#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n3x s ILE 2 N 0.00 3.50 0.38 -0.18 1.01 -1.24 -4.95 121.20 119.72 1n3x s ILE 2 Ca 0.00 1.00 -0.26 0.00 0.00 0.00 0.00 60.65 61.39 1n3x s ILE 2 Cb 0.00 -3.64 -0.11 0.00 0.01 0.00 0.00 42.46 38.72 1n3x s ILE 2 CO 0.00 0.04 1.10 1.21 0.00 0.00 0.00 174.94 177.28 1n3x n GLU 3 N 4.72 1.58 -4.08 2.79 4.07 -1.26 -4.79 120.64 123.66 1n3x n GLU 3 Ca 0.12 0.56 -0.34 0.00 -0.06 0.00 0.00 57.16 57.44 1n3x n GLU 3 Cb 0.43 -2.10 -0.07 0.00 -0.06 0.00 0.00 31.44 29.64 1n3x n GLU 3 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 1n3x s GLU 4 N -1.92 3.17 0.00 5.31 2.12 -1.26 -4.45 118.70 121.68 1n3x s GLU 4 Ca 0.60 -0.38 0.00 0.00 0.36 0.00 0.00 54.97 55.56 1n3x s GLU 4 Cb -0.58 -2.94 0.00 0.00 0.26 0.00 0.00 34.13 30.86 1n3x s GLU 4 CO 0.59 0.69 0.00 0.41 -0.54 0.00 0.00 175.26 176.41 1n3x n GLY 5 N 1.51 0.82 3.58 -1.50 0.00 -1.26 -5.06 105.19 103.28 1n3x n GLY 5 Ca -0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.77 1n3x n GLY 5 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n3x s LYS 6 N -0.66 1.65 -0.11 1.61 -2.85 -1.26 -4.51 119.74 113.62 1n3x s LYS 6 Ca 0.00 -1.36 0.01 0.00 -1.00 0.00 0.00 55.97 53.61 1n3x s LYS 6 Cb 0.00 0.47 0.02 0.00 -2.06 0.00 0.00 37.83 36.26 1n3x s LYS 6 CO 0.00 -0.69 -0.11 -0.51 0.10 0.00 0.00 175.35 174.14 1n3x s LEU 7 N -3.06 1.45 -0.16 2.77 1.43 -0.81 -4.87 118.68 115.42 1n3x s LEU 7 Ca 0.24 -0.34 -0.03 0.00 -1.03 0.00 0.00 54.13 52.97 1n3x s LEU 7 Cb -0.01 -0.92 -0.02 0.00 0.03 0.00 0.00 46.19 45.27 1n3x s LEU 7 CO 0.11 -0.05 -0.07 0.54 0.23 0.00 0.00 176.35 177.11 1n3x s VAL 8 N 1.31 3.51 -0.01 -1.59 0.11 -1.26 -0.34 120.40 122.14 1n3x s VAL 8 Ca -0.02 -0.48 0.07 0.00 -2.93 0.00 0.00 61.98 58.62 1n3x s VAL 8 Cb -0.14 -2.54 -0.03 0.00 -1.53 0.00 0.00 36.38 32.15 1n3x s VAL 8 CO -0.05 0.48 -0.22 -0.63 -3.33 0.00 0.00 175.10 171.36 1n3x s ILE 9 N 0.65 2.44 -0.12 7.04 1.01 0.10 -0.97 121.20 131.35 1n3x s ILE 9 Ca -0.04 -1.08 0.01 0.00 0.00 0.00 0.00 60.65 59.55 1n3x s ILE 9 Cb -0.15 -1.93 -0.01 0.00 0.01 0.00 0.00 42.46 40.39 1n3x s ILE 9 CO 0.02 0.50 -0.17 0.26 0.00 0.00 0.00 174.94 175.56 1n3x s TRP 10 N -0.73 2.73 -0.03 3.97 0.52 -0.51 -0.02 118.94 124.87 1n3x s TRP 10 Ca 0.11 -0.81 -0.11 0.00 0.02 0.00 0.00 56.10 55.31 1n3x s TRP 10 Cb -0.10 -1.81 0.02 0.00 -1.15 0.00 0.00 33.47 30.43 1n3x s TRP 10 CO 0.01 -0.30 0.26 -1.50 0.02 0.00 0.00 176.95 175.43 1n3x s ILE 11 N 0.40 0.05 0.66 2.03 2.07 -0.74 -0.79 121.20 124.88 1n3x s ILE 11 Ca -0.13 -0.40 -0.17 0.00 -1.41 0.00 0.00 60.65 58.55 1n3x s ILE 11 Cb -0.16 -0.51 0.00 0.00 0.13 0.00 0.00 42.46 41.92 1n3x s ILE 11 CO 0.06 -0.22 1.20 0.21 -1.91 0.00 0.00 174.94 174.28 1n3x s ASN 12 N -0.94 4.75 0.47 4.50 2.47 -1.26 -4.05 114.94 120.88 1n3x s ASN 12 Ca -0.10 2.33 0.32 0.00 0.42 0.00 0.00 52.86 55.83 1n3x s ASN 12 Cb -0.05 -2.59 1.61 0.00 -1.45 0.00 0.00 41.25 38.77 1n3x s ASN 12 CO 0.02 -1.89 1.97 1.23 -3.72 0.00 0.00 177.10 174.72 1n3x h GLY 13 N 0.26 0.00 -1.37 1.21 0.00 -1.86 -2.30 103.07 99.02 1n3x h GLY 13 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1n3x h GLY 13 CO 0.53 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.16 1n3x n ASP 14 N -2.69 1.99 -4.88 0.19 5.68 -1.26 -4.90 116.55 110.69 1n3x n ASP 14 Ca -0.01 -2.04 -0.25 0.00 -0.50 0.00 0.00 54.79 51.99 1n3x n ASP 14 Cb 0.13 -0.26 -0.02 0.00 -1.14 0.00 0.00 41.12 39.83 1n3x n ASP 14 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1n3x s LYS 15 N -1.56 2.29 -1.36 0.11 -0.14 -0.87 -5.03 119.74 113.19 1n3x s LYS 15 Ca 0.24 -1.93 -0.07 0.00 -1.36 0.00 0.00 55.97 52.85 1n3x s LYS 15 Cb 0.13 -2.13 0.02 0.00 -1.68 0.00 0.00 37.83 34.17 1n3x s LYS 15 CO 0.15 -0.49 2.68 0.41 -0.76 0.00 0.00 175.35 177.34 1n3x n GLY 16 N -1.67 4.71 0.35 -3.33 0.00 -1.26 -4.70 105.19 99.29 1n3x n GLY 16 Ca -0.01 -1.79 0.05 0.00 0.00 0.00 0.00 46.02 44.28 1n3x n GLY 16 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1n3x h TYR 17 N 4.63 0.76 -0.45 1.61 -0.00 -1.92 0.49 116.97 122.10 1n3x h TYR 17 Ca 0.74 0.02 -0.01 0.00 0.00 0.00 0.00 58.73 59.48 1n3x h TYR 17 Cb 0.35 -0.25 -0.02 0.00 0.00 0.00 0.00 36.73 36.81 1n3x h TYR 17 CO 1.72 0.42 0.23 -0.91 -0.00 0.00 0.00 178.16 179.62 1n3x h ASN 18 N 0.77 0.57 -0.20 0.10 -0.26 -1.97 0.16 115.58 114.75 1n3x h ASN 18 Ca 0.29 -0.11 -0.08 0.00 -0.56 0.00 0.00 56.30 55.84 1n3x h ASN 18 Cb 0.18 -0.15 -0.02 0.00 -1.06 0.00 0.00 38.32 37.28 1n3x h ASN 18 CO -0.09 0.52 -0.12 1.23 -1.06 0.00 0.00 177.43 177.91 1n3x h GLY 19 N 0.59 0.63 1.31 2.83 0.00 -1.44 -1.92 103.07 105.07 1n3x h GLY 19 Ca 0.16 -0.45 -0.08 0.00 0.00 0.00 0.00 47.33 46.95 1n3x h GLY 19 CO -0.02 0.42 -0.02 -2.00 0.00 0.00 0.00 176.54 174.91 1n3x h LEU 20 N 0.54 0.81 -1.36 3.11 5.85 -0.31 -1.73 115.31 122.21 1n3x h LEU 20 Ca 0.10 -0.21 0.01 0.00 0.84 0.00 0.00 57.88 58.62 1n3x h LEU 20 Cb 0.53 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 1n3x h LEU 20 CO 0.03 0.89 0.44 0.00 -0.34 0.00 0.00 178.44 179.45 1n3x h ALA 21 N 1.20 1.54 -0.19 1.25 0.00 0.02 -0.34 119.26 122.75 1n3x h ALA 21 Ca 0.14 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1n3x h ALA 21 Cb 0.50 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1n3x h ALA 21 CO 0.02 0.42 0.11 0.93 0.00 0.00 0.00 179.25 180.74 1n3x h GLU 22 N 0.88 0.23 -0.45 0.00 4.39 -0.62 0.47 114.58 119.47 1n3x h GLU 22 Ca 0.24 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.91 1n3x h GLU 22 Cb -0.09 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.49 1n3x h GLU 22 CO -0.05 0.15 0.18 0.28 -1.16 0.00 0.00 179.01 178.41 1n3x h VAL 23 N 0.23 1.17 -0.70 3.13 2.07 -1.05 -1.99 116.25 119.11 1n3x h VAL 23 Ca 0.07 -0.52 -0.05 0.00 0.82 0.00 0.00 66.70 67.02 1n3x h VAL 23 Cb -0.01 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.35 1n3x h VAL 23 CO -0.03 0.21 0.26 1.23 0.02 0.00 0.00 177.57 179.26 1n3x h GLY 24 N 0.79 1.14 1.02 2.17 0.00 -0.09 -1.75 103.07 106.35 1n3x h GLY 24 Ca 0.16 -0.64 -0.04 0.00 0.00 0.00 0.00 47.33 46.81 1n3x h GLY 24 CO -0.02 0.60 0.29 0.50 0.00 0.00 0.00 176.54 177.91 1n3x h LYS 25 N 1.01 1.05 -0.46 4.80 1.57 -0.24 -1.54 116.57 122.77 1n3x h LYS 25 Ca 0.23 -0.19 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 1n3x h LYS 25 Cb 0.24 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 1n3x h LYS 25 CO -0.02 0.86 0.09 -0.22 -0.57 0.00 0.00 179.45 179.59 1n3x h LYS 26 N 1.00 0.70 -0.52 3.15 3.64 -1.11 -1.37 116.57 122.06 1n3x h LYS 26 Ca 0.23 -0.14 -0.08 0.00 -1.27 0.00 0.00 60.65 59.40 1n3x h LYS 26 Cb 0.20 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1n3x h LYS 26 CO -0.02 0.65 0.03 0.35 -2.27 0.00 0.00 179.45 178.19 1n3x h PHE 27 N 0.67 0.97 -0.33 1.91 3.57 -0.78 -2.93 116.94 120.02 1n3x h PHE 27 Ca 0.15 -0.16 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 1n3x h PHE 27 Cb 0.29 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 1n3x h PHE 27 CO 0.01 0.89 -0.02 1.49 -2.23 0.00 0.00 178.31 178.45 1n3x h GLU 28 N 0.77 0.51 0.76 1.11 4.81 -0.72 -2.59 114.58 119.24 1n3x h GLU 28 Ca 0.15 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1n3x h GLU 28 Cb 0.48 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1n3x h GLU 28 CO 0.02 0.55 -0.50 0.87 -0.73 0.00 0.00 179.01 179.22 1n3x h LYS 29 N 0.49 -1.15 -1.05 1.92 1.57 -1.08 0.13 116.57 117.41 1n3x h LYS 29 Ca 0.10 0.08 -0.41 0.00 -1.87 0.00 0.00 60.65 58.55 1n3x h LYS 29 Cb 0.35 0.26 -0.23 0.00 0.08 0.00 0.00 32.23 32.69 1n3x h LYS 29 CO 0.01 -0.77 0.53 -0.40 -0.57 0.00 0.00 179.45 178.25 1n3x n ASP 30 N -5.61 4.27 0.00 0.86 5.75 -1.21 -4.24 116.55 116.36 1n3x n ASP 30 Ca -0.15 -3.25 0.00 0.00 -0.01 0.00 0.00 54.79 51.38 1n3x n ASP 30 Cb 0.50 -0.81 0.00 0.00 -1.03 0.00 0.00 41.12 39.79 1n3x n ASP 30 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 1n3x n THR 31 N -0.65 0.00 0.00 2.12 -1.04 -0.98 -5.02 114.28 108.71 1n3x n THR 31 Ca 0.45 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.46 1n3x n THR 31 Cb 1.23 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.74 1n3x n THR 31 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1n3x n GLY 32 N 0.12 1.35 3.71 3.41 0.00 0.45 -5.03 105.19 109.20 1n3x n GLY 32 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1n3x n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1n3x s ILE 33 N -2.35 5.01 0.29 -0.61 -1.09 -1.26 -5.01 121.20 116.18 1n3x s ILE 33 Ca 0.00 1.56 -0.19 0.00 -2.23 0.00 0.00 60.65 59.79 1n3x s ILE 33 Cb 0.00 -4.09 -0.09 0.00 -1.58 0.00 0.00 42.46 36.70 1n3x s ILE 33 CO 0.00 0.22 0.77 -1.59 -1.23 0.00 0.00 174.94 173.11 1n3x s LYS 34 N 0.94 4.19 -0.17 2.79 -2.85 -1.26 -3.70 119.74 119.68 1n3x s LYS 34 Ca 0.40 0.86 0.01 0.00 -1.00 0.00 0.00 55.97 56.24 1n3x s LYS 34 Cb -0.18 -2.64 0.02 0.00 -2.06 0.00 0.00 37.83 32.97 1n3x s LYS 34 CO 0.19 0.25 -0.16 0.08 0.10 0.00 0.00 175.35 175.82 1n3x s VAL 35 N -1.77 1.78 -0.23 1.79 1.01 -1.26 -1.92 120.40 119.80 1n3x s VAL 35 Ca 0.50 -0.80 -0.07 0.00 0.00 0.00 0.00 61.98 61.61 1n3x s VAL 35 Cb -0.14 -1.66 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 1n3x s VAL 35 CO 0.19 0.46 0.07 -0.89 0.00 0.00 0.00 175.10 174.93 1n3x s THR 36 N 1.40 4.41 -0.22 3.92 2.01 0.54 -4.83 115.64 122.87 1n3x s THR 36 Ca 0.04 -0.14 -0.08 0.00 0.31 0.00 0.00 61.69 61.82 1n3x s THR 36 Cb -0.13 -3.04 -0.04 0.00 0.01 0.00 0.00 72.50 69.29 1n3x s THR 36 CO -0.11 0.37 0.09 -0.69 -0.69 0.00 0.00 174.62 173.58 1n3x s VAL 37 N 1.32 4.79 0.19 3.82 1.01 -1.26 0.01 120.40 130.28 1n3x s VAL 37 Ca 0.05 -0.02 0.09 0.00 0.00 0.00 0.00 61.98 62.10 1n3x s VAL 37 Cb -0.15 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 32.99 1n3x s VAL 37 CO 0.03 0.39 -0.18 -1.61 0.00 0.00 0.00 175.10 173.74 1n3x s GLU 38 N 0.92 1.36 -0.40 2.72 2.02 0.97 -4.96 118.70 121.34 1n3x s GLU 38 Ca 0.05 -1.52 0.08 0.00 0.02 0.00 0.00 54.97 53.60 1n3x s GLU 38 Cb -0.14 -1.37 0.27 0.00 0.10 0.00 0.00 34.13 32.99 1n3x s GLU 38 CO 0.03 0.26 0.62 -2.39 0.02 0.00 0.00 175.26 173.80 1n3x n HIS 39 N -0.03 -0.75 -1.24 1.61 1.44 -1.26 -1.80 115.22 113.20 1n3x n HIS 39 Ca -0.10 -3.32 -0.31 0.00 -2.01 0.00 0.00 57.72 51.98 1n3x n HIS 39 Cb 0.58 -0.05 0.11 0.00 0.12 0.00 0.00 29.99 30.75 1n3x n HIS 39 CO 0.00 0.00 0.00 -1.25 -2.81 0.00 0.00 176.34 172.28 1n3x s PRO 40 N -1.09 1.91 0.30 -1.40 0.04 -1.26 -4.56 135.00 128.93 1n3x s PRO 40 Ca 0.35 1.05 -0.25 0.00 0.04 0.00 0.00 61.00 62.19 1n3x s PRO 40 Cb 0.21 -1.87 -0.10 0.00 0.04 0.00 0.00 34.50 32.79 1n3x s PRO 40 CO -0.12 -1.86 0.91 -0.51 0.04 0.00 0.00 177.00 175.46 1n3x s ASP 41 N -3.40 7.31 -1.48 6.66 1.01 -1.26 -3.66 116.67 121.85 1n3x s ASP 41 Ca 0.62 1.77 -0.12 0.00 0.71 0.00 0.00 52.55 55.54 1n3x s ASP 41 Cb -0.17 -2.55 0.07 0.00 1.01 0.00 0.00 42.92 41.27 1n3x s ASP 41 CO 0.56 -0.04 0.92 0.29 0.21 0.00 0.00 175.17 177.11 1n3x n LYS 42 N 0.65 -5.56 0.11 8.23 5.02 -1.26 -4.86 118.16 120.49 1n3x n LYS 42 Ca 0.01 0.65 0.03 0.00 -2.02 0.00 0.00 58.31 56.98 1n3x n LYS 42 Cb 0.50 -5.54 0.42 0.00 -0.02 0.00 0.00 35.03 30.39 1n3x n LYS 42 CO 0.00 0.00 0.00 1.37 -0.52 0.00 0.00 177.40 178.25 1n3x h LEU 43 N -1.97 0.25 -0.62 -0.35 8.10 -1.97 0.54 115.31 119.29 1n3x h LEU 43 Ca -0.55 -0.04 0.00 0.00 0.11 0.00 0.00 57.88 57.40 1n3x h LEU 43 Cb 1.36 -0.06 0.00 0.00 -0.44 0.00 0.00 40.66 41.52 1n3x h LEU 43 CO 0.63 0.34 0.00 -1.84 -4.11 0.00 0.00 178.44 173.46 1n3x n GLU 44 N -4.33 0.12 -0.10 0.17 0.00 -1.26 -1.32 120.64 113.91 1n3x n GLU 44 Ca -0.00 0.44 -0.12 0.00 0.00 0.00 0.00 57.16 57.47 1n3x n GLU 44 Cb 0.22 -1.76 -0.13 0.00 0.00 0.00 0.00 31.44 29.76 1n3x n GLU 44 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1n3x n GLU 45 N -1.99 0.84 0.01 3.44 4.07 0.02 -4.56 120.64 122.47 1n3x n GLU 45 Ca 0.01 0.05 -0.19 0.00 -0.06 0.00 0.00 57.16 56.98 1n3x n GLU 45 Cb 0.15 -1.47 -0.09 0.00 -0.06 0.00 0.00 31.44 29.97 1n3x n GLU 45 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 1n3x h LYS 46 N 0.00 0.70 -0.65 5.31 1.57 -0.73 -3.34 116.57 119.42 1n3x h LYS 46 Ca -0.51 -0.67 0.12 0.00 -1.87 0.00 0.00 60.65 57.73 1n3x h LYS 46 Cb 2.00 0.17 -0.12 0.00 0.08 0.00 0.00 32.23 34.36 1n3x h LYS 46 CO -0.02 1.26 -0.29 0.35 -0.57 0.00 0.00 179.45 180.19 1n3x h PHE 47 N 0.37 -0.75 -0.87 -1.35 3.57 -1.45 0.15 116.94 116.62 1n3x h PHE 47 Ca -0.09 0.07 0.11 0.00 3.53 0.00 0.00 57.97 61.59 1n3x h PHE 47 Cb 1.52 0.43 -0.06 0.00 2.79 0.00 0.00 35.95 40.62 1n3x h PHE 47 CO 0.10 -0.36 0.56 -1.35 -2.23 0.00 0.00 178.31 175.04 1n3x h PRO 48 N -0.10 0.78 -0.07 6.41 0.11 -1.82 0.17 132.00 137.48 1n3x h PRO 48 Ca 0.27 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.26 1n3x h PRO 48 Cb 0.54 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.48 1n3x h PRO 48 CO -0.71 0.52 -0.26 1.96 -0.21 0.00 0.00 178.00 179.29 1n3x h GLN 49 N 0.80 0.30 0.04 1.05 4.20 -1.16 -2.88 115.11 117.47 1n3x h GLN 49 Ca 0.41 -0.23 -0.23 0.00 0.06 0.00 0.00 58.65 58.66 1n3x h GLN 49 Cb 0.49 0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.31 1n3x h GLN 49 CO -0.18 0.86 -1.02 -0.39 -0.67 0.00 0.00 178.83 177.44 1n3x h VAL 50 N -0.19 1.49 -0.17 -0.54 -1.51 -0.94 -3.23 116.25 111.15 1n3x h VAL 50 Ca -0.01 -2.77 -0.11 0.00 -1.23 0.00 0.00 66.70 62.58 1n3x h VAL 50 Cb 0.89 2.63 -0.01 0.00 -2.13 0.00 0.00 31.29 32.67 1n3x h VAL 50 CO 0.05 0.81 -0.35 0.00 -1.23 0.00 0.00 177.57 176.85 1n3x h ALA 51 N 0.79 1.08 0.00 5.19 0.00 -0.71 0.32 119.26 125.93 1n3x h ALA 51 Ca -0.08 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1n3x h ALA 51 Cb 1.69 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1n3x h ALA 51 CO 0.16 0.58 0.00 0.00 0.00 0.00 0.00 179.25 179.99 1n3x h ALA 52 N 1.32 1.00 -0.33 0.00 0.00 -1.52 -1.26 119.26 118.47 1n3x h ALA 52 Ca 0.04 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 1n3x h ALA 52 Cb 0.77 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.50 1n3x h ALA 52 CO 0.06 0.00 -0.01 0.25 0.00 0.00 0.00 179.25 179.55 1n3x n THR 53 N -2.86 2.44 -1.18 0.00 -2.24 -0.99 -4.94 114.28 104.52 1n3x n THR 53 Ca -0.02 -2.29 -0.06 0.00 -2.27 0.00 0.00 64.05 59.41 1n3x n THR 53 Cb 0.09 -0.30 -0.03 0.00 -2.10 0.00 0.00 70.33 68.00 1n3x n THR 53 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n3x n GLY 54 N -0.84 0.83 0.00 3.38 0.00 -0.48 -5.00 105.19 103.08 1n3x n GLY 54 Ca 0.28 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1n3x n GLY 54 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1n3x n ASP 55 N 0.39 1.41 0.00 1.61 8.00 0.07 -3.66 116.55 124.37 1n3x n ASP 55 Ca -0.06 -0.44 0.00 0.00 0.71 0.00 0.00 54.79 55.00 1n3x n ASP 55 Cb 0.25 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.35 1n3x n ASP 55 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1n3x n GLY 56 N 5.00 -2.55 3.90 0.44 0.00 -1.26 -3.51 105.19 107.20 1n3x n GLY 56 Ca 0.00 -1.99 -0.29 0.00 0.00 0.00 0.00 46.02 43.74 1n3x n GLY 56 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1n3x s PRO 57 N -0.35 2.07 0.01 1.61 0.04 -1.26 -4.80 135.00 132.33 1n3x s PRO 57 Ca 0.00 0.15 -0.18 0.00 0.04 0.00 0.00 61.00 61.01 1n3x s PRO 57 Cb 0.00 -1.96 -0.31 0.00 0.04 0.00 0.00 34.50 32.27 1n3x s PRO 57 CO 0.00 -1.53 1.01 -0.44 0.04 0.00 0.00 177.00 176.08 1n3x h ASP 58 N -1.01 0.73 -3.94 6.66 3.32 -1.44 -3.40 116.42 117.33 1n3x h ASP 58 Ca -0.46 -0.88 -0.61 0.00 0.02 0.00 0.00 57.03 55.10 1n3x h ASP 58 Cb 1.32 -0.23 -0.31 0.00 0.22 0.00 0.00 39.33 40.32 1n3x h ASP 58 CO 0.66 1.55 -0.85 -0.63 -1.72 0.00 0.00 179.24 178.25 1n3x s ILE 59 N -2.74 1.64 -0.06 0.35 1.01 -1.10 -0.30 121.20 120.00 1n3x s ILE 59 Ca -0.11 -0.84 0.04 0.00 0.00 0.00 0.00 60.65 59.75 1n3x s ILE 59 Cb 0.04 -1.40 -0.00 0.00 0.01 0.00 0.00 42.46 41.10 1n3x s ILE 59 CO 0.90 0.47 -0.19 -0.51 0.00 0.00 0.00 174.94 175.61 1n3x s ILE 60 N -0.04 1.62 -0.22 2.92 2.07 -0.44 -1.43 121.20 125.69 1n3x s ILE 60 Ca -0.04 -0.80 -0.08 0.00 -1.41 0.00 0.00 60.65 58.33 1n3x s ILE 60 Cb -0.12 -1.40 -0.04 0.00 0.13 0.00 0.00 42.46 41.03 1n3x s ILE 60 CO 0.03 0.46 0.07 -0.36 -1.91 0.00 0.00 174.94 173.23 1n3x s PHE 61 N 0.20 3.16 0.18 3.50 0.40 0.03 -0.57 117.98 124.89 1n3x s PHE 61 Ca -0.09 -0.16 -0.24 0.00 -0.60 0.00 0.00 56.93 55.84 1n3x s PHE 61 Cb -0.14 -2.17 0.06 0.00 0.51 0.00 0.00 43.02 41.27 1n3x s PHE 61 CO 0.04 -0.12 0.93 -0.46 0.70 0.00 0.00 175.22 176.31 1n3x s TRP 62 N 1.07 -0.11 0.52 0.36 -0.11 -0.48 -4.37 118.94 115.82 1n3x s TRP 62 Ca 0.04 -0.25 -0.22 0.00 1.22 0.00 0.00 56.10 56.89 1n3x s TRP 62 Cb -0.14 0.66 -0.06 0.00 -1.50 0.00 0.00 33.47 32.44 1n3x s TRP 62 CO 0.03 -0.93 1.34 0.00 -4.62 0.00 0.00 176.95 172.77 1n3x s ALA 63 N -3.23 2.91 0.29 5.86 0.00 -1.26 -0.30 121.76 126.03 1n3x s ALA 63 Ca 0.13 1.30 -0.01 0.00 0.00 0.00 0.00 51.96 53.38 1n3x s ALA 63 Cb -0.02 -3.54 0.44 0.00 0.00 0.00 0.00 23.12 19.99 1n3x s ALA 63 CO 0.04 -1.24 1.89 1.12 0.00 0.00 0.00 175.76 177.56 1n3x h HIS 64 N 1.68 0.90 0.00 0.00 2.07 -1.18 -3.07 115.15 115.55 1n3x h HIS 64 Ca -0.51 -0.04 0.00 0.00 -2.85 0.00 0.00 60.37 56.97 1n3x h HIS 64 Cb 1.29 -0.28 0.00 0.00 2.57 0.00 0.00 27.41 30.99 1n3x h HIS 64 CO 0.48 0.67 0.23 0.38 -3.07 0.00 0.00 177.93 176.62 1n3x h ASP 65 N 0.90 0.00 0.45 3.10 2.03 -1.85 -0.59 116.42 120.46 1n3x h ASP 65 Ca 0.22 0.00 -0.28 0.00 -0.73 0.00 0.00 57.03 56.23 1n3x h ASP 65 Cb 0.12 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.57 1n3x h ASP 65 CO -0.03 0.00 -1.76 -1.14 -1.03 0.00 0.00 179.24 175.28 1n3x n ARG 66 N -2.25 0.64 0.30 4.15 3.00 -1.16 -4.19 116.66 117.15 1n3x n ARG 66 Ca -0.01 0.24 0.16 0.00 -0.00 0.00 0.00 57.85 58.24 1n3x n ARG 66 Cb 0.25 -1.76 0.95 0.00 0.00 0.00 0.00 32.46 31.91 1n3x n ARG 66 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.63 178.37 1n3x h PHE 67 N 0.00 0.00 -0.73 -0.14 -1.00 -1.25 -2.60 116.94 111.22 1n3x h PHE 67 Ca -0.30 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.47 1n3x h PHE 67 Cb 1.98 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 41.51 1n3x h PHE 67 CO 0.00 0.01 0.43 0.78 -1.61 0.00 0.00 178.31 177.92 1n3x h GLY 68 N 0.12 1.08 1.33 -1.45 0.00 -1.62 -0.66 103.07 101.86 1n3x h GLY 68 Ca -0.00 -0.46 -0.15 0.00 0.00 0.00 0.00 47.33 46.72 1n3x h GLY 68 CO 0.00 0.44 -0.42 -1.33 0.00 0.00 0.00 176.54 175.23 1n3x h GLY 69 N 1.01 0.80 1.20 4.60 0.00 -1.56 -2.26 103.07 106.86 1n3x h GLY 69 Ca 0.26 -0.83 -0.06 0.00 0.00 0.00 0.00 47.33 46.71 1n3x h GLY 69 CO -0.05 0.75 0.17 -0.97 0.00 0.00 0.00 176.54 176.44 1n3x h TYR 70 N 0.59 1.03 -0.36 5.60 0.05 -1.45 -2.67 116.97 119.76 1n3x h TYR 70 Ca 0.04 -0.10 -0.12 0.00 0.05 0.00 0.00 58.73 58.60 1n3x h TYR 70 Cb 0.98 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 38.40 1n3x h TYR 70 CO 0.05 0.84 -0.26 0.00 -1.05 0.00 0.00 178.16 177.74 1n3x h ALA 71 N 1.23 0.85 -0.60 3.88 0.00 -1.01 -1.10 119.26 122.51 1n3x h ALA 71 Ca 0.21 -0.39 0.08 0.00 0.00 0.00 0.00 54.91 54.81 1n3x h ALA 71 Cb 0.32 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1n3x h ALA 71 CO -0.00 0.64 0.40 0.37 0.00 0.00 0.00 179.25 180.65 1n3x h GLN 72 N 0.65 0.49 -0.62 0.00 4.15 -1.06 0.16 115.11 118.89 1n3x h GLN 72 Ca 0.08 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.47 1n3x h GLN 72 Cb 0.78 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.36 1n3x h GLN 72 CO 0.06 0.32 0.00 0.43 -1.93 0.00 0.00 178.83 177.72 1n3x n SER 73 N -4.48 3.71 -2.49 -0.69 7.64 -1.09 -4.93 113.62 111.29 1n3x n SER 73 Ca 0.09 -2.29 -0.20 0.00 1.01 0.00 0.00 58.87 57.49 1n3x n SER 73 Cb 0.30 -0.49 0.02 0.00 -1.01 0.00 0.00 64.21 63.03 1n3x n SER 73 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1n3x n GLY 74 N 1.04 -0.40 0.12 0.23 0.00 0.05 -4.91 105.19 101.32 1n3x n GLY 74 Ca 0.20 -0.02 0.07 0.00 0.00 0.00 0.00 46.02 46.27 1n3x n GLY 74 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1n3x h LEU 75 N -0.76 0.00 -9.31 0.99 3.38 -1.40 -3.44 115.31 104.77 1n3x h LEU 75 Ca -0.47 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 56.84 1n3x h LEU 75 Cb 1.33 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.94 1n3x h LEU 75 CO 0.52 0.25 -0.58 -0.76 0.09 0.00 0.00 178.44 177.96 1n3x s LEU 76 N -5.67 3.80 0.19 1.67 1.43 -1.25 -0.06 118.68 118.78 1n3x s LEU 76 Ca -0.00 0.19 -0.25 0.00 -1.03 0.00 0.00 54.13 53.04 1n3x s LEU 76 Cb 0.09 -1.90 -0.08 0.00 0.03 0.00 0.00 46.19 44.32 1n3x s LEU 76 CO 0.78 0.33 0.79 0.00 0.23 0.00 0.00 176.35 178.49 1n3x s ALA 77 N -0.60 3.42 0.10 4.21 0.00 0.39 -4.65 121.76 124.63 1n3x s ALA 77 Ca 0.11 0.37 -0.31 0.00 0.00 0.00 0.00 51.96 52.13 1n3x s ALA 77 Cb -0.12 -2.97 -0.07 0.00 0.00 0.00 0.00 23.12 19.96 1n3x s ALA 77 CO 0.02 0.28 1.31 -2.00 0.00 0.00 0.00 175.76 175.37 1n3x s GLU 78 N -1.30 4.37 0.20 0.00 2.12 -1.26 -4.62 118.70 118.20 1n3x s GLU 78 Ca 0.38 1.95 -0.03 0.00 0.36 0.00 0.00 54.97 57.63 1n3x s GLU 78 Cb -0.22 -3.28 -0.05 0.00 0.26 0.00 0.00 34.13 30.84 1n3x s GLU 78 CO 0.26 -0.35 0.41 0.96 -0.54 0.00 0.00 175.26 176.01 1n3x s ILE 79 N 1.00 5.16 -0.45 -3.70 -4.36 -0.51 -5.02 121.20 113.31 1n3x s ILE 79 Ca 0.62 -0.17 0.07 0.00 -0.26 0.00 0.00 60.65 60.90 1n3x s ILE 79 Cb -0.34 -3.70 0.24 0.00 1.25 0.00 0.00 42.46 39.91 1n3x s ILE 79 CO 0.30 -0.13 0.54 0.35 0.24 0.00 0.00 174.94 176.25 1n3x n THR 80 N -0.48 -0.06 -2.63 8.37 -2.24 -1.26 -4.54 114.28 111.45 1n3x n THR 80 Ca -0.03 -4.21 -0.36 0.00 -2.27 0.00 0.00 64.05 57.17 1n3x n THR 80 Cb 0.53 -1.96 -0.05 0.00 -2.10 0.00 0.00 70.33 66.75 1n3x n THR 80 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1n3x s PRO 81 N -1.30 4.24 0.65 -0.78 0.04 -1.26 -5.03 135.00 131.56 1n3x s PRO 81 Ca 0.35 1.42 -0.12 0.00 0.04 0.00 0.00 61.00 62.70 1n3x s PRO 81 Cb 0.14 -2.53 -0.02 0.00 0.04 0.00 0.00 34.50 32.14 1n3x s PRO 81 CO -0.10 -0.05 1.04 0.16 0.04 0.00 0.00 177.00 178.08 1n3x s ASP 82 N -1.67 5.82 0.30 6.66 -4.77 -1.26 -4.82 116.67 116.94 1n3x s ASP 82 Ca 0.57 1.55 0.06 0.00 -3.30 0.00 0.00 52.55 51.43 1n3x s ASP 82 Cb -0.19 -2.49 0.78 0.00 -1.09 0.00 0.00 42.92 39.92 1n3x s ASP 82 CO 0.25 -1.14 1.72 0.50 0.70 0.00 0.00 175.17 177.19 1n3x h LYS 83 N -0.37 0.50 -0.49 2.11 3.11 -1.99 -0.77 116.57 118.67 1n3x h LYS 83 Ca -0.44 -0.03 0.06 0.00 -2.81 0.00 0.00 60.65 57.43 1n3x h LYS 83 Cb 1.20 -0.11 -0.05 0.00 -1.00 0.00 0.00 32.23 32.27 1n3x h LYS 83 CO 0.59 0.33 0.19 0.00 -2.81 0.00 0.00 179.45 177.75 1n3x h ALA 84 N 1.70 0.60 -0.23 5.00 0.00 -2.00 -2.06 119.26 122.27 1n3x h ALA 84 Ca 0.59 0.05 -0.19 0.00 0.00 0.00 0.00 54.91 55.37 1n3x h ALA 84 Cb 1.08 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 1n3x h ALA 84 CO -0.48 -0.20 -0.59 0.35 0.00 0.00 0.00 179.25 178.33 1n3x h PHE 85 N 0.38 0.97 -0.92 0.00 3.57 -1.56 -3.22 116.94 116.16 1n3x h PHE 85 Ca 0.23 -0.36 0.09 0.00 3.53 0.00 0.00 57.97 61.46 1n3x h PHE 85 Cb 0.22 -0.18 -0.07 0.00 2.79 0.00 0.00 35.95 38.72 1n3x h PHE 85 CO -0.15 1.16 0.59 1.96 -2.23 0.00 0.00 178.31 179.65 1n3x h GLN 86 N 0.57 0.94 0.00 1.11 4.20 -0.69 -0.71 115.11 120.53 1n3x h GLN 86 Ca 0.00 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1n3x h GLN 86 Cb 1.18 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.75 1n3x h GLN 86 CO 0.12 0.62 0.00 -0.25 -0.67 0.00 0.00 178.83 178.66 1n3x n ASP 87 N -4.52 0.00 0.19 1.46 8.00 -0.82 -2.39 116.55 118.46 1n3x n ASP 87 Ca 0.15 0.22 0.14 0.00 0.71 0.00 0.00 54.79 56.01 1n3x n ASP 87 Cb 0.27 -0.36 0.43 0.00 -0.02 0.00 0.00 41.12 41.44 1n3x n ASP 87 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1n3x h LYS 88 N 0.00 0.00 -6.36 -1.24 1.79 -1.23 -3.45 116.57 106.08 1n3x h LYS 88 Ca 0.00 0.00 -0.61 0.00 -2.18 0.00 0.00 60.65 57.86 1n3x h LYS 88 Cb 0.19 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 30.70 1n3x h LYS 88 CO 0.00 0.00 -0.73 -0.51 -1.08 0.00 0.00 179.45 177.13 1n3x s LEU 89 N -5.42 2.84 0.18 2.94 1.43 -1.01 -1.87 118.68 117.78 1n3x s LEU 89 Ca 0.06 -0.75 -0.32 0.00 -1.03 0.00 0.00 54.13 52.09 1n3x s LEU 89 Cb 0.09 -1.45 -0.11 0.00 0.03 0.00 0.00 46.19 44.74 1n3x s LEU 89 CO 0.56 0.07 1.74 -0.31 0.23 0.00 0.00 176.35 178.64 1n3x s TYR 90 N -2.05 2.71 0.26 0.29 2.02 -0.80 -4.89 117.35 114.89 1n3x s TYR 90 Ca 0.27 0.26 -0.08 0.00 -0.37 0.00 0.00 57.07 57.15 1n3x s TYR 90 Cb -0.07 -4.14 0.44 0.00 -0.40 0.00 0.00 41.96 37.79 1n3x s TYR 90 CO 0.15 -4.41 1.59 -1.35 -1.57 0.00 0.00 175.55 169.96 1n3x h PRO 91 N 7.30 0.01 0.00 -1.71 0.11 -1.93 -1.30 132.00 134.48 1n3x h PRO 91 Ca -0.44 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.65 1n3x h PRO 91 Cb 1.21 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1n3x h PRO 91 CO 0.95 0.01 -0.12 0.27 -0.21 0.00 0.00 178.00 178.90 1n3x h PHE 92 N 0.01 0.00 0.00 0.65 -5.15 -2.01 -2.22 116.94 108.22 1n3x h PHE 92 Ca 0.44 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 58.20 1n3x h PHE 92 Cb 0.73 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.90 1n3x h PHE 92 CO -0.63 0.12 -0.06 1.79 -2.00 0.00 0.00 178.31 177.53 1n3x h THR 93 N 0.00 0.24 0.00 0.88 1.35 -1.61 -2.32 112.91 111.46 1n3x h THR 93 Ca -0.00 -0.47 -0.13 0.00 -0.55 0.00 0.00 66.41 65.26 1n3x h THR 93 Cb 0.40 1.37 -0.02 0.00 -1.73 0.00 0.00 68.15 68.17 1n3x h THR 93 CO 0.02 0.06 -0.60 -0.50 -0.25 0.00 0.00 175.52 174.25 1n3x h TRP 94 N 0.00 0.00 0.00 4.73 4.06 -1.50 -2.93 115.95 120.31 1n3x h TRP 94 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1n3x h TRP 94 Cb 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.53 1n3x h TRP 94 CO 0.00 0.60 0.00 -0.25 -3.56 0.00 0.00 178.44 175.23 1n3x n ASP 95 N -3.47 0.22 0.07 -3.49 8.00 -0.87 -2.63 116.55 114.39 1n3x n ASP 95 Ca 0.00 0.55 -0.09 0.00 0.71 0.00 0.00 54.79 55.96 1n3x n ASP 95 Cb 0.69 -0.60 -0.13 0.00 -0.02 0.00 0.00 41.12 41.06 1n3x n ASP 95 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1n3x h ALA 96 N 2.51 0.31 -0.69 2.24 0.00 -1.57 -3.31 119.26 118.73 1n3x h ALA 96 Ca 0.00 -0.93 -0.38 0.00 0.00 0.00 0.00 54.91 53.60 1n3x h ALA 96 Cb 0.34 -0.08 -0.22 0.00 0.00 0.00 0.00 17.79 17.83 1n3x h ALA 96 CO 0.00 1.20 0.27 1.33 0.00 0.00 0.00 179.25 182.05 1n3x n VAL 97 N -3.38 2.92 -4.53 0.00 0.24 -1.08 -4.82 118.33 107.67 1n3x n VAL 97 Ca -0.03 -2.50 -0.33 0.00 -2.04 0.00 0.00 64.34 59.43 1n3x n VAL 97 Cb 0.97 -0.49 -0.13 0.00 -1.47 0.00 0.00 33.84 32.72 1n3x n VAL 97 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1n3x s ARG 98 N -3.34 3.51 -0.04 7.34 3.52 -1.22 -0.77 118.95 127.95 1n3x s ARG 98 Ca 0.52 -0.57 -0.02 0.00 -0.13 0.00 0.00 55.73 55.53 1n3x s ARG 98 Cb 0.45 -2.80 0.03 0.00 -1.56 0.00 0.00 34.95 31.06 1n3x s ARG 98 CO 0.04 0.27 0.05 -0.47 -0.81 0.00 0.00 175.30 174.38 1n3x s TYR 99 N 0.25 0.18 -1.46 5.12 5.04 0.03 -4.83 117.35 121.68 1n3x s TYR 99 Ca -0.05 0.16 -0.05 0.00 -2.44 0.00 0.00 57.07 54.69 1n3x s TYR 99 Cb -0.14 -0.52 0.02 0.00 0.35 0.00 0.00 41.96 41.67 1n3x s TYR 99 CO 0.04 -0.21 0.47 0.09 -1.34 0.00 0.00 175.55 174.61 1n3x n ASN 100 N 5.15 -5.26 -0.18 4.32 3.02 -1.26 -1.76 115.26 119.29 1n3x n ASN 100 Ca -0.06 -0.25 -0.02 0.00 -0.03 0.00 0.00 54.58 54.22 1n3x n ASN 100 Cb 0.50 -4.30 -0.00 0.00 -0.61 0.00 0.00 39.78 35.37 1n3x n ASN 100 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1n3x n GLY 101 N -1.33 0.38 2.94 7.41 0.00 -1.26 -5.05 105.19 108.28 1n3x n GLY 101 Ca -0.10 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 44.91 1n3x n GLY 101 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n3x s LYS 102 N -3.36 0.23 -0.22 1.61 1.02 -0.72 -5.11 119.74 113.18 1n3x s LYS 102 Ca 0.00 -0.24 -0.29 0.00 0.02 0.00 0.00 55.97 55.46 1n3x s LYS 102 Cb 0.00 -0.13 0.01 0.00 -0.52 0.00 0.00 37.83 37.18 1n3x s LYS 102 CO 0.00 0.03 1.08 -0.51 -0.92 0.00 0.00 175.35 175.03 1n3x s LEU 103 N -0.46 4.11 0.00 3.17 1.02 -1.26 -0.79 118.68 124.47 1n3x s LEU 103 Ca -0.03 1.43 0.10 0.00 0.02 0.00 0.00 54.13 55.65 1n3x s LEU 103 Cb -0.03 -3.54 0.13 0.00 0.02 0.00 0.00 46.19 42.77 1n3x s LEU 103 CO -0.00 -0.69 0.92 2.30 0.02 0.00 0.00 176.35 178.90 1n3x n ILE 104 N 5.35 0.24 -3.69 -0.59 -5.35 0.05 -1.43 119.36 113.94 1n3x n ILE 104 Ca 0.12 -0.62 -0.04 0.00 -0.27 0.00 0.00 62.75 61.94 1n3x n ILE 104 Cb 0.46 1.04 -0.01 0.00 -1.74 0.00 0.00 39.64 39.38 1n3x n ILE 104 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1n3x s ALA 105 N -0.88 -1.73 -0.19 -1.28 0.00 -1.25 -4.49 121.76 111.93 1n3x s ALA 105 Ca 0.14 0.35 -0.08 0.00 0.00 0.00 0.00 51.96 52.37 1n3x s ALA 105 Cb 0.09 0.57 -0.04 0.00 0.00 0.00 0.00 23.12 23.74 1n3x s ALA 105 CO 0.13 -0.97 0.07 0.71 0.00 0.00 0.00 175.76 175.70 1n3x s TYR 106 N -3.19 3.25 0.40 0.00 2.02 0.01 -4.85 117.35 114.98 1n3x s TYR 106 Ca 0.11 0.07 -0.25 0.00 -0.37 0.00 0.00 57.07 56.63 1n3x s TYR 106 Cb -0.01 -2.09 -0.09 0.00 -0.40 0.00 0.00 41.96 39.37 1n3x s TYR 106 CO -0.00 0.14 1.12 -2.14 -1.57 0.00 0.00 175.55 173.10 1n3x s PRO 107 N 0.44 4.11 0.09 -1.71 0.02 -1.26 -0.41 135.00 136.27 1n3x s PRO 107 Ca 0.03 1.72 0.00 0.00 0.02 0.00 0.00 61.00 62.78 1n3x s PRO 107 Cb -0.12 -2.65 0.00 0.00 0.02 0.00 0.00 34.50 31.75 1n3x s PRO 107 CO 0.00 -0.24 0.00 -0.89 -0.33 0.00 0.00 177.00 175.54 1n3x n ILE 108 N 0.06 0.41 -4.27 2.83 2.08 0.33 -4.84 119.36 115.97 1n3x n ILE 108 Ca 0.04 0.14 -0.20 0.00 0.56 0.00 0.00 62.75 63.30 1n3x n ILE 108 Cb 0.47 -0.93 -0.11 0.00 -0.75 0.00 0.00 39.64 38.32 1n3x n ILE 108 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1n3x s ALA 109 N -2.00 1.66 -0.05 -1.39 0.00 -1.10 -0.84 121.76 118.04 1n3x s ALA 109 Ca 0.00 -1.34 0.04 0.00 0.00 0.00 0.00 51.96 50.66 1n3x s ALA 109 Cb 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 22.98 1n3x s ALA 109 CO 0.00 0.16 -0.18 0.08 0.00 0.00 0.00 175.76 175.83 1n3x s VAL 110 N -2.01 2.74 -0.02 0.00 1.01 0.16 -0.92 120.40 121.36 1n3x s VAL 110 Ca 0.10 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.26 1n3x s VAL 110 Cb -0.06 -2.05 0.01 0.00 0.00 0.00 0.00 36.38 34.28 1n3x s VAL 110 CO 0.04 0.58 -0.04 -0.70 0.00 0.00 0.00 175.10 174.98 1n3x s GLU 111 N -0.52 0.50 0.06 2.72 2.12 0.75 -3.43 118.70 120.89 1n3x s GLU 111 Ca 0.07 -0.12 -0.27 0.00 0.36 0.00 0.00 54.97 55.01 1n3x s GLU 111 Cb -0.11 -0.52 0.07 0.00 0.26 0.00 0.00 34.13 33.83 1n3x s GLU 111 CO 0.01 0.03 0.65 0.00 -0.54 0.00 0.00 175.26 175.41 1n3x s ALA 112 N 0.30 -1.69 0.56 6.30 0.00 -1.26 -0.83 121.76 125.14 1n3x s ALA 112 Ca -0.03 0.90 -0.18 0.00 0.00 0.00 0.00 51.96 52.64 1n3x s ALA 112 Cb -0.07 0.45 -0.05 0.00 0.00 0.00 0.00 23.12 23.45 1n3x s ALA 112 CO -0.00 -0.58 1.09 -0.51 0.00 0.00 0.00 175.76 175.76 1n3x s LEU 113 N -2.02 3.67 0.35 0.00 1.43 -1.26 -4.60 118.68 116.26 1n3x s LEU 113 Ca -0.04 2.02 0.04 0.00 -1.03 0.00 0.00 54.13 55.12 1n3x s LEU 113 Cb -0.01 -4.56 -0.03 0.00 0.03 0.00 0.00 46.19 41.62 1n3x s LEU 113 CO -0.02 -1.16 0.16 -0.44 0.23 0.00 0.00 176.35 175.12 1n3x s SER 114 N -2.14 2.12 -0.25 2.29 0.01 -0.65 -4.84 113.70 110.24 1n3x s SER 114 Ca 0.69 -1.63 -0.11 0.00 1.31 0.00 0.00 55.95 56.21 1n3x s SER 114 Cb -0.20 0.44 -0.05 0.00 0.21 0.00 0.00 66.02 66.43 1n3x s SER 114 CO 0.29 -0.92 0.18 -0.22 0.41 0.00 0.00 173.24 172.98 1n3x s LEU 115 N -3.48 4.10 -0.11 2.44 1.98 -0.78 -3.04 118.68 119.78 1n3x s LEU 115 Ca 0.31 0.11 0.00 0.00 -2.89 0.00 0.00 54.13 51.66 1n3x s LEU 115 Cb 0.04 -2.13 -0.02 0.00 0.66 0.00 0.00 46.19 44.73 1n3x s LEU 115 CO 0.18 0.03 -0.11 -0.63 -1.89 0.00 0.00 176.35 173.93 1n3x s ILE 116 N 1.23 3.25 0.07 6.68 1.01 -0.31 -1.11 121.20 132.01 1n3x s ILE 116 Ca 0.08 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 60.13 1n3x s ILE 116 Cb -0.14 -2.35 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 1n3x s ILE 116 CO 0.06 0.54 -0.05 -0.72 0.00 0.00 0.00 174.94 174.77 1n3x s TYR 117 N 0.01 0.71 -0.42 3.97 1.13 -0.87 -0.70 117.35 121.19 1n3x s TYR 117 Ca -0.03 -0.90 -0.24 0.00 -1.41 0.00 0.00 57.07 54.49 1n3x s TYR 117 Cb -0.14 -0.45 0.02 0.00 -1.10 0.00 0.00 41.96 40.29 1n3x s TYR 117 CO 0.04 -0.22 0.82 1.21 -2.51 0.00 0.00 175.55 174.89 1n3x s ASN 118 N -2.77 6.48 0.45 -0.18 3.84 0.19 -1.74 114.94 121.21 1n3x s ASN 118 Ca 0.06 0.11 0.12 0.00 0.21 0.00 0.00 52.86 53.37 1n3x s ASN 118 Cb 0.04 -2.41 1.00 0.00 -0.55 0.00 0.00 41.25 39.33 1n3x s ASN 118 CO -0.06 -0.89 2.02 0.11 -2.79 0.00 0.00 177.10 175.50 1n3x h LYS 119 N 8.83 0.14 -0.17 0.43 1.57 -1.17 0.26 116.57 126.46 1n3x h LYS 119 Ca -0.24 -0.02 -0.19 0.00 -1.87 0.00 0.00 60.65 58.33 1n3x h LYS 119 Cb 1.09 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.37 1n3x h LYS 119 CO 0.96 0.21 -0.64 -0.44 -0.57 0.00 0.00 179.45 178.97 1n3x h ASP 120 N 0.14 0.72 0.55 0.86 3.32 -1.93 -2.91 116.42 117.18 1n3x h ASP 120 Ca 0.03 -0.43 -0.29 0.00 0.02 0.00 0.00 57.03 56.37 1n3x h ASP 120 Cb 0.19 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1n3x h ASP 120 CO 0.01 1.18 -1.41 -0.07 -1.72 0.00 0.00 179.24 177.23 1n3x h LEU 121 N 0.46 0.36 -6.74 1.55 3.38 -1.86 -3.42 115.31 109.04 1n3x h LEU 121 Ca -0.01 -0.46 -0.59 0.00 0.09 0.00 0.00 57.88 56.91 1n3x h LEU 121 Cb 1.23 -0.12 -0.39 0.00 0.09 0.00 0.00 40.66 41.47 1n3x h LEU 121 CO 0.13 1.37 -0.81 -0.76 0.09 0.00 0.00 178.44 178.46 1n3x s LEU 122 N -6.98 1.74 0.52 1.67 1.02 0.89 -4.98 118.68 112.57 1n3x s LEU 122 Ca -0.07 -2.43 0.34 0.00 0.02 0.00 0.00 54.13 52.00 1n3x s LEU 122 Cb 0.07 -0.67 1.59 0.00 0.02 0.00 0.00 46.19 47.20 1n3x s LEU 122 CO 0.86 -0.28 2.03 1.55 0.02 0.00 0.00 176.35 180.53 1n3x h PRO 123 N 6.81 0.00 -2.95 1.29 0.13 -1.73 -3.37 132.00 132.17 1n3x h PRO 123 Ca 0.04 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.59 1n3x h PRO 123 Cb 0.95 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.68 1n3x h PRO 123 CO 0.36 0.00 -0.79 1.21 -0.23 0.00 0.00 178.00 178.56 1n3x s ASN 124 N -5.20 3.49 0.62 1.44 3.84 -1.26 -5.06 114.94 112.82 1n3x s ASN 124 Ca -0.00 -2.03 -0.19 0.00 0.21 0.00 0.00 52.86 50.85 1n3x s ASN 124 Cb 0.10 -0.67 -0.02 0.00 -0.55 0.00 0.00 41.25 40.11 1n3x s ASN 124 CO 0.46 -0.34 1.29 -2.16 -2.79 0.00 0.00 177.10 173.55 1n3x s PRO 125 N 1.18 2.70 0.30 0.43 0.04 -1.26 -4.95 135.00 133.44 1n3x s PRO 125 Ca 0.14 2.05 -0.29 0.00 0.04 0.00 0.00 61.00 62.94 1n3x s PRO 125 Cb -0.21 -1.91 -0.10 0.00 0.04 0.00 0.00 34.50 32.32 1n3x s PRO 125 CO -0.11 -1.48 1.35 -1.25 0.04 0.00 0.00 177.00 175.54 1n3x s PRO 126 N -3.30 4.33 0.00 0.56 0.04 -1.26 -4.91 135.00 130.45 1n3x s PRO 126 Ca 0.80 2.23 0.24 0.00 0.04 0.00 0.00 61.00 64.32 1n3x s PRO 126 Cb -0.37 -3.09 0.27 0.00 0.04 0.00 0.00 34.50 31.35 1n3x s PRO 126 CO 0.40 -0.26 1.28 1.63 0.04 0.00 0.00 177.00 180.09 1n3x n LYS 127 N 1.40 1.69 -4.39 4.56 4.76 -1.26 -4.60 118.16 120.32 1n3x n LYS 127 Ca 0.02 -1.33 -0.20 0.00 -2.87 0.00 0.00 58.31 53.93 1n3x n LYS 127 Cb 0.41 -1.47 -0.14 0.00 -1.84 0.00 0.00 35.03 32.00 1n3x n LYS 127 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1n3x s THR 128 N -2.23 1.06 0.21 -0.18 2.01 -1.26 -1.45 115.64 113.81 1n3x s THR 128 Ca 0.25 -0.89 0.08 0.00 0.31 0.00 0.00 61.69 61.44 1n3x s THR 128 Cb 0.19 -0.95 -0.10 0.00 0.01 0.00 0.00 72.50 71.65 1n3x s THR 128 CO 0.43 0.05 1.48 -0.50 -0.69 0.00 0.00 174.62 175.39 1n3x h TRP 129 N 5.12 0.03 0.00 4.92 4.06 -1.18 -3.24 115.95 125.66 1n3x h TRP 129 Ca -0.37 -0.02 -0.04 0.00 2.06 0.00 0.00 58.89 60.52 1n3x h TRP 129 Cb 1.18 -0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.33 1n3x h TRP 129 CO 0.51 0.78 -0.21 0.93 -3.56 0.00 0.00 178.44 176.89 1n3x h GLU 130 N 0.01 0.00 -0.00 0.49 3.07 -1.96 -2.90 114.58 113.28 1n3x h GLU 130 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1n3x h GLU 130 Cb 1.36 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.27 1n3x h GLU 130 CO 0.10 0.21 -0.17 -0.85 -1.40 0.00 0.00 179.01 176.91 1n3x n GLU 131 N -3.50 0.56 -0.17 2.33 0.28 -1.22 -4.10 120.64 114.82 1n3x n GLU 131 Ca -0.01 -0.22 -0.10 0.00 -0.16 0.00 0.00 57.16 56.67 1n3x n GLU 131 Cb 0.38 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.75 1n3x n GLU 131 CO 0.00 0.00 0.00 0.82 -0.16 0.00 0.00 177.13 177.79 1n3x h ILE 132 N 0.54 1.26 -0.86 3.84 2.04 -1.64 -1.92 117.51 120.76 1n3x h ILE 132 Ca 0.00 -1.02 0.07 0.00 1.00 0.00 0.00 64.86 64.91 1n3x h ILE 132 Cb 0.41 0.97 -0.07 0.00 -0.74 0.00 0.00 36.82 37.40 1n3x h ILE 132 CO 0.00 0.36 0.53 -0.65 0.00 0.00 0.00 178.15 178.38 1n3x h PRO 133 N 0.69 0.91 -0.45 2.37 0.11 -1.78 -0.20 132.00 133.65 1n3x h PRO 133 Ca 0.14 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.08 1n3x h PRO 133 Cb 0.47 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 1n3x h PRO 133 CO 0.02 0.60 -0.18 0.00 -0.21 0.00 0.00 178.00 178.23 1n3x h ALA 134 N 1.43 0.62 -0.94 -0.75 0.00 -1.78 -2.86 119.26 114.99 1n3x h ALA 134 Ca 0.39 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1n3x h ALA 134 Cb 0.24 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 1n3x h ALA 134 CO -0.20 0.57 0.61 1.25 0.00 0.00 0.00 179.25 181.49 1n3x h LEU 135 N 0.74 1.09 -0.62 0.00 5.85 -0.53 -2.86 115.31 118.98 1n3x h LEU 135 Ca 0.10 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.75 1n3x h LEU 135 Cb 0.74 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1n3x h LEU 135 CO 0.06 0.80 0.23 -0.78 -0.34 0.00 0.00 178.44 178.41 1n3x h ASP 136 N 1.28 0.87 0.32 1.25 3.58 -0.92 -1.61 116.42 121.19 1n3x h ASP 136 Ca 0.34 -0.18 -0.03 0.00 0.42 0.00 0.00 57.03 57.58 1n3x h ASP 136 Cb -0.13 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 40.69 1n3x h ASP 136 CO -0.07 0.82 -0.14 0.07 -2.88 0.00 0.00 179.24 177.03 1n3x h LYS 137 N 0.88 0.00 0.10 0.28 5.09 -1.30 0.98 116.57 122.60 1n3x h LYS 137 Ca 0.21 0.00 -0.26 0.00 0.09 0.00 0.00 60.65 60.69 1n3x h LYS 137 Cb 0.23 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 32.56 1n3x h LYS 137 CO -0.01 0.14 -1.17 1.49 -2.09 0.00 0.00 179.45 177.80 1n3x h GLU 138 N 0.00 0.25 0.00 0.07 4.81 -1.20 -3.24 114.58 115.27 1n3x h GLU 138 Ca -0.00 -0.40 -0.11 0.00 -0.13 0.00 0.00 59.36 58.72 1n3x h GLU 138 Cb 0.34 0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 1n3x h GLU 138 CO 0.02 1.17 -0.51 -0.07 -0.73 0.00 0.00 179.01 178.89 1n3x h LEU 139 N 0.08 0.00 -1.17 1.64 3.38 -0.67 -3.17 115.31 115.39 1n3x h LEU 139 Ca -0.11 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.78 1n3x h LEU 139 Cb 1.89 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.63 1n3x h LEU 139 CO 0.19 0.51 -0.27 0.11 0.09 0.00 0.00 178.44 179.07 1n3x h LYS 140 N 0.00 0.23 0.00 1.13 1.79 0.15 0.39 116.57 120.25 1n3x h LYS 140 Ca -0.01 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1n3x h LYS 140 Cb 1.38 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 32.01 1n3x h LYS 140 CO 0.07 0.49 0.00 0.00 -1.08 0.00 0.00 179.45 178.93 1n3x h ALA 141 N 1.52 1.00 -0.22 3.86 0.00 -1.57 0.66 119.26 124.51 1n3x h ALA 141 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1n3x h ALA 141 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1n3x h ALA 141 CO 0.04 0.00 0.00 1.63 0.00 0.00 0.00 179.25 180.92 1n3x n LYS 142 N -2.76 2.32 -1.84 0.00 5.02 -0.80 -4.97 118.16 115.13 1n3x n LYS 142 Ca -0.02 -1.74 -0.01 0.00 -2.02 0.00 0.00 58.31 54.52 1n3x n LYS 142 Cb 0.08 -1.20 -0.00 0.00 -0.02 0.00 0.00 35.03 33.89 1n3x n LYS 142 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n3x n GLY 143 N 0.34 0.35 3.30 0.72 0.00 0.23 -5.05 105.19 105.08 1n3x n GLY 143 Ca 0.08 -0.89 -0.21 0.00 0.00 0.00 0.00 46.02 45.01 1n3x n GLY 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1n3x s LYS 144 N -3.69 1.19 0.24 1.61 -0.14 0.13 -4.97 119.74 114.12 1n3x s LYS 144 Ca 0.00 -1.35 0.07 0.00 -1.36 0.00 0.00 55.97 53.33 1n3x s LYS 144 Cb 0.00 -1.19 -0.04 0.00 -1.68 0.00 0.00 37.83 34.92 1n3x s LYS 144 CO 0.00 0.24 0.12 -1.54 -0.76 0.00 0.00 175.35 173.41 1n3x s SER 145 N -2.60 5.22 -0.11 2.83 1.04 -1.02 -1.63 113.70 117.43 1n3x s SER 145 Ca 0.14 -0.35 -0.15 0.00 0.48 0.00 0.00 55.95 56.07 1n3x s SER 145 Cb -0.05 -1.24 -0.26 0.00 0.10 0.00 0.00 66.02 64.56 1n3x s SER 145 CO 0.05 -0.01 0.51 0.00 0.98 0.00 0.00 173.24 174.77 1n3x h ALA 146 N 1.79 0.22 -3.71 5.32 0.00 -1.88 -1.88 119.26 119.11 1n3x h ALA 146 Ca -0.47 -1.13 -0.25 0.00 0.00 0.00 0.00 54.91 53.06 1n3x h ALA 146 Cb 1.23 0.53 -0.29 0.00 0.00 0.00 0.00 17.79 19.26 1n3x h ALA 146 CO 0.61 0.88 -0.72 -1.17 0.00 0.00 0.00 179.25 178.84 1n3x s LEU 147 N -7.51 1.87 -0.19 0.00 2.96 -1.26 -1.15 118.68 113.40 1n3x s LEU 147 Ca -0.21 -0.00 -0.07 0.00 -0.22 0.00 0.00 54.13 53.63 1n3x s LEU 147 Cb 0.05 -0.03 0.09 0.00 0.50 0.00 0.00 46.19 46.79 1n3x s LEU 147 CO 0.75 -0.01 0.39 -0.04 -1.32 0.00 0.00 176.35 176.12 1n3x s MET 148 N 0.14 0.29 0.18 1.98 -1.94 -0.89 -4.90 119.30 114.17 1n3x s MET 148 Ca -0.01 0.99 -0.13 0.00 -1.71 0.00 0.00 55.69 54.83 1n3x s MET 148 Cb -0.02 0.28 0.01 0.00 2.01 0.00 0.00 34.83 37.10 1n3x s MET 148 CO -0.00 -0.26 0.39 -0.59 -0.01 0.00 0.00 175.02 174.55 1n3x s PHE 149 N 2.58 0.19 -0.16 -0.03 -0.71 -1.26 -4.25 117.98 114.34 1n3x s PHE 149 Ca -0.01 -0.55 -0.29 0.00 -1.04 0.00 0.00 56.93 55.03 1n3x s PHE 149 Cb -0.12 0.14 -0.07 0.00 -1.21 0.00 0.00 43.02 41.76 1n3x s PHE 149 CO -0.12 -0.82 2.15 -1.71 -1.34 0.00 0.00 175.22 173.38 1n3x n ASN 150 N -0.28 3.39 -0.31 1.98 5.15 -1.26 -4.67 115.26 119.26 1n3x n ASN 150 Ca -0.08 0.42 0.11 0.00 -0.60 0.00 0.00 54.58 54.43 1n3x n ASN 150 Cb 0.63 -1.52 0.10 0.00 -0.53 0.00 0.00 39.78 38.46 1n3x n ASN 150 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1n3x n LEU 151 N 10.35 1.47 0.13 1.20 4.77 -0.99 -4.28 117.00 129.64 1n3x n LEU 151 Ca 0.28 -0.52 0.03 0.00 -0.03 0.00 0.00 56.01 55.77 1n3x n LEU 151 Cb 0.41 -0.05 0.02 0.00 -2.33 0.00 0.00 43.42 41.47 1n3x n LEU 151 CO 0.68 0.29 0.40 1.56 -1.33 0.00 0.00 177.39 178.98 1n3x h GLN 152 N 1.50 0.00 -5.14 3.23 1.08 -1.88 -3.45 115.11 110.45 1n3x h GLN 152 Ca 0.00 0.00 -0.64 0.00 -1.45 0.00 0.00 58.65 56.56 1n3x h GLN 152 Cb 0.63 0.00 -0.21 0.00 -0.05 0.00 0.00 27.48 27.85 1n3x h GLN 152 CO 0.00 0.45 -0.63 -2.00 -0.95 0.00 0.00 178.83 175.70 1n3x s GLU 153 N -2.97 3.71 0.43 1.46 2.56 -1.26 -4.97 118.70 117.67 1n3x s GLU 153 Ca 0.03 -0.47 0.17 0.00 0.00 0.00 0.00 54.97 54.70 1n3x s GLU 153 Cb 0.08 -3.15 1.09 0.00 2.00 0.00 0.00 34.13 34.15 1n3x s GLU 153 CO 0.75 0.05 1.91 -1.35 -0.56 0.00 0.00 175.26 176.06 1n3x h PRO 154 N 7.40 0.37 -0.98 4.30 0.11 -1.90 -0.70 132.00 140.59 1n3x h PRO 154 Ca -0.36 -0.02 0.16 0.00 0.11 0.00 0.00 66.00 65.89 1n3x h PRO 154 Cb 1.18 -0.08 -0.09 0.00 0.11 0.00 0.00 31.00 32.12 1n3x h PRO 154 CO 0.62 0.24 0.61 -0.92 -0.21 0.00 0.00 178.00 178.35 1n3x h TYR 155 N 0.38 1.01 0.00 0.65 3.20 -1.95 0.13 116.97 120.38 1n3x h TYR 155 Ca 0.39 0.03 -0.20 0.00 3.14 0.00 0.00 58.73 62.09 1n3x h TYR 155 Cb 0.95 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 38.88 1n3x h TYR 155 CO -0.00 0.32 -1.14 0.74 -1.64 0.00 0.00 178.16 176.44 1n3x h PHE 156 N 0.81 0.00 0.00 -3.82 -1.00 -1.39 -3.35 116.94 108.18 1n3x h PHE 156 Ca 0.52 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.30 1n3x h PHE 156 Cb 0.75 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.31 1n3x h PHE 156 CO -0.00 0.82 -0.98 0.25 -1.61 0.00 0.00 178.31 176.79 1n3x n THR 157 N -3.17 0.03 -0.34 -1.55 -2.24 -1.01 -4.40 114.28 101.59 1n3x n THR 157 Ca -0.05 -0.07 -0.02 0.00 -2.27 0.00 0.00 64.05 61.64 1n3x n THR 157 Cb 0.91 0.66 0.11 0.00 -2.10 0.00 0.00 70.33 69.91 1n3x n THR 157 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 1n3x h TRP 158 N 0.00 1.15 -1.05 4.78 2.91 -0.89 -2.61 115.95 120.23 1n3x h TRP 158 Ca 0.00 0.03 0.28 0.00 1.13 0.00 0.00 58.89 60.32 1n3x h TRP 158 Cb 0.57 -0.38 -0.09 0.00 -0.51 0.00 0.00 29.16 28.75 1n3x h TRP 158 CO 0.00 0.69 0.69 -1.35 -1.03 0.00 0.00 178.44 177.44 1n3x h PRO 159 N 1.21 0.33 0.00 2.65 0.11 -1.77 0.13 132.00 134.66 1n3x h PRO 159 Ca 0.36 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.42 1n3x h PRO 159 Cb -0.06 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 30.97 1n3x h PRO 159 CO -0.10 0.22 -0.13 1.25 -0.21 0.00 0.00 178.00 179.03 1n3x h LEU 160 N 0.34 0.00 -1.80 2.35 6.46 -1.78 -1.83 115.31 119.04 1n3x h LEU 160 Ca 0.59 -0.89 0.11 0.00 -0.12 0.00 0.00 57.88 57.57 1n3x h LEU 160 Cb 1.61 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 41.51 1n3x h LEU 160 CO -0.26 1.02 0.35 0.40 -0.62 0.00 0.00 178.44 179.33 1n3x h ILE 161 N -1.00 0.85 0.00 4.05 2.04 -1.06 -2.61 117.51 119.78 1n3x h ILE 161 Ca -0.03 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.75 1n3x h ILE 161 Cb 0.97 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.66 1n3x h ILE 161 CO -0.02 0.04 -1.34 0.00 0.00 0.00 0.00 178.15 176.83 1n3x n ALA 162 N -2.56 3.50 -0.35 1.87 0.00 -0.04 -3.47 120.51 119.44 1n3x n ALA 162 Ca 0.09 -0.48 -0.00 0.00 0.00 0.00 0.00 53.44 53.04 1n3x n ALA 162 Cb 0.43 -0.86 0.06 0.00 0.00 0.00 0.00 19.45 19.08 1n3x n ALA 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1n3x h ALA 163 N 2.45 0.24 -0.32 0.00 0.00 -1.30 -0.63 119.26 119.69 1n3x h ALA 163 Ca 0.00 0.28 -0.14 0.00 0.00 0.00 0.00 54.91 55.06 1n3x h ALA 163 Cb 0.78 0.92 -0.08 0.00 0.00 0.00 0.00 17.79 19.40 1n3x h ALA 163 CO 0.00 -0.58 0.17 -3.47 0.00 0.00 0.00 179.25 175.38 1n3x n ASP 164 N -5.50 3.13 0.00 0.00 2.03 -1.26 -4.57 116.55 110.38 1n3x n ASP 164 Ca 0.10 -2.52 0.00 0.00 0.52 0.00 0.00 54.79 52.90 1n3x n ASP 164 Cb 0.41 -0.61 0.00 0.00 -0.72 0.00 0.00 41.12 40.20 1n3x n ASP 164 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1n3x n GLY 165 N -0.01 1.07 3.83 0.27 0.00 -0.31 -4.12 105.19 105.92 1n3x n GLY 165 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 1n3x n GLY 165 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1n3x s GLY 166 N -1.01 1.83 0.04 -0.02 0.00 -0.80 -4.73 107.32 102.63 1n3x s GLY 166 Ca 0.00 0.15 -0.27 0.00 0.00 0.00 0.00 44.72 44.59 1n3x s GLY 166 CO 0.00 0.45 0.82 -2.52 0.00 0.00 0.00 173.10 171.85 1n3x s TYR 167 N -2.87 -0.38 0.00 1.90 -0.85 -0.68 -4.67 117.35 109.81 1n3x s TYR 167 Ca 0.59 0.21 0.00 0.00 -0.52 0.00 0.00 57.07 57.35 1n3x s TYR 167 Cb -0.14 0.55 0.00 0.00 0.38 0.00 0.00 41.96 42.76 1n3x s TYR 167 CO 0.47 -0.64 0.00 0.00 -1.52 0.00 0.00 175.55 173.87 1n3x n ALA 168 N -0.29 0.00 -3.66 9.51 0.00 -1.26 -1.03 120.51 123.78 1n3x n ALA 168 Ca -0.10 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.03 1n3x n ALA 168 Cb 0.62 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.91 1n3x n ALA 168 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1n3x s PHE 169 N 0.00 2.41 -0.11 0.00 0.40 -1.26 -2.92 117.98 116.49 1n3x s PHE 169 Ca 0.00 -1.19 -0.29 0.00 -0.60 0.00 0.00 56.93 54.85 1n3x s PHE 169 Cb 0.00 -1.67 -0.05 0.00 0.51 0.00 0.00 43.02 41.81 1n3x s PHE 169 CO 0.00 -0.56 1.75 0.15 0.70 0.00 0.00 175.22 177.26 1n3x s LYS 170 N 0.88 3.94 0.00 0.44 1.02 -0.58 -4.31 119.74 121.13 1n3x s LYS 170 Ca -0.07 2.06 0.00 0.00 0.02 0.00 0.00 55.97 57.99 1n3x s LYS 170 Cb -0.15 -4.07 0.00 0.00 -0.52 0.00 0.00 37.83 33.09 1n3x s LYS 170 CO -0.02 -1.14 0.00 0.98 -0.92 0.00 0.00 175.35 174.26 1n3x n TYR 171 N 8.09 0.00 0.00 3.18 9.36 -1.26 -0.99 117.16 135.54 1n3x n TYR 171 Ca 0.19 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.41 1n3x n TYR 171 Cb 0.44 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.15 1n3x n TYR 171 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1n3x n GLY 174 N -0.27 2.13 3.05 2.98 0.00 -1.26 -5.00 105.19 106.81 1n3x n GLY 174 Ca 0.00 -0.65 -0.46 0.00 0.00 0.00 0.00 46.02 44.91 1n3x n GLY 174 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1n3x n ASP 177 N 3.03 0.47 0.01 1.61 -0.08 -0.16 -4.74 116.55 116.69 1n3x n ASP 177 Ca 0.00 0.39 0.09 0.00 -1.51 0.00 0.00 54.79 53.76 1n3x n ASP 177 Cb 0.00 -0.82 0.41 0.00 2.34 0.00 0.00 41.12 43.04 1n3x n ASP 177 CO 0.00 0.00 0.00 2.30 0.12 0.00 0.00 177.20 179.62 1n3x n ILE 178 N 6.33 0.72 1.06 5.18 -5.35 -1.26 -2.62 119.36 123.42 1n3x n ILE 178 Ca 0.55 0.17 0.12 0.00 -0.27 0.00 0.00 62.75 63.31 1n3x n ILE 178 Cb -0.00 -0.87 0.09 0.00 -1.74 0.00 0.00 39.64 37.12 1n3x n ILE 178 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1n3x n LYS 179 N -1.58 1.19 -3.47 6.28 5.02 -1.26 -4.72 118.16 119.61 1n3x n LYS 179 Ca 0.04 -0.93 -0.43 0.00 -2.02 0.00 0.00 58.31 54.97 1n3x n LYS 179 Cb 0.23 -1.48 -0.05 0.00 -0.02 0.00 0.00 35.03 33.71 1n3x n LYS 179 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1n3x s ASP 180 N -2.46 6.20 -0.03 4.39 -1.08 -1.08 -5.04 116.67 117.57 1n3x s ASP 180 Ca 0.20 -2.75 0.02 0.00 -0.52 0.00 0.00 52.55 49.51 1n3x s ASP 180 Cb 0.18 -2.08 -0.03 0.00 -1.46 0.00 0.00 42.92 39.53 1n3x s ASP 180 CO 0.55 -0.50 -0.07 -0.69 0.52 0.00 0.00 175.17 174.97 1n3x s VAL 181 N 0.09 3.62 -0.40 1.11 1.01 -1.26 -1.52 120.40 123.05 1n3x s VAL 181 Ca 0.17 -0.63 0.06 0.00 0.00 0.00 0.00 61.98 61.59 1n3x s VAL 181 Cb -0.14 -2.52 0.43 0.00 0.00 0.00 0.00 36.38 34.15 1n3x s VAL 181 CO -0.07 0.51 1.12 0.61 0.00 0.00 0.00 175.10 177.27 1n3x n GLY 182 N 1.94 5.90 0.00 4.51 0.00 -0.20 -4.75 105.19 112.59 1n3x n GLY 182 Ca -0.17 -2.68 0.11 0.00 0.00 0.00 0.00 46.02 43.28 1n3x n GLY 182 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1n3x n VAL 183 N -0.52 0.01 -1.15 1.61 0.24 -1.21 -1.68 118.33 115.63 1n3x n VAL 183 Ca 0.39 -0.04 0.09 0.00 -2.04 0.00 0.00 64.34 62.74 1n3x n VAL 183 Cb 0.73 0.75 0.16 0.00 -1.47 0.00 0.00 33.84 34.01 1n3x n VAL 183 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1n3x n ASP 184 N -1.57 2.33 -4.73 -1.34 5.75 -1.26 -4.68 116.55 111.04 1n3x n ASP 184 Ca 0.04 -3.21 -0.24 0.00 -0.01 0.00 0.00 54.79 51.36 1n3x n ASP 184 Cb 0.35 -0.45 0.09 0.00 -1.03 0.00 0.00 41.12 40.08 1n3x n ASP 184 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1n3x s ASN 185 N -2.89 4.50 0.33 -1.12 2.20 -1.26 -4.85 114.94 111.85 1n3x s ASN 185 Ca 0.33 -0.01 0.07 0.00 -0.94 0.00 0.00 52.86 52.32 1n3x s ASN 185 Cb 0.30 -0.50 0.76 0.00 -2.00 0.00 0.00 41.25 39.81 1n3x s ASN 185 CO 0.02 -1.76 1.83 0.00 -2.94 0.00 0.00 177.10 174.25 1n3x h ALA 186 N -0.56 1.75 0.94 3.54 0.00 -1.95 -0.26 119.26 122.71 1n3x h ALA 186 Ca -0.41 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.50 1n3x h ALA 186 Cb 1.28 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.96 1n3x h ALA 186 CO 0.47 -0.04 -0.45 0.78 0.00 0.00 0.00 179.25 180.01 1n3x h GLY 187 N 0.76 -1.31 0.61 0.00 0.00 -1.87 -0.83 103.07 100.43 1n3x h GLY 187 Ca 0.51 0.49 0.10 0.00 0.00 0.00 0.00 47.33 48.42 1n3x h GLY 187 CO -0.27 -0.48 0.62 0.00 0.00 0.00 0.00 176.54 176.41 1n3x h ALA 188 N -1.35 1.52 -0.20 3.60 0.00 -1.52 -1.81 119.26 119.51 1n3x h ALA 188 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1n3x h ALA 188 Cb 0.96 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1n3x h ALA 188 CO 0.21 0.27 0.13 0.87 0.00 0.00 0.00 179.25 180.74 1n3x h LYS 189 N 1.01 0.27 0.52 0.00 1.57 -0.94 -1.60 116.57 117.40 1n3x h LYS 189 Ca 0.46 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.20 1n3x h LYS 189 Cb 0.39 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1n3x h LYS 189 CO -0.22 0.18 -0.28 0.00 -0.57 0.00 0.00 179.45 178.57 1n3x h ALA 190 N 1.07 -0.74 -0.40 3.86 0.00 -0.45 -1.33 119.26 121.27 1n3x h ALA 190 Ca 0.07 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 54.91 1n3x h ALA 190 Cb -0.03 0.32 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 1n3x h ALA 190 CO -0.02 -0.92 -0.04 0.78 0.00 0.00 0.00 179.25 179.05 1n3x h GLY 191 N -0.74 0.35 1.47 0.00 0.00 -1.29 -1.32 103.07 101.54 1n3x h GLY 191 Ca -0.07 0.09 -0.06 0.00 0.00 0.00 0.00 47.33 47.29 1n3x h GLY 191 CO 0.10 -0.12 -0.01 -2.00 0.00 0.00 0.00 176.54 174.51 1n3x h LEU 192 N 0.06 0.62 -1.06 3.11 5.85 -1.24 -1.98 115.31 120.67 1n3x h LEU 192 Ca 0.20 -0.14 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 1n3x h LEU 192 Cb 0.29 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 1n3x h LEU 192 CO -0.37 0.70 0.20 0.74 -0.34 0.00 0.00 178.44 179.37 1n3x h THR 193 N 0.62 1.22 -0.38 1.05 2.02 -0.56 -0.51 112.91 116.37 1n3x h THR 193 Ca 0.13 -0.74 -0.10 0.00 0.77 0.00 0.00 66.41 66.46 1n3x h THR 193 Cb 0.40 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 1n3x h THR 193 CO 0.02 0.29 -0.18 0.15 0.37 0.00 0.00 175.52 176.16 1n3x h PHE 194 N 0.85 0.80 -0.25 3.16 3.57 -0.57 -1.86 116.94 122.64 1n3x h PHE 194 Ca 0.20 -0.16 -0.05 0.00 3.53 0.00 0.00 57.97 61.48 1n3x h PHE 194 Cb 0.23 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 1n3x h PHE 194 CO 0.01 0.85 -0.04 1.25 -2.23 0.00 0.00 178.31 178.15 1n3x h LEU 195 N 0.63 0.46 -0.85 0.59 5.85 -0.66 -2.40 115.31 118.93 1n3x h LEU 195 Ca 0.10 -0.35 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 1n3x h LEU 195 Cb 0.66 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 1n3x h LEU 195 CO 0.05 0.70 0.28 0.58 -0.34 0.00 0.00 178.44 179.71 1n3x h VAL 196 N 0.21 1.26 -0.60 1.05 2.07 -1.06 -2.39 116.25 116.79 1n3x h VAL 196 Ca 0.06 -0.83 -0.02 0.00 0.82 0.00 0.00 66.70 66.73 1n3x h VAL 196 Cb 0.49 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 1n3x h VAL 196 CO 0.02 0.33 0.27 0.44 0.02 0.00 0.00 177.57 178.65 1n3x h ASP 197 N 1.10 0.77 -0.20 0.57 5.19 -1.24 -0.27 116.42 122.34 1n3x h ASP 197 Ca 0.25 -0.08 -0.03 0.00 -0.62 0.00 0.00 57.03 56.54 1n3x h ASP 197 Cb 0.24 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 39.53 1n3x h ASP 197 CO -0.02 0.67 0.04 -0.07 -3.12 0.00 0.00 179.24 176.74 1n3x h LEU 198 N 0.85 0.40 0.00 1.55 3.38 -0.93 -1.91 115.31 118.65 1n3x h LEU 198 Ca 0.21 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 1n3x h LEU 198 Cb 0.11 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1n3x h LEU 198 CO -0.02 0.43 -0.00 0.40 0.09 0.00 0.00 178.44 179.34 1n3x h ILE 199 N 0.42 1.64 0.00 1.22 2.04 -0.98 -0.93 117.51 120.92 1n3x h ILE 199 Ca 0.10 -1.89 0.00 0.00 1.00 0.00 0.00 64.86 64.07 1n3x h ILE 199 Cb 0.22 2.93 0.00 0.00 -0.74 0.00 0.00 36.82 39.23 1n3x h ILE 199 CO 0.00 0.49 0.00 2.29 0.00 0.00 0.00 178.15 180.93 1n3x n LYS 200 N -4.70 0.05 -0.60 2.37 2.85 -0.22 -1.45 118.16 116.45 1n3x n LYS 200 Ca -0.09 0.25 0.09 0.00 -1.05 0.00 0.00 58.31 57.50 1n3x n LYS 200 Cb 0.39 -1.50 0.33 0.00 -0.65 0.00 0.00 35.03 33.61 1n3x n LYS 200 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1n3x n ASN 201 N -1.45 4.65 -1.01 -5.58 5.03 -0.72 -4.94 115.26 111.24 1n3x n ASN 201 Ca 0.04 -2.58 -0.13 0.00 0.87 0.00 0.00 54.58 52.78 1n3x n ASN 201 Cb 0.14 -0.56 -0.06 0.00 -1.02 0.00 0.00 39.78 38.28 1n3x n ASN 201 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1n3x n LYS 202 N 0.74 -1.39 0.11 3.52 4.76 -0.53 -4.84 118.16 120.53 1n3x n LYS 202 Ca 0.24 0.94 0.12 0.00 -2.87 0.00 0.00 58.31 56.75 1n3x n LYS 202 Cb 0.90 -5.22 0.21 0.00 -1.84 0.00 0.00 35.03 29.09 1n3x n LYS 202 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1n3x h HIS 203 N 0.00 0.00 -2.43 2.13 3.86 -1.37 -3.46 115.15 113.88 1n3x h HIS 203 Ca -0.27 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 58.86 1n3x h HIS 203 Cb 1.09 0.00 -0.21 0.00 1.06 0.00 0.00 27.41 29.36 1n3x h HIS 203 CO 0.52 0.00 -0.03 -1.64 0.86 0.00 0.00 177.93 177.64 1n3x s MET 204 N -3.19 0.80 -0.03 2.45 -1.94 -1.00 -4.80 119.30 111.59 1n3x s MET 204 Ca 0.07 0.33 -0.16 0.00 -1.71 0.00 0.00 55.69 54.22 1n3x s MET 204 Cb 0.11 0.38 -0.05 0.00 2.01 0.00 0.00 34.83 37.27 1n3x s MET 204 CO 0.69 -0.19 0.43 -0.80 -0.01 0.00 0.00 175.02 175.13 1n3x s ASN 205 N -0.66 6.78 0.16 3.03 -0.87 -1.26 -4.29 114.94 117.82 1n3x s ASN 205 Ca -0.07 0.93 0.20 0.00 -1.57 0.00 0.00 52.86 52.35 1n3x s ASN 205 Cb -0.03 -2.27 0.84 0.00 -0.02 0.00 0.00 41.25 39.77 1n3x s ASN 205 CO 0.05 0.23 1.62 0.00 -2.57 0.00 0.00 177.10 176.43 1n3x n ALA 206 N 2.34 1.67 1.01 0.60 0.00 -1.26 -2.59 120.51 122.27 1n3x n ALA 206 Ca -0.12 0.03 0.11 0.00 0.00 0.00 0.00 53.44 53.46 1n3x n ALA 206 Cb 0.52 -1.33 -0.01 0.00 0.00 0.00 0.00 19.45 18.63 1n3x n ALA 206 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1n3x n ASP 207 N -1.95 1.81 -4.67 0.00 3.85 -1.26 -4.83 116.55 109.51 1n3x n ASP 207 Ca 0.03 -1.40 -0.47 0.00 -0.71 0.00 0.00 54.79 52.23 1n3x n ASP 207 Cb 0.21 0.56 -0.05 0.00 -1.35 0.00 0.00 41.12 40.49 1n3x n ASP 207 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.20 176.60 1n3x n THR 208 N -0.31 0.16 -3.77 2.12 -1.04 -1.07 -4.96 114.28 105.41 1n3x n THR 208 Ca 0.08 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 1n3x n THR 208 Cb 0.44 -1.56 0.00 0.00 -1.82 0.00 0.00 70.33 67.39 1n3x n THR 208 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1n3x n ASP 209 N 4.22 1.92 0.31 8.00 5.75 -1.26 -2.36 116.55 133.14 1n3x n ASP 209 Ca 0.19 -0.77 -0.17 0.00 -0.01 0.00 0.00 54.79 54.03 1n3x n ASP 209 Cb 0.28 0.00 -0.09 0.00 -1.03 0.00 0.00 41.12 40.28 1n3x n ASP 209 CO 0.00 0.00 0.00 0.22 -0.11 0.00 0.00 177.20 177.31 1n3x h TYR 210 N 0.77 -0.78 -0.44 2.11 3.20 -1.92 -2.11 116.97 117.81 1n3x h TYR 210 Ca 0.00 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.88 1n3x h TYR 210 Cb 0.00 0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 1n3x h TYR 210 CO 0.00 -0.47 0.25 0.77 -1.64 0.00 0.00 178.16 177.07 1n3x h SER 211 N -0.79 0.40 -0.40 -2.11 0.02 -1.99 0.31 113.55 108.99 1n3x h SER 211 Ca -0.07 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1n3x h SER 211 Cb 0.62 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.07 1n3x h SER 211 CO 0.10 0.28 0.26 0.40 -1.14 0.00 0.00 176.83 176.73 1n3x h ILE 212 N 0.50 1.11 -0.53 3.27 2.04 -1.96 -0.90 117.51 121.05 1n3x h ILE 212 Ca 0.18 -0.23 -0.06 0.00 1.00 0.00 0.00 64.86 65.75 1n3x h ILE 212 Cb 0.03 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 1n3x h ILE 212 CO -0.09 0.11 0.10 0.00 0.00 0.00 0.00 178.15 178.26 1n3x h ALA 213 N 1.13 0.70 0.35 1.87 0.00 -1.12 -2.10 119.26 120.09 1n3x h ALA 213 Ca 0.15 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1n3x h ALA 213 Cb -0.04 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1n3x h ALA 213 CO -0.03 0.44 -0.17 1.49 0.00 0.00 0.00 179.25 180.98 1n3x h GLU 214 N 0.76 -0.45 -0.67 0.00 4.81 -0.66 -1.59 114.58 116.78 1n3x h GLU 214 Ca 0.16 0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.49 1n3x h GLU 214 Cb 0.39 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 29.82 1n3x h GLU 214 CO 0.01 -0.23 0.37 0.00 -0.73 0.00 0.00 179.01 178.43 1n3x h ALA 215 N 0.02 0.90 -0.31 2.92 0.00 -1.19 -0.19 119.26 121.41 1n3x h ALA 215 Ca -0.05 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1n3x h ALA 215 Cb 0.43 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1n3x h ALA 215 CO 0.08 0.03 0.15 0.00 0.00 0.00 0.00 179.25 179.51 1n3x h ALA 216 N 1.36 0.40 -0.18 0.00 0.00 -1.31 -0.97 119.26 118.56 1n3x h ALA 216 Ca 0.30 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1n3x h ALA 216 Cb 0.21 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1n3x h ALA 216 CO -0.19 -0.05 0.02 0.35 0.00 0.00 0.00 179.25 179.37 1n3x h PHE 217 N 0.36 0.33 0.00 0.00 3.57 -0.97 -0.29 116.94 119.94 1n3x h PHE 217 Ca 0.11 -0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1n3x h PHE 217 Cb 0.11 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.76 1n3x h PHE 217 CO -0.02 0.49 0.00 0.09 -2.23 0.00 0.00 178.31 176.64 1n3x n ASN 218 N -4.74 0.63 -1.04 0.41 5.03 -0.11 -1.64 115.26 113.80 1n3x n ASN 218 Ca -0.05 0.69 0.12 0.00 0.87 0.00 0.00 54.58 56.21 1n3x n ASN 218 Cb 0.20 -0.81 0.15 0.00 -1.02 0.00 0.00 39.78 38.30 1n3x n ASN 218 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1n3x n LYS 219 N -2.24 2.39 -1.06 3.52 5.02 -0.38 -4.83 118.16 120.58 1n3x n LYS 219 Ca 0.01 -2.07 -0.02 0.00 -2.02 0.00 0.00 58.31 54.21 1n3x n LYS 219 Cb 0.17 -1.48 -0.01 0.00 -0.02 0.00 0.00 35.03 33.69 1n3x n LYS 219 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n3x n GLY 220 N 1.40 0.55 0.15 0.72 0.00 -0.65 -4.93 105.19 102.44 1n3x n GLY 220 Ca 0.16 -0.71 0.04 0.00 0.00 0.00 0.00 46.02 45.51 1n3x n GLY 220 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1n3x h GLU 221 N 0.22 0.00 -5.50 1.61 5.08 -1.26 -3.46 114.58 111.27 1n3x h GLU 221 Ca -0.04 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.87 1n3x h GLU 221 Cb 0.17 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 29.20 1n3x h GLU 221 CO 0.06 0.37 -0.79 -0.08 -1.00 0.00 0.00 179.01 177.57 1n3x s THR 222 N -3.02 1.23 -0.00 1.13 -1.32 -1.21 -2.43 115.64 110.02 1n3x s THR 222 Ca 0.04 -1.27 0.10 0.00 -1.21 0.00 0.00 61.69 59.35 1n3x s THR 222 Cb 0.07 -1.15 -0.09 0.00 -1.51 0.00 0.00 72.50 69.82 1n3x s THR 222 CO 0.74 -0.13 1.35 0.00 -2.21 0.00 0.00 174.62 174.37 1n3x h ALA 223 N 4.42 0.49 -2.34 11.08 0.00 -1.37 -3.43 119.26 128.10 1n3x h ALA 223 Ca -0.41 -0.72 -0.13 0.00 0.00 0.00 0.00 54.91 53.65 1n3x h ALA 223 Cb 1.19 -0.13 -0.16 0.00 0.00 0.00 0.00 17.79 18.69 1n3x h ALA 223 CO 0.41 0.98 -0.68 -1.64 0.00 0.00 0.00 179.25 178.32 1n3x s MET 224 N -2.82 0.58 0.24 0.00 -1.94 -0.30 -0.64 119.30 114.43 1n3x s MET 224 Ca 0.02 -1.15 -0.13 0.00 -1.71 0.00 0.00 55.69 52.72 1n3x s MET 224 Cb 0.09 0.18 -0.00 0.00 2.01 0.00 0.00 34.83 37.11 1n3x s MET 224 CO 0.79 -0.10 0.49 -0.08 -0.01 0.00 0.00 175.02 176.11 1n3x s THR 225 N -3.59 0.00 -0.14 2.05 -1.32 0.13 -2.10 115.64 110.67 1n3x s THR 225 Ca 0.04 -1.34 -0.00 0.00 -1.21 0.00 0.00 61.69 59.18 1n3x s THR 225 Cb 0.06 -2.13 0.03 0.00 -1.51 0.00 0.00 72.50 68.94 1n3x s THR 225 CO -0.09 -0.02 -0.08 -0.63 -2.21 0.00 0.00 174.62 171.59 1n3x s ILE 226 N -4.00 1.17 0.33 5.08 1.01 -1.26 -1.17 121.20 122.37 1n3x s ILE 226 Ca 0.21 -0.48 -0.11 0.00 0.00 0.00 0.00 60.65 60.27 1n3x s ILE 226 Cb -0.01 -1.22 0.02 0.00 0.01 0.00 0.00 42.46 41.27 1n3x s ILE 226 CO 0.08 0.31 0.62 0.21 0.00 0.00 0.00 174.94 176.15 1n3x s ASN 227 N 1.63 0.26 0.57 3.58 3.84 -1.17 -4.76 114.94 118.90 1n3x s ASN 227 Ca 0.04 -1.16 0.07 0.00 0.21 0.00 0.00 52.86 52.02 1n3x s ASN 227 Cb -0.13 0.73 0.07 0.00 -0.55 0.00 0.00 41.25 41.37 1n3x s ASN 227 CO -0.09 -1.42 0.62 0.61 -2.79 0.00 0.00 177.10 174.04 1n3x n GLY 228 N -0.51 2.34 0.33 1.21 0.00 -1.26 -1.64 105.19 105.66 1n3x n GLY 228 Ca -0.04 -2.26 0.17 0.00 0.00 0.00 0.00 46.02 43.89 1n3x n GLY 228 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1n3x h PRO 229 N 0.00 0.00 0.00 1.61 0.11 -1.99 -2.00 132.00 129.72 1n3x h PRO 229 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1n3x h PRO 229 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1n3x h PRO 229 CO 0.47 0.00 0.00 -2.67 -0.21 0.00 0.00 178.00 175.59 1n3x n TRP 230 N -3.81 0.10 0.71 0.65 2.14 -1.26 -2.52 117.44 113.45 1n3x n TRP 230 Ca 0.01 0.05 0.08 0.00 2.07 0.00 0.00 57.50 59.71 1n3x n TRP 230 Cb 0.30 -0.57 0.03 0.00 -0.81 0.00 0.00 31.31 30.26 1n3x n TRP 230 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1n3x n ALA 231 N -1.54 2.85 -0.14 -1.67 0.00 -0.75 -4.64 120.51 114.62 1n3x n ALA 231 Ca 0.02 -0.58 -0.09 0.00 0.00 0.00 0.00 53.44 52.78 1n3x n ALA 231 Cb 0.10 -0.57 -0.01 0.00 0.00 0.00 0.00 19.45 18.97 1n3x n ALA 231 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 1n3x h TRP 232 N 2.53 0.68 -0.09 0.00 6.55 -1.65 -2.83 115.95 121.13 1n3x h TRP 232 Ca 0.00 -0.07 -0.02 0.00 0.95 0.00 0.00 58.89 59.74 1n3x h TRP 232 Cb 0.63 -0.19 -0.01 0.00 -0.86 0.00 0.00 29.16 28.73 1n3x h TRP 232 CO 0.00 0.63 -0.05 0.66 -1.05 0.00 0.00 178.44 178.63 1n3x h SER 233 N 0.52 0.12 0.40 -3.49 4.64 -1.82 0.28 113.55 114.20 1n3x h SER 233 Ca 0.13 -0.01 -0.14 0.00 -0.47 0.00 0.00 61.79 61.30 1n3x h SER 233 Cb 0.29 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 1n3x h SER 233 CO -0.00 0.20 -0.59 -1.13 -0.87 0.00 0.00 176.83 174.44 1n3x h ASN 234 N 0.13 0.21 0.93 4.97 -1.24 -1.82 -3.13 115.58 115.63 1n3x h ASN 234 Ca 0.03 -0.12 -0.22 0.00 0.71 0.00 0.00 56.30 56.70 1n3x h ASN 234 Cb 0.18 -0.06 -0.03 0.00 0.73 0.00 0.00 38.32 39.14 1n3x h ASN 234 CO 0.01 0.75 -1.11 0.40 -1.29 0.00 0.00 177.43 176.19 1n3x h ILE 235 N 0.14 1.50 -0.38 2.57 2.04 -1.04 -3.22 117.51 119.12 1n3x h ILE 235 Ca -0.00 -3.22 0.01 0.00 1.00 0.00 0.00 64.86 62.64 1n3x h ILE 235 Cb 1.07 2.74 -0.02 0.00 -0.74 0.00 0.00 36.82 39.87 1n3x h ILE 235 CO 0.09 0.86 0.26 0.44 0.00 0.00 0.00 178.15 179.79 1n3x h ASP 236 N 0.00 0.43 0.22 1.72 3.32 -0.93 -2.81 116.42 118.37 1n3x h ASP 236 Ca -0.06 -0.01 -0.30 0.00 0.02 0.00 0.00 57.03 56.68 1n3x h ASP 236 Cb 1.79 -0.11 0.03 0.00 0.22 0.00 0.00 39.33 41.27 1n3x h ASP 236 CO 0.12 0.31 -1.27 0.74 -1.72 0.00 0.00 179.24 177.41 1n3x h THR 237 N 0.50 1.31 0.00 0.35 2.02 -1.62 -3.28 112.91 112.19 1n3x h THR 237 Ca 0.14 -2.57 0.00 0.00 0.77 0.00 0.00 66.41 64.75 1n3x h THR 237 Cb -0.03 2.77 0.00 0.00 -1.74 0.00 0.00 68.15 69.15 1n3x h THR 237 CO -0.03 0.78 0.14 -1.54 0.37 0.00 0.00 175.52 175.23 1n3x n SER 238 N -3.75 0.24 -3.45 4.18 3.41 -1.06 -4.81 113.62 108.38 1n3x n SER 238 Ca -0.13 0.53 -0.19 0.00 -0.26 0.00 0.00 58.87 58.82 1n3x n SER 238 Cb 1.00 -0.53 0.09 0.00 -0.26 0.00 0.00 64.21 64.51 1n3x n SER 238 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1n3x n LYS 239 N -1.80 -6.92 -4.26 4.33 0.00 -1.24 -4.96 118.16 103.31 1n3x n LYS 239 Ca -0.01 0.84 -0.34 0.00 0.00 0.00 0.00 58.31 58.81 1n3x n LYS 239 Cb 0.16 -5.85 -0.15 0.00 0.00 0.00 0.00 35.03 29.19 1n3x n LYS 239 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1n3x s VAL 240 N -3.35 2.85 -0.71 3.15 1.01 -1.26 -5.06 120.40 117.03 1n3x s VAL 240 Ca 0.14 -0.69 -0.26 0.00 0.00 0.00 0.00 61.98 61.17 1n3x s VAL 240 Cb -0.06 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 1n3x s VAL 240 CO 0.72 0.49 1.81 0.21 0.00 0.00 0.00 175.10 178.34 1n3x s ASN 241 N 1.07 5.36 0.32 3.32 2.47 -1.26 -4.91 114.94 121.31 1n3x s ASN 241 Ca -0.00 -0.06 0.09 0.00 0.42 0.00 0.00 52.86 53.31 1n3x s ASN 241 Cb -0.15 -2.54 -0.04 0.00 -1.45 0.00 0.00 41.25 37.07 1n3x s ASN 241 CO -0.03 -2.39 0.09 -0.72 -3.72 0.00 0.00 177.10 170.34 1n3x s TYR 242 N 8.87 2.70 0.07 0.43 1.13 -1.26 -0.83 117.35 128.46 1n3x s TYR 242 Ca 0.64 -0.34 0.01 0.00 -1.41 0.00 0.00 57.07 55.97 1n3x s TYR 242 Cb -0.10 -1.51 -0.03 0.00 -1.10 0.00 0.00 41.96 39.22 1n3x s TYR 242 CO 0.14 0.43 -0.06 0.20 -2.51 0.00 0.00 175.55 173.75 1n3x s GLY 243 N -3.79 0.60 -0.08 5.49 0.00 -0.71 -4.88 107.32 103.95 1n3x s GLY 243 Ca 0.36 -1.10 0.05 0.00 0.00 0.00 0.00 44.72 44.02 1n3x s GLY 243 CO 0.22 -1.19 -0.24 0.14 0.00 0.00 0.00 173.10 172.03 1n3x s VAL 244 N -2.89 2.01 0.35 1.40 1.01 -1.26 -2.05 120.40 118.97 1n3x s VAL 244 Ca 0.03 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 61.00 1n3x s VAL 244 Cb 0.00 -1.72 -0.00 0.00 0.00 0.00 0.00 36.38 34.66 1n3x s VAL 244 CO -0.04 0.55 0.45 0.28 0.00 0.00 0.00 175.10 176.34 1n3x s THR 245 N 0.16 0.00 0.49 3.92 -1.32 -0.27 -4.68 115.64 113.94 1n3x s THR 245 Ca -0.13 -1.69 -0.22 0.00 -1.21 0.00 0.00 61.69 58.44 1n3x s THR 245 Cb -0.16 -2.65 -0.06 0.00 -1.51 0.00 0.00 72.50 68.12 1n3x s THR 245 CO 0.07 0.00 1.22 0.54 -2.21 0.00 0.00 174.62 174.23 1n3x s VAL 246 N -3.02 2.81 0.64 5.08 0.11 -1.26 -1.87 120.40 122.89 1n3x s VAL 246 Ca 0.33 0.60 -0.16 0.00 -2.93 0.00 0.00 61.98 59.82 1n3x s VAL 246 Cb -0.00 -3.30 -0.01 0.00 -1.53 0.00 0.00 36.38 31.55 1n3x s VAL 246 CO 0.23 -0.02 1.13 -0.76 -3.33 0.00 0.00 175.10 172.35 1n3x s LEU 247 N -3.25 3.45 0.88 2.54 1.43 -1.26 -4.59 118.68 117.87 1n3x s LEU 247 Ca 0.67 2.07 -0.11 0.00 -1.03 0.00 0.00 54.13 55.74 1n3x s LEU 247 Cb -0.32 -4.56 0.12 0.00 0.03 0.00 0.00 46.19 41.46 1n3x s LEU 247 CO 0.38 -1.62 1.11 -2.84 0.23 0.00 0.00 176.35 173.60 1n3x s PRO 248 N -3.92 1.37 0.34 1.29 0.02 -1.26 -4.68 135.00 128.16 1n3x s PRO 248 Ca 0.69 1.25 0.03 0.00 0.02 0.00 0.00 61.00 62.98 1n3x s PRO 248 Cb -0.22 -1.79 -0.02 0.00 0.02 0.00 0.00 34.50 32.49 1n3x s PRO 248 CO 0.39 -2.29 0.51 0.95 -0.33 0.00 0.00 177.00 176.24 1n3x s THR 249 N -2.77 4.77 -0.08 0.99 -4.23 -0.53 -3.49 115.64 110.29 1n3x s THR 249 Ca 0.64 -0.69 -0.01 0.00 -1.18 0.00 0.00 61.69 60.46 1n3x s THR 249 Cb -0.20 -3.72 0.03 0.00 1.34 0.00 0.00 72.50 69.95 1n3x s THR 249 CO 0.58 -0.40 -0.02 0.12 -0.54 0.00 0.00 174.62 174.36 1n3x s PHE 250 N -2.26 0.89 -1.51 3.99 5.36 0.58 -0.65 117.98 124.39 1n3x s PHE 250 Ca 0.41 -0.32 -0.06 0.00 -0.96 0.00 0.00 56.93 56.00 1n3x s PHE 250 Cb -0.09 -0.92 0.02 0.00 -0.34 0.00 0.00 43.02 41.69 1n3x s PHE 250 CO 0.34 -0.38 0.65 1.63 -1.46 0.00 0.00 175.22 176.00 1n3x n LYS 251 N 5.08 -4.97 -0.15 10.12 5.02 -1.26 -0.91 118.16 131.09 1n3x n LYS 251 Ca -0.09 0.84 0.00 0.00 -2.02 0.00 0.00 58.31 57.04 1n3x n LYS 251 Cb 0.50 -5.70 0.00 0.00 -0.02 0.00 0.00 35.03 29.81 1n3x n LYS 251 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n3x n GLY 252 N -1.52 2.27 3.85 0.72 0.00 -1.26 -5.01 105.19 104.24 1n3x n GLY 252 Ca -0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.57 1n3x n GLY 252 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1n3x s GLN 253 N -0.02 3.82 0.54 1.61 -1.52 -0.08 -5.00 119.66 119.00 1n3x s GLN 253 Ca 0.00 0.27 -0.21 0.00 -1.95 0.00 0.00 55.36 53.48 1n3x s GLN 253 Cb 0.00 -3.09 -0.05 0.00 -0.22 0.00 0.00 33.01 29.65 1n3x s GLN 253 CO 0.00 0.62 1.22 -2.14 -0.25 0.00 0.00 175.29 174.74 1n3x s PRO 254 N -1.54 3.26 0.38 2.91 0.02 -1.26 -0.31 135.00 138.46 1n3x s PRO 254 Ca 0.29 1.88 -0.26 0.00 0.02 0.00 0.00 61.00 62.93 1n3x s PRO 254 Cb -0.15 -2.14 -0.09 0.00 0.02 0.00 0.00 34.50 32.14 1n3x s PRO 254 CO 0.16 -0.99 1.17 -1.12 -0.33 0.00 0.00 177.00 175.89 1n3x s SER 255 N -1.40 6.64 -0.85 2.53 0.01 -1.23 -4.47 113.70 114.93 1n3x s SER 255 Ca 0.72 2.37 -0.04 0.00 1.31 0.00 0.00 55.95 60.31 1n3x s SER 255 Cb -0.32 -2.62 0.21 0.00 0.21 0.00 0.00 66.02 63.51 1n3x s SER 255 CO 0.36 -0.59 0.74 -0.54 0.41 0.00 0.00 173.24 173.62 1n3x s LYS 256 N -2.15 3.24 0.44 12.44 3.01 -0.70 -4.57 119.74 131.44 1n3x s LYS 256 Ca 0.55 -3.05 -0.20 0.00 -1.01 0.00 0.00 55.97 52.25 1n3x s LYS 256 Cb -0.32 -4.00 -0.10 0.00 -1.01 0.00 0.00 37.83 32.40 1n3x s LYS 256 CO 0.40 -1.24 0.95 -1.25 0.51 0.00 0.00 175.35 174.71 1n3x s PRO 257 N -0.95 4.17 0.45 -1.68 0.04 -1.26 -3.77 135.00 131.99 1n3x s PRO 257 Ca 0.25 1.07 -0.24 0.00 0.04 0.00 0.00 61.00 62.11 1n3x s PRO 257 Cb -0.11 -2.18 -0.07 0.00 0.04 0.00 0.00 34.50 32.18 1n3x s PRO 257 CO -0.10 -0.06 1.27 -0.06 0.04 0.00 0.00 177.00 178.09 1n3x s PHE 258 N -2.25 2.73 -0.19 0.56 0.08 -1.26 -0.87 117.98 116.79 1n3x s PHE 258 Ca 0.61 1.44 -0.05 0.00 0.12 0.00 0.00 56.93 59.06 1n3x s PHE 258 Cb -0.09 -3.60 -0.02 0.00 -0.57 0.00 0.00 43.02 38.73 1n3x s PHE 258 CO 0.16 -2.06 -0.01 0.08 -0.10 0.00 0.00 175.22 173.30 1n3x s VAL 259 N -1.36 3.94 -0.18 -0.44 1.01 0.60 -4.55 120.40 119.42 1n3x s VAL 259 Ca 0.62 -0.32 -0.07 0.00 0.00 0.00 0.00 61.98 62.21 1n3x s VAL 259 Cb -0.35 -2.77 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 1n3x s VAL 259 CO 0.44 0.44 0.04 -0.83 0.00 0.00 0.00 175.10 175.19 1n3x s GLY 260 N 0.92 1.86 -0.27 4.51 0.00 -0.01 -2.96 107.32 111.37 1n3x s GLY 260 Ca 0.01 -0.77 0.02 0.00 0.00 0.00 0.00 44.72 43.98 1n3x s GLY 260 CO 0.02 0.04 -0.08 0.14 0.00 0.00 0.00 173.10 173.21 1n3x s VAL 261 N 0.40 2.31 -0.05 1.40 1.01 -1.26 -0.18 120.40 124.03 1n3x s VAL 261 Ca 0.01 -1.63 -0.30 0.00 0.00 0.00 0.00 61.98 60.07 1n3x s VAL 261 Cb -0.13 -2.37 -0.07 0.00 0.00 0.00 0.00 36.38 33.81 1n3x s VAL 261 CO 0.01 -0.07 1.83 -0.22 0.00 0.00 0.00 175.10 176.65 1n3x s LEU 262 N 1.12 4.25 0.19 3.92 2.96 -0.09 -0.56 118.68 130.47 1n3x s LEU 262 Ca -0.07 2.32 0.08 0.00 -0.22 0.00 0.00 54.13 56.23 1n3x s LEU 262 Cb -0.20 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 1n3x s LEU 262 CO -0.04 -1.10 -0.16 -0.44 -1.32 0.00 0.00 176.35 173.28 1n3x s SER 263 N 4.32 2.68 -0.22 3.68 0.01 0.59 -0.51 113.70 124.25 1n3x s SER 263 Ca 0.82 -0.96 -0.01 0.00 1.31 0.00 0.00 55.95 57.11 1n3x s SER 263 Cb -0.36 -0.16 0.02 0.00 0.21 0.00 0.00 66.02 65.73 1n3x s SER 263 CO 0.35 -0.10 -0.11 0.00 0.41 0.00 0.00 173.24 173.79 1n3x s ALA 264 N -2.58 2.59 0.26 1.44 0.00 0.45 -1.38 121.76 122.54 1n3x s ALA 264 Ca 0.20 -1.34 0.07 0.00 0.00 0.00 0.00 51.96 50.89 1n3x s ALA 264 Cb -0.03 -1.51 -0.04 0.00 0.00 0.00 0.00 23.12 21.54 1n3x s ALA 264 CO 0.07 -0.60 0.18 0.20 0.00 0.00 0.00 175.76 175.61 1n3x s GLY 265 N 1.33 1.45 -0.15 0.00 0.00 0.27 -0.81 107.32 109.41 1n3x s GLY 265 Ca 0.02 -1.46 -0.01 0.00 0.00 0.00 0.00 44.72 43.27 1n3x s GLY 265 CO -0.07 -1.49 -0.11 -0.42 0.00 0.00 0.00 173.10 171.01 1n3x s ILE 266 N -2.16 3.19 0.18 0.90 1.01 -1.26 -1.32 121.20 121.73 1n3x s ILE 266 Ca 0.33 -0.60 -0.32 0.00 0.00 0.00 0.00 60.65 60.06 1n3x s ILE 266 Cb -0.08 -2.37 -0.12 0.00 0.01 0.00 0.00 42.46 39.91 1n3x s ILE 266 CO 0.24 0.50 1.75 -3.20 0.00 0.00 0.00 174.94 174.24 1n3x n ASN 267 N 3.76 3.96 0.26 3.58 2.85 0.59 -0.47 115.26 129.80 1n3x n ASN 267 Ca -0.18 1.04 0.12 0.00 -0.11 0.00 0.00 54.58 55.44 1n3x n ASN 267 Cb 0.52 -1.56 0.72 0.00 1.24 0.00 0.00 39.78 40.71 1n3x n ASN 267 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1n3x h ALA 268 N 7.28 1.43 -0.22 5.20 0.00 -0.74 -1.64 119.26 130.56 1n3x h ALA 268 Ca -0.44 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1n3x h ALA 268 Cb 1.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1n3x h ALA 268 CO 0.95 0.13 0.00 0.00 0.00 0.00 0.00 179.25 180.33 1n3x n ALA 269 N -2.34 2.50 -2.70 0.00 0.00 -1.26 -4.89 120.51 111.81 1n3x n ALA 269 Ca -0.02 -0.54 -0.42 0.00 0.00 0.00 0.00 53.44 52.45 1n3x n ALA 269 Cb 0.20 -1.05 -0.03 0.00 0.00 0.00 0.00 19.45 18.57 1n3x n ALA 269 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1n3x s SER 270 N -1.38 7.36 0.00 0.00 0.15 -0.62 -4.74 113.70 114.47 1n3x s SER 270 Ca 0.29 1.65 0.28 0.00 0.70 0.00 0.00 55.95 58.88 1n3x s SER 270 Cb 0.16 -2.57 1.10 0.00 -1.71 0.00 0.00 66.02 63.00 1n3x s SER 270 CO 0.23 -0.25 1.77 -0.81 1.20 0.00 0.00 173.24 175.38 1n3x n PRO 271 N 3.88 1.05 -1.47 5.44 -0.04 -1.26 -3.92 135.00 138.68 1n3x n PRO 271 Ca 0.06 -0.50 -0.23 0.00 -0.04 0.00 0.00 63.50 62.79 1n3x n PRO 271 Cb 0.51 -1.49 0.09 0.00 -0.04 0.00 0.00 33.50 32.57 1n3x n PRO 271 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1n3x n ASN 272 N -0.54 5.21 -0.34 3.54 3.02 -1.26 -4.76 115.26 120.13 1n3x n ASN 272 Ca 0.16 -3.77 -0.01 0.00 -0.03 0.00 0.00 54.58 50.93 1n3x n ASN 272 Cb 0.30 -0.64 0.12 0.00 -0.61 0.00 0.00 39.78 38.95 1n3x n ASN 272 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1n3x h LYS 273 N 1.79 1.12 -0.55 3.52 1.57 -1.94 -1.37 116.57 120.71 1n3x h LYS 273 Ca 0.43 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 59.05 1n3x h LYS 273 Cb 1.39 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 33.43 1n3x h LYS 273 CO 0.97 0.74 -0.02 0.93 -0.57 0.00 0.00 179.45 181.50 1n3x h GLU 274 N 1.15 0.95 -0.48 3.15 3.07 -1.94 -1.57 114.58 118.91 1n3x h GLU 274 Ca 0.37 -0.29 -0.13 0.00 -0.50 0.00 0.00 59.36 58.80 1n3x h GLU 274 Cb 0.01 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 27.81 1n3x h GLU 274 CO -0.12 0.95 -0.20 -0.07 -1.40 0.00 0.00 179.01 178.17 1n3x h LEU 275 N 0.87 1.00 -0.52 1.33 3.38 -1.85 -1.85 115.31 117.67 1n3x h LEU 275 Ca 0.16 -0.37 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 1n3x h LEU 275 Cb 0.54 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1n3x h LEU 275 CO 0.03 1.17 0.30 0.00 0.09 0.00 0.00 178.44 180.03 1n3x h ALA 276 N 0.91 0.66 0.27 1.53 0.00 -1.03 0.23 119.26 121.83 1n3x h ALA 276 Ca 0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1n3x h ALA 276 Cb 0.78 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1n3x h ALA 276 CO 0.06 0.16 -0.17 -0.22 0.00 0.00 0.00 179.25 179.08 1n3x h LYS 277 N 0.69 -0.41 -0.89 0.00 3.64 -1.16 -0.13 116.57 118.32 1n3x h LYS 277 Ca 0.18 0.03 0.12 0.00 -1.27 0.00 0.00 60.65 59.71 1n3x h LYS 277 Cb 0.01 0.09 -0.08 0.00 -0.41 0.00 0.00 32.23 31.84 1n3x h LYS 277 CO -0.03 -0.27 0.51 1.49 -2.27 0.00 0.00 179.45 178.88 1n3x h GLU 278 N -0.42 0.77 0.27 1.90 4.57 -1.07 0.23 114.58 120.83 1n3x h GLU 278 Ca -0.03 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.10 1n3x h GLU 278 Cb 0.35 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 1n3x h GLU 278 CO 0.02 0.51 -0.13 0.35 -1.18 0.00 0.00 179.01 178.59 1n3x h PHE 279 N 0.80 -0.33 -0.56 0.92 3.57 -0.52 -1.91 116.94 118.90 1n3x h PHE 279 Ca 0.45 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.90 1n3x h PHE 279 Cb 0.50 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.32 1n3x h PHE 279 CO -0.05 -0.01 0.18 -0.07 -2.23 0.00 0.00 178.31 176.13 1n3x h LEU 280 N -0.68 0.82 0.00 0.59 3.38 -0.78 -0.67 115.31 117.98 1n3x h LEU 280 Ca -0.04 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 1n3x h LEU 280 Cb 0.47 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1n3x h LEU 280 CO 0.06 0.80 -0.17 -0.33 0.09 0.00 0.00 178.44 178.89 1n3x h GLU 281 N 0.79 0.11 -0.05 1.13 5.08 -1.04 -0.01 114.58 120.59 1n3x h GLU 281 Ca 0.18 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1n3x h GLU 281 Cb 0.27 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1n3x h GLU 281 CO -0.01 0.90 0.00 0.09 -1.00 0.00 0.00 179.01 179.00 1n3x n ASN 282 N -4.56 3.01 0.06 1.42 3.02 -0.72 -4.30 115.26 113.19 1n3x n ASN 282 Ca -0.10 -1.99 0.00 0.00 -0.03 0.00 0.00 54.58 52.46 1n3x n ASN 282 Cb 0.48 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.64 1n3x n ASN 282 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1n3x n TYR 283 N 1.35 -0.47 0.03 3.10 4.02 -0.56 -4.91 117.16 119.72 1n3x n TYR 283 Ca 0.14 0.08 -0.11 0.00 -0.01 0.00 0.00 57.90 58.00 1n3x n TYR 283 Cb 0.60 0.13 -0.08 0.00 -0.02 0.00 0.00 39.34 39.97 1n3x n TYR 283 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 1n3x h LEU 284 N 0.00 -0.14 -5.35 7.72 5.85 -1.23 -3.33 115.31 118.83 1n3x h LEU 284 Ca 0.00 -0.42 -0.50 0.00 0.84 0.00 0.00 57.88 57.80 1n3x h LEU 284 Cb 0.18 0.04 0.02 0.00 0.37 0.00 0.00 40.66 41.27 1n3x h LEU 284 CO 0.00 0.43 3.06 0.18 -0.34 0.00 0.00 178.44 181.77 1n3x n LEU 285 N -4.89 6.32 -4.11 2.25 7.99 -0.02 -2.88 117.00 121.67 1n3x n LEU 285 Ca -0.08 -3.45 -0.10 0.00 -0.01 0.00 0.00 56.01 52.37 1n3x n LEU 285 Cb 0.28 -1.28 -0.09 0.00 -0.11 0.00 0.00 43.42 42.22 1n3x n LEU 285 CO 0.27 1.11 -0.19 0.42 -1.51 0.00 0.00 177.39 177.49 1n3x s THR 286 N 3.03 0.06 0.19 -5.08 -4.23 -1.26 -4.80 115.64 103.56 1n3x s THR 286 Ca 0.51 -1.78 -0.12 0.00 -1.18 0.00 0.00 61.69 59.12 1n3x s THR 286 Cb 0.13 -2.12 0.11 0.00 1.34 0.00 0.00 72.50 71.97 1n3x s THR 286 CO -0.04 -0.28 1.86 0.44 -0.54 0.00 0.00 174.62 176.05 1n3x h ASP 287 N 2.69 0.75 0.34 3.99 3.32 -1.91 -1.25 116.42 124.36 1n3x h ASP 287 Ca -0.34 -0.03 -0.12 0.00 0.02 0.00 0.00 57.03 56.57 1n3x h ASP 287 Cb 1.22 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.57 1n3x h ASP 287 CO 0.54 0.55 -0.49 -0.33 -1.72 0.00 0.00 179.24 177.78 1n3x h GLU 288 N 0.88 0.18 0.28 3.56 3.07 -1.91 -2.19 114.58 118.44 1n3x h GLU 288 Ca 0.24 -0.10 -0.01 0.00 -0.50 0.00 0.00 59.36 58.98 1n3x h GLU 288 Cb -0.09 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.83 1n3x h GLU 288 CO -0.05 0.64 -0.13 0.78 -1.40 0.00 0.00 179.01 178.84 1n3x h GLY 289 N 1.38 -0.39 2.00 -3.84 0.00 -1.51 -2.41 103.07 98.30 1n3x h GLY 289 Ca 0.01 0.14 -0.04 0.00 0.00 0.00 0.00 47.33 47.44 1n3x h GLY 289 CO 0.07 -0.14 -0.20 1.41 0.00 0.00 0.00 176.54 177.68 1n3x h LEU 290 N -0.74 0.00 -0.36 3.11 3.38 -1.11 -2.65 115.31 116.94 1n3x h LEU 290 Ca -0.04 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 1n3x h LEU 290 Cb 0.50 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1n3x h LEU 290 CO 0.06 0.20 -0.26 -0.08 0.09 0.00 0.00 178.44 178.45 1n3x h GLU 291 N 0.00 0.81 -0.73 1.13 4.81 -1.35 0.15 114.58 119.40 1n3x h GLU 291 Ca -0.00 -0.39 -0.04 0.00 -0.13 0.00 0.00 59.36 58.80 1n3x h GLU 291 Cb 0.49 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.84 1n3x h GLU 291 CO 0.03 1.03 0.32 0.00 -0.73 0.00 0.00 179.01 179.65 1n3x h ALA 292 N 0.77 0.95 -0.07 2.92 0.00 -1.09 -0.01 119.26 122.74 1n3x h ALA 292 Ca 0.07 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1n3x h ALA 292 Cb 0.83 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1n3x h ALA 292 CO 0.07 0.55 -0.07 0.28 0.00 0.00 0.00 179.25 180.08 1n3x h VAL 293 N 1.04 1.37 -0.61 0.00 2.07 -1.39 -3.19 116.25 115.54 1n3x h VAL 293 Ca 0.25 -1.21 0.06 0.00 0.82 0.00 0.00 66.70 66.62 1n3x h VAL 293 Cb 0.17 2.03 -0.06 0.00 -1.52 0.00 0.00 31.29 31.92 1n3x h VAL 293 CO -0.03 0.34 0.31 -1.13 0.02 0.00 0.00 177.57 177.08 1n3x h ASN 294 N -0.27 0.42 -0.85 0.57 -1.24 -0.52 -1.72 115.58 111.97 1n3x h ASN 294 Ca 0.01 0.04 0.12 0.00 0.71 0.00 0.00 56.30 57.18 1n3x h ASN 294 Cb 0.57 -0.03 -0.06 0.00 0.73 0.00 0.00 38.32 39.52 1n3x h ASN 294 CO 0.02 0.27 0.55 0.11 -1.29 0.00 0.00 177.43 177.09 1n3x h LYS 295 N 0.57 0.71 0.30 6.67 1.57 -1.04 -2.32 116.57 123.03 1n3x h LYS 295 Ca 0.28 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.00 1n3x h LYS 295 Cb 0.22 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1n3x h LYS 295 CO -0.21 0.47 -0.14 0.22 -0.57 0.00 0.00 179.45 179.22 1n3x h ASP 296 N 0.73 -0.34 -2.96 0.86 3.58 -1.32 -3.45 116.42 113.52 1n3x h ASP 296 Ca 0.41 -0.19 -0.21 0.00 0.42 0.00 0.00 57.03 57.45 1n3x h ASP 296 Cb 0.57 0.09 -0.32 0.00 1.72 0.00 0.00 39.33 41.39 1n3x h ASP 296 CO -0.17 0.10 -0.52 -0.54 -2.88 0.00 0.00 179.24 175.23 1n3x s LYS 297 N -3.98 0.16 0.20 0.28 1.02 -0.88 -4.95 119.74 111.58 1n3x s LYS 297 Ca -0.13 0.71 -0.32 0.00 0.02 0.00 0.00 55.97 56.25 1n3x s LYS 297 Cb 0.01 -0.05 -0.14 0.00 -0.52 0.00 0.00 37.83 37.13 1n3x s LYS 297 CO 0.46 -0.26 1.34 -0.35 -0.92 0.00 0.00 175.35 175.61 1n3x n PRO 298 N 5.13 1.68 0.07 -1.68 -0.04 -0.93 -4.16 135.00 135.06 1n3x n PRO 298 Ca -0.10 0.60 0.12 0.00 -0.04 0.00 0.00 63.50 64.08 1n3x n PRO 298 Cb 0.50 -2.21 0.17 0.00 -0.04 0.00 0.00 33.50 31.92 1n3x n PRO 298 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1n3x h LEU 299 N 4.13 0.00 0.00 1.53 3.38 -1.90 -3.49 115.31 118.96 1n3x h LEU 299 Ca -0.45 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.34 1n3x h LEU 299 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1n3x h LEU 299 CO 0.75 0.09 0.00 0.61 0.09 0.00 0.00 178.44 179.98 1n3x n GLY 300 N 1.32 0.66 3.81 0.83 0.00 -1.26 -4.70 105.19 105.85 1n3x n GLY 300 Ca 0.03 -1.11 -0.38 0.00 0.00 0.00 0.00 46.02 44.56 1n3x n GLY 300 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n3x s ALA 301 N -2.00 3.56 0.17 4.61 0.00 -1.22 -4.97 121.76 121.91 1n3x s ALA 301 Ca 0.00 0.07 0.07 0.00 0.00 0.00 0.00 51.96 52.10 1n3x s ALA 301 Cb 0.00 -2.68 -0.04 0.00 0.00 0.00 0.00 23.12 20.40 1n3x s ALA 301 CO 0.00 0.39 0.01 0.14 0.00 0.00 0.00 175.76 176.30 1n3x s VAL 302 N -1.17 3.81 -0.49 0.00 -7.23 -1.26 0.37 120.40 114.42 1n3x s VAL 302 Ca 0.31 -1.37 0.26 0.00 -1.81 0.00 0.00 61.98 59.37 1n3x s VAL 302 Cb -0.19 -2.92 0.31 0.00 0.56 0.00 0.00 36.38 34.14 1n3x s VAL 302 CO 0.20 -0.10 1.75 0.00 -0.31 0.00 0.00 175.10 176.64 1n3x h ALA 303 N 2.70 1.00 -1.82 1.32 0.00 -1.31 -3.44 119.26 117.70 1n3x h ALA 303 Ca -0.47 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 53.87 1n3x h ALA 303 Cb 1.20 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.92 1n3x h ALA 303 CO 0.59 0.00 0.90 -1.17 0.00 0.00 0.00 179.25 179.57 1n3x s LEU 304 N -5.22 3.76 0.16 0.00 2.96 -1.26 -1.90 118.68 117.18 1n3x s LEU 304 Ca 0.07 0.73 -0.19 0.00 -0.22 0.00 0.00 54.13 54.52 1n3x s LEU 304 Cb 0.09 -3.55 0.06 0.00 0.50 0.00 0.00 46.19 43.30 1n3x s LEU 304 CO 0.57 -1.10 1.66 0.11 -1.32 0.00 0.00 176.35 176.27 1n3x h LYS 305 N 8.79 -0.10 -0.51 1.98 1.57 -1.65 -0.30 116.57 126.37 1n3x h LYS 305 Ca -0.22 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.65 1n3x h LYS 305 Cb 1.06 0.02 -0.07 0.00 0.08 0.00 0.00 32.23 33.32 1n3x h LYS 305 CO 1.09 -0.06 0.10 0.66 -0.57 0.00 0.00 179.45 180.66 1n3x h SER 306 N -0.10 -0.01 0.73 0.86 4.64 -1.92 -1.20 113.55 116.56 1n3x h SER 306 Ca 0.17 0.09 -0.23 0.00 -0.47 0.00 0.00 61.79 61.35 1n3x h SER 306 Cb 0.35 0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 1n3x h SER 306 CO -0.39 0.02 -1.04 0.22 -0.87 0.00 0.00 176.83 174.78 1n3x h TYR 307 N 0.23 0.26 -0.86 4.77 3.20 -1.91 -3.28 116.97 119.39 1n3x h TYR 307 Ca 0.25 -0.18 -0.03 0.00 3.14 0.00 0.00 58.73 61.92 1n3x h TYR 307 Cb 0.35 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.56 1n3x h TYR 307 CO -0.23 1.08 0.44 1.49 -1.64 0.00 0.00 178.16 179.30 1n3x h GLU 308 N 0.06 1.23 0.00 1.82 4.57 -0.61 -1.63 114.58 120.01 1n3x h GLU 308 Ca -0.06 -0.16 -0.00 0.00 -1.18 0.00 0.00 59.36 57.95 1n3x h GLU 308 Cb 1.74 -0.23 -0.00 0.00 -0.16 0.00 0.00 28.75 30.10 1n3x h GLU 308 CO 0.16 0.92 -0.01 0.93 -1.18 0.00 0.00 179.01 179.83 1n3x h GLU 309 N 1.22 0.00 0.21 1.92 5.08 -1.29 0.03 114.58 121.76 1n3x h GLU 309 Ca 0.30 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.32 1n3x h GLU 309 Cb 0.08 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.35 1n3x h GLU 309 CO -0.04 0.01 -1.62 1.49 -1.00 0.00 0.00 179.01 177.85 1n3x h GLU 310 N 0.00 0.44 0.00 2.33 4.81 -1.43 -3.32 114.58 117.41 1n3x h GLU 310 Ca -0.00 -0.76 -0.02 0.00 -0.13 0.00 0.00 59.36 58.45 1n3x h GLU 310 Cb 0.02 0.28 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 1n3x h GLU 310 CO 0.00 1.36 -0.12 -0.07 -0.73 0.00 0.00 179.01 179.46 1n3x h LEU 311 N 0.09 0.00 0.00 1.64 3.38 -0.76 -2.96 115.31 116.70 1n3x h LEU 311 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1n3x h LEU 311 Cb 2.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.85 1n3x h LEU 311 CO 0.21 0.12 0.00 0.00 0.09 0.00 0.00 178.44 178.85 1n3x n ALA 312 N -2.17 2.17 0.26 1.53 0.00 -0.05 -2.07 120.51 120.18 1n3x n ALA 312 Ca 0.00 -0.11 0.15 0.00 0.00 0.00 0.00 53.44 53.48 1n3x n ALA 312 Cb 0.36 -1.29 0.65 0.00 0.00 0.00 0.00 19.45 19.17 1n3x n ALA 312 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1n3x h LYS 313 N 0.00 0.00 -6.05 0.00 1.57 -1.72 -3.37 116.57 107.00 1n3x h LYS 313 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 1n3x h LYS 313 Cb 0.00 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 32.20 1n3x h LYS 313 CO 0.00 0.08 0.56 0.34 -0.57 0.00 0.00 179.45 179.87 1n3x s ASP 314 N -5.87 6.45 0.54 0.86 -1.08 -0.88 -4.94 116.67 111.75 1n3x s ASP 314 Ca 0.00 -0.02 0.30 0.00 -0.52 0.00 0.00 52.55 52.31 1n3x s ASP 314 Cb 0.10 -2.44 1.46 0.00 -1.46 0.00 0.00 42.92 40.58 1n3x s ASP 314 CO 0.57 -1.09 1.92 1.55 0.52 0.00 0.00 175.17 178.64 1n3x h PRO 315 N 9.14 0.00 -0.64 4.34 0.13 -1.88 -1.35 132.00 141.74 1n3x h PRO 315 Ca -0.25 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.85 1n3x h PRO 315 Cb 1.08 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.18 1n3x h PRO 315 CO 1.04 0.00 0.26 0.00 -0.23 0.00 0.00 178.00 179.07 1n3x h ARG 316 N 0.00 0.96 -0.25 0.86 3.08 -1.92 -0.85 114.38 116.26 1n3x h ARG 316 Ca 0.37 -0.17 -0.18 0.00 0.07 0.00 0.00 59.98 60.07 1n3x h ARG 316 Cb 1.50 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.40 1n3x h ARG 316 CO -0.00 0.80 -0.55 0.82 -1.07 0.00 0.00 179.97 179.97 1n3x h ILE 317 N 0.90 1.28 -0.66 2.04 2.04 -1.57 -2.05 117.51 119.50 1n3x h ILE 317 Ca 0.21 -1.75 0.07 0.00 1.00 0.00 0.00 64.86 64.40 1n3x h ILE 317 Cb 0.20 1.73 -0.06 0.00 -0.74 0.00 0.00 36.82 37.96 1n3x h ILE 317 CO -0.02 0.56 0.35 0.00 0.00 0.00 0.00 178.15 179.04 1n3x h ALA 318 N 0.64 0.88 -0.50 1.87 0.00 -1.12 -1.75 119.26 119.28 1n3x h ALA 318 Ca 0.00 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 1n3x h ALA 318 Cb 1.16 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1n3x h ALA 318 CO 0.12 -0.00 -0.18 0.00 0.00 0.00 0.00 179.25 179.19 1n3x h ALA 319 N 1.36 0.69 -0.67 0.00 0.00 -1.11 -1.79 119.26 117.74 1n3x h ALA 319 Ca 0.30 -0.38 0.06 0.00 0.00 0.00 0.00 54.91 54.89 1n3x h ALA 319 Cb 0.23 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1n3x h ALA 319 CO -0.21 0.65 0.37 1.15 0.00 0.00 0.00 179.25 181.22 1n3x h THR 320 N 0.86 0.97 -0.41 0.00 2.02 -0.69 -0.08 112.91 115.58 1n3x h THR 320 Ca 0.12 -0.24 -0.11 0.00 0.77 0.00 0.00 66.41 66.95 1n3x h THR 320 Cb 0.75 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 1n3x h THR 320 CO 0.06 0.13 -0.21 -0.03 0.37 0.00 0.00 175.52 175.84 1n3x h MET 321 N 0.69 0.81 -0.74 6.66 -1.53 -1.16 -1.64 114.93 118.02 1n3x h MET 321 Ca 0.30 -0.32 -0.06 0.00 -3.44 0.00 0.00 59.70 56.18 1n3x h MET 321 Cb 0.18 -0.04 -0.03 0.00 -0.55 0.00 0.00 31.60 31.16 1n3x h MET 321 CO -0.18 0.94 0.22 1.49 0.14 0.00 0.00 176.91 179.52 1n3x h GLU 322 N 0.71 1.16 -0.08 0.39 4.81 -0.47 -0.36 114.58 120.74 1n3x h GLU 322 Ca 0.10 -0.25 -0.14 0.00 -0.13 0.00 0.00 59.36 58.94 1n3x h GLU 322 Cb 0.72 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 1n3x h GLU 322 CO 0.06 0.99 -0.57 -0.91 -0.73 0.00 0.00 179.01 177.85 1n3x h ASN 323 N 1.11 0.26 0.48 1.04 2.35 -0.90 -3.03 115.58 116.89 1n3x h ASN 323 Ca 0.24 -0.14 -0.15 0.00 -0.55 0.00 0.00 56.30 55.69 1n3x h ASN 323 Cb 0.32 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 1n3x h ASN 323 CO -0.01 0.78 -0.67 0.00 -1.65 0.00 0.00 177.43 175.88 1n3x h ALA 324 N 1.23 0.81 0.00 -0.83 0.00 -0.92 -1.74 119.26 117.81 1n3x h ALA 324 Ca -0.00 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1n3x h ALA 324 Cb 1.05 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1n3x h ALA 324 CO 0.09 0.79 0.00 1.96 0.00 0.00 0.00 179.25 182.08 1n3x h GLN 325 N 0.12 0.00 -0.01 0.00 4.20 -0.96 -2.54 115.11 115.91 1n3x h GLN 325 Ca -0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1n3x h GLN 325 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1n3x h GLN 325 CO 0.10 0.00 -0.22 1.63 -0.67 0.00 0.00 178.83 179.67 1n3x n LYS 326 N -3.05 1.57 -1.55 1.46 5.02 -1.15 -5.00 118.16 115.47 1n3x n LYS 326 Ca 0.01 -1.05 -0.20 0.00 -2.02 0.00 0.00 58.31 55.06 1n3x n LYS 326 Cb 0.35 -1.29 0.13 0.00 -0.02 0.00 0.00 35.03 34.20 1n3x n LYS 326 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1n3x n GLY 327 N 1.09 -0.86 3.48 0.72 0.00 -0.67 -4.59 105.19 104.36 1n3x n GLY 327 Ca 0.08 -1.78 -0.35 0.00 0.00 0.00 0.00 46.02 43.97 1n3x n GLY 327 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1n3x s GLU 328 N -4.91 3.67 -0.13 1.61 2.12 -0.05 -4.89 118.70 116.13 1n3x s GLU 328 Ca 0.53 -0.50 -0.29 0.00 0.36 0.00 0.00 54.97 55.07 1n3x s GLU 328 Cb -0.02 -3.06 -0.04 0.00 0.26 0.00 0.00 34.13 31.28 1n3x s GLU 328 CO 0.37 0.10 1.53 0.42 -0.54 0.00 0.00 175.26 177.13 1n3x s ILE 329 N 0.77 3.82 0.04 -3.70 1.01 -1.26 -0.29 121.20 121.59 1n3x s ILE 329 Ca 0.00 0.98 -0.35 0.00 0.00 0.00 0.00 60.65 61.28 1n3x s ILE 329 Cb -0.14 -3.68 -0.14 0.00 0.01 0.00 0.00 42.46 38.51 1n3x s ILE 329 CO 0.02 -0.14 1.60 0.80 0.00 0.00 0.00 174.94 177.22 1n3x n MET 330 N 7.09 1.80 -1.71 2.79 1.56 -1.16 -4.85 117.12 122.65 1n3x n MET 330 Ca 0.17 0.65 -0.42 0.00 -0.27 0.00 0.00 57.70 57.82 1n3x n MET 330 Cb 0.44 -2.40 -0.01 0.00 2.15 0.00 0.00 33.22 33.40 1n3x n MET 330 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94 1n3x n PRO 331 N 4.11 2.23 -0.66 2.12 -0.02 -1.26 -4.73 135.00 136.79 1n3x n PRO 331 Ca 0.20 0.78 0.07 0.00 -2.02 0.00 0.00 63.50 62.53 1n3x n PRO 331 Cb 0.25 -2.41 0.33 0.00 -0.02 0.00 0.00 33.50 31.65 1n3x n PRO 331 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1n3x n ASN 332 N 0.95 4.62 -4.91 2.55 0.23 -1.26 -4.71 115.26 112.74 1n3x n ASN 332 Ca 0.05 -2.61 -0.28 0.00 -0.53 0.00 0.00 54.58 51.20 1n3x n ASN 332 Cb 0.36 -0.61 -0.03 0.00 -2.08 0.00 0.00 39.78 37.42 1n3x n ASN 332 CO 0.00 0.00 0.00 0.27 -0.93 0.00 0.00 177.26 176.60 1n3x s ILE 333 N -2.20 5.02 0.35 1.53 -4.36 -1.26 -2.69 121.20 117.59 1n3x s ILE 333 Ca 0.45 0.05 0.23 0.00 -0.26 0.00 0.00 60.65 61.12 1n3x s ILE 333 Cb 0.32 -3.74 0.23 0.00 1.25 0.00 0.00 42.46 40.52 1n3x s ILE 333 CO 0.17 -0.35 1.96 1.55 0.24 0.00 0.00 174.94 178.50 1n3x h PRO 334 N 1.59 0.00 0.00 0.37 0.13 -1.90 -2.75 132.00 129.44 1n3x h PRO 334 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1n3x h PRO 334 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1n3x h PRO 334 CO 0.66 0.20 0.01 1.04 -0.23 0.00 0.00 178.00 179.68 1n3x n GLN 335 N -3.73 0.03 0.31 0.86 3.00 -1.26 -1.91 117.38 114.68 1n3x n GLN 335 Ca -0.01 0.53 0.20 0.00 -0.01 0.00 0.00 57.00 57.70 1n3x n GLN 335 Cb 0.32 -1.61 1.06 0.00 0.00 0.00 0.00 30.24 30.01 1n3x n GLN 335 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.06 179.04 1n3x h MET 336 N 0.00 0.00 -0.42 -1.09 4.05 -1.84 -1.66 114.93 113.97 1n3x h MET 336 Ca 0.00 0.00 -0.10 0.00 -0.28 0.00 0.00 59.70 59.32 1n3x h MET 336 Cb 0.01 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.79 1n3x h MET 336 CO 0.00 0.00 -0.16 0.77 0.23 0.00 0.00 176.91 177.75 1n3x h SER 337 N 0.00 0.78 -0.18 1.39 0.02 -1.66 -2.26 113.55 111.65 1n3x h SER 337 Ca 0.01 -0.25 -0.13 0.00 -0.84 0.00 0.00 61.79 60.58 1n3x h SER 337 Cb 0.16 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.47 1n3x h SER 337 CO -0.00 0.94 -0.35 0.00 -1.14 0.00 0.00 176.83 176.28 1n3x h ALA 338 N 1.13 0.80 0.31 3.77 0.00 -1.54 -2.89 119.26 120.83 1n3x h ALA 338 Ca 0.11 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1n3x h ALA 338 Cb 0.65 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1n3x h ALA 338 CO 0.05 0.65 -0.23 0.35 0.00 0.00 0.00 179.25 180.06 1n3x h PHE 339 N 0.58 -0.60 -0.23 0.00 3.04 -1.43 0.16 116.94 118.46 1n3x h PHE 339 Ca 0.06 -0.00 0.05 0.00 3.98 0.00 0.00 57.97 62.06 1n3x h PHE 339 Cb 0.87 0.22 -0.06 0.00 2.56 0.00 0.00 35.95 39.55 1n3x h PHE 339 CO 0.04 -0.35 -0.13 -1.49 -2.02 0.00 0.00 178.31 174.36 1n3x h TRP 340 N -0.54 -0.33 -0.58 0.41 -0.00 -1.39 -0.67 115.95 112.85 1n3x h TRP 340 Ca -0.02 0.03 -0.06 0.00 -0.00 0.00 0.00 58.89 58.83 1n3x h TRP 340 Cb 0.47 0.18 -0.03 0.00 -0.00 0.00 0.00 29.16 29.78 1n3x h TRP 340 CO -0.12 -0.20 0.12 -0.92 -0.00 0.00 0.00 178.44 177.32 1n3x h TYR 341 N -0.11 0.96 0.10 0.49 5.03 -1.38 -1.90 116.97 120.14 1n3x h TYR 341 Ca 0.13 -0.11 -0.00 0.00 2.58 0.00 0.00 58.73 61.33 1n3x h TYR 341 Cb 0.31 -0.27 0.00 0.00 1.55 0.00 0.00 36.73 38.31 1n3x h TYR 341 CO -0.30 0.81 -0.05 0.00 -1.32 0.00 0.00 178.16 177.30 1n3x h ALA 342 N 1.25 -0.13 -0.29 1.82 0.00 -0.21 -3.03 119.26 118.68 1n3x h ALA 342 Ca 0.18 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1n3x h ALA 342 Cb 0.35 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1n3x h ALA 342 CO 0.00 -0.31 -0.14 0.28 0.00 0.00 0.00 179.25 179.08 1n3x h VAL 343 N -0.65 1.23 -0.12 0.00 2.07 -1.19 -1.77 116.25 115.83 1n3x h VAL 343 Ca -0.01 -1.04 0.03 0.00 0.82 0.00 0.00 66.70 66.49 1n3x h VAL 343 Cb 0.52 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 1n3x h VAL 343 CO 0.02 0.34 -0.04 -0.09 0.02 0.00 0.00 177.57 177.82 1n3x h ARG 344 N 0.45 -0.02 -0.57 1.57 2.43 -1.41 -0.48 114.38 116.37 1n3x h ARG 344 Ca 0.08 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.22 1n3x h ARG 344 Cb 0.51 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.04 1n3x h ARG 344 CO 0.03 -0.01 0.24 1.15 -1.51 0.00 0.00 179.97 179.87 1n3x h THR 345 N -0.02 1.22 -0.33 0.20 2.02 -1.38 -2.46 112.91 112.16 1n3x h THR 345 Ca 0.06 -0.67 0.01 0.00 0.77 0.00 0.00 66.41 66.59 1n3x h THR 345 Cb 0.11 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 1n3x h THR 345 CO -0.13 0.26 0.19 0.00 0.37 0.00 0.00 175.52 176.21 1n3x h ALA 346 N 1.08 0.42 -0.63 6.16 0.00 -0.85 -0.60 119.26 124.84 1n3x h ALA 346 Ca 0.19 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1n3x h ALA 346 Cb 0.18 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1n3x h ALA 346 CO -0.02 -0.16 0.16 0.28 0.00 0.00 0.00 179.25 179.51 1n3x h VAL 347 N 0.40 1.24 -0.23 0.00 2.07 -1.00 -0.84 116.25 117.89 1n3x h VAL 347 Ca 0.13 -0.88 -0.07 0.00 0.82 0.00 0.00 66.70 66.70 1n3x h VAL 347 Cb 0.01 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1n3x h VAL 347 CO -0.06 0.34 -0.14 0.40 0.02 0.00 0.00 177.57 178.12 1n3x h ILE 348 N 0.94 1.31 -0.06 4.57 1.08 -1.16 -1.27 117.51 122.92 1n3x h ILE 348 Ca 0.20 -1.24 -0.11 0.00 -0.39 0.00 0.00 64.86 63.32 1n3x h ILE 348 Cb 0.32 1.63 -0.01 0.00 -3.07 0.00 0.00 36.82 35.68 1n3x h ILE 348 CO -0.00 0.38 -0.48 0.78 -0.69 0.00 0.00 178.15 178.14 1n3x h ASN 349 N 0.20 0.17 -0.06 1.72 2.35 -1.03 -2.08 115.58 116.85 1n3x h ASN 349 Ca 0.05 -0.08 -0.21 0.00 -0.55 0.00 0.00 56.30 55.51 1n3x h ASN 349 Cb 0.65 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.98 1n3x h ASN 349 CO 0.04 0.62 -0.73 0.00 -1.65 0.00 0.00 177.43 175.71 1n3x h ALA 350 N 1.38 0.42 -0.09 -0.83 0.00 -1.10 -1.88 119.26 117.17 1n3x h ALA 350 Ca 0.01 -0.59 -0.15 0.00 0.00 0.00 0.00 54.91 54.18 1n3x h ALA 350 Cb 0.89 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1n3x h ALA 350 CO 0.07 0.70 -0.59 0.00 0.00 0.00 0.00 179.25 179.43 1n3x h ALA 351 N 0.68 0.84 -0.09 0.00 0.00 -1.15 -3.08 119.26 116.46 1n3x h ALA 351 Ca -0.04 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1n3x h ALA 351 Cb 1.34 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1n3x h ALA 351 CO 0.14 0.72 0.00 -1.13 0.00 0.00 0.00 179.25 178.98 1n3x n SER 352 N -3.89 1.21 0.00 0.00 3.41 -0.79 -4.91 113.62 108.65 1n3x n SER 352 Ca -0.02 -1.56 0.00 0.00 -0.26 0.00 0.00 58.87 57.03 1n3x n SER 352 Cb 0.61 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 1n3x n SER 352 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1n3x n GLY 353 N 1.07 1.19 0.32 5.00 0.00 -1.12 -4.81 105.19 106.83 1n3x n GLY 353 Ca 0.17 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.37 1n3x n GLY 353 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1n3x h ARG 354 N 1.48 0.00 -2.65 1.61 2.43 -1.70 -3.43 114.38 112.13 1n3x h ARG 354 Ca 0.00 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.07 1n3x h ARG 354 Cb 0.00 0.00 -0.20 0.00 -0.42 0.00 0.00 29.97 29.35 1n3x h ARG 354 CO 0.00 0.00 -0.11 -1.14 -1.51 0.00 0.00 179.97 177.21 1n3x s GLN 355 N -4.44 0.79 0.64 0.20 0.74 -0.76 -5.02 119.66 111.81 1n3x s GLN 355 Ca -0.05 0.02 -0.13 0.00 0.05 0.00 0.00 55.36 55.26 1n3x s GLN 355 Cb 0.14 0.36 -0.02 0.00 1.10 0.00 0.00 33.01 34.60 1n3x s GLN 355 CO 0.49 -0.22 1.05 0.95 -0.55 0.00 0.00 175.29 177.00 1n3x s THR 356 N -1.16 4.05 0.16 -0.34 -4.23 -1.26 -3.94 115.64 108.92 1n3x s THR 356 Ca -0.12 0.79 -0.15 0.00 -1.18 0.00 0.00 61.69 61.03 1n3x s THR 356 Cb -0.03 -3.46 0.04 0.00 1.34 0.00 0.00 72.50 70.39 1n3x s THR 356 CO 0.06 -0.75 1.75 0.58 -0.54 0.00 0.00 174.62 175.71 1n3x h VAL 357 N -0.17 0.87 -0.68 2.29 2.07 -1.94 0.19 116.25 118.88 1n3x h VAL 357 Ca -0.45 -0.10 0.01 0.00 0.82 0.00 0.00 66.70 66.98 1n3x h VAL 357 Cb 1.21 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 1n3x h VAL 357 CO 0.58 0.05 0.45 0.44 0.02 0.00 0.00 177.57 179.11 1n3x h ASP 358 N 0.28 0.79 -0.15 0.57 3.32 -1.94 -1.78 116.42 117.50 1n3x h ASP 358 Ca 0.18 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.14 1n3x h ASP 358 Cb 0.17 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.52 1n3x h ASP 358 CO -0.19 0.58 -0.14 -0.33 -1.72 0.00 0.00 179.24 177.43 1n3x h GLU 359 N 0.92 0.36 0.04 3.56 5.08 -1.82 -2.53 114.58 120.21 1n3x h GLU 359 Ca 0.25 -0.19 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1n3x h GLU 359 Cb -0.10 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.12 1n3x h GLU 359 CO -0.05 0.74 -0.21 0.00 -1.00 0.00 0.00 179.01 178.48 1n3x h ALA 360 N 0.62 -0.31 -0.59 3.43 0.00 -0.47 -0.99 119.26 120.96 1n3x h ALA 360 Ca 0.03 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1n3x h ALA 360 Cb 0.67 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1n3x h ALA 360 CO 0.04 -0.72 0.19 -0.07 0.00 0.00 0.00 179.25 178.68 1n3x h LEU 361 N -0.36 0.82 -0.66 0.00 3.38 -1.43 -1.62 115.31 115.45 1n3x h LEU 361 Ca 0.05 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1n3x h LEU 361 Cb 0.42 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 1n3x h LEU 361 CO -0.17 0.78 0.37 0.50 0.09 0.00 0.00 178.44 180.00 1n3x h LYS 362 N 0.87 0.91 -0.03 1.13 3.64 -1.04 0.23 116.57 122.28 1n3x h LYS 362 Ca 0.20 -0.10 -0.13 0.00 -1.27 0.00 0.00 60.65 59.35 1n3x h LYS 362 Cb 0.25 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 1n3x h LYS 362 CO -0.01 0.68 -0.58 -0.44 -2.27 0.00 0.00 179.45 176.83 1n3x h ASP 363 N 0.89 0.09 0.14 4.20 3.32 -0.92 -2.57 116.42 121.58 1n3x h ASP 363 Ca 0.23 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.22 1n3x h ASP 363 Cb 0.03 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1n3x h ASP 363 CO -0.04 0.65 -0.07 0.00 -1.72 0.00 0.00 179.24 178.06 1n3x h ALA 364 N 1.35 -0.19 -0.57 3.45 0.00 -0.86 -2.37 119.26 120.07 1n3x h ALA 364 Ca -0.00 -0.18 0.12 0.00 0.00 0.00 0.00 54.91 54.84 1n3x h ALA 364 Cb 1.04 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.80 1n3x h ALA 364 CO 0.08 -0.43 -0.04 0.37 0.00 0.00 0.00 179.25 179.23 1n3x h GLN 365 N -0.54 0.08 -0.96 0.00 5.75 -0.93 -1.26 115.11 117.25 1n3x h GLN 365 Ca -0.02 -0.00 0.03 0.00 -0.15 0.00 0.00 58.65 58.50 1n3x h GLN 365 Cb 0.42 -0.02 -0.05 0.00 1.07 0.00 0.00 27.48 28.90 1n3x h GLN 365 CO 0.03 0.05 0.63 1.15 -2.65 0.00 0.00 178.83 178.04 1n3x h THR 366 N 0.08 1.20 -0.04 2.39 2.02 -1.40 -1.74 112.91 115.42 1n3x h THR 366 Ca 0.29 -0.43 -0.12 0.00 0.77 0.00 0.00 66.41 66.93 1n3x h THR 366 Cb 0.46 -0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.69 1n3x h THR 366 CO -0.51 0.23 -0.51 0.03 0.37 0.00 0.00 175.52 175.13 1n3x h ARG 367 N 1.24 0.10 0.08 6.66 3.08 -0.72 -1.51 114.38 123.32 1n3x h ARG 367 Ca 0.37 -0.06 -0.26 0.00 0.07 0.00 0.00 59.98 60.10 1n3x h ARG 367 Cb -0.06 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.02 1n3x h ARG 367 CO -0.10 0.59 -1.07 0.82 -1.07 0.00 0.00 179.97 179.14 1n3x h ILE 368 N 0.08 1.32 -0.02 2.04 2.04 -0.90 -3.26 117.51 118.81 1n3x h ILE 368 Ca 0.00 -2.36 0.00 0.00 1.00 0.00 0.00 64.86 63.50 1n3x h ILE 368 Cb 0.93 2.66 0.00 0.00 -0.74 0.00 0.00 36.82 39.66 1n3x h ILE 368 CO 0.07 0.71 0.00 0.35 0.00 0.00 0.00 178.15 179.28 1n3x n THR 369 N -3.90 0.01 0.00 -0.27 -2.24 -0.69 -4.95 114.28 102.23 1n3x n THR 369 Ca -0.13 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1n3x n THR 369 Cb 0.90 0.45 0.00 0.00 -2.10 0.00 0.00 70.33 69.58 1n3x n THR 369 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67