467 Ca 0.00 -0.12 -0.01 0.00 1.55 0.00 0.00 64.86 66.28 2f3u h ILE 467 Cb 0.00 0.42 -0.00 0.00 -0.27 0.00 0.00 36.82 36.97 2f3u h ILE 467 CO 0.00 0.06 -0.01 0.49 -1.05 0.00 0.00 178.15 177.64 2f3u n PHE 468 N -4.46 0.54 -0.23 0.16 0.99 -0.35 -4.77 117.46 109.34 2f3u n PHE 468 Ca 0.13 -0.97 0.03 0.00 -0.00 0.00 0.00 57.45 56.64 2f3u n PHE 468 Cb 0.51 -0.25 0.15 0.00 -1.00 0.00 0.00 39.48 38.89 2f3u n PHE 468 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 2f3u h LYS 469 N 1.00 0.35 -0.85 -1.08 3.64 -1.42 -0.32 116.57 117.89 2f3u h LYS 469 Ca 0.01 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2f3u h LYS 469 Cb 1.26 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.96 2f3u h LYS 469 CO 0.13 0.23 0.49 -0.44 -2.27 0.00 0.00 179.45 177.59 2f3u h ASP 470 N 0.36 1.03 -0.24 4.20 3.32 -1.86 -1.69 116.42 121.53 2f3u h ASP 470 Ca 0.36 -0.08 -0.13 0.00 0.02 0.00 0.00 57.03 57.20 2f3u h ASP 470 Cb 0.54 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 2f3u h ASP 470 CO -0.40 0.81 -0.33 -0.26 -1.72 0.00 0.00 179.24 177.34 2f3u h PHE 471 N 1.17 0.89 -0.78 4.55 0.04 -1.72 -2.46 116.94 118.64 2f3u h PHE 471 Ca 0.30 -0.24 -0.05 0.00 2.80 0.00 0.00 57.97 60.78 2f3u h PHE 471 Cb -0.02 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 37.90 2f3u h PHE 471 CO 0.00 0.99 0.29 -0.92 -0.60 0.00 0.00 178.31 178.07 2f3u h TYR 472 N 0.64 1.21 -0.13 -0.55 3.20 -0.70 0.52 116.97 121.16 2f3u h TYR 472 Ca 0.07 -0.10 -0.09 0.00 3.14 0.00 0.00 58.73 61.75 2f3u h TYR 472 Cb 0.86 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 2f3u h TYR 472 CO 0.05 0.92 -0.32 0.93 -1.64 0.00 0.00 178.16 178.10 2f3u h GLU 473 N 1.14 0.26 0.04 1.82 5.08 -1.14 -0.90 114.58 120.88 2f3u h GLU 473 Ca 0.26 -0.10 -0.16 0.00 -1.00 0.00 0.00 59.36 58.36 2f3u h GLU 473 Cb 0.25 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.50 2f3u h GLU 473 CO -0.02 0.56 -0.64 1.25 -1.00 0.00 0.00 179.01 179.16 2f3u h LEU 474 N 0.23 0.50 -6.29 1.33 5.85 -1.00 -3.41 115.31 112.52 2f3u h LEU 474 Ca 0.03 -0.81 -0.58 0.00 0.84 0.00 0.00 57.88 57.36 2f3u h LEU 474 Cb 0.69 -0.16 -0.39 0.00 0.37 0.00 0.00 40.66 41.17 2f3u h LEU 474 CO 0.05 1.25 -0.96 -0.62 -0.34 0.00 0.00 178.44 177.82 2f3u n GLU 475 N -4.21 0.66 -0.12 1.25 1.02 0.13 -4.98 120.64 114.40 2f3u n GLU 475 Ca -0.11 -3.40 0.08 0.00 -0.02 0.00 0.00 57.16 53.71 2f3u n GLU 475 Cb 0.70 -1.60 0.41 0.00 -0.02 0.00 0.00 31.44 30.94 2f3u n GLU 475 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2f3u h PRO 476 N 4.94 0.59 0.00 3.49 0.13 -1.37 -2.72 132.00 137.06 2f3u h PRO 476 Ca 0.18 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2f3u h PRO 476 Cb 0.87 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 31.87 2f3u h PRO 476 CO 0.46 0.39 -0.01 1.12 -0.23 0.00 0.00 178.00 179.73 2f3u h HIS 477 N 0.61 0.00 0.00 1.56 2.07 -1.94 -2.80 115.15 114.65 2f3u h HIS 477 Ca 0.28 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.70 2f3u h HIS 477 Cb 0.32 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.28 2f3u h HIS 477 CO -0.00 0.01 -0.49 0.87 -3.07 0.00 0.00 177.93 175.25 2f3u h LYS 478 N 0.00 0.00 -6.08 5.12 1.57 -1.72 -3.45 116.57 112.01 2f3u h LYS 478 Ca -0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 2f3u h LYS 478 Cb 0.02 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.28 2f3u h LYS 478 CO 0.00 0.49 0.54 -0.06 -0.57 0.00 0.00 179.45 179.85 2f3u s PHE 479 N -3.76 3.44 0.33 -1.35 0.08 -1.06 -0.51 117.98 115.16 2f3u s PHE 479 Ca -0.01 1.42 0.04 0.00 0.12 0.00 0.00 56.93 58.49 2f3u s PHE 479 Cb 0.13 -3.13 -0.03 0.00 -0.57 0.00 0.00 43.02 39.41 2f3u s PHE 479 CO 0.73 -0.28 0.16 -0.65 -0.10 0.00 0.00 175.22 175.08 2f3u s GLN 480 N 2.32 1.70 0.01 0.44 -0.21 0.19 -4.96 119.66 119.14 2f3u s GLN 480 Ca 0.43 -1.99 0.05 0.00 0.02 0.00 0.00 55.36 53.87 2f3u s GLN 480 Cb -0.17 -0.21 -0.02 0.00 1.00 0.00 0.00 33.01 33.61 2f3u s GLN 480 CO 0.13 -0.47 -0.15 1.21 -2.12 0.00 0.00 175.29 173.89 2f3u s ASN 481 N -3.44 1.81 -0.36 5.90 3.84 -1.26 -2.41 114.94 119.02 2f3u s ASN 481 Ca 0.33 -0.36 0.02 0.00 0.21 0.00 0.00 52.86 53.06 2f3u s ASN 481 Cb 0.04 -0.17 0.15 0.00 -0.55 0.00 0.00 41.25 40.72 2f3u s ASN 481 CO 0.18 0.13 0.30 -0.54 -2.79 0.00 0.00 177.10 174.38 2f3u s LYS 482 N -0.70 0.58 0.27 0.43 -0.14 -0.97 -4.92 119.74 114.29 2f3u s LYS 482 Ca 0.05 -1.00 -0.30 0.00 -1.36 0.00 0.00 55.97 53.35 2f3u s LYS 482 Cb -0.07 -0.95 -0.11 0.00 -1.68 0.00 0.00 37.83 35.02 2f3u s LYS 482 CO 0.00 -1.19 1.60 0.99 -0.76 0.00 0.00 175.35 175.99 2f3u s THR 483 N 1.35 2.12 1.16 2.17 2.01 -1.26 -4.25 115.64 118.94 2f3u s THR 483 Ca 0.17 0.10 -0.13 0.00 0.31 0.00 0.00 61.69 62.14 2f3u s THR 483 Cb -0.18 -3.06 0.28 0.00 0.01 0.00 0.00 72.50 69.55 2f3u s THR 483 CO -0.04 0.01 1.03 0.20 -0.69 0.00 0.00 174.62 175.14 2f3u s ASN 484 N 0.60 0.95 0.33 3.53 0.02 -0.04 -4.65 114.94 115.68 2f3u s ASN 484 Ca 0.65 1.60 -0.13 0.00 -1.02 0.00 0.00 52.86 53.96 2f3u s ASN 484 Cb -0.48 -2.36 0.03 0.00 0.02 0.00 0.00 41.25 38.46 2f3u s ASN 484 CO 0.45 -4.24 0.65 -0.83 0.02 0.00 0.00 177.10 173.15 2f3u s GLY 485 N -2.45 0.57 0.09 0.66 0.00 -1.26 -4.81 107.32 100.12 2f3u s GLY 485 Ca 0.69 -0.87 0.04 0.00 0.00 0.00 0.00 44.72 44.58 2f3u s GLY 485 CO 0.65 -0.48 -0.11 -0.26 0.00 0.00 0.00 173.10 172.90 2f3u s ILE 486 N -3.07 0.94 -0.05 0.90 -4.36 0.08 -4.50 121.20 111.14 2f3u s ILE 486 Ca 0.19 -1.50 -0.30 0.00 -0.26 0.00 0.00 60.65 58.78 2f3u s ILE 486 Cb -0.03 -1.21 -0.02 0.00 1.25 0.00 0.00 42.46 42.44 2f3u s ILE 486 CO 0.12 -0.46 1.02 0.28 0.24 0.00 0.00 174.94 176.14 2f3u s THR 487 N -2.06 4.75 -1.12 8.37 -1.32 -1.26 -1.02 115.64 121.98 2f3u s THR 487 Ca 0.02 1.99 0.17 0.00 -1.21 0.00 0.00 61.69 62.67 2f3u s THR 487 Cb -0.05 -4.28 0.19 0.00 -1.51 0.00 0.00 72.50 66.85 2f3u s THR 487 CO 0.01 0.07 1.55 -0.81 -2.21 0.00 0.00 174.62 173.23 2f3u n PRO 488 N 4.53 0.07 0.12 7.08 -0.04 -1.26 -1.69 135.00 143.81 2f3u n PRO 488 Ca 0.08 0.18 -0.06 0.00 -0.04 0.00 0.00 63.50 63.66 2f3u n PRO 488 Cb 0.49 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.43 2f3u n PRO 488 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2f3u h ARG 489 N 0.00 -0.35 -0.48 0.54 -0.00 -1.91 -2.79 114.38 109.39 2f3u h ARG 489 Ca 0.00 0.02 -0.13 0.00 -0.50 0.00 0.00 59.98 59.37 2f3u h ARG 489 Cb 0.26 0.08 -0.01 0.00 0.00 0.00 0.00 29.97 30.30 2f3u h ARG 489 CO 0.00 -0.24 -0.22 -0.09 0.00 0.00 0.00 179.97 179.42 2f3u h ARG 490 N -0.87 1.00 -0.56 0.04 2.43 -1.97 0.17 114.38 114.62 2f3u h ARG 490 Ca -0.04 -0.43 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 2f3u h ARG 490 Cb 0.28 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 2f3u h ARG 490 CO 0.06 1.11 0.00 0.91 -1.51 0.00 0.00 179.97 180.54 2f3u n TRP 491 N -4.11 0.66 0.02 2.20 7.02 -0.68 -2.82 117.44 119.72 2f3u n TRP 491 Ca -0.00 -0.26 0.00 0.00 -1.02 0.00 0.00 57.50 56.22 2f3u n TRP 491 Cb 0.46 -0.14 0.00 0.00 -2.42 0.00 0.00 31.31 29.22 2f3u n TRP 491 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 2f3u n LEU 492 N 0.35 -0.19 -0.00 -0.99 7.94 -1.09 -4.77 117.00 118.24 2f3u n LEU 492 Ca 0.11 0.06 -0.10 0.00 -1.11 0.00 0.00 56.01 54.97 2f3u n LEU 492 Cb 0.46 0.41 -0.05 0.00 0.53 0.00 0.00 43.42 44.78 2f3u n LEU 492 CO 0.11 -0.48 0.86 0.58 -1.11 0.00 0.00 177.39 177.35 2f3u h VAL 493 N 0.00 0.92 0.12 1.96 2.07 -1.30 0.40 116.25 120.42 2f3u h VAL 493 Ca 0.00 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 2f3u h VAL 493 Cb 0.00 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 2f3u h VAL 493 CO 0.00 0.01 -0.06 0.25 0.02 0.00 0.00 177.57 177.79 2f3u h LEU 494 N 0.03 -0.14 0.00 2.57 6.46 -1.11 -3.14 115.31 119.99 2f3u h LEU 494 Ca 0.05 -0.34 0.00 0.00 -0.12 0.00 0.00 57.88 57.47 2f3u h LEU 494 Cb 0.06 0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.03 2f3u h LEU 494 CO -0.09 0.30 -0.48 0.00 -0.62 0.00 0.00 178.44 177.55 2f3u n ASN 496 N -2.27 0.70 -0.17 0.00 2.85 0.14 -4.85 115.26 111.67 2f3u n ASN 496 Ca 0.04 -2.90 0.04 0.00 -0.11 0.00 0.00 54.58 51.64 2f3u n ASN 496 Cb 0.45 -0.63 0.32 0.00 1.24 0.00 0.00 39.78 41.17 2f3u n ASN 496 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2f3u h PRO 497 N 3.43 0.81 -0.71 1.20 0.13 -1.62 -1.75 132.00 133.49 2f3u h PRO 497 Ca 0.09 -0.05 0.05 0.00 -0.87 0.00 0.00 66.00 65.22 2f3u h PRO 497 Cb 0.92 -0.18 -0.05 0.00 0.13 0.00 0.00 31.00 31.81 2f3u h PRO 497 CO 0.50 0.54 0.42 0.78 -0.23 0.00 0.00 178.00 180.00 2f3u h GLY 498 N 0.83 1.04 1.15 1.56 0.00 -1.91 0.69 103.07 106.43 2f3u h GLY 498 Ca 0.27 -0.30 -0.21 0.00 0.00 0.00 0.00 47.33 47.08 2f3u h GLY 498 CO -0.07 0.22 -0.73 -2.00 0.00 0.00 0.00 176.54 173.95 2f3u h LEU 499 N 0.79 0.93 -1.50 3.11 5.85 -1.80 -2.70 115.31 119.98 2f3u h LEU 499 Ca 0.30 -0.62 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 2f3u h LEU 499 Cb 0.12 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 2f3u h LEU 499 CO -0.15 1.40 0.20 0.00 -0.34 0.00 0.00 178.44 179.55 2f3u h ALA 500 N 0.56 1.62 0.23 1.25 0.00 -0.92 -2.26 119.26 119.74 2f3u h ALA 500 Ca -0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2f3u h ALA 500 Cb 1.36 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2f3u h ALA 500 CO 0.15 0.31 -0.11 1.49 0.00 0.00 0.00 179.25 181.10 2f3u h GLU 501 N 0.54 -0.30 0.00 0.00 4.57 -0.77 -1.30 114.58 117.33 2f3u h GLU 501 Ca 0.14 0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.33 2f3u h GLU 501 Cb 0.03 0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.69 2f3u h GLU 501 CO -0.02 0.07 -0.03 -0.84 -1.18 0.00 0.00 179.01 177.01 2f3u h ILE 502 N -0.77 0.83 -0.06 2.32 3.07 -1.39 0.04 117.51 121.55 2f3u h ILE 502 Ca -0.03 -0.11 -0.12 0.00 1.55 0.00 0.00 64.86 66.14 2f3u h ILE 502 Cb 0.50 1.06 0.01 0.00 -0.27 0.00 0.00 36.82 38.13 2f3u h ILE 502 CO 0.05 0.03 -0.45 0.40 -1.05 0.00 0.00 178.15 177.13 2f3u h ILE 503 N 0.00 1.42 -0.35 0.16 2.04 -1.37 -3.20 117.51 116.20 2f3u h ILE 503 Ca -0.00 -1.87 -0.03 0.00 1.00 0.00 0.00 64.86 63.96 2f3u h ILE 503 Cb 0.06 2.39 -0.02 0.00 -0.74 0.00 0.00 36.82 38.52 2f3u h ILE 503 CO 0.00 0.54 0.11 0.00 0.00 0.00 0.00 178.15 178.81 2f3u h ALA 504 N 0.40 1.53 -0.48 1.87 0.00 -0.29 -1.38 119.26 120.91 2f3u h ALA 504 Ca -0.04 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.82 2f3u h ALA 504 Cb 1.12 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 2f3u h ALA 504 CO 0.09 0.36 0.32 0.93 0.00 0.00 0.00 179.25 180.95 2f3u h GLU 505 N 0.50 0.33 0.04 0.00 5.08 -1.02 0.34 114.58 119.84 2f3u h GLU 505 Ca 0.12 -0.02 -0.33 0.00 -1.00 0.00 0.00 59.36 58.13 2f3u h GLU 505 Cb 0.16 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 2f3u h GLU 505 CO -0.01 0.22 -1.83 0.54 -1.00 0.00 0.00 179.01 176.93 2f3u n ARG 506 N -4.47 0.63 -0.05 2.33 5.12 -0.76 -4.69 116.66 114.78 2f3u n ARG 506 Ca 0.07 0.39 0.03 0.00 -1.93 0.00 0.00 57.85 56.40 2f3u n ARG 506 Cb 0.30 -1.67 0.05 0.00 -1.16 0.00 0.00 32.46 29.99 2f3u n ARG 506 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 2f3u n ILE 507 N -4.01 0.54 -1.35 0.55 -5.35 -0.59 -5.12 119.36 104.03 2f3u n ILE 507 Ca -0.38 -0.77 0.00 0.00 -0.27 0.00 0.00 62.75 61.33 2f3u n ILE 507 Cb 0.86 0.78 0.00 0.00 -1.74 0.00 0.00 39.64 39.54 2f3u n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2f3u n GLY 508 N 0.15 -2.28 0.49 3.28 0.00 0.12 -4.64 105.19 102.29 2f3u n GLY 508 Ca 0.05 -1.79 0.10 0.00 0.00 0.00 0.00 46.02 44.37 2f3u n GLY 508 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2f3u n GLU 509 N -0.12 1.48 0.21 1.61 1.02 -1.26 -4.05 120.64 119.53 2f3u n GLU 509 Ca 0.00 -1.02 0.16 0.00 -0.02 0.00 0.00 57.16 56.28 2f3u n GLU 509 Cb 0.00 -1.39 0.82 0.00 -0.02 0.00 0.00 31.44 30.85 2f3u n GLU 509 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2f3u h GLU 510 N 2.41 0.00 0.00 3.49 4.39 -1.96 -2.57 114.58 120.34 2f3u h GLU 510 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 2f3u h GLU 510 Cb 0.69 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.34 2f3u h GLU 510 CO 0.00 0.00 -0.14 0.10 -1.16 0.00 0.00 179.01 177.81 2f3u h TYR 511 N 0.00 0.00 -0.19 4.33 -0.00 -1.80 -2.79 116.97 116.51 2f3u h TYR 511 Ca 0.08 0.00 0.06 0.00 -0.00 0.00 0.00 58.73 58.87 2f3u h TYR 511 Cb 0.42 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.15 2f3u h TYR 511 CO 0.00 0.14 0.19 0.82 -0.00 0.00 0.00 178.16 179.32 2f3u h ILE 512 N 0.00 0.56 0.00 -0.90 2.04 -1.81 -0.51 117.51 116.88 2f3u h ILE 512 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 2f3u h ILE 512 Cb 0.33 0.85 0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2f3u h ILE 512 CO 0.02 0.00 -0.01 -1.54 0.00 0.00 0.00 178.15 176.62 2f3u n SER 513 N -3.95 1.94 -2.82 1.72 3.41 -1.10 -4.67 113.62 108.15 2f3u n SER 513 Ca 0.02 -2.25 -0.11 0.00 -0.26 0.00 0.00 58.87 56.27 2f3u n SER 513 Cb 0.32 -0.13 0.03 0.00 -0.26 0.00 0.00 64.21 64.17 2f3u n SER 513 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2f3u n ASP 514 N -0.72 -2.39 0.31 4.04 4.64 -0.40 -5.03 116.55 117.00 2f3u n ASP 514 Ca 0.05 -3.21 0.19 0.00 -1.38 0.00 0.00 54.79 50.44 2f3u n ASP 514 Cb 0.38 1.42 0.99 0.00 -1.04 0.00 0.00 41.12 42.88 2f3u n ASP 514 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 2f3u h LEU 515 N 4.00 0.00 -2.69 -2.67 5.85 -1.44 -1.80 115.31 116.56 2f3u h LEU 515 Ca -0.11 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2f3u h LEU 515 Cb 1.00 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.03 2f3u h LEU 515 CO 0.35 0.00 0.01 0.44 -0.34 0.00 0.00 178.44 178.90 2f3u h ASP 516 N 0.00 0.00 0.23 1.25 3.32 -1.85 -1.51 116.42 117.86 2f3u h ASP 516 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2f3u h ASP 516 Cb 0.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.90 2f3u h ASP 516 CO -0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 2f3u n GLN 517 N -3.49 0.16 0.31 3.56 6.02 -0.68 -2.06 117.38 121.20 2f3u n GLN 517 Ca -0.03 0.58 0.21 0.00 -0.01 0.00 0.00 57.00 57.75 2f3u n GLN 517 Cb 0.09 -1.94 1.08 0.00 1.02 0.00 0.00 30.24 30.49 2f3u n GLN 517 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2f3u h LEU 518 N 0.00 0.00 -2.35 1.08 3.38 -1.51 -1.49 115.31 114.43 2f3u h LEU 518 Ca 0.00 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.99 2f3u h LEU 518 Cb 0.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 2f3u h LEU 518 CO 0.00 0.00 0.06 0.03 0.09 0.00 0.00 178.44 178.62 2f3u h ARG 519 N 0.00 0.00 0.00 1.13 3.08 -0.87 0.08 114.38 117.79 2f3u h ARG 519 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2f3u h ARG 519 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 2f3u h ARG 519 CO 0.00 0.00 0.00 0.87 -1.07 0.00 0.00 179.97 179.77 2f3u h LYS 520 N 0.00 0.00 0.00 0.04 1.57 -1.52 -1.05 116.57 115.62 2f3u h LYS 520 Ca 0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2f3u h LYS 520 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 2f3u h LYS 520 CO -0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 2f3u n LEU 521 N -3.00 0.32 0.25 2.94 4.77 0.01 -2.66 117.00 119.63 2f3u n LEU 521 Ca -0.02 0.57 0.09 0.00 -0.03 0.00 0.00 56.01 56.62 2f3u n LEU 521 Cb 0.12 -0.52 0.63 0.00 -2.33 0.00 0.00 43.42 41.32 2f3u n LEU 521 CO 0.21 -0.35 0.95 0.25 -1.33 0.00 0.00 177.39 177.12 2f3u h LEU 522 N 0.00 0.00 -0.05 2.23 5.85 -1.36 -1.27 115.31 120.71 2f3u h LEU 522 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2f3u h LEU 522 Cb 0.34 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.37 2f3u h LEU 522 CO 0.00 0.14 0.00 -1.54 -0.34 0.00 0.00 178.44 176.70 2f3u n SER 523 N -4.05 0.07 0.00 1.25 3.41 -1.09 -2.90 113.62 110.31 2f3u n SER 523 Ca -0.02 -1.82 0.00 0.00 -0.26 0.00 0.00 58.87 56.76 2f3u n SER 523 Cb 0.22 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.16 2f3u n SER 523 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2f3u n TYR 524 N -0.55 0.00 0.31 7.33 4.01 -0.48 -4.70 117.16 123.08 2f3u n TYR 524 Ca 0.05 -0.22 0.17 0.00 -0.16 0.00 0.00 57.90 57.74 2f3u n TYR 524 Cb 0.03 -0.02 0.98 0.00 -0.31 0.00 0.00 39.34 40.02 2f3u n TYR 524 CO 0.00 0.00 0.00 -0.24 -0.46 0.00 0.00 176.86 176.16 2f3u h VAL 525 N 0.04 0.39 -0.24 -0.72 3.04 -1.56 -0.20 116.25 117.00 2f3u h VAL 525 Ca 0.00 -0.04 0.00 0.00 -1.01 0.00 0.00 66.70 65.65 2f3u h VAL 525 Cb 0.23 1.03 0.00 0.00 -2.01 0.00 0.00 31.29 30.54 2f3u h VAL 525 CO 0.00 0.01 0.00 0.47 -1.01 0.00 0.00 177.57 177.04 2f3u n ASP 526 N -3.63 2.77 -4.61 3.17 10.43 -1.26 -4.87 116.55 118.55 2f3u n ASP 526 Ca -0.03 -1.81 -0.43 0.00 2.57 0.00 0.00 54.79 55.09 2f3u n ASP 526 Cb 0.09 -0.16 -0.02 0.00 1.84 0.00 0.00 41.12 42.87 2f3u n ASP 526 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2f3u s ASP 527 N -1.15 6.70 0.41 -2.24 3.68 -0.09 -4.91 116.67 119.07 2f3u s ASP 527 Ca 0.25 0.59 0.08 0.00 2.13 0.00 0.00 52.55 55.60 2f3u s ASP 527 Cb 0.15 -2.54 0.86 0.00 -1.45 0.00 0.00 42.92 39.94 2f3u s ASP 527 CO 0.20 -1.14 2.04 -0.08 0.13 0.00 0.00 175.17 176.33 2f3u h GLU 528 N 8.91 0.55 -0.16 4.34 4.57 -1.91 -0.90 114.58 129.98 2f3u h GLU 528 Ca -0.22 -0.03 -0.05 0.00 -1.18 0.00 0.00 59.36 57.87 2f3u h GLU 528 Cb 1.06 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.52 2f3u h GLU 528 CO 1.09 0.36 -0.09 0.00 -1.18 0.00 0.00 179.01 179.19 2f3u h ALA 529 N 1.72 0.23 -0.37 2.92 0.00 -1.94 -2.37 119.26 119.45 2f3u h ALA 529 Ca 0.19 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2f3u h ALA 529 Cb 0.05 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2f3u h ALA 529 CO -0.05 0.06 0.14 0.35 0.00 0.00 0.00 179.25 179.75 2f3u h PHE 530 N 0.01 0.56 -0.92 0.00 -0.00 -1.78 -1.22 116.94 113.60 2f3u h PHE 530 Ca 0.03 -0.04 0.09 0.00 -0.00 0.00 0.00 57.97 58.05 2f3u h PHE 530 Cb 0.58 -0.17 -0.07 0.00 -0.00 0.00 0.00 35.95 36.29 2f3u h PHE 530 CO 0.07 0.52 0.56 0.82 -0.00 0.00 0.00 178.31 180.28 2f3u h ILE 531 N 0.44 0.97 -0.43 1.41 2.04 -1.19 0.60 117.51 121.35 2f3u h ILE 531 Ca 0.12 -0.33 -0.11 0.00 1.00 0.00 0.00 64.86 65.55 2f3u h ILE 531 Cb 0.20 -0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.20 2f3u h ILE 531 CO -0.01 0.17 -0.15 -0.09 0.00 0.00 0.00 178.15 178.07 2f3u h ARG 532 N 0.95 0.86 -0.27 2.37 2.43 -1.04 -2.53 114.38 117.17 2f3u h ARG 532 Ca 0.43 -0.35 -0.05 0.00 -0.81 0.00 0.00 59.98 59.20 2f3u h ARG 532 Cb 0.33 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 2f3u h ARG 532 CO -0.23 0.99 -0.03 -0.44 -1.51 0.00 0.00 179.97 178.75 2f3u h ASP 533 N 0.69 0.49 -0.27 -3.80 3.32 -0.40 -0.69 116.42 115.77 2f3u h ASP 533 Ca 0.10 -0.34 0.04 0.00 0.02 0.00 0.00 57.03 56.86 2f3u h ASP 533 Cb 0.70 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 40.08 2f3u h ASP 533 CO 0.05 0.71 0.01 0.58 -1.72 0.00 0.00 179.24 178.88 2f3u h VAL 534 N 0.26 0.82 -0.29 -1.35 2.07 -0.92 0.63 116.25 117.47 2f3u h VAL 534 Ca 0.07 -0.03 -0.05 0.00 0.82 0.00 0.00 66.70 67.50 2f3u h VAL 534 Cb 0.48 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 2f3u h VAL 534 CO 0.02 0.02 -0.05 0.00 0.02 0.00 0.00 177.57 177.58 2f3u h ALA 535 N 1.23 1.37 -0.32 1.67 0.00 -1.38 -2.45 119.26 119.37 2f3u h ALA 535 Ca 0.13 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 2f3u h ALA 535 Cb 0.16 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2f3u h ALA 535 CO -0.21 0.43 -0.14 -0.22 0.00 0.00 0.00 179.25 179.12 2f3u h LYS 536 N 0.44 0.66 -0.58 0.00 3.64 -0.19 -2.03 116.57 118.50 2f3u h LYS 536 Ca 0.09 -0.28 0.01 0.00 -1.27 0.00 0.00 60.65 59.20 2f3u h LYS 536 Cb 0.37 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 2f3u h LYS 536 CO 0.02 0.87 0.39 0.28 -2.27 0.00 0.00 179.45 178.73 2f3u h VAL 537 N 0.43 1.14 -0.25 2.00 2.07 -0.64 -1.05 116.25 119.95 2f3u h VAL 537 Ca 0.07 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 2f3u h VAL 537 Cb 0.66 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.71 2f3u h VAL 537 CO 0.04 0.14 0.13 0.50 0.02 0.00 0.00 177.57 178.41 2f3u h LYS 538 N 0.79 0.35 -0.76 1.57 1.63 -1.39 -1.35 116.57 117.42 2f3u h LYS 538 Ca 0.22 -0.04 0.02 0.00 -0.85 0.00 0.00 60.65 60.00 2f3u h LYS 538 Cb -0.08 -0.07 -0.04 0.00 -0.60 0.00 0.00 32.23 31.44 2f3u h LYS 538 CO -0.05 0.33 0.49 0.37 -3.45 0.00 0.00 179.45 177.13 2f3u h GLN 539 N 0.29 0.94 -0.77 1.90 5.75 -1.05 -0.59 115.11 121.58 2f3u h GLN 539 Ca 0.09 -0.06 -0.05 0.00 -0.15 0.00 0.00 58.65 58.48 2f3u h GLN 539 Cb 0.08 -0.21 -0.03 0.00 1.07 0.00 0.00 27.48 28.38 2f3u h GLN 539 CO -0.01 0.62 0.29 0.93 -2.65 0.00 0.00 178.83 178.01 2f3u h GLU 540 N 0.97 1.16 -0.61 1.69 5.08 -0.96 -0.87 114.58 121.04 2f3u h GLU 540 Ca 0.29 -0.22 -0.07 0.00 -1.00 0.00 0.00 59.36 58.36 2f3u h GLU 540 Cb -0.03 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.01 2f3u h GLU 540 CO -0.09 0.95 0.09 -0.91 -1.00 0.00 0.00 179.01 178.05 2f3u h ASN 541 N 1.13 0.98 -0.44 1.42 2.35 -0.56 -0.72 115.58 119.73 2f3u h ASN 541 Ca 0.26 -0.26 -0.08 0.00 -0.55 0.00 0.00 56.30 55.66 2f3u h ASN 541 Cb 0.23 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.32 2f3u h ASN 541 CO -0.02 1.00 -0.00 0.11 -1.65 0.00 0.00 177.43 176.87 2f3u h LYS 542 N 0.93 0.85 -0.34 0.81 1.57 -0.81 -0.35 116.57 119.23 2f3u h LYS 542 Ca 0.19 -0.24 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 2f3u h LYS 542 Cb 0.44 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 2f3u h LYS 542 CO 0.01 0.86 -0.06 -0.07 -0.57 0.00 0.00 179.45 179.62 2f3u h LEU 543 N 0.79 0.65 -0.98 2.94 3.38 -0.91 0.16 115.31 121.34 2f3u h LEU 543 Ca 0.15 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 2f3u h LEU 543 Cb 0.48 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 2f3u h LEU 543 CO 0.02 0.84 0.31 0.50 0.09 0.00 0.00 178.44 180.20 2f3u h LYS 544 N 0.44 1.04 -0.02 1.13 3.64 -0.86 -1.33 116.57 120.60 2f3u h LYS 544 Ca 0.09 -0.16 -0.25 0.00 -1.27 0.00 0.00 60.65 59.06 2f3u h LYS 544 Cb 0.55 -0.18 0.01 0.00 -0.41 0.00 0.00 32.23 32.20 2f3u h LYS 544 CO 0.03 0.83 -0.97 0.35 -2.27 0.00 0.00 179.45 177.41 2f3u h PHE 545 N 1.02 0.92 -0.20 1.91 3.57 -0.88 -2.26 116.94 121.02 2f3u h PHE 545 Ca 0.24 -0.48 -0.02 0.00 3.53 0.00 0.00 57.97 61.23 2f3u h PHE 545 Cb 0.16 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 2f3u h PHE 545 CO 0.01 1.31 0.02 0.00 -2.23 0.00 0.00 178.31 177.42 2f3u h ALA 546 N 0.53 1.66 -0.14 2.41 0.00 -0.44 -1.02 119.26 122.26 2f3u h ALA 546 Ca -0.10 -0.11 -0.21 0.00 0.00 0.00 0.00 54.91 54.48 2f3u h ALA 546 Cb 1.61 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.32 2f3u h ALA 546 CO 0.19 0.26 -0.73 0.00 0.00 0.00 0.00 179.25 178.97 2f3u h ALA 547 N 1.74 0.28 -0.90 0.00 0.00 -1.18 -3.19 119.26 116.01 2f3u h ALA 547 Ca 0.07 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2f3u h ALA 547 Cb 0.17 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 2f3u h ALA 547 CO 0.00 0.62 0.57 -0.92 0.00 0.00 0.00 179.25 179.52 2f3u h TYR 548 N 0.45 1.15 -0.04 0.00 5.03 -0.72 -0.73 116.97 122.10 2f3u h TYR 548 Ca -0.05 0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.29 2f3u h TYR 548 Cb 1.36 -0.38 -0.00 0.00 1.55 0.00 0.00 36.73 39.26 2f3u h TYR 548 CO 0.09 0.74 0.03 -0.07 -1.32 0.00 0.00 178.16 177.64 2f3u h LEU 549 N 1.22 0.00 0.05 2.82 3.38 -1.21 -1.84 115.31 119.73 2f3u h LEU 549 Ca 0.32 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 58.00 2f3u h LEU 549 Cb -0.10 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2f3u h LEU 549 CO -0.07 0.00 -1.58 -0.33 0.09 0.00 0.00 178.44 176.55 2f3u h GLU 550 N 0.00 0.10 0.26 1.13 5.08 -1.39 -0.97 114.58 118.79 2f3u h GLU 550 Ca 0.02 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 2f3u h GLU 550 Cb 0.08 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.40 2f3u h GLU 550 CO -0.00 0.84 -0.13 0.00 -1.00 0.00 0.00 179.01 178.72 2f3u h ARG 551 N 0.03 -0.34 0.00 2.33 3.08 -0.39 -2.13 114.38 116.95 2f3u h ARG 551 Ca -0.25 0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.83 2f3u h ARG 551 Cb 1.98 0.08 0.00 0.00 0.08 0.00 0.00 29.97 32.11 2f3u h ARG 551 CO 0.11 -0.23 -0.47 0.39 -1.07 0.00 0.00 179.97 178.70 2f3u n GLU 552 N -3.07 0.17 0.00 0.04 4.71 -0.76 -4.40 120.64 117.32 2f3u n GLU 552 Ca -0.04 0.06 0.00 0.00 -0.01 0.00 0.00 57.16 57.17 2f3u n GLU 552 Cb 0.14 -1.62 0.00 0.00 -1.01 0.00 0.00 31.44 28.95 2f3u n GLU 552 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 2f3u n TYR 553 N -1.86 0.00 -3.53 -0.32 4.01 -1.07 -5.08 117.16 109.31 2f3u n TYR 553 Ca 0.05 -0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.48 2f3u n TYR 553 Cb 0.39 -0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.45 2f3u n TYR 553 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2f3u n LYS 554 N -0.00 -1.83 -3.63 -0.72 4.76 -0.39 -4.88 118.16 111.47 2f3u n LYS 554 Ca 0.00 1.28 -0.07 0.00 -2.87 0.00 0.00 58.31 56.65 2f3u n LYS 554 Cb 0.14 -2.56 -0.08 0.00 -1.84 0.00 0.00 35.03 30.69 2f3u n LYS 554 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2f3u s VAL 555 N -2.09 -0.72 0.14 -0.18 -7.23 -1.09 -4.94 120.40 104.28 2f3u s VAL 555 Ca 0.24 0.12 -0.30 0.00 -1.81 0.00 0.00 61.98 60.23 2f3u s VAL 555 Cb -0.03 -0.75 -0.06 0.00 0.56 0.00 0.00 36.38 36.10 2f3u s VAL 555 CO 0.87 0.05 0.97 -1.00 -0.31 0.00 0.00 175.10 175.68 2f3u s HIS 556 N 2.67 3.82 0.04 2.82 3.76 -1.26 -4.01 115.29 123.13 2f3u s HIS 556 Ca -0.01 1.80 -0.04 0.00 -0.15 0.00 0.00 55.06 56.66 2f3u s HIS 556 Cb -0.12 -3.06 -0.02 0.00 1.11 0.00 0.00 32.58 30.49 2f3u s HIS 556 CO -0.14 0.18 0.06 0.96 -0.85 0.00 0.00 174.74 174.94 2f3u s ILE 557 N -0.19 0.14 -0.44 0.60 -4.36 -1.26 -5.13 121.20 110.56 2f3u s ILE 557 Ca 0.46 -1.18 -0.20 0.00 -0.26 0.00 0.00 60.65 59.47 2f3u s ILE 557 Cb -0.24 -0.90 0.02 0.00 1.25 0.00 0.00 42.46 42.59 2f3u s ILE 557 CO 0.31 -0.65 0.61 0.21 0.24 0.00 0.00 174.94 175.65 2f3u s ASN 558 N -2.16 6.30 0.30 4.36 2.47 -1.26 -4.94 114.94 120.01 2f3u s ASN 558 Ca -0.05 -0.40 0.21 0.00 0.42 0.00 0.00 52.86 53.04 2f3u s ASN 558 Cb -0.01 -2.30 1.10 0.00 -1.45 0.00 0.00 41.25 38.58 2f3u s ASN 558 CO -0.05 -0.75 1.63 -2.65 -3.72 0.00 0.00 177.10 171.56 2f3u n PRO 559 N 6.16 0.14 0.00 0.43 -0.02 -1.26 -1.69 135.00 138.75 2f3u n PRO 559 Ca -0.03 0.61 0.12 0.00 -2.02 0.00 0.00 63.50 62.19 2f3u n PRO 559 Cb 0.48 -1.93 0.32 0.00 -0.02 0.00 0.00 33.50 32.34 2f3u n PRO 559 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2f3u n ASN 560 N -2.22 0.55 -4.89 2.55 5.03 -1.26 -4.90 115.26 110.12 2f3u n ASN 560 Ca -0.01 -0.32 -0.30 0.00 0.87 0.00 0.00 54.58 54.83 2f3u n ASN 560 Cb 0.05 0.16 0.04 0.00 -1.02 0.00 0.00 39.78 39.01 2f3u n ASN 560 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2f3u s SER 561 N -2.89 5.59 -0.02 6.41 1.04 -0.68 -4.93 113.70 118.21 2f3u s SER 561 Ca 0.14 1.09 -0.30 0.00 0.48 0.00 0.00 55.95 57.37 2f3u s SER 561 Cb 0.18 -1.97 -0.03 0.00 0.10 0.00 0.00 66.02 64.30 2f3u s SER 561 CO 0.65 -1.21 1.10 -0.22 0.98 0.00 0.00 173.24 174.53 2f3u s LEU 562 N -5.26 4.32 -0.59 2.42 0.20 -0.01 -4.81 118.68 114.95 2f3u s LEU 562 Ca 0.57 1.76 -0.23 0.00 0.69 0.00 0.00 54.13 56.92 2f3u s LEU 562 Cb -0.11 -3.57 0.06 0.00 -0.43 0.00 0.00 46.19 42.14 2f3u s LEU 562 CO 0.51 -0.44 0.91 -0.36 -0.29 0.00 0.00 176.35 176.68 2f3u s PHE 563 N 1.57 2.78 -0.47 5.38 2.99 -1.26 -1.08 117.98 127.88 2f3u s PHE 563 Ca 0.54 -0.32 -0.16 0.00 0.00 0.00 0.00 56.93 56.99 2f3u s PHE 563 Cb -0.23 -4.10 0.06 0.00 0.00 0.00 0.00 43.02 38.75 2f3u s PHE 563 CO 0.24 -1.44 0.42 0.34 -0.00 0.00 0.00 175.22 174.79 2f3u s ASP 564 N 3.19 6.16 0.00 1.36 3.68 -0.34 -1.30 116.67 129.42 2f3u s ASP 564 Ca 0.25 -1.18 0.06 0.00 2.13 0.00 0.00 52.55 53.80 2f3u s ASP 564 Cb -0.15 -2.20 -0.02 0.00 -1.45 0.00 0.00 42.92 39.10 2f3u s ASP 564 CO 0.14 -0.66 -0.18 0.68 0.13 0.00 0.00 175.17 175.28 2f3u s VAL 565 N 1.83 1.42 -0.29 1.11 -7.23 -0.70 0.41 120.40 116.95 2f3u s VAL 565 Ca 0.06 -0.85 -0.01 0.00 -1.81 0.00 0.00 61.98 59.38 2f3u s VAL 565 Cb -0.23 -1.20 0.09 0.00 0.56 0.00 0.00 36.38 35.61 2f3u s VAL 565 CO 0.08 0.33 0.08 -1.58 -0.31 0.00 0.00 175.10 173.71 2f3u s GLN 566 N -0.60 0.77 -0.12 4.82 0.74 0.29 -2.14 119.66 123.41 2f3u s GLN 566 Ca 0.07 -1.01 0.03 0.00 0.05 0.00 0.00 55.36 54.49 2f3u s GLN 566 Cb -0.07 -2.05 0.01 0.00 1.10 0.00 0.00 33.01 31.99 2f3u s GLN 566 CO -0.00 -0.93 -0.20 0.14 -0.55 0.00 0.00 175.29 173.75 2f3u s VAL 567 N 1.62 1.86 0.00 1.34 -7.23 -1.26 -1.89 120.40 114.84 2f3u s VAL 567 Ca 0.08 -0.87 0.00 0.00 -1.81 0.00 0.00 61.98 59.38 2f3u s VAL 567 Cb -0.17 -1.65 0.00 0.00 0.56 0.00 0.00 36.38 35.12 2f3u s VAL 567 CO -0.22 0.51 0.00 2.29 -0.31 0.00 0.00 175.10 177.37 2f3u n LYS 568 N 3.97 0.00 -1.69 4.82 2.85 -0.96 -4.99 118.16 122.17 2f3u n LYS 568 Ca -0.20 0.00 -0.38 0.00 -1.05 0.00 0.00 58.31 56.68 2f3u n LYS 568 Cb 0.52 0.00 0.05 0.00 -0.65 0.00 0.00 35.03 34.94 2f3u n LYS 568 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2f3u n ARG 569 N -0.35 1.37 -2.61 -1.58 5.12 -1.26 -4.01 116.66 113.33 2f3u n ARG 569 Ca 0.00 0.51 -0.43 0.00 -1.93 0.00 0.00 57.85 56.00 2f3u n ARG 569 Cb 0.00 -2.40 -0.02 0.00 -1.16 0.00 0.00 32.46 28.88 2f3u n ARG 569 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2f3u s ILE 570 N -1.36 4.61 -0.06 0.55 -1.09 -0.45 -4.89 121.20 118.50 2f3u s ILE 570 Ca 0.73 1.92 -0.24 0.00 -2.23 0.00 0.00 60.65 60.83 2f3u s ILE 570 Cb -0.43 -4.24 0.05 0.00 -1.58 0.00 0.00 42.46 36.27 2f3u s ILE 570 CO 0.48 -0.10 0.54 -2.28 -1.23 0.00 0.00 174.94 172.35 2f3u s HIS 571 N 2.80 -0.50 0.31 3.97 2.46 -1.26 -4.69 115.29 118.38 2f3u s HIS 571 Ca 0.48 0.91 -0.01 0.00 0.47 0.00 0.00 55.06 56.91 2f3u s HIS 571 Cb -0.18 0.28 0.49 0.00 -0.13 0.00 0.00 32.58 33.04 2f3u s HIS 571 CO 0.12 -0.49 1.97 0.93 -2.47 0.00 0.00 174.74 174.81 2f3u h GLU 572 N 3.64 1.03 0.00 2.88 5.08 -1.97 -2.36 114.58 122.88 2f3u h GLU 572 Ca -0.28 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 57.98 2f3u h GLU 572 Cb 1.16 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 2f3u h GLU 572 CO 0.35 0.68 -0.18 0.10 -1.00 0.00 0.00 179.01 178.97 2f3u h TYR 573 N 1.06 0.00 0.00 4.33 -0.00 -1.97 -1.74 116.97 118.65 2f3u h TYR 573 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.02 2f3u h TYR 573 Cb -0.10 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.63 2f3u h TYR 573 CO -0.00 0.18 0.00 1.63 -0.00 0.00 0.00 178.16 179.97 2f3u n LYS 574 N -3.54 0.13 -3.73 0.10 5.02 -0.90 -2.88 118.16 112.37 2f3u n LYS 574 Ca -0.01 0.15 -0.22 0.00 -2.02 0.00 0.00 58.31 56.21 2f3u n LYS 574 Cb 0.33 -1.67 0.03 0.00 -0.02 0.00 0.00 35.03 33.70 2f3u n LYS 574 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2f3u n ARG 575 N -1.90 -4.85 0.30 1.97 1.74 -0.65 -4.03 116.66 109.24 2f3u n ARG 575 Ca 0.06 0.60 0.16 0.00 -0.77 0.00 0.00 57.85 57.90 2f3u n ARG 575 Cb 0.36 -5.16 0.94 0.00 -1.02 0.00 0.00 32.46 27.58 2f3u n ARG 575 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2f3u h GLN 576 N -1.88 0.00 -0.37 5.56 7.50 -1.84 -0.94 115.11 123.14 2f3u h GLN 576 Ca -0.61 0.00 -0.05 0.00 0.50 0.00 0.00 58.65 58.49 2f3u h GLN 576 Cb 1.36 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.87 2f3u h GLN 576 CO 0.58 0.02 0.00 -0.07 -1.50 0.00 0.00 178.83 177.86 2f3u h LEU 577 N 0.00 0.55 -0.83 1.46 3.38 -1.91 -0.70 115.31 117.26 2f3u h LEU 577 Ca -0.00 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.77 2f3u h LEU 577 Cb 0.05 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2f3u h LEU 577 CO 0.00 0.62 -0.12 0.25 0.09 0.00 0.00 178.44 179.28 2f3u h LEU 578 N 0.56 0.74 -0.39 1.67 5.85 -1.54 -1.27 115.31 120.93 2f3u h LEU 578 Ca 0.12 -0.22 -0.03 0.00 0.84 0.00 0.00 57.88 58.59 2f3u h LEU 578 Cb 0.35 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 2f3u h LEU 578 CO 0.01 0.88 0.13 -1.13 -0.34 0.00 0.00 178.44 177.99 2f3u h ASN 579 N 0.67 0.56 -0.97 1.25 -0.00 -1.34 -2.37 115.58 113.39 2f3u h ASN 579 Ca 0.11 -0.20 0.06 0.00 -0.00 0.00 0.00 56.30 56.28 2f3u h ASN 579 Cb 0.59 -0.15 -0.06 0.00 -0.00 0.00 0.00 38.32 38.70 2f3u h ASN 579 CO 0.04 0.61 0.62 0.00 -0.00 0.00 0.00 177.43 178.70 2f3u h LEU 581 N 1.14 1.08 -0.32 0.00 3.38 -0.91 -1.74 115.31 117.94 2f3u h LEU 581 Ca 0.41 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 58.15 2f3u h LEU 581 Cb 0.15 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2f3u h LEU 581 CO -0.17 0.98 0.03 -0.74 0.09 0.00 0.00 178.44 178.64 2f3u h HIS 582 N 1.12 0.58 -0.49 1.13 2.76 -0.85 -1.45 115.15 117.96 2f3u h HIS 582 Ca 0.25 -0.09 0.07 0.00 -2.20 0.00 0.00 60.37 58.40 2f3u h HIS 582 Cb 0.26 -0.16 -0.06 0.00 1.55 0.00 0.00 27.41 29.01 2f3u h HIS 582 CO 0.02 0.64 0.17 0.28 -1.30 0.00 0.00 177.93 177.75 2f3u h VAL 583 N 0.36 0.83 -0.13 5.26 2.07 -0.99 0.27 116.25 123.92 2f3u h VAL 583 Ca 0.09 -0.12 -0.08 0.00 0.82 0.00 0.00 66.70 67.42 2f3u h VAL 583 Cb 0.38 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 2f3u h VAL 583 CO 0.01 0.06 -0.28 0.40 0.02 0.00 0.00 177.57 177.79 2f3u h ILE 584 N 0.35 1.25 -0.53 4.57 2.04 -1.21 -1.38 117.51 122.60 2f3u h ILE 584 Ca 0.24 -1.18 -0.06 0.00 1.00 0.00 0.00 64.86 64.86 2f3u h ILE 584 Cb 0.25 1.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 2f3u h ILE 584 CO -0.24 0.36 0.11 0.74 0.00 0.00 0.00 178.15 179.11 2f3u h THR 585 N 0.21 1.25 -0.73 -0.27 2.02 -0.12 0.47 112.91 115.75 2f3u h THR 585 Ca 0.03 -0.91 -0.05 0.00 0.77 0.00 0.00 66.41 66.24 2f3u h THR 585 Cb 0.61 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.80 2f3u h THR 585 CO 0.04 0.33 0.24 -0.07 0.37 0.00 0.00 175.52 176.43 2f3u h LEU 586 N 0.76 1.05 -0.22 2.58 4.07 -0.56 -0.80 115.31 122.19 2f3u h LEU 586 Ca 0.16 -0.20 -0.03 0.00 0.08 0.00 0.00 57.88 57.89 2f3u h LEU 586 Cb 0.37 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.83 2f3u h LEU 586 CO 0.01 0.97 0.03 0.22 -1.08 0.00 0.00 178.44 178.58 2f3u h TYR 587 N 1.07 0.40 -0.36 1.13 5.03 -0.92 -2.26 116.97 121.05 2f3u h TYR 587 Ca 0.24 -0.06 -0.06 0.00 2.58 0.00 0.00 58.73 61.42 2f3u h TYR 587 Cb 0.29 -0.11 -0.02 0.00 1.55 0.00 0.00 36.73 38.44 2f3u h TYR 587 CO 0.02 0.52 -0.04 -0.91 -1.32 0.00 0.00 178.16 176.43 2f3u h ASN 588 N 0.16 0.56 -0.06 -2.11 2.35 -0.72 -1.39 115.58 114.37 2f3u h ASN 588 Ca 0.07 -0.13 -0.10 0.00 -0.55 0.00 0.00 56.30 55.59 2f3u h ASN 588 Cb 0.34 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 2f3u h ASN 588 CO 0.01 0.66 -0.25 0.03 -1.65 0.00 0.00 177.43 176.23 2f3u h ARG 589 N 0.56 0.49 -0.15 0.81 3.08 -1.04 -1.33 114.38 116.81 2f3u h ARG 589 Ca 0.11 -0.19 -0.08 0.00 0.07 0.00 0.00 59.98 59.89 2f3u h ARG 589 Cb 0.42 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.44 2f3u h ARG 589 CO 0.02 0.71 -0.23 0.82 -1.07 0.00 0.00 179.97 180.21 2f3u h ILE 590 N 0.43 1.36 -0.10 2.04 2.04 -1.00 -2.14 117.51 120.15 2f3u h ILE 590 Ca 0.06 -1.47 -0.01 0.00 1.00 0.00 0.00 64.86 64.45 2f3u h ILE 590 Cb 0.67 1.96 -0.01 0.00 -0.74 0.00 0.00 36.82 38.71 2f3u h ILE 590 CO 0.05 0.43 0.03 0.11 0.00 0.00 0.00 178.15 178.77 2f3u h LYS 591 N 0.03 0.13 -0.03 2.37 1.79 -1.14 0.10 116.57 119.83 2f3u h LYS 591 Ca 0.01 -0.01 -0.25 0.00 -2.18 0.00 0.00 60.65 58.22 2f3u h LYS 591 Cb 0.81 -0.03 0.01 0.00 -1.58 0.00 0.00 32.23 31.44 2f3u h LYS 591 CO 0.05 0.13 -0.97 -0.22 -1.08 0.00 0.00 179.45 177.37 2f3u h LYS 592 N 0.14 0.62 -2.18 3.15 3.64 -1.11 -3.38 116.57 117.45 2f3u h LYS 592 Ca 0.04 -0.64 -0.58 0.00 -1.27 0.00 0.00 60.65 58.20 2f3u h LYS 592 Cb 0.05 0.17 -0.39 0.00 -0.41 0.00 0.00 32.23 31.65 2f3u h LYS 592 CO -0.00 1.24 -0.97 0.39 -2.27 0.00 0.00 179.45 177.84 2f3u n GLU 593 N -3.84 0.92 -0.25 1.90 1.02 -0.82 -5.01 120.64 114.57 2f3u n GLU 593 Ca -0.09 -3.50 0.05 0.00 -0.02 0.00 0.00 57.16 53.60 2f3u n GLU 593 Cb 0.84 -1.54 0.18 0.00 -0.02 0.00 0.00 31.44 30.91 2f3u n GLU 593 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 2f3u h PRO 594 N 4.49 0.37 -0.84 3.49 0.11 -1.00 -2.46 132.00 136.17 2f3u h PRO 594 Ca 0.14 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.20 2f3u h PRO 594 Cb 0.85 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.86 2f3u h PRO 594 CO 0.51 0.25 0.03 0.09 -0.21 0.00 0.00 178.00 178.67 2f3u n ASN 595 N -5.05 3.15 -4.88 -2.05 4.13 -1.26 -4.83 115.26 104.46 2f3u n ASN 595 Ca 0.14 -2.45 -0.36 0.00 1.68 0.00 0.00 54.58 53.59 2f3u n ASN 595 Cb 0.42 -0.59 -0.06 0.00 -1.54 0.00 0.00 39.78 38.01 2f3u n ASN 595 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 2f3u s LYS 596 N -1.75 3.56 0.21 3.52 2.36 -0.93 -5.07 119.74 121.65 2f3u s LYS 596 Ca 0.24 -0.05 -0.30 0.00 -2.55 0.00 0.00 55.97 53.32 2f3u s LYS 596 Cb 0.19 -3.14 -0.08 0.00 -1.05 0.00 0.00 37.83 33.75 2f3u s LYS 596 CO 0.07 0.71 0.98 0.12 1.55 0.00 0.00 175.35 178.77 2f3u s PHE 597 N -1.17 3.87 -0.04 4.03 5.36 -1.26 -5.05 117.98 123.71 2f3u s PHE 597 Ca 0.22 1.84 -0.05 0.00 -0.96 0.00 0.00 56.93 57.99 2f3u s PHE 597 Cb -0.13 -3.06 0.01 0.00 -0.34 0.00 0.00 43.02 39.50 2f3u s PHE 597 CO 0.11 0.20 0.13 0.14 -1.46 0.00 0.00 175.22 174.35 2f3u s VAL 598 N -0.84 0.01 0.11 3.12 -7.23 -1.26 -5.12 120.40 109.20 2f3u s VAL 598 Ca 0.43 -0.10 -0.31 0.00 -1.81 0.00 0.00 61.98 60.20 2f3u s VAL 598 Cb -0.26 -0.22 -0.10 0.00 0.56 0.00 0.00 36.38 36.36 2f3u s VAL 598 CO 0.33 -0.05 1.83 -0.69 -0.31 0.00 0.00 175.10 176.20 2f3u s VAL 599 N -0.13 2.60 0.33 1.32 1.01 -1.26 -4.91 120.40 119.36 2f3u s VAL 599 Ca -0.02 0.08 -0.29 0.00 0.00 0.00 0.00 61.98 61.75 2f3u s VAL 599 Cb -0.02 -3.05 -0.11 0.00 0.00 0.00 0.00 36.38 33.20 2f3u s VAL 599 CO 0.00 -0.00 1.48 -2.84 0.00 0.00 0.00 175.10 173.74 2f3u s PRO 600 N 2.86 4.18 0.05 2.72 0.02 -1.26 -4.92 135.00 138.64 2f3u s PRO 600 Ca 0.81 2.47 0.03 0.00 0.02 0.00 0.00 61.00 64.33 2f3u s PRO 600 Cb -0.45 -3.02 -0.03 0.00 0.02 0.00 0.00 34.50 31.02 2f3u s PRO 600 CO 0.36 -0.49 -0.09 1.03 -0.33 0.00 0.00 177.00 177.48 2f3u s ARG 601 N -1.32 0.61 -0.26 5.54 0.52 -0.25 -0.83 118.95 122.96 2f3u s ARG 601 Ca 0.56 -0.80 0.02 0.00 -0.52 0.00 0.00 55.73 54.99 2f3u s ARG 601 Cb -0.45 -0.44 0.07 0.00 0.52 0.00 0.00 34.95 34.65 2f3u s ARG 601 CO 0.54 0.09 -0.05 0.99 0.02 0.00 0.00 175.30 176.89 2f3u s THR 602 N -1.33 1.77 -0.29 0.02 2.01 -0.24 -2.07 115.64 115.51 2f3u s THR 602 Ca -0.08 -1.50 -0.17 0.00 0.31 0.00 0.00 61.69 60.25 2f3u s THR 602 Cb -0.10 -2.05 -0.02 0.00 0.01 0.00 0.00 72.50 70.34 2f3u s THR 602 CO 0.01 -0.18 0.49 -0.69 -0.69 0.00 0.00 174.62 173.56 2f3u s VAL 603 N 1.26 5.07 -0.17 3.82 1.01 0.13 -1.20 120.40 130.32 2f3u s VAL 603 Ca -0.04 0.64 -0.01 0.00 0.00 0.00 0.00 61.98 62.57 2f3u s VAL 603 Cb -0.19 -3.85 -0.01 0.00 0.00 0.00 0.00 36.38 32.33 2f3u s VAL 603 CO -0.07 -0.01 -0.12 -0.04 0.00 0.00 0.00 175.10 174.85 2f3u s MET 604 N 2.30 3.28 -0.06 2.72 -1.94 0.16 -0.86 119.30 124.92 2f3u s MET 604 Ca 0.19 -0.71 0.03 0.00 -1.71 0.00 0.00 55.69 53.49 2f3u s MET 604 Cb -0.16 -2.72 0.01 0.00 2.01 0.00 0.00 34.83 33.97 2f3u s MET 604 CO 0.11 -0.00 -0.14 0.42 -0.01 0.00 0.00 175.02 175.40 2f3u s ILE 605 N 0.89 1.23 0.08 2.53 1.01 -0.56 -0.55 121.20 125.83 2f3u s ILE 605 Ca -0.03 -0.56 -0.10 0.00 0.00 0.00 0.00 60.65 59.96 2f3u s ILE 605 Cb -0.15 -1.10 0.00 0.00 0.01 0.00 0.00 42.46 41.23 2f3u s ILE 605 CO -0.01 0.37 0.22 -0.83 0.00 0.00 0.00 174.94 174.70 2f3u s GLY 606 N 0.45 0.03 0.00 6.18 0.00 -0.79 -0.03 107.32 113.15 2f3u s GLY 606 Ca -0.11 -0.46 0.00 0.00 0.00 0.00 0.00 44.72 44.15 2f3u s GLY 606 CO 0.03 -0.65 0.00 0.61 0.00 0.00 0.00 173.10 173.09 2f3u n GLY 607 N 0.09 4.14 3.91 0.20 0.00 -1.26 -2.26 105.19 110.01 2f3u n GLY 607 Ca -0.16 -1.01 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 2f3u n GLY 607 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f3u s LYS 608 N -3.00 3.55 -0.02 1.61 1.02 -1.26 -4.62 119.74 117.02 2f3u s LYS 608 Ca 0.00 -0.24 0.02 0.00 0.02 0.00 0.00 55.97 55.77 2f3u s LYS 608 Cb 0.00 -2.86 -0.03 0.00 -0.52 0.00 0.00 37.83 34.41 2f3u s LYS 608 CO 0.00 0.45 -0.05 0.00 -0.92 0.00 0.00 175.35 174.83 2f3u s ALA 609 N -1.74 3.08 0.33 5.17 0.00 -1.26 -1.34 121.76 126.00 2f3u s ALA 609 Ca 0.39 -0.95 -0.29 0.00 0.00 0.00 0.00 51.96 51.11 2f3u s ALA 609 Cb -0.12 -1.23 -0.11 0.00 0.00 0.00 0.00 23.12 21.67 2f3u s ALA 609 CO 0.27 0.61 1.47 0.00 0.00 0.00 0.00 175.76 178.10 2f3u s ALA 610 N -0.95 3.60 0.37 0.00 0.00 -1.26 -4.87 121.76 118.65 2f3u s ALA 610 Ca 0.16 1.48 0.18 0.00 0.00 0.00 0.00 51.96 53.77 2f3u s ALA 610 Cb -0.11 -3.58 1.11 0.00 0.00 0.00 0.00 23.12 20.53 2f3u s ALA 610 CO 0.06 -0.92 1.71 -1.35 0.00 0.00 0.00 175.76 175.27 2f3u h PRO 611 N 3.73 0.36 -0.70 0.00 0.11 -1.98 -1.18 132.00 132.33 2f3u h PRO 611 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2f3u h PRO 611 Cb 1.23 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2f3u h PRO 611 CO 0.69 0.24 0.00 0.41 -0.21 0.00 0.00 178.00 179.13 2f3u n GLY 612 N -1.40 2.30 3.40 -0.55 0.00 -1.26 -4.78 105.19 102.90 2f3u n GLY 612 Ca 0.29 -0.77 -0.45 0.00 0.00 0.00 0.00 46.02 45.09 2f3u n GLY 612 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2f3u s TYR 613 N -1.07 3.46 0.15 1.61 6.04 -0.45 -4.92 117.35 122.17 2f3u s TYR 613 Ca 0.47 -1.76 -0.20 0.00 0.04 0.00 0.00 57.07 55.62 2f3u s TYR 613 Cb 0.25 -4.09 0.03 0.00 -1.04 0.00 0.00 41.96 37.11 2f3u s TYR 613 CO 0.32 -1.27 1.66 1.25 -1.54 0.00 0.00 175.55 175.98 2f3u h HIS 614 N 8.16 -0.36 -0.92 4.97 -0.00 -1.86 -2.16 115.15 122.98 2f3u h HIS 614 Ca 0.16 0.03 0.03 0.00 -0.00 0.00 0.00 60.37 60.59 2f3u h HIS 614 Cb 1.01 0.20 -0.05 0.00 -0.00 0.00 0.00 27.41 28.56 2f3u h HIS 614 CO 1.09 -0.21 0.61 1.98 -0.00 0.00 0.00 177.93 181.39 2f3u h MET 615 N -0.12 1.15 -0.60 5.26 1.85 -1.98 -1.27 114.93 119.22 2f3u h MET 615 Ca 0.14 -0.07 -0.05 0.00 -0.61 0.00 0.00 59.70 59.11 2f3u h MET 615 Cb 0.33 -0.26 -0.03 0.00 0.43 0.00 0.00 31.60 32.07 2f3u h MET 615 CO -0.33 0.76 0.16 0.00 -0.40 0.00 0.00 176.91 177.10 2f3u h ALA 616 N 1.45 1.16 -0.04 0.39 0.00 -1.80 -1.57 119.26 118.85 2f3u h ALA 616 Ca 0.36 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 2f3u h ALA 616 Cb -0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 2f3u h ALA 616 CO -0.10 0.58 -0.53 0.87 0.00 0.00 0.00 179.25 180.06 2f3u h LYS 617 N 0.89 0.10 0.00 0.00 1.57 -0.71 -2.82 116.57 115.61 2f3u h LYS 617 Ca 0.19 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.80 2f3u h LYS 617 Cb 0.30 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 2f3u h LYS 617 CO -0.00 0.61 -0.55 0.52 -0.57 0.00 0.00 179.45 179.46 2f3u h MET 618 N 0.08 0.00 -0.26 3.15 2.86 -0.59 -2.58 114.93 117.59 2f3u h MET 618 Ca -0.00 0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.49 2f3u h MET 618 Cb 0.97 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.62 2f3u h MET 618 CO 0.08 0.55 -0.45 0.82 1.06 0.00 0.00 176.91 178.96 2f3u h ILE 619 N 0.00 1.30 -0.39 -1.22 2.04 -1.08 -0.81 117.51 117.35 2f3u h ILE 619 Ca -0.01 -1.64 -0.04 0.00 1.00 0.00 0.00 64.86 64.17 2f3u h ILE 619 Cb 0.98 1.57 -0.02 0.00 -0.74 0.00 0.00 36.82 38.61 2f3u h ILE 619 CO 0.07 0.52 0.07 0.40 0.00 0.00 0.00 178.15 179.22 2f3u h ILE 620 N 0.54 1.24 -0.87 -0.67 2.04 -1.37 -1.09 117.51 117.33 2f3u h ILE 620 Ca 0.04 -0.84 -0.02 0.00 1.00 0.00 0.00 64.86 65.04 2f3u h ILE 620 Cb 0.99 1.03 -0.04 0.00 -0.74 0.00 0.00 36.82 38.06 2f3u h ILE 620 CO 0.09 0.29 0.48 0.50 0.00 0.00 0.00 178.15 179.51 2f3u h LYS 621 N 0.49 1.21 -0.60 2.37 1.63 -1.30 -1.96 116.57 118.41 2f3u h LYS 621 Ca 0.12 -0.14 -0.02 0.00 -0.85 0.00 0.00 60.65 59.76 2f3u h LYS 621 Cb 0.35 -0.24 -0.03 0.00 -0.60 0.00 0.00 32.23 31.71 2f3u h LYS 621 CO 0.01 0.89 0.30 1.25 -3.45 0.00 0.00 179.45 178.44 2f3u h LEU 622 N 1.21 0.78 -0.27 5.20 6.46 -0.85 -0.50 115.31 127.34 2f3u h LEU 622 Ca 0.31 -0.12 0.00 0.00 -0.12 0.00 0.00 57.88 57.95 2f3u h LEU 622 Cb 0.03 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 39.74 2f3u h LEU 622 CO -0.05 0.68 0.18 0.40 -0.62 0.00 0.00 178.44 179.03 2f3u h ILE 623 N 0.82 1.07 -0.16 4.05 2.04 -0.67 -0.42 117.51 124.23 2f3u h ILE 623 Ca 0.21 -0.13 -0.11 0.00 1.00 0.00 0.00 64.86 65.84 2f3u h ILE 623 Cb 0.10 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 2f3u h ILE 623 CO -0.03 0.07 -0.36 0.71 0.00 0.00 0.00 178.15 178.54 2f3u h THR 624 N 0.37 1.29 -0.55 -0.27 1.35 -1.22 -2.23 112.91 111.65 2f3u h THR 624 Ca 0.10 -1.43 -0.07 0.00 -0.55 0.00 0.00 66.41 64.46 2f3u h THR 624 Cb -0.04 1.56 -0.02 0.00 -1.73 0.00 0.00 68.15 67.92 2f3u h THR 624 CO -0.03 0.44 0.05 0.00 -0.25 0.00 0.00 175.52 175.73 2f3u h ALA 625 N 1.33 1.06 -0.36 6.62 0.00 -0.60 0.36 119.26 127.67 2f3u h ALA 625 Ca 0.03 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 2f3u h ALA 625 Cb 0.77 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 2f3u h ALA 625 CO 0.06 0.60 0.02 0.82 0.00 0.00 0.00 179.25 180.75 2f3u h ILE 626 N 0.84 1.25 -0.93 0.00 2.04 -0.85 -2.80 117.51 117.06 2f3u h ILE 626 Ca 0.17 -0.94 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 2f3u h ILE 626 Cb 0.43 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.63 2f3u h ILE 626 CO 0.01 0.31 0.56 1.23 0.00 0.00 0.00 178.15 180.27 2f3u h GLY 627 N 0.44 1.35 1.13 5.37 0.00 -0.98 0.80 103.07 111.18 2f3u h GLY 627 Ca 0.10 -0.56 0.09 0.00 0.00 0.00 0.00 47.33 46.96 2f3u h GLY 627 CO 0.02 0.55 0.37 -0.55 0.00 0.00 0.00 176.54 176.92 2f3u h ASP 628 N 1.28 0.33 0.00 0.19 3.45 -0.68 0.11 116.42 121.10 2f3u h ASP 628 Ca 0.33 0.01 -0.21 0.00 0.43 0.00 0.00 57.03 57.59 2f3u h ASP 628 Cb -0.05 -0.06 -0.03 0.00 -0.56 0.00 0.00 39.33 38.62 2f3u h ASP 628 CO -0.06 0.21 -1.15 0.58 -1.57 0.00 0.00 179.24 177.24 2f3u h VAL 629 N 0.37 0.99 -0.30 -1.35 2.07 -1.19 -3.37 116.25 113.48 2f3u h VAL 629 Ca 0.25 -2.20 -0.03 0.00 0.82 0.00 0.00 66.70 65.55 2f3u h VAL 629 Cb 0.50 2.33 -0.01 0.00 -1.52 0.00 0.00 31.29 32.59 2f3u h VAL 629 CO -0.06 0.34 0.08 0.58 0.02 0.00 0.00 177.57 178.53 2f3u h VAL 630 N -0.99 1.21 0.00 2.57 2.07 -0.77 -3.02 116.25 117.33 2f3u h VAL 630 Ca -0.32 -0.69 0.00 0.00 0.82 0.00 0.00 66.70 66.51 2f3u h VAL 630 Cb 1.29 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 32.16 2f3u h VAL 630 CO -0.19 0.23 0.00 0.59 0.02 0.00 0.00 177.57 178.22 2f3u n ASN 631 N -4.68 0.62 -0.26 0.57 3.02 0.36 -2.77 115.26 112.12 2f3u n ASN 631 Ca -0.02 0.68 0.03 0.00 -0.03 0.00 0.00 54.58 55.25 2f3u n ASN 631 Cb 0.18 -0.81 0.08 0.00 -0.61 0.00 0.00 39.78 38.62 2f3u n ASN 631 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2f3u n HIS 632 N -2.22 0.20 -2.92 3.10 8.25 -1.18 -4.96 115.22 115.49 2f3u n HIS 632 Ca 0.01 -0.58 -0.43 0.00 -0.26 0.00 0.00 57.72 56.46 2f3u n HIS 632 Cb 0.18 -0.07 -0.05 0.00 1.12 0.00 0.00 29.99 31.17 2f3u n HIS 632 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2f3u s ASP 633 N -1.28 6.50 0.28 0.41 -1.08 -1.11 -4.94 116.67 115.45 2f3u s ASP 633 Ca 0.13 0.17 0.02 0.00 -0.52 0.00 0.00 52.55 52.36 2f3u s ASP 633 Cb 0.09 -2.41 0.64 0.00 -1.46 0.00 0.00 42.92 39.79 2f3u s ASP 633 CO 0.06 -0.87 1.75 -0.65 0.52 0.00 0.00 175.17 175.98 2f3u h PRO 634 N 8.77 0.61 -0.23 4.34 0.11 -1.92 -1.71 132.00 141.96 2f3u h PRO 634 Ca -0.24 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.81 2f3u h PRO 634 Cb 1.09 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.05 2f3u h PRO 634 CO 0.96 0.40 0.04 0.28 -0.21 0.00 0.00 178.00 179.47 2f3u h VAL 635 N 0.62 1.12 -0.27 3.15 2.07 -1.97 -2.77 116.25 118.21 2f3u h VAL 635 Ca 0.52 -0.44 -0.18 0.00 0.82 0.00 0.00 66.70 67.42 2f3u h VAL 635 Cb 0.82 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 2f3u h VAL 635 CO -0.40 0.15 -0.55 0.58 0.02 0.00 0.00 177.57 177.37 2f3u h VAL 636 N 0.33 1.28 0.00 2.57 2.07 -1.65 -3.49 116.25 117.36 2f3u h VAL 636 Ca 0.08 -1.74 0.00 0.00 0.82 0.00 0.00 66.70 65.86 2f3u h VAL 636 Cb 0.15 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.60 2f3u h VAL 636 CO -0.00 0.56 0.00 0.61 0.02 0.00 0.00 177.57 178.76 2f3u n GLY 637 N 0.40 2.24 1.72 2.17 0.00 -1.05 -2.38 105.19 108.30 2f3u n GLY 637 Ca -0.05 -0.52 0.04 0.00 0.00 0.00 0.00 46.02 45.50 2f3u n GLY 637 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2f3u n ASP 638 N 2.13 5.01 0.13 1.61 5.75 -1.26 -4.31 116.55 125.61 2f3u n ASP 638 Ca 0.00 -2.83 0.03 0.00 -0.01 0.00 0.00 54.79 51.97 2f3u n ASP 638 Cb 0.00 -0.67 0.02 0.00 -1.03 0.00 0.00 41.12 39.44 2f3u n ASP 638 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 2f3u h ARG 639 N 3.29 0.00 -2.79 0.11 3.08 -1.81 -3.43 114.38 112.83 2f3u h ARG 639 Ca 0.03 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.92 2f3u h ARG 639 Cb 1.83 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 31.59 2f3u h ARG 639 CO 0.46 0.44 -0.41 -1.17 -1.07 0.00 0.00 179.97 178.22 2f3u s LEU 640 N -6.34 -0.02 -0.01 3.04 2.96 -1.25 -1.09 118.68 115.96 2f3u s LEU 640 Ca 0.03 0.73 0.02 0.00 -0.22 0.00 0.00 54.13 54.69 2f3u s LEU 640 Cb 0.08 1.03 0.00 0.00 0.50 0.00 0.00 46.19 47.80 2f3u s LEU 640 CO 0.75 -0.20 -0.07 -0.13 -1.32 0.00 0.00 176.35 175.39 2f3u s ARG 641 N 1.66 0.64 -0.24 1.98 1.81 -0.88 -4.64 118.95 119.28 2f3u s ARG 641 Ca -0.07 -0.22 0.02 0.00 -1.72 0.00 0.00 55.73 53.74 2f3u s ARG 641 Cb -0.10 -0.62 0.05 0.00 -0.45 0.00 0.00 34.95 33.83 2f3u s ARG 641 CO -0.11 0.10 -0.11 0.08 -0.68 0.00 0.00 175.30 174.59 2f3u s VAL 642 N 0.07 2.01 -0.05 3.52 1.01 -1.26 0.18 120.40 125.88 2f3u s VAL 642 Ca -0.01 -1.45 0.06 0.00 0.00 0.00 0.00 61.98 60.58 2f3u s VAL 642 Cb -0.05 -2.12 -0.01 0.00 0.00 0.00 0.00 36.38 34.20 2f3u s VAL 642 CO -0.00 0.03 -0.25 -0.63 0.00 0.00 0.00 175.10 174.25 2f3u s ILE 643 N 1.19 2.12 -0.33 2.22 1.09 -0.04 -4.52 121.20 122.93 2f3u s ILE 643 Ca -0.07 -1.05 -0.12 0.00 -1.10 0.00 0.00 60.65 58.31 2f3u s ILE 643 Cb -0.19 -1.76 -0.02 0.00 -1.06 0.00 0.00 42.46 39.43 2f3u s ILE 643 CO -0.06 0.57 0.22 0.12 -0.10 0.00 0.00 174.94 175.69 2f3u s PHE 644 N -0.25 3.22 -0.49 3.97 2.19 -1.26 -1.50 117.98 123.87 2f3u s PHE 644 Ca -0.01 -0.18 -0.28 0.00 0.33 0.00 0.00 56.93 56.79 2f3u s PHE 644 Cb -0.13 -2.45 0.01 0.00 -1.31 0.00 0.00 43.02 39.14 2f3u s PHE 644 CO 0.03 -0.33 1.43 -0.51 1.83 0.00 0.00 175.22 177.67 2f3u s LEU 645 N 1.72 3.49 0.32 6.12 1.02 0.95 -4.95 118.68 127.36 2f3u s LEU 645 Ca 0.06 0.57 -0.28 0.00 0.02 0.00 0.00 54.13 54.50 2f3u s LEU 645 Cb -0.17 -3.29 -0.10 0.00 0.02 0.00 0.00 46.19 42.65 2f3u s LEU 645 CO 0.10 -1.59 1.18 -0.70 0.02 0.00 0.00 176.35 175.36 2f3u s GLU 646 N 5.27 4.42 -1.34 1.70 2.12 -1.26 -4.00 118.70 125.61 2f3u s GLU 646 Ca 0.58 1.95 -0.03 0.00 0.36 0.00 0.00 54.97 57.82 2f3u s GLU 646 Cb -0.12 -3.04 0.02 0.00 0.26 0.00 0.00 34.13 31.24 2f3u s GLU 646 CO 0.29 -0.03 0.81 -1.71 -0.54 0.00 0.00 175.26 174.08 2f3u n ASN 647 N 0.82 -2.23 -4.69 -1.70 5.15 -1.25 -4.90 115.26 106.46 2f3u n ASN 647 Ca 0.00 -0.78 -0.44 0.00 -0.60 0.00 0.00 54.58 52.76 2f3u n ASN 647 Cb 0.44 -4.18 -0.04 0.00 -0.53 0.00 0.00 39.78 35.47 2f3u n ASN 647 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2f3u n TYR 648 N -4.38 2.47 -3.87 1.20 9.36 -1.26 -4.86 117.16 115.83 2f3u n TYR 648 Ca -0.22 0.17 -0.10 0.00 3.32 0.00 0.00 57.90 61.07 2f3u n TYR 648 Cb 0.64 -2.60 0.01 0.00 -0.63 0.00 0.00 39.34 36.76 2f3u n TYR 648 CO 0.00 0.00 0.00 -0.98 0.22 0.00 0.00 176.86 176.10 2f3u s ARG 649 N 1.07 2.12 0.19 2.98 1.70 -1.26 -4.74 118.95 121.01 2f3u s ARG 649 Ca 0.77 -1.45 -0.12 0.00 -0.47 0.00 0.00 55.73 54.47 2f3u s ARG 649 Cb -0.61 0.59 0.21 0.00 -0.57 0.00 0.00 34.95 34.57 2f3u s ARG 649 CO 0.36 -0.97 1.74 0.28 -1.08 0.00 0.00 175.30 175.63 2f3u h VAL 650 N 2.03 0.78 -0.30 4.99 2.07 -1.96 -0.61 116.25 123.26 2f3u h VAL 650 Ca -0.30 -0.12 -0.03 0.00 0.82 0.00 0.00 66.70 67.07 2f3u h VAL 650 Cb 1.25 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 2f3u h VAL 650 CO 0.38 0.06 0.06 0.77 0.02 0.00 0.00 177.57 178.87 2f3u h SER 651 N 0.34 0.39 0.33 0.57 4.64 -1.97 -1.73 113.55 116.13 2f3u h SER 651 Ca 0.26 -0.05 -0.22 0.00 -0.47 0.00 0.00 61.79 61.32 2f3u h SER 651 Cb 0.32 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2f3u h SER 651 CO -0.29 0.41 -0.91 0.25 -0.87 0.00 0.00 176.83 175.43 2f3u h LEU 652 N 0.43 0.51 -1.12 5.97 5.85 -1.70 -3.14 115.31 122.12 2f3u h LEU 652 Ca 0.10 -0.40 0.01 0.00 0.84 0.00 0.00 57.88 58.43 2f3u h LEU 652 Cb 0.19 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2f3u h LEU 652 CO -0.00 1.19 0.58 0.00 -0.34 0.00 0.00 178.44 179.87 2f3u h ALA 653 N 0.78 1.35 0.00 1.25 0.00 -0.53 -0.12 119.26 121.99 2f3u h ALA 653 Ca -0.07 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 2f3u h ALA 653 Cb 1.54 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 2f3u h ALA 653 CO 0.16 0.59 -0.02 0.93 0.00 0.00 0.00 179.25 180.91 2f3u h GLU 654 N 1.20 0.00 0.03 0.00 5.08 -1.29 -1.98 114.58 117.62 2f3u h GLU 654 Ca 0.32 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.35 2f3u h GLU 654 Cb -0.12 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.09 2f3u h GLU 654 CO -0.07 0.02 -1.85 1.63 -1.00 0.00 0.00 179.01 177.74 2f3u n LYS 655 N -3.18 0.63 0.09 2.33 5.02 -0.22 -4.49 118.16 118.34 2f3u n LYS 655 Ca -0.02 0.38 -0.13 0.00 -2.02 0.00 0.00 58.31 56.53 2f3u n LYS 655 Cb 0.18 -1.66 -0.10 0.00 -0.02 0.00 0.00 35.03 33.43 2f3u n LYS 655 CO 0.00 0.00 0.00 -0.24 -0.52 0.00 0.00 177.40 176.64 2f3u h VAL 656 N -0.61 1.52 -0.41 -0.18 3.04 -1.07 -3.34 116.25 115.20 2f3u h VAL 656 Ca -0.47 -2.96 -0.01 0.00 -1.01 0.00 0.00 66.70 62.25 2f3u h VAL 656 Cb 1.62 2.78 -0.02 0.00 -2.01 0.00 0.00 31.29 33.66 2f3u h VAL 656 CO -0.16 0.86 0.22 0.40 -1.01 0.00 0.00 177.57 177.88 2f3u h ILE 657 N 0.09 1.16 0.00 3.17 2.04 -1.60 -1.92 117.51 120.46 2f3u h ILE 657 Ca -0.09 -0.43 -0.00 0.00 1.00 0.00 0.00 64.86 65.34 2f3u h ILE 657 Cb 1.80 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 38.57 2f3u h ILE 657 CO 0.17 0.17 -0.01 -0.65 0.00 0.00 0.00 178.15 177.83 2f3u h PRO 658 N 0.53 0.00 -0.01 2.37 0.11 -1.79 -2.31 132.00 130.91 2f3u h PRO 658 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 2f3u h PRO 658 Cb 0.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.18 2f3u h PRO 658 CO -0.02 0.01 -0.32 0.00 -0.21 0.00 0.00 178.00 177.46 2f3u n ALA 659 N -2.12 3.22 -1.87 -0.75 0.00 -0.76 -4.75 120.51 113.48 2f3u n ALA 659 Ca -0.02 -0.43 -0.35 0.00 0.00 0.00 0.00 53.44 52.64 2f3u n ALA 659 Cb 0.17 -1.08 -0.07 0.00 0.00 0.00 0.00 19.45 18.47 2f3u n ALA 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2f3u s ALA 660 N -2.56 3.19 -0.21 0.00 0.00 -0.87 -4.60 121.76 116.71 2f3u s ALA 660 Ca 0.22 0.40 0.00 0.00 0.00 0.00 0.00 51.96 52.58 2f3u s ALA 660 Cb 0.19 -3.09 -0.13 0.00 0.00 0.00 0.00 23.12 20.09 2f3u s ALA 660 CO 0.55 0.19 -0.20 -0.25 0.00 0.00 0.00 175.76 176.06 2f3u n ASP 661 N 0.14 2.27 -4.09 0.00 8.00 -0.58 -4.15 116.55 118.14 2f3u n ASP 661 Ca 0.03 -0.07 -0.29 0.00 0.71 0.00 0.00 54.79 55.17 2f3u n ASP 661 Cb 0.52 -0.37 -0.17 0.00 -0.02 0.00 0.00 41.12 41.08 2f3u n ASP 661 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2f3u s LEU 662 N -6.35 1.83 -0.27 0.64 0.20 -0.42 -0.43 118.68 113.89 2f3u s LEU 662 Ca -0.29 -0.47 -0.10 0.00 0.69 0.00 0.00 54.13 53.97 2f3u s LEU 662 Cb 0.08 -1.17 -0.04 0.00 -0.43 0.00 0.00 46.19 44.62 2f3u s LEU 662 CO 0.48 0.05 0.15 -0.55 -0.29 0.00 0.00 176.35 176.19 2f3u s SER 663 N 0.85 5.79 -0.39 3.68 0.15 0.45 -1.72 113.70 122.51 2f3u s SER 663 Ca -0.09 -0.05 -0.20 0.00 0.70 0.00 0.00 55.95 56.32 2f3u s SER 663 Cb -0.15 -2.06 0.01 0.00 -1.71 0.00 0.00 66.02 62.10 2f3u s SER 663 CO 0.00 -0.03 0.58 -1.61 1.20 0.00 0.00 173.24 173.38 2f3u s GLU 664 N 1.64 3.48 -0.51 5.44 0.41 -0.91 -1.28 118.70 126.96 2f3u s GLU 664 Ca 0.07 -0.22 0.06 0.00 -0.41 0.00 0.00 54.97 54.46 2f3u s GLU 664 Cb -0.15 -3.87 0.21 0.00 -1.78 0.00 0.00 34.13 28.54 2f3u s GLU 664 CO 0.08 -0.81 0.50 1.04 -0.49 0.00 0.00 175.26 175.59 2f3u n GLN 665 N 5.99 1.12 -1.12 1.61 1.13 -0.78 -4.79 117.38 120.53 2f3u n GLN 665 Ca -0.03 -3.73 -0.13 0.00 -1.94 0.00 0.00 57.00 51.17 2f3u n GLN 665 Cb 0.48 -1.77 0.15 0.00 0.11 0.00 0.00 30.24 29.22 2f3u n GLN 665 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 2f3u n ILE 666 N 1.85 2.71 -1.44 5.09 -5.35 -1.26 -2.36 119.36 118.60 2f3u n ILE 666 Ca 0.25 -3.03 -0.34 0.00 -0.27 0.00 0.00 62.75 59.37 2f3u n ILE 666 Cb 0.46 -0.58 0.09 0.00 -1.74 0.00 0.00 39.64 37.86 2f3u n ILE 666 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2f3u s SER 667 N -2.61 4.32 0.21 7.28 1.04 -1.26 -4.65 113.70 118.04 2f3u s SER 667 Ca 0.49 2.23 -0.31 0.00 0.48 0.00 0.00 55.95 58.84 2f3u s SER 667 Cb 0.42 -2.57 -0.10 0.00 0.10 0.00 0.00 66.02 63.87 2f3u s SER 667 CO 0.01 -2.17 1.50 -0.89 0.98 0.00 0.00 173.24 172.67 2f3u s THR 668 N -2.17 2.62 0.02 2.02 2.01 -1.14 -4.67 115.64 114.34 2f3u s THR 668 Ca 0.71 0.49 -0.37 0.00 0.31 0.00 0.00 61.69 62.83 2f3u s THR 668 Cb -0.26 -3.31 -0.16 0.00 0.01 0.00 0.00 72.50 68.77 2f3u s THR 668 CO 0.46 0.06 1.42 0.00 -0.69 0.00 0.00 174.62 175.87 2f3u n ALA 669 N 3.04 -0.78 -0.24 7.40 0.00 -1.26 -1.88 120.51 126.78 2f3u n ALA 669 Ca 0.10 0.49 0.00 0.00 0.00 0.00 0.00 53.44 54.03 2f3u n ALA 669 Cb 0.39 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.73 2f3u n ALA 669 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2f3u n GLY 670 N 2.84 0.69 0.06 0.00 0.00 -1.26 -4.69 105.19 102.83 2f3u n GLY 670 Ca 0.20 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.15 2f3u n GLY 670 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2f3u n THR 671 N -2.06 0.76 -2.94 2.61 -2.24 -0.79 -4.88 114.28 104.75 2f3u n THR 671 Ca 0.00 -0.40 -0.43 0.00 -2.27 0.00 0.00 64.05 60.95 2f3u n THR 671 Cb 0.00 -0.82 -0.05 0.00 -2.10 0.00 0.00 70.33 67.36 2f3u n THR 671 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2f3u s GLU 672 N -2.27 3.25 0.23 -0.78 2.56 -1.26 -4.74 118.70 115.69 2f3u s GLU 672 Ca -0.11 -0.49 -0.10 0.00 0.00 0.00 0.00 54.97 54.27 2f3u s GLU 672 Cb 0.04 -4.08 0.34 0.00 2.00 0.00 0.00 34.13 32.43 2f3u s GLU 672 CO 0.39 -1.43 1.62 0.00 -0.56 0.00 0.00 175.26 175.29 2f3u h ALA 673 N 9.23 0.59 0.00 6.30 0.00 -1.90 -2.86 119.26 130.62 2f3u h ALA 673 Ca -0.27 0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2f3u h ALA 673 Cb 1.08 0.48 0.00 0.00 0.00 0.00 0.00 17.79 19.35 2f3u h ALA 673 CO 1.06 -0.42 0.00 0.45 0.00 0.00 0.00 179.25 180.34 2f3u n SER 674 N -5.41 -0.96 0.00 0.00 2.88 -1.26 -4.22 113.62 104.65 2f3u n SER 674 Ca 0.11 0.49 0.00 0.00 -1.33 0.00 0.00 58.87 58.14 2f3u n SER 674 Cb 0.40 1.06 0.00 0.00 -0.75 0.00 0.00 64.21 64.93 2f3u n SER 674 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2f3u n GLY 675 N 0.79 -0.14 0.00 0.46 0.00 -1.26 -1.13 105.19 103.91 2f3u n GLY 675 Ca 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 46.02 44.51 2f3u n GLY 675 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2f3u n THR 676 N 0.41 0.00 -0.19 2.61 -2.24 -1.26 -4.73 114.28 108.88 2f3u n THR 676 Ca 0.00 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.80 2f3u n THR 676 Cb 0.00 -0.08 0.28 0.00 -2.10 0.00 0.00 70.33 68.43 2f3u n THR 676 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2f3u h GLY 677 N 0.00 1.01 0.63 3.38 0.00 -1.95 -1.30 103.07 104.83 2f3u h GLY 677 Ca 0.00 -0.37 0.11 0.00 0.00 0.00 0.00 47.33 47.07 2f3u h GLY 677 CO 0.00 0.35 0.60 3.45 0.00 0.00 0.00 176.54 180.94 2f3u h ASN 678 N 0.94 0.85 -0.31 0.19 -0.00 -1.94 -1.73 115.58 113.59 2f3u h ASN 678 Ca 0.27 0.03 -0.15 0.00 -0.00 0.00 0.00 56.30 56.46 2f3u h ASN 678 Cb -0.06 -0.14 -0.01 0.00 -0.00 0.00 0.00 38.32 38.11 2f3u h ASN 678 CO -0.07 0.49 -0.35 0.24 -0.00 0.00 0.00 177.43 177.74 2f3u h MET 679 N 0.94 0.85 -0.76 4.14 2.86 -1.55 -2.62 114.93 118.78 2f3u h MET 679 Ca 0.45 -0.42 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2f3u h MET 679 Cb 0.44 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.06 2f3u h MET 679 CO -0.21 1.06 0.47 0.87 1.06 0.00 0.00 176.91 180.16 2f3u h LYS 680 N 0.70 1.02 -0.53 1.72 1.57 -0.98 -1.87 116.57 118.21 2f3u h LYS 680 Ca 0.07 -0.09 -0.09 0.00 -1.87 0.00 0.00 60.65 58.67 2f3u h LYS 680 Cb 0.91 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 2f3u h LYS 680 CO 0.08 0.71 -0.03 0.74 -0.57 0.00 0.00 179.45 180.39 2f3u h PHE 681 N 1.04 1.05 -0.75 -1.35 0.04 -1.36 -2.64 116.94 112.97 2f3u h PHE 681 Ca 0.27 -0.19 -0.05 0.00 2.80 0.00 0.00 57.97 60.80 2f3u h PHE 681 Cb -0.05 -0.27 -0.03 0.00 2.20 0.00 0.00 35.95 37.79 2f3u h PHE 681 CO -0.01 0.97 0.26 1.98 -0.60 0.00 0.00 178.31 180.91 2f3u h MET 682 N 0.83 1.14 0.00 1.51 4.05 -1.19 -2.31 114.93 118.96 2f3u h MET 682 Ca 0.15 -0.23 -0.03 0.00 -0.28 0.00 0.00 59.70 59.31 2f3u h MET 682 Cb 0.57 -0.17 -0.00 0.00 -0.80 0.00 0.00 31.60 31.19 2f3u h MET 682 CO 0.03 0.95 -0.13 1.25 0.23 0.00 0.00 176.91 179.25 2f3u h LEU 683 N 1.10 0.00 -3.28 3.39 5.85 -1.27 -3.25 115.31 117.85 2f3u h LEU 683 Ca 0.25 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.97 2f3u h LEU 683 Cb 0.27 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.30 2f3u h LEU 683 CO -0.01 0.13 0.00 0.59 -0.34 0.00 0.00 178.44 178.80 2f3u n ASN 684 N -3.25 4.79 0.00 1.25 3.02 -0.96 -4.92 115.26 115.18 2f3u n ASN 684 Ca 0.01 -2.68 0.00 0.00 -0.03 0.00 0.00 54.58 51.88 2f3u n ASN 684 Cb 0.39 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 38.98 2f3u n ASN 684 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2f3u n GLY 685 N 0.61 0.75 3.58 7.41 0.00 -1.16 -4.79 105.19 111.60 2f3u n GLY 685 Ca 0.25 -0.68 -0.31 0.00 0.00 0.00 0.00 46.02 45.28 2f3u n GLY 685 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f3u s ALA 686 N -2.00 2.97 0.45 4.61 0.00 -0.91 -4.78 121.76 122.10 2f3u s ALA 686 Ca 0.00 -1.13 -0.03 0.00 0.00 0.00 0.00 51.96 50.79 2f3u s ALA 686 Cb 0.00 -1.01 -0.03 0.00 0.00 0.00 0.00 23.12 22.08 2f3u s ALA 686 CO 0.00 0.63 0.73 -0.51 0.00 0.00 0.00 175.76 176.60 2f3u s LEU 687 N -1.80 3.70 -0.10 0.00 1.43 0.43 -4.39 118.68 117.96 2f3u s LEU 687 Ca 0.19 0.76 0.02 0.00 -1.03 0.00 0.00 54.13 54.07 2f3u s LEU 687 Cb -0.11 -3.68 -0.01 0.00 0.03 0.00 0.00 46.19 42.42 2f3u s LEU 687 CO 0.11 -0.54 -0.16 -0.89 0.23 0.00 0.00 176.35 175.09 2f3u s THR 688 N -2.64 2.77 -0.23 5.49 2.01 -1.26 -0.41 115.64 121.37 2f3u s THR 688 Ca 0.46 -0.78 -0.04 0.00 0.31 0.00 0.00 61.69 61.64 2f3u s THR 688 Cb -0.10 -2.12 -0.01 0.00 0.01 0.00 0.00 72.50 70.28 2f3u s THR 688 CO 0.42 0.55 -0.04 -0.51 -0.69 0.00 0.00 174.62 174.35 2f3u s ILE 689 N 0.13 3.38 0.19 1.82 2.07 -0.41 -1.23 121.20 127.16 2f3u s ILE 689 Ca -0.08 -0.53 -0.23 0.00 -1.41 0.00 0.00 60.65 58.40 2f3u s ILE 689 Cb -0.15 -2.56 0.06 0.00 0.13 0.00 0.00 42.46 39.94 2f3u s ILE 689 CO 0.05 0.39 0.95 -0.83 -1.91 0.00 0.00 174.94 173.60 2f3u s GLY 690 N 1.47 -0.10 0.51 1.50 0.00 -0.32 -1.87 107.32 108.51 2f3u s GLY 690 Ca 0.05 -0.07 -0.04 0.00 0.00 0.00 0.00 44.72 44.67 2f3u s GLY 690 CO -0.03 0.47 0.79 -0.51 0.00 0.00 0.00 173.10 173.82 2f3u s THR 691 N -3.02 4.13 -1.39 0.90 -4.23 -1.00 -2.26 115.64 108.77 2f3u s THR 691 Ca 0.14 -0.11 -0.15 0.00 -1.18 0.00 0.00 61.69 60.39 2f3u s THR 691 Cb -0.02 -3.58 0.06 0.00 1.34 0.00 0.00 72.50 70.29 2f3u s THR 691 CO 0.04 -0.53 2.02 0.23 -0.54 0.00 0.00 174.62 175.84 2f3u n MET 692 N -2.32 3.02 -4.16 3.99 2.81 -1.26 -4.69 117.12 114.50 2f3u n MET 692 Ca 0.02 -2.91 -0.17 0.00 -1.81 0.00 0.00 57.70 52.84 2f3u n MET 692 Cb 0.57 -3.35 -0.12 0.00 -0.71 0.00 0.00 33.22 29.61 2f3u n MET 692 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2f3u s ASP 693 N 3.48 1.53 0.51 7.83 3.68 -1.26 -4.64 116.67 127.80 2f3u s ASP 693 Ca 0.49 -0.64 0.00 0.00 2.13 0.00 0.00 52.55 54.54 2f3u s ASP 693 Cb 0.10 -0.03 0.00 0.00 -1.45 0.00 0.00 42.92 41.54 2f3u s ASP 693 CO -0.02 -0.12 0.00 0.61 0.13 0.00 0.00 175.17 175.77 2f3u n GLY 694 N 1.19 2.22 0.06 2.66 0.00 -1.08 -1.34 105.19 108.91 2f3u n GLY 694 Ca -0.21 -0.24 0.11 0.00 0.00 0.00 0.00 46.02 45.68 2f3u n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f3u n ALA 695 N 7.26 1.85 -0.31 4.61 0.00 -0.28 -3.15 120.51 130.49 2f3u n ALA 695 Ca 0.00 -0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.56 2f3u n ALA 695 Cb 0.00 -1.36 0.36 0.00 0.00 0.00 0.00 19.45 18.45 2f3u n ALA 695 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2f3u h ASN 696 N 0.00 0.70 -0.37 0.00 4.21 -1.42 0.58 115.58 119.28 2f3u h ASN 696 Ca 0.00 0.06 0.00 0.00 1.21 0.00 0.00 56.30 57.57 2f3u h ASN 696 Cb 0.40 -0.07 -0.02 0.00 -1.12 0.00 0.00 38.32 37.51 2f3u h ASN 696 CO 0.00 0.31 0.23 0.58 -1.29 0.00 0.00 177.43 177.27 2f3u h VAL 697 N 0.72 1.11 -0.04 2.81 2.07 -1.63 -1.08 116.25 120.20 2f3u h VAL 697 Ca 0.50 -0.24 -0.15 0.00 0.82 0.00 0.00 66.70 67.64 2f3u h VAL 697 Cb 0.82 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 2f3u h VAL 697 CO -0.26 0.11 -0.64 -0.33 0.02 0.00 0.00 177.57 176.47 2f3u h GLU 698 N 0.49 0.17 -0.16 1.57 5.08 -1.40 -1.92 114.58 118.42 2f3u h GLU 698 Ca 0.13 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2f3u h GLU 698 Cb -0.02 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2f3u h GLU 698 CO -0.03 0.75 0.05 0.52 -1.00 0.00 0.00 179.01 179.31 2f3u h MET 699 N 0.13 0.25 -0.46 2.33 2.86 -0.64 0.07 114.93 119.47 2f3u h MET 699 Ca -0.01 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.53 2f3u h MET 699 Cb 1.15 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.76 2f3u h MET 699 CO 0.10 0.37 0.08 0.00 1.06 0.00 0.00 176.91 178.52 2f3u h ALA 700 N 0.86 1.29 -0.63 6.32 0.00 -1.18 -0.83 119.26 125.10 2f3u h ALA 700 Ca 0.05 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 2f3u h ALA 700 Cb 0.23 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2f3u h ALA 700 CO -0.00 0.49 0.05 1.49 0.00 0.00 0.00 179.25 181.28 2f3u h GLU 701 N 0.67 1.06 -0.18 0.00 4.81 -1.06 0.54 114.58 120.43 2f3u h GLU 701 Ca 0.15 -0.30 -0.12 0.00 -0.13 0.00 0.00 59.36 58.95 2f3u h GLU 701 Cb 0.29 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.56 2f3u h GLU 701 CO 0.00 1.00 -0.37 0.93 -0.73 0.00 0.00 179.01 179.85 2f3u h GLU 702 N 0.98 0.56 0.00 1.92 4.39 -0.39 -3.32 114.58 118.73 2f3u h GLU 702 Ca 0.19 -0.37 -0.06 0.00 0.34 0.00 0.00 59.36 59.46 2f3u h GLU 702 Cb 0.49 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.18 2f3u h GLU 702 CO 0.02 0.98 -0.88 0.00 -1.16 0.00 0.00 179.01 177.97 2f3u h ALA 703 N 0.58 0.65 0.00 3.43 0.00 -1.14 -3.47 119.26 119.32 2f3u h ALA 703 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2f3u h ALA 703 Cb 0.97 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2f3u h ALA 703 CO 0.08 0.34 0.00 0.41 0.00 0.00 0.00 179.25 180.08 2f3u n GLY 704 N 1.23 2.05 0.34 0.00 0.00 0.19 -4.62 105.19 104.37 2f3u n GLY 704 Ca -0.02 -1.35 0.17 0.00 0.00 0.00 0.00 46.02 44.82 2f3u n GLY 704 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2f3u h GLU 705 N 0.00 0.00 0.00 1.61 5.08 -1.84 0.55 114.58 119.98 2f3u h GLU 705 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2f3u h GLU 705 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2f3u h GLU 705 CO 0.00 0.00 0.00 0.93 -1.00 0.00 0.00 179.01 178.94 2f3u h GLU 706 N 0.00 0.00 -0.47 2.33 3.07 -1.89 -2.38 114.58 115.23 2f3u h GLU 706 Ca 0.11 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.97 2f3u h GLU 706 Cb 0.54 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.45 2f3u h GLU 706 CO -0.00 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.70 2f3u n ASN 707 N -2.94 4.64 -4.09 1.42 3.02 0.18 -4.93 115.26 112.57 2f3u n ASN 707 Ca -0.00 -2.75 -0.15 0.00 -0.03 0.00 0.00 54.58 51.65 2f3u n ASN 707 Cb 0.23 -0.57 -0.12 0.00 -0.61 0.00 0.00 39.78 38.71 2f3u n ASN 707 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2f3u s PHE 708 N -2.38 0.83 -1.00 3.10 5.36 -0.90 -4.79 117.98 118.21 2f3u s PHE 708 Ca 0.47 -0.44 -0.09 0.00 -0.96 0.00 0.00 56.93 55.90 2f3u s PHE 708 Cb 0.34 -0.49 0.25 0.00 -0.34 0.00 0.00 43.02 42.79 2f3u s PHE 708 CO 0.16 -0.03 0.96 -0.06 -1.46 0.00 0.00 175.22 174.79 2f3u s PHE 709 N -1.21 4.07 0.07 10.12 0.08 -0.36 -4.94 117.98 125.82 2f3u s PHE 709 Ca -0.06 -2.57 -0.18 0.00 0.12 0.00 0.00 56.93 54.24 2f3u s PHE 709 Cb -0.09 -3.74 -0.07 0.00 -0.57 0.00 0.00 43.02 38.56 2f3u s PHE 709 CO 0.01 -0.93 0.54 0.42 -0.10 0.00 0.00 175.22 175.16 2f3u s ILE 710 N -0.89 4.81 0.28 0.64 1.09 -1.26 -1.18 121.20 124.69 2f3u s ILE 710 Ca 0.27 1.09 -0.14 0.00 -1.10 0.00 0.00 60.65 60.76 2f3u s ILE 710 Cb -0.10 -3.84 0.01 0.00 -1.06 0.00 0.00 42.46 37.47 2f3u s ILE 710 CO -0.09 0.51 0.57 0.72 -0.10 0.00 0.00 174.94 176.55 2f3u s PHE 711 N -1.16 0.26 0.00 3.97 -0.71 -0.96 -4.95 117.98 114.43 2f3u s PHE 711 Ca 0.29 -0.67 0.00 0.00 -1.04 0.00 0.00 56.93 55.52 2f3u s PHE 711 Cb -0.18 0.36 0.00 0.00 -1.21 0.00 0.00 43.02 41.98 2f3u s PHE 711 CO 0.18 -1.12 0.00 0.41 -1.34 0.00 0.00 175.22 173.35 2f3u n GLY 712 N -0.43 -1.24 3.76 1.99 0.00 -1.26 -4.25 105.19 103.75 2f3u n GLY 712 Ca -0.03 -1.58 -0.37 0.00 0.00 0.00 0.00 46.02 44.05 2f3u n GLY 712 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2f3u s MET 713 N -1.20 3.23 0.54 1.61 -1.94 -1.26 -4.91 119.30 115.37 2f3u s MET 713 Ca 0.00 1.87 0.04 0.00 -1.71 0.00 0.00 55.69 55.90 2f3u s MET 713 Cb 0.00 -2.11 0.05 0.00 2.01 0.00 0.00 34.83 34.78 2f3u s MET 713 CO 0.00 -1.01 0.75 1.03 -0.01 0.00 0.00 175.02 175.78 2f3u s ARG 714 N -3.09 2.45 0.27 2.03 1.81 -1.26 -4.52 118.95 116.63 2f3u s ARG 714 Ca 0.73 -1.12 -0.01 0.00 -1.72 0.00 0.00 55.73 53.61 2f3u s ARG 714 Cb -0.31 -2.57 0.52 0.00 -0.45 0.00 0.00 34.95 32.14 2f3u s ARG 714 CO 0.36 -0.72 1.79 0.28 -0.68 0.00 0.00 175.30 176.32 2f3u h VAL 715 N 0.16 0.81 -0.59 3.52 2.07 -1.83 -0.80 116.25 119.59 2f3u h VAL 715 Ca -0.38 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 66.86 2f3u h VAL 715 Cb 1.29 -0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 2f3u h VAL 715 CO 0.46 0.14 0.30 -0.33 0.02 0.00 0.00 177.57 178.16 2f3u h GLU 716 N 0.76 0.82 -0.34 1.57 3.07 -1.95 -1.99 114.58 116.51 2f3u h GLU 716 Ca 0.47 -0.09 -0.13 0.00 -0.50 0.00 0.00 59.36 59.11 2f3u h GLU 716 Cb 0.57 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 2f3u h GLU 716 CO -0.31 0.62 -0.31 -0.44 -1.40 0.00 0.00 179.01 177.17 2f3u h ASP 717 N 0.82 0.76 -0.46 1.42 3.45 -1.53 -2.13 116.42 118.76 2f3u h ASP 717 Ca 0.21 -0.30 -0.05 0.00 0.43 0.00 0.00 57.03 57.31 2f3u h ASP 717 Cb 0.05 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 38.59 2f3u h ASP 717 CO -0.03 1.01 0.09 0.58 -1.57 0.00 0.00 179.24 179.32 2f3u h VAL 718 N 0.62 1.24 -0.65 -1.35 2.07 -0.81 -2.03 116.25 115.35 2f3u h VAL 718 Ca 0.07 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 2f3u h VAL 718 Cb 0.83 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 2f3u h VAL 718 CO 0.07 0.31 0.38 0.44 0.02 0.00 0.00 177.57 178.79 2f3u h ASP 719 N 0.62 0.78 -0.85 0.57 3.32 -1.25 -1.32 116.42 118.30 2f3u h ASP 719 Ca 0.14 -0.07 0.01 0.00 0.02 0.00 0.00 57.03 57.13 2f3u h ASP 719 Cb 0.36 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.67 2f3u h ASP 719 CO 0.01 0.62 0.57 0.03 -1.72 0.00 0.00 179.24 178.74 2f3u h ARG 720 N 0.88 1.12 -0.68 3.56 3.08 -1.21 -0.56 114.38 120.57 2f3u h ARG 720 Ca 0.23 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 60.13 2f3u h ARG 720 Cb -0.01 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 29.76 2f3u h ARG 720 CO -0.04 0.74 0.11 1.25 -1.07 0.00 0.00 179.97 180.96 2f3u h LEU 721 N 1.16 1.08 -0.41 3.04 6.46 -0.91 -2.12 115.31 123.60 2f3u h LEU 721 Ca 0.31 -0.26 -0.08 0.00 -0.12 0.00 0.00 57.88 57.73 2f3u h LEU 721 Cb -0.13 -0.29 -0.01 0.00 -0.73 0.00 0.00 40.66 39.50 2f3u h LEU 721 CO -0.07 1.06 -0.07 0.44 -0.62 0.00 0.00 178.44 179.19 2f3u h ASP 722 N 1.05 0.77 -0.49 1.25 3.32 -0.76 0.53 116.42 122.09 2f3u h ASP 722 Ca 0.21 -0.35 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 2f3u h ASP 722 Cb 0.44 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.76 2f3u h ASP 722 CO 0.01 0.94 0.29 1.56 -1.72 0.00 0.00 179.24 180.32 2f3u h GLN 723 N 0.60 0.70 0.01 3.56 4.20 -0.97 -2.45 115.11 120.75 2f3u h GLN 723 Ca 0.11 -0.06 -0.25 0.00 0.06 0.00 0.00 58.65 58.50 2f3u h GLN 723 Cb 0.58 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 28.18 2f3u h GLN 723 CO 0.03 0.51 -1.34 -0.09 -0.67 0.00 0.00 178.83 177.27 2f3u h ARG 724 N 0.71 0.03 0.00 1.46 2.43 -1.18 -3.50 114.38 114.33 2f3u h ARG 724 Ca 0.18 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 2f3u h ARG 724 Cb 0.01 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2f3u h ARG 724 CO -0.03 0.81 0.00 0.41 -1.51 0.00 0.00 179.97 179.65 2f3u n GLY 725 N 1.47 1.47 3.66 2.80 0.00 0.18 -5.02 105.19 109.74 2f3u n GLY 725 Ca -0.08 -1.04 -0.43 0.00 0.00 0.00 0.00 46.02 44.47 2f3u n GLY 725 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2f3u s TYR 726 N 0.00 2.93 -0.33 1.61 5.04 -1.18 -4.90 117.35 120.52 2f3u s TYR 726 Ca 0.00 1.09 0.03 0.00 -2.44 0.00 0.00 57.07 55.75 2f3u s TYR 726 Cb 0.00 -3.50 0.10 0.00 0.35 0.00 0.00 41.96 38.91 2f3u s TYR 726 CO 0.00 -1.45 0.05 1.21 -1.34 0.00 0.00 175.55 174.02 2f3u s ASN 727 N 1.89 4.68 0.47 4.32 3.84 -1.26 -4.98 114.94 123.91 2f3u s ASN 727 Ca 0.53 -2.07 0.13 0.00 0.21 0.00 0.00 52.86 51.65 2f3u s ASN 727 Cb -0.20 -1.55 1.09 0.00 -0.55 0.00 0.00 41.25 40.05 2f3u s ASN 727 CO 0.14 -0.37 2.10 0.00 -2.79 0.00 0.00 177.10 176.17 2f3u h ALA 728 N 7.67 1.86 -0.89 1.71 0.00 -1.87 -2.52 119.26 125.21 2f3u h ALA 728 Ca -0.06 -0.03 0.15 0.00 0.00 0.00 0.00 54.91 54.98 2f3u h ALA 728 Cb 1.02 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.68 2f3u h ALA 728 CO 0.51 0.12 0.58 0.37 0.00 0.00 0.00 179.25 180.83 2f3u h GLN 729 N 0.20 0.65 -0.59 0.00 5.75 -1.92 -1.84 115.11 117.36 2f3u h GLN 729 Ca 0.05 -0.04 0.05 0.00 -0.15 0.00 0.00 58.65 58.57 2f3u h GLN 729 Cb 0.01 -0.15 -0.05 0.00 1.07 0.00 0.00 27.48 28.36 2f3u h GLN 729 CO -0.01 0.43 0.31 1.49 -2.65 0.00 0.00 178.83 178.40 2f3u h GLU 730 N 0.67 0.57 -0.37 1.69 4.81 -1.87 -0.07 114.58 120.01 2f3u h GLU 730 Ca 0.45 -0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 59.50 2f3u h GLU 730 Cb 0.76 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 2f3u h GLU 730 CO -0.21 0.38 -0.37 1.88 -0.73 0.00 0.00 179.01 179.96 2f3u h TYR 731 N 0.59 1.03 -0.84 0.92 -1.99 -1.51 -2.29 116.97 112.88 2f3u h TYR 731 Ca 0.27 -0.30 0.01 0.00 2.00 0.00 0.00 58.73 60.70 2f3u h TYR 731 Cb 0.17 -0.22 -0.04 0.00 2.00 0.00 0.00 36.73 38.64 2f3u h TYR 731 CO -0.09 1.10 0.55 -0.92 -0.00 0.00 0.00 178.16 178.80 2f3u h TYR 732 N 0.71 1.07 -0.01 4.88 5.03 -1.02 -0.88 116.97 126.75 2f3u h TYR 732 Ca 0.06 0.02 -0.17 0.00 2.58 0.00 0.00 58.73 61.22 2f3u h TYR 732 Cb 0.94 -0.36 -0.02 0.00 1.55 0.00 0.00 36.73 38.85 2f3u h TYR 732 CO 0.06 0.68 -0.77 -0.44 -1.32 0.00 0.00 178.16 176.36 2f3u h ASP 733 N 1.15 0.15 0.00 -2.11 3.32 -0.83 -3.33 116.42 114.76 2f3u h ASP 733 Ca 0.31 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2f3u h ASP 733 Cb -0.12 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.38 2f3u h ASP 733 CO -0.07 0.86 -0.47 0.54 -1.72 0.00 0.00 179.24 178.39 2f3u n ARG 734 N -3.70 1.17 -3.91 3.56 1.74 -0.88 -4.78 116.66 109.86 2f3u n ARG 734 Ca -0.02 -0.95 -0.30 0.00 -0.77 0.00 0.00 57.85 55.80 2f3u n ARG 734 Cb 0.74 -1.48 -0.15 0.00 -1.02 0.00 0.00 32.46 30.55 2f3u n ARG 734 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2f3u s ILE 735 N -2.49 1.92 0.25 0.55 1.01 -0.36 -5.00 121.20 117.08 2f3u s ILE 735 Ca 0.19 -2.34 -0.04 0.00 0.00 0.00 0.00 60.65 58.46 2f3u s ILE 735 Cb 0.18 -2.40 0.22 0.00 0.01 0.00 0.00 42.46 40.47 2f3u s ILE 735 CO 0.57 -0.69 1.71 -0.65 0.00 0.00 0.00 174.94 175.89 2f3u h PRO 736 N 7.41 0.36 -0.40 2.79 0.11 -1.86 -1.18 132.00 139.22 2f3u h PRO 736 Ca -0.07 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.96 2f3u h PRO 736 Cb 0.98 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.99 2f3u h PRO 736 CO 0.54 0.24 0.00 0.93 -0.21 0.00 0.00 178.00 179.50 2f3u h GLU 737 N 0.37 0.64 -0.30 1.05 5.08 -1.95 -1.57 114.58 117.89 2f3u h GLU 737 Ca 0.42 -0.15 -0.16 0.00 -1.00 0.00 0.00 59.36 58.47 2f3u h GLU 737 Cb 0.68 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 2f3u h GLU 737 CO -0.45 0.66 -0.45 1.25 -1.00 0.00 0.00 179.01 179.02 2f3u h LEU 738 N 0.61 0.92 -0.57 1.33 5.85 -1.67 -2.88 115.31 118.90 2f3u h LEU 738 Ca 0.13 -0.51 0.02 0.00 0.84 0.00 0.00 57.88 58.36 2f3u h LEU 738 Cb 0.38 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 2f3u h LEU 738 CO 0.01 1.25 0.35 -0.09 -0.34 0.00 0.00 178.44 179.62 2f3u h ARG 739 N 0.61 0.68 -0.67 1.25 2.43 -0.93 -2.03 114.38 115.72 2f3u h ARG 739 Ca 0.03 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.19 2f3u h ARG 739 Cb 1.05 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 30.41 2f3u h ARG 739 CO 0.10 0.45 0.42 0.37 -1.51 0.00 0.00 179.97 179.80 2f3u h GLN 740 N 0.70 0.80 -0.30 0.20 4.15 -1.24 -0.94 115.11 118.47 2f3u h GLN 740 Ca 0.23 -0.05 -0.01 0.00 0.77 0.00 0.00 58.65 59.59 2f3u h GLN 740 Cb 0.01 -0.18 -0.01 0.00 0.21 0.00 0.00 27.48 27.50 2f3u h GLN 740 CO -0.09 0.53 0.15 0.82 -1.93 0.00 0.00 178.83 178.31 2f3u h ILE 741 N 0.82 1.15 -0.60 2.39 2.04 -1.21 -0.17 117.51 121.92 2f3u h ILE 741 Ca 0.27 -0.41 -0.03 0.00 1.00 0.00 0.00 64.86 65.69 2f3u h ILE 741 Cb 0.02 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 36.93 2f3u h ILE 741 CO -0.10 0.15 0.24 0.40 0.00 0.00 0.00 178.15 178.83 2f3u h ILE 742 N 0.36 1.22 -0.18 -0.67 1.08 -1.09 -0.98 117.51 117.24 2f3u h ILE 742 Ca 0.10 -0.68 -0.14 0.00 -0.39 0.00 0.00 64.86 63.75 2f3u h ILE 742 Cb 0.10 0.50 -0.01 0.00 -3.07 0.00 0.00 36.82 34.34 2f3u h ILE 742 CO -0.01 0.27 -0.49 -0.33 -0.69 0.00 0.00 178.15 176.90 2f3u h GLU 743 N 0.87 0.48 -0.57 2.37 5.08 -0.83 -0.66 114.58 121.32 2f3u h GLU 743 Ca 0.21 -0.28 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 2f3u h GLU 743 Cb 0.18 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2f3u h GLU 743 CO -0.02 0.87 0.05 1.96 -1.00 0.00 0.00 179.01 180.86 2f3u h GLN 744 N 0.38 0.97 -0.29 2.33 4.20 -0.45 -0.79 115.11 121.47 2f3u h GLN 744 Ca 0.02 -0.29 -0.04 0.00 0.06 0.00 0.00 58.65 58.41 2f3u h GLN 744 Cb 1.00 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.67 2f3u h GLN 744 CO 0.09 0.95 0.04 -0.07 -0.67 0.00 0.00 178.83 179.17 2f3u h LEU 745 N 0.86 0.47 -0.96 1.46 3.38 -1.01 -0.62 115.31 118.89 2f3u h LEU 745 Ca 0.17 -0.27 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 2f3u h LEU 745 Cb 0.48 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2f3u h LEU 745 CO 0.02 0.62 -0.31 0.28 0.09 0.00 0.00 178.44 179.13 2f3u h SER 746 N 0.30 0.38 0.88 -0.43 0.02 -1.01 -3.10 113.55 110.59 2f3u h SER 746 Ca 0.09 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2f3u h SER 746 Cb 0.36 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.79 2f3u h SER 746 CO 0.01 0.68 -0.13 -1.54 -1.14 0.00 0.00 176.83 174.71 2f3u n SER 747 N -4.09 0.15 0.00 3.07 3.41 -0.31 -4.69 113.62 111.16 2f3u n SER 747 Ca -0.01 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.91 2f3u n SER 747 Cb 0.43 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 2f3u n SER 747 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2f3u n GLY 748 N 1.49 0.79 0.30 5.00 0.00 -1.09 -4.84 105.19 106.85 2f3u n GLY 748 Ca 0.07 -0.40 0.06 0.00 0.00 0.00 0.00 46.02 45.74 2f3u n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2f3u h PHE 749 N 0.00 0.40 -0.64 1.61 3.04 -1.36 -1.42 116.94 118.57 2f3u h PHE 749 Ca 0.00 0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.96 2f3u h PHE 749 Cb 0.01 -0.13 0.00 0.00 2.56 0.00 0.00 35.95 38.38 2f3u h PHE 749 CO 0.00 0.24 0.00 1.19 -2.02 0.00 0.00 178.31 177.72 2f3u n PHE 750 N -4.49 0.84 -2.82 0.41 3.72 -1.26 -4.58 117.46 109.29 2f3u n PHE 750 Ca 0.02 -0.47 -0.11 0.00 -0.05 0.00 0.00 57.45 56.85 2f3u n PHE 750 Cb 0.10 -0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.67 2f3u n PHE 750 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2f3u n SER 751 N 1.47 -2.30 -0.16 4.37 3.41 -0.58 -4.80 113.62 115.02 2f3u n SER 751 Ca 0.22 -3.30 -0.04 0.00 -0.26 0.00 0.00 58.87 55.50 2f3u n SER 751 Cb 0.59 1.47 0.03 0.00 -0.26 0.00 0.00 64.21 66.03 2f3u n SER 751 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2f3u h PRO 752 N 3.78 -0.10 0.00 4.33 0.11 -1.68 -1.47 132.00 136.98 2f3u h PRO 752 Ca -0.11 0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.94 2f3u h PRO 752 Cb 1.02 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 2f3u h PRO 752 CO 0.32 -0.06 -0.34 0.87 -0.21 0.00 0.00 178.00 178.57 2f3u h LYS 753 N -0.10 0.00 -2.38 1.05 1.57 -1.96 -3.34 116.57 111.42 2f3u h LYS 753 Ca 0.24 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.42 2f3u h LYS 753 Cb 0.47 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.37 2f3u h LYS 753 CO -0.57 0.34 -0.80 1.04 -0.57 0.00 0.00 179.45 178.90 2f3u n GLN 754 N -3.71 1.45 -0.33 3.15 6.02 -0.63 -5.00 117.38 118.33 2f3u n GLN 754 Ca -0.01 -3.96 0.26 0.00 -0.01 0.00 0.00 57.00 53.28 2f3u n GLN 754 Cb 0.44 -1.88 0.50 0.00 1.02 0.00 0.00 30.24 30.32 2f3u n GLN 754 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 2f3u h PRO 755 N 4.68 0.19 -0.57 -1.09 0.11 -1.48 -0.21 132.00 133.62 2f3u h PRO 755 Ca 0.17 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.27 2f3u h PRO 755 Cb 0.79 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.85 2f3u h PRO 755 CO 0.62 0.12 0.00 -0.40 -0.21 0.00 0.00 178.00 178.14 2f3u n ASP 756 N -5.15 5.03 -0.33 -2.05 3.85 -1.26 -3.01 116.55 113.62 2f3u n ASP 756 Ca 0.33 -2.69 0.18 0.00 -0.71 0.00 0.00 54.79 51.90 2f3u n ASP 756 Cb 1.07 -0.61 0.41 0.00 -1.35 0.00 0.00 41.12 40.64 2f3u n ASP 756 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 2f3u h LEU 757 N 3.77 0.63 -3.70 -2.12 5.85 -1.35 -1.22 115.31 117.17 2f3u h LEU 757 Ca 0.00 0.10 -0.20 0.00 0.84 0.00 0.00 57.88 58.61 2f3u h LEU 757 Cb 1.65 -0.01 -0.12 0.00 0.37 0.00 0.00 40.66 42.55 2f3u h LEU 757 CO 0.33 0.17 0.24 0.49 -0.34 0.00 0.00 178.44 179.33 2f3u n PHE 758 N -4.73 2.31 -0.20 1.25 3.01 -1.26 -4.58 117.46 113.26 2f3u n PHE 758 Ca 0.24 -1.21 0.04 0.00 1.01 0.00 0.00 57.45 57.54 2f3u n PHE 758 Cb 0.72 -0.66 0.31 0.00 -0.01 0.00 0.00 39.48 39.84 2f3u n PHE 758 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 2f3u h LYS 759 N 2.54 0.83 -0.51 -1.08 2.10 -1.54 -1.97 116.57 116.93 2f3u h LYS 759 Ca 0.25 -0.05 -0.10 0.00 -2.00 0.00 0.00 60.65 58.75 2f3u h LYS 759 Cb 2.26 -0.19 -0.02 0.00 -0.90 0.00 0.00 32.23 33.38 2f3u h LYS 759 CO 0.70 0.55 -0.10 -0.44 -2.00 0.00 0.00 179.45 178.16 2f3u h ASP 760 N 0.85 0.94 0.03 7.07 3.32 -1.83 -1.32 116.42 125.48 2f3u h ASP 760 Ca 0.30 -0.30 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 2f3u h ASP 760 Cb 0.13 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.42 2f3u h ASP 760 CO -0.09 1.05 -0.01 0.40 -1.72 0.00 0.00 179.24 178.86 2f3u h ILE 761 N 0.85 1.15 -0.45 0.35 2.04 -1.72 -1.67 117.51 118.05 2f3u h ILE 761 Ca 0.14 -0.55 0.01 0.00 1.00 0.00 0.00 64.86 65.46 2f3u h ILE 761 Cb 0.63 1.52 -0.03 0.00 -0.74 0.00 0.00 36.82 38.20 2f3u h ILE 761 CO 0.04 0.14 0.28 0.58 0.00 0.00 0.00 178.15 179.20 2f3u h VAL 762 N -0.28 1.08 -0.62 1.67 2.07 -1.36 -0.99 116.25 117.81 2f3u h VAL 762 Ca -0.00 -0.20 0.03 0.00 0.82 0.00 0.00 66.70 67.35 2f3u h VAL 762 Cb 0.26 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.45 2f3u h VAL 762 CO 0.01 0.10 0.38 -1.13 0.02 0.00 0.00 177.57 176.95 2f3u h ASN 763 N 0.57 0.62 -0.20 0.57 -1.24 -1.19 0.37 115.58 115.08 2f3u h ASN 763 Ca 0.17 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.17 2f3u h ASN 763 Cb -0.02 -0.13 -0.01 0.00 0.73 0.00 0.00 38.32 38.89 2f3u h ASN 763 CO -0.06 0.43 0.06 -0.03 -1.29 0.00 0.00 177.43 176.54 2f3u h MET 764 N 0.75 0.31 -0.69 6.67 4.05 -0.97 0.23 114.93 125.29 2f3u h MET 764 Ca 0.25 -0.07 0.03 0.00 -0.28 0.00 0.00 59.70 59.64 2f3u h MET 764 Cb 0.03 -0.04 -0.05 0.00 -0.80 0.00 0.00 31.60 30.74 2f3u h MET 764 CO -0.11 0.42 0.42 -0.07 0.23 0.00 0.00 176.91 177.81 2f3u h LEU 765 N 0.14 0.68 0.03 3.39 4.07 -0.83 -0.95 115.31 121.84 2f3u h LEU 765 Ca 0.06 0.00 -0.26 0.00 0.08 0.00 0.00 57.88 57.77 2f3u h LEU 765 Cb 0.25 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.85 2f3u h LEU 765 CO -0.00 0.47 -1.15 0.24 -1.08 0.00 0.00 178.44 176.92 2f3u h MET 766 N 0.82 0.32 0.00 1.13 2.86 -0.79 -3.41 114.93 115.86 2f3u h MET 766 Ca 0.28 -0.47 -0.07 0.00 -2.06 0.00 0.00 59.70 57.38 2f3u h MET 766 Cb 0.05 0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 2f3u h MET 766 CO -0.12 1.19 -1.29 0.72 1.06 0.00 0.00 176.91 178.47 2f3u n HIS 767 N -3.61 0.00 -2.95 -0.22 8.25 0.80 -4.39 115.22 113.10 2f3u n HIS 767 Ca -0.08 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.24 2f3u n HIS 767 Cb 0.96 -0.21 0.02 0.00 1.12 0.00 0.00 29.99 31.88 2f3u n HIS 767 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2f3u n HIS 768 N -2.12 -0.24 -3.03 4.41 -0.00 -0.47 -5.03 115.22 108.74 2f3u n HIS 768 Ca -0.07 -3.15 -0.44 0.00 -0.00 0.00 0.00 57.72 54.07 2f3u n HIS 768 Cb 0.60 0.06 -0.05 0.00 -0.00 0.00 0.00 29.99 30.61 2f3u n HIS 768 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 2f3u s ASP 769 N -2.34 6.21 0.43 4.39 2.15 -0.57 -4.85 116.67 122.10 2f3u s ASP 769 Ca 0.33 -1.03 0.30 0.00 0.43 0.00 0.00 52.55 52.57 2f3u s ASP 769 Cb 0.37 -2.34 1.31 0.00 -0.30 0.00 0.00 42.92 41.96 2f3u s ASP 769 CO -0.05 -1.14 1.89 0.03 -0.17 0.00 0.00 175.17 175.73 2f3u h ARG 770 N 9.24 0.00 -0.44 4.34 3.08 -1.97 -3.19 114.38 125.44 2f3u h ARG 770 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2f3u h ARG 770 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.13 2f3u h ARG 770 CO 1.08 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 181.17 2f3u n PHE 771 N -2.68 0.78 -3.99 3.04 3.72 -1.26 -5.01 117.46 112.06 2f3u n PHE 771 Ca 0.01 -0.58 -0.30 0.00 -0.05 0.00 0.00 57.45 56.53 2f3u n PHE 771 Cb 0.23 -0.10 -0.02 0.00 -0.94 0.00 0.00 39.48 38.64 2f3u n PHE 771 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2f3u n LYS 772 N 0.62 -2.09 -0.08 -1.08 5.02 -1.21 -4.75 118.16 114.60 2f3u n LYS 772 Ca 0.17 0.31 -0.07 0.00 -2.02 0.00 0.00 58.31 56.71 2f3u n LYS 772 Cb 0.61 -4.02 0.00 0.00 -0.02 0.00 0.00 35.03 31.60 2f3u n LYS 772 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2f3u h VAL 773 N -1.94 0.81 -0.62 -0.18 2.07 -1.94 -2.59 116.25 111.87 2f3u h VAL 773 Ca -0.65 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 2f3u h VAL 773 Cb 1.38 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 31.80 2f3u h VAL 773 CO 0.60 0.02 0.34 -0.26 0.02 0.00 0.00 177.57 178.29 2f3u h PHE 774 N 0.13 0.83 -0.31 1.57 0.05 -1.91 -2.88 116.94 114.41 2f3u h PHE 774 Ca 0.14 -0.01 0.09 0.00 3.82 0.00 0.00 57.97 62.01 2f3u h PHE 774 Cb 0.18 -0.27 -0.01 0.00 2.00 0.00 0.00 35.95 37.85 2f3u h PHE 774 CO -0.20 0.58 0.25 0.00 -0.18 0.00 0.00 178.31 178.76 2f3u h ALA 775 N 1.51 2.20 -0.08 2.45 0.00 -1.84 -2.02 119.26 121.49 2f3u h ALA 775 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2f3u h ALA 775 Cb 0.02 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2f3u h ALA 775 CO -0.04 -0.41 0.00 -0.25 0.00 0.00 0.00 179.25 178.56 2f3u n ASP 776 N -4.27 2.48 0.19 0.00 8.00 -1.10 -4.71 116.55 117.15 2f3u n ASP 776 Ca 0.05 -1.72 -0.15 0.00 0.71 0.00 0.00 54.79 53.68 2f3u n ASP 776 Cb 0.41 -0.04 -0.07 0.00 -0.02 0.00 0.00 41.12 41.40 2f3u n ASP 776 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 2f3u h TYR 777 N 3.17 -0.87 0.06 1.24 5.03 -1.26 -1.17 116.97 123.17 2f3u h TYR 777 Ca 0.00 0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.34 2f3u h TYR 777 Cb 0.70 0.34 -0.03 0.00 1.55 0.00 0.00 36.73 39.29 2f3u h TYR 777 CO 0.04 -0.45 -0.22 0.93 -1.32 0.00 0.00 178.16 177.14 2f3u h GLU 778 N -0.65 -0.37 -0.46 1.82 5.08 -1.84 -1.23 114.58 116.94 2f3u h GLU 778 Ca -0.01 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2f3u h GLU 778 Cb 0.60 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.92 2f3u h GLU 778 CO -0.08 -0.25 0.19 1.49 -1.00 0.00 0.00 179.01 179.36 2f3u h GLU 779 N -0.38 0.65 -0.02 2.33 4.81 -1.87 -1.46 114.58 118.63 2f3u h GLU 779 Ca 0.04 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2f3u h GLU 779 Cb 0.43 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 2f3u h GLU 779 CO -0.16 0.53 0.00 -0.92 -0.73 0.00 0.00 179.01 177.73 2f3u h TYR 780 N 0.65 0.04 -0.85 0.92 3.20 -0.82 -0.22 116.97 119.89 2f3u h TYR 780 Ca 0.16 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.01 2f3u h TYR 780 Cb 0.12 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.34 2f3u h TYR 780 CO 0.01 0.26 0.50 0.28 -1.64 0.00 0.00 178.16 177.56 2f3u h VAL 781 N -0.20 1.24 -0.51 1.81 2.07 -1.01 -0.13 116.25 119.53 2f3u h VAL 781 Ca 0.01 -0.56 -0.02 0.00 0.82 0.00 0.00 66.70 66.95 2f3u h VAL 781 Cb 0.24 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.06 2f3u h VAL 781 CO 0.00 0.26 0.23 0.50 0.02 0.00 0.00 177.57 178.58 2f3u h LYS 782 N 1.18 0.73 -0.71 1.57 1.63 -1.15 -2.32 116.57 117.50 2f3u h LYS 782 Ca 0.30 -0.11 -0.04 0.00 -0.85 0.00 0.00 60.65 59.95 2f3u h LYS 782 Cb -0.02 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 31.45 2f3u h LYS 782 CO -0.05 0.62 0.29 0.00 -3.45 0.00 0.00 179.45 176.86 2f3u h GLN 784 N 1.01 0.14 -0.36 0.00 1.08 -0.72 -1.07 115.11 115.19 2f3u h GLN 784 Ca 0.24 -0.01 -0.13 0.00 -1.45 0.00 0.00 58.65 57.30 2f3u h GLN 784 Cb 0.21 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 2f3u h GLN 784 CO -0.02 0.15 -0.29 0.93 -0.95 0.00 0.00 178.83 178.65 2f3u h GLU 785 N 0.14 0.76 -0.06 1.46 5.08 -0.88 -2.10 114.58 118.98 2f3u h GLU 785 Ca 0.04 -0.34 -0.07 0.00 -1.00 0.00 0.00 59.36 57.98 2f3u h GLU 785 Cb 0.08 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2f3u h GLU 785 CO -0.00 0.96 -0.31 0.00 -1.00 0.00 0.00 179.01 178.66 2f3u h ARG 786 N 0.65 0.11 -0.04 2.33 3.08 -1.01 -1.59 114.38 117.92 2f3u h ARG 786 Ca 0.08 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 2f3u h ARG 786 Cb 0.82 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.86 2f3u h ARG 786 CO 0.07 0.42 0.00 0.28 -1.07 0.00 0.00 179.97 179.66 2f3u h VAL 787 N 0.10 1.25 -0.76 2.04 2.07 -0.93 -2.44 116.25 117.58 2f3u h VAL 787 Ca 0.01 -0.74 0.01 0.00 0.82 0.00 0.00 66.70 66.81 2f3u h VAL 787 Cb 0.60 1.68 -0.04 0.00 -1.52 0.00 0.00 31.29 32.01 2f3u h VAL 787 CO 0.04 0.20 0.50 0.28 0.02 0.00 0.00 177.57 178.62 2f3u h SER 788 N -0.23 0.86 -0.70 0.57 0.02 -1.15 -1.30 113.55 111.62 2f3u h SER 788 Ca 0.01 -0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 2f3u h SER 788 Cb 0.32 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 2f3u h SER 788 CO 0.00 0.61 0.26 0.00 -1.14 0.00 0.00 176.83 176.56 2f3u h ALA 789 N 1.53 0.91 -0.07 3.77 0.00 -1.18 -2.79 119.26 121.44 2f3u h ALA 789 Ca 0.28 -0.19 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 2f3u h ALA 789 Cb -0.08 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2f3u h ALA 789 CO -0.07 0.55 -0.66 1.25 0.00 0.00 0.00 179.25 180.32 2f3u h LEU 790 N 1.00 0.32 -1.77 0.00 6.46 -0.92 -3.07 115.31 117.32 2f3u h LEU 790 Ca 0.23 -0.19 -0.03 0.00 -0.12 0.00 0.00 57.88 57.76 2f3u h LEU 790 Cb 0.24 -0.09 -0.00 0.00 -0.73 0.00 0.00 40.66 40.07 2f3u h LEU 790 CO -0.01 0.89 -0.16 0.22 -0.62 0.00 0.00 178.44 178.75 2f3u h TYR 791 N 0.19 0.00 0.00 1.25 3.20 -1.00 -1.63 116.97 118.98 2f3u h TYR 791 Ca -0.01 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2f3u h TYR 791 Cb 1.19 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.46 2f3u h TYR 791 CO 0.03 0.16 0.00 1.63 -1.64 0.00 0.00 178.16 178.34 2f3u n LYS 792 N -3.92 0.18 -3.76 1.82 5.02 -1.08 -3.78 118.16 112.64 2f3u n LYS 792 Ca -0.02 0.45 -0.32 0.00 -2.02 0.00 0.00 58.31 56.40 2f3u n LYS 792 Cb 0.25 -1.88 -0.09 0.00 -0.02 0.00 0.00 35.03 33.29 2f3u n LYS 792 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2f3u n ASN 793 N -2.23 3.66 -0.35 4.39 2.85 -0.61 -4.98 115.26 117.99 2f3u n ASN 793 Ca 0.02 -3.18 0.04 0.00 -0.11 0.00 0.00 54.58 51.34 2f3u n ASN 793 Cb 0.20 -0.91 0.10 0.00 1.24 0.00 0.00 39.78 40.42 2f3u n ASN 793 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 2f3u n PRO 794 N 2.11 -0.13 -0.13 1.20 -0.02 -1.25 -1.34 135.00 135.44 2f3u n PRO 794 Ca 0.21 1.48 -0.07 0.00 -2.02 0.00 0.00 63.50 63.10 2f3u n PRO 794 Cb 0.36 -2.21 0.02 0.00 -0.02 0.00 0.00 33.50 31.65 2f3u n PRO 794 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 2f3u h ARG 795 N 0.00 0.47 -0.01 -0.52 2.43 -1.93 -0.99 114.38 113.83 2f3u h ARG 795 Ca 0.42 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.41 2f3u h ARG 795 Cb 0.66 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 2f3u h ARG 795 CO -0.97 0.31 -0.72 0.93 -1.51 0.00 0.00 179.97 178.01 2f3u h GLU 796 N 0.49 0.04 -0.08 0.20 4.39 -1.60 -1.68 114.58 116.34 2f3u h GLU 796 Ca 0.17 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.82 2f3u h GLU 796 Cb 0.02 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.67 2f3u h GLU 796 CO -0.08 0.74 0.02 2.35 -1.16 0.00 0.00 179.01 180.89 2f3u h TRP 797 N 0.03 0.13 -0.51 4.33 2.91 -0.94 -2.24 115.95 119.66 2f3u h TRP 797 Ca -0.01 -0.01 -0.04 0.00 1.13 0.00 0.00 58.89 59.95 2f3u h TRP 797 Cb 1.27 -0.04 -0.02 0.00 -0.51 0.00 0.00 29.16 29.86 2f3u h TRP 797 CO 0.01 0.28 0.14 1.15 -1.03 0.00 0.00 178.44 178.98 2f3u h THR 798 N -0.06 1.21 -0.50 2.65 2.02 -1.12 -1.51 112.91 115.59 2f3u h THR 798 Ca 0.03 -0.74 -0.08 0.00 0.77 0.00 0.00 66.41 66.38 2f3u h THR 798 Cb 0.21 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.27 2f3u h THR 798 CO -0.00 0.28 -0.02 0.03 0.37 0.00 0.00 175.52 176.18 2f3u h ARG 799 N 0.74 0.86 -0.28 6.66 3.08 -1.16 -0.79 114.38 123.49 2f3u h ARG 799 Ca 0.17 -0.25 -0.11 0.00 0.07 0.00 0.00 59.98 59.86 2f3u h ARG 799 Cb 0.25 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 2f3u h ARG 799 CO -0.01 0.87 -0.27 1.98 -1.07 0.00 0.00 179.97 181.48 2f3u h MET 800 N 0.79 0.57 -0.35 0.04 4.05 -0.93 -2.25 114.93 116.85 2f3u h MET 800 Ca 0.15 -0.23 -0.00 0.00 -0.28 0.00 0.00 59.70 59.34 2f3u h MET 800 Cb 0.50 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.26 2f3u h MET 800 CO 0.03 0.78 0.21 0.28 0.23 0.00 0.00 176.91 178.44 2f3u h VAL 801 N 0.49 1.12 -0.84 -5.77 2.07 -0.62 -1.92 116.25 110.78 2f3u h VAL 801 Ca 0.07 -0.27 0.03 0.00 0.82 0.00 0.00 66.70 67.35 2f3u h VAL 801 Cb 0.72 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.11 2f3u h VAL 801 CO 0.06 0.12 0.55 0.40 0.02 0.00 0.00 177.57 178.71 2f3u h ILE 802 N 0.46 1.15 0.00 4.57 2.04 -0.86 0.23 117.51 125.09 2f3u h ILE 802 Ca 0.13 -0.36 -0.04 0.00 1.00 0.00 0.00 64.86 65.58 2f3u h ILE 802 Cb 0.00 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.08 2f3u h ILE 802 CO -0.02 0.19 -0.21 0.03 0.00 0.00 0.00 178.15 178.14 2f3u h ARG 803 N 1.06 0.00 0.03 2.37 3.08 -0.81 -0.65 114.38 119.45 2f3u h ARG 803 Ca 0.33 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.38 2f3u h ARG 803 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2f3u h ARG 803 CO -0.09 0.21 -0.01 -0.91 -1.07 0.00 0.00 179.97 178.10 2f3u h ASN 804 N 0.00 -0.03 -0.72 7.04 2.35 -0.28 -3.18 115.58 120.75 2f3u h ASN 804 Ca -0.00 -0.66 0.09 0.00 -0.55 0.00 0.00 56.30 55.17 2f3u h ASN 804 Cb 0.46 0.01 -0.07 0.00 0.05 0.00 0.00 38.32 38.76 2f3u h ASN 804 CO 0.03 0.77 0.38 0.40 -1.65 0.00 0.00 177.43 177.35 2f3u h ILE 805 N -0.94 0.88 0.00 2.81 2.04 -1.01 -1.99 117.51 119.29 2f3u h ILE 805 Ca -0.00 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 2f3u h ILE 805 Cb 0.69 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 36.94 2f3u h ILE 805 CO 0.01 0.12 -0.08 0.00 0.00 0.00 0.00 178.15 178.20 2f3u h ALA 806 N 1.42 1.37 -0.26 1.87 0.00 -1.23 -2.85 119.26 119.58 2f3u h ALA 806 Ca 0.35 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2f3u h ALA 806 Cb 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2f3u h ALA 806 CO -0.25 0.10 0.00 0.25 0.00 0.00 0.00 179.25 179.35 2f3u n THR 807 N -3.72 2.29 1.43 0.00 -2.24 -0.77 -2.13 114.28 109.15 2f3u n THR 807 Ca -0.02 -1.88 0.14 0.00 -2.27 0.00 0.00 64.05 60.02 2f3u n THR 807 Cb 0.18 -0.26 0.47 0.00 -2.10 0.00 0.00 70.33 68.63 2f3u n THR 807 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2f3u n SER 808 N -0.50 1.64 -0.34 3.42 3.41 -1.05 -4.41 113.62 115.78 2f3u n SER 808 Ca 0.21 -1.53 0.13 0.00 -0.26 0.00 0.00 58.87 57.42 2f3u n SER 808 Cb 0.90 0.01 0.33 0.00 -0.26 0.00 0.00 64.21 65.18 2f3u n SER 808 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2f3u h GLY 809 N 4.84 1.68 1.81 5.00 0.00 -1.80 -1.40 103.07 113.21 2f3u h GLY 809 Ca 0.00 -0.36 0.02 0.00 0.00 0.00 0.00 47.33 46.99 2f3u h GLY 809 CO 0.00 -0.02 0.08 1.70 0.00 0.00 0.00 176.54 178.30 2f3u h LYS 810 N 0.77 0.00 -0.73 4.80 3.64 -1.88 -2.75 116.57 120.42 2f3u h LYS 810 Ca 0.56 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.94 2f3u h LYS 810 Cb 0.86 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.68 2f3u h LYS 810 CO -0.34 0.00 0.00 1.19 -2.27 0.00 0.00 179.45 178.03 2f3u n PHE 811 N -3.68 1.00 -2.77 1.91 3.01 -0.53 -4.75 117.46 111.65 2f3u n PHE 811 Ca -0.01 -0.36 -0.41 0.00 1.01 0.00 0.00 57.45 57.68 2f3u n PHE 811 Cb 0.17 -0.27 -0.05 0.00 -0.01 0.00 0.00 39.48 39.32 2f3u n PHE 811 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2f3u s SER 812 N -0.49 7.50 0.09 4.37 0.15 -1.04 -0.74 113.70 123.55 2f3u s SER 812 Ca 0.28 1.78 0.13 0.00 0.70 0.00 0.00 55.95 58.84 2f3u s SER 812 Cb 0.20 -2.58 0.58 0.00 -1.71 0.00 0.00 66.02 62.52 2f3u s SER 812 CO 0.10 0.01 1.41 -1.54 1.20 0.00 0.00 173.24 174.41 2f3u n SER 813 N 2.44 0.20 -0.08 5.45 3.41 -0.19 -1.46 113.62 123.39 2f3u n SER 813 Ca 0.00 0.56 -0.08 0.00 -0.26 0.00 0.00 58.87 59.10 2f3u n SER 813 Cb 0.49 -0.60 0.08 0.00 -0.26 0.00 0.00 64.21 63.92 2f3u n SER 813 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2f3u h ASP 814 N 0.00 0.78 -0.17 4.04 3.32 -1.91 0.62 116.42 123.09 2f3u h ASP 814 Ca 0.00 -0.29 -0.04 0.00 0.02 0.00 0.00 57.03 56.71 2f3u h ASP 814 Cb 0.17 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.50 2f3u h ASP 814 CO 0.00 1.00 -0.06 -0.09 -1.72 0.00 0.00 179.24 178.37 2f3u h ARG 815 N 0.65 0.34 -0.11 3.56 1.12 -1.57 -1.24 114.38 117.13 2f3u h ARG 815 Ca 0.08 -0.14 0.03 0.00 -1.11 0.00 0.00 59.98 58.85 2f3u h ARG 815 Cb 0.78 -0.02 -0.04 0.00 -0.01 0.00 0.00 29.97 30.68 2f3u h ARG 815 CO 0.06 0.63 -0.11 1.15 -3.11 0.00 0.00 179.97 178.60 2f3u h THR 816 N 0.04 0.70 -0.49 0.20 2.02 -1.38 -2.00 112.91 112.00 2f3u h THR 816 Ca 0.04 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.16 2f3u h THR 816 Cb 0.51 0.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 2f3u h THR 816 CO 0.02 0.00 0.06 0.40 0.37 0.00 0.00 175.52 176.37 2f3u h ILE 817 N -0.13 1.23 -0.53 3.11 1.08 -0.85 -1.82 117.51 119.59 2f3u h ILE 817 Ca 0.08 -0.88 -0.01 0.00 -0.39 0.00 0.00 64.86 63.65 2f3u h ILE 817 Cb 0.24 0.79 -0.03 0.00 -3.07 0.00 0.00 36.82 34.76 2f3u h ILE 817 CO -0.19 0.32 0.27 0.00 -0.69 0.00 0.00 178.15 177.87 2f3u h ALA 818 N 1.33 1.48 -0.25 1.87 0.00 -0.84 0.57 119.26 123.43 2f3u h ALA 818 Ca 0.15 -0.10 -0.20 0.00 0.00 0.00 0.00 54.91 54.77 2f3u h ALA 818 Cb 0.36 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2f3u h ALA 818 CO 0.01 0.42 -0.62 1.96 0.00 0.00 0.00 179.25 181.02 2f3u h GLN 819 N 0.74 0.85 -0.58 0.00 4.20 -0.68 -1.94 115.11 117.72 2f3u h GLN 819 Ca 0.19 -0.59 -0.02 0.00 0.06 0.00 0.00 58.65 58.29 2f3u h GLN 819 Cb 0.05 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.89 2f3u h GLN 819 CO -0.03 1.22 0.29 1.88 -0.67 0.00 0.00 178.83 181.52 2f3u h TYR 820 N 0.63 0.82 -0.09 2.96 0.05 -0.91 0.14 116.97 120.58 2f3u h TYR 820 Ca -0.01 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.74 2f3u h TYR 820 Cb 1.24 -0.26 -0.00 0.00 1.01 0.00 0.00 36.73 38.72 2f3u h TYR 820 CO 0.08 0.62 0.06 0.00 -1.05 0.00 0.00 178.16 177.87 2f3u h ALA 821 N 1.12 0.12 0.15 3.88 0.00 -0.81 -0.13 119.26 123.58 2f3u h ALA 821 Ca 0.20 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.80 2f3u h ALA 821 Cb 0.10 -0.04 0.03 0.00 0.00 0.00 0.00 17.79 17.88 2f3u h ALA 821 CO -0.03 -0.39 -1.25 0.00 0.00 0.00 0.00 179.25 177.58 2f3u h ARG 822 N 0.12 0.59 0.00 0.00 3.08 -1.29 0.17 114.38 117.05 2f3u h ARG 822 Ca 0.03 -0.83 0.00 0.00 0.07 0.00 0.00 59.98 59.25 2f3u h ARG 822 Cb -0.00 0.28 0.00 0.00 0.08 0.00 0.00 29.97 30.33 2f3u h ARG 822 CO -0.01 1.38 -0.94 0.39 -1.07 0.00 0.00 179.97 179.73 2f3u n GLU 823 N -3.81 0.27 0.00 0.04 1.02 0.03 -4.27 120.64 113.92 2f3u n GLU 823 Ca -0.14 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 2f3u n GLU 823 Cb 0.99 -1.60 0.00 0.00 -0.02 0.00 0.00 31.44 30.81 2f3u n GLU 823 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2f3u n ILE 824 N -1.96 0.03 0.16 -3.67 5.41 -0.25 -4.86 119.36 114.22 2f3u n ILE 824 Ca 0.02 0.01 0.07 0.00 1.00 0.00 0.00 62.75 63.86 2f3u n ILE 824 Cb 0.43 -1.24 0.07 0.00 -0.71 0.00 0.00 39.64 38.20 2f3u n ILE 824 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 2f3u h TRP 825 N 0.00 0.00 -2.85 1.39 6.55 -1.12 -3.48 115.95 116.44 2f3u h TRP 825 Ca 0.00 0.00 -0.14 0.00 0.95 0.00 0.00 58.89 59.70 2f3u h TRP 825 Cb 0.71 0.00 0.05 0.00 -0.86 0.00 0.00 29.16 29.06 2f3u h TRP 825 CO 0.00 0.25 -0.25 0.41 -1.05 0.00 0.00 178.44 177.80 2f3u n GLY 826 N 1.18 0.36 3.10 1.49 0.00 0.38 -4.95 105.19 106.75 2f3u n GLY 826 Ca 0.02 -0.33 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 2f3u n GLY 826 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2f3u s VAL 827 N -3.12 0.61 -0.22 1.61 -7.23 0.02 -5.01 120.40 107.05 2f3u s VAL 827 Ca 0.16 -1.33 -0.10 0.00 -1.81 0.00 0.00 61.98 58.90 2f3u s VAL 827 Cb -0.07 -0.93 -0.05 0.00 0.56 0.00 0.00 36.38 35.89 2f3u s VAL 827 CO 0.26 -0.51 0.15 -1.61 -0.31 0.00 0.00 175.10 173.07 2f3u s GLU 828 N -2.21 4.11 0.64 4.82 0.41 -1.26 -3.42 118.70 121.79 2f3u s GLU 828 Ca -0.04 -0.25 -0.16 0.00 -0.41 0.00 0.00 54.97 54.11 2f3u s GLU 828 Cb -0.06 -3.49 -0.01 0.00 -1.78 0.00 0.00 34.13 28.80 2f3u s GLU 828 CO -0.01 0.15 1.12 -1.25 -0.49 0.00 0.00 175.26 174.79 2f3u s PRO 829 N 0.79 2.85 -0.01 0.39 0.04 -1.26 -4.94 135.00 132.86 2f3u s PRO 829 Ca 0.08 1.46 0.01 0.00 0.04 0.00 0.00 61.00 62.58 2f3u s PRO 829 Cb -0.13 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.47 2f3u s PRO 829 CO 0.02 -1.22 -0.01 0.45 0.04 0.00 0.00 177.00 176.27 2f3u s SER 830 N -2.38 0.23 -0.11 6.66 0.15 0.91 -5.01 113.70 114.14 2f3u s SER 830 Ca 0.69 -0.03 0.17 0.00 0.70 0.00 0.00 55.95 57.48 2f3u s SER 830 Cb -0.22 -0.05 0.61 0.00 -1.71 0.00 0.00 66.02 64.65 2f3u s SER 830 CO 0.39 -0.00 1.53 0.54 1.20 0.00 0.00 173.24 176.90 2f3u n ARG 831 N 3.24 3.46 -2.55 5.44 5.12 -1.26 -2.88 116.66 127.22 2f3u n ARG 831 Ca -0.15 -2.73 -0.42 0.00 -1.93 0.00 0.00 57.85 52.62 2f3u n ARG 831 Cb 0.58 -1.78 -0.03 0.00 -1.16 0.00 0.00 32.46 30.07 2f3u n ARG 831 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2f3u s GLN 832 N -1.88 4.51 0.50 5.56 -0.21 -1.26 -5.03 119.66 121.85 2f3u s GLN 832 Ca 0.44 1.63 -0.20 0.00 0.02 0.00 0.00 55.36 57.25 2f3u s GLN 832 Cb 0.29 -3.38 -0.08 0.00 1.00 0.00 0.00 33.01 30.85 2f3u s GLN 832 CO 0.20 -0.12 1.07 1.03 -2.12 0.00 0.00 175.29 175.35 2f3u s ARG 833 N 0.80 3.68 0.01 2.91 3.00 -1.26 -4.95 118.95 123.14 2f3u s ARG 833 Ca 0.55 1.45 -0.00 0.00 0.00 0.00 0.00 55.73 57.72 2f3u s ARG 833 Cb -0.26 -2.09 -0.04 0.00 0.00 0.00 0.00 34.95 32.56 2f3u s ARG 833 CO 0.30 -0.55 0.11 -0.51 0.00 0.00 0.00 175.30 174.65 2f3u s LEU 834 N -3.53 4.01 0.09 2.53 1.43 -0.14 -5.03 118.68 118.04 2f3u s LEU 834 Ca 0.68 0.18 -0.31 0.00 -1.03 0.00 0.00 54.13 53.66 2f3u s LEU 834 Cb -0.19 -2.40 -0.09 0.00 0.03 0.00 0.00 46.19 43.54 2f3u s LEU 834 CO 0.23 0.25 1.74 -2.16 0.23 0.00 0.00 176.35 176.64 2f3u s PRO 835 N -1.89 4.17 0.00 1.29 0.04 -1.26 -4.60 135.00 132.75 2f3u s PRO 835 Ca 0.25 2.45 0.30 0.00 0.04 0.00 0.00 61.00 64.03 2f3u s PRO 835 Cb -0.12 -3.64 1.41 0.00 0.04 0.00 0.00 34.50 32.19 2f3u s PRO 835 CO 0.16 -0.79 1.95 0.00 0.04 0.00 0.00 177.00 178.36