#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i4h n ASP 11 N 0.00 -1.50 -4.92 3.14 9.92 -1.26 -5.07 116.55 116.86 1i4h n ASP 11 Ca 0.00 0.00 -0.28 0.00 -0.53 0.00 0.00 54.79 53.98 1i4h n ASP 11 Cb 0.00 -0.45 -0.03 0.00 -0.64 0.00 0.00 41.12 40.00 1i4h n ASP 11 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1i4h s LEU 12 N 0.00 4.16 0.45 0.64 1.43 -1.26 -5.05 118.68 119.06 1i4h s LEU 12 Ca 0.00 0.51 -0.24 0.00 -1.03 0.00 0.00 54.13 53.37 1i4h s LEU 12 Cb 0.00 -3.30 -0.07 0.00 0.03 0.00 0.00 46.19 42.85 1i4h s LEU 12 CO 0.00 -0.10 1.27 -0.60 0.23 0.00 0.00 176.35 177.15 1i4h s ARG 13 N -3.41 3.71 0.22 1.70 6.06 -1.26 -4.99 118.95 120.98 1i4h s ARG 13 Ca 0.40 2.06 -0.18 0.00 -2.50 0.00 0.00 55.73 55.52 1i4h s ARG 13 Cb -0.11 -2.54 -0.08 0.00 0.06 0.00 0.00 34.95 32.28 1i4h s ARG 13 CO 0.29 -0.67 0.68 0.15 -2.50 0.00 0.00 175.30 173.26 1i4h s LYS 14 N -2.53 4.15 0.37 5.12 1.02 -1.26 -4.56 119.74 122.05 1i4h s LYS 14 Ca 0.62 0.75 0.05 0.00 0.02 0.00 0.00 55.97 57.41 1i4h s LYS 14 Cb -0.36 -2.82 0.75 0.00 -0.52 0.00 0.00 37.83 34.87 1i4h s LYS 14 CO 0.44 0.38 2.01 -0.22 -0.92 0.00 0.00 175.35 177.04 1i4h h LYS 15 N 3.27 0.70 0.00 1.68 3.64 -0.85 -1.98 116.57 123.03 1i4h h LYS 15 Ca -0.48 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 58.86 1i4h h LYS 15 Cb 1.19 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1i4h h LYS 15 CO 0.65 0.47 -0.01 0.66 -2.27 0.00 0.00 179.45 178.95 1i4h h SER 16 N 0.73 0.00 1.03 4.20 4.64 -1.94 -2.25 113.55 119.96 1i4h h SER 16 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1i4h h SER 16 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1i4h h SER 16 CO -0.06 0.01 0.00 -0.62 -0.87 0.00 0.00 176.83 175.29 1i4h n GLU 17 N -3.12 0.09 -2.83 4.77 1.02 -0.74 -4.73 120.64 115.09 1i4h n GLU 17 Ca -0.01 0.13 -0.39 0.00 -0.02 0.00 0.00 57.16 56.87 1i4h n GLU 17 Cb 0.18 -1.61 -0.06 0.00 -0.02 0.00 0.00 31.44 29.93 1i4h n GLU 17 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1i4h s LEU 18 N -3.53 4.53 0.00 -4.62 1.43 -0.85 -5.06 118.68 110.58 1i4h s LEU 18 Ca 0.11 1.82 -0.07 0.00 -1.03 0.00 0.00 54.13 54.96 1i4h s LEU 18 Cb 0.15 -3.66 0.13 0.00 0.03 0.00 0.00 46.19 42.84 1i4h s LEU 18 CO 0.50 0.10 0.83 0.00 0.23 0.00 0.00 176.35 178.00 1i4h n GLN 19 N 1.19 -0.54 0.00 1.70 -0.00 -1.26 -4.93 117.38 113.54 1i4h n GLN 19 Ca -0.02 -1.56 0.00 0.00 -0.00 0.00 0.00 57.00 55.42 1i4h n GLN 19 Cb 0.48 -0.77 0.00 0.00 -0.00 0.00 0.00 30.24 29.96 1i4h n GLN 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1i4h n GLY 20 N -0.70 0.00 0.43 2.61 0.00 -1.26 -3.52 105.19 102.75 1i4h n GLY 20 Ca 0.11 0.00 0.24 0.00 0.00 0.00 0.00 46.02 46.38 1i4h n GLY 20 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1i4h h THR 21 N 0.00 0.54 -0.49 2.61 1.35 -1.96 -3.05 112.91 111.91 1i4h h THR 21 Ca 0.00 -0.11 0.10 0.00 -0.55 0.00 0.00 66.41 65.85 1i4h h THR 21 Cb 0.00 0.20 -0.09 0.00 -1.73 0.00 0.00 68.15 66.53 1i4h h THR 21 CO 0.00 0.06 -0.11 0.00 -0.25 0.00 0.00 175.52 175.22 1i4h h ALA 22 N 1.58 0.33 -0.19 6.62 0.00 -1.69 1.00 119.26 126.91 1i4h h ALA 22 Ca 0.56 0.19 0.03 0.00 0.00 0.00 0.00 54.91 55.68 1i4h h ALA 22 Cb 1.57 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 19.69 1i4h h ALA 22 CO -0.21 -0.44 0.03 1.25 0.00 0.00 0.00 179.25 179.88 1i4h h LEU 23 N 0.01 -0.01 -1.06 0.00 5.85 -1.61 -0.76 115.31 117.73 1i4h h LEU 23 Ca 0.24 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.98 1i4h h LEU 23 Cb 0.36 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 1i4h h LEU 23 CO -0.49 0.02 0.50 1.23 -0.34 0.00 0.00 178.44 179.36 1i4h h GLY 24 N 0.10 1.23 1.79 3.75 0.00 -1.49 -2.21 103.07 106.24 1i4h h GLY 24 Ca 0.09 -0.51 -0.09 0.00 0.00 0.00 0.00 47.33 46.81 1i4h h GLY 24 CO -0.12 0.50 -0.34 3.43 0.00 0.00 0.00 176.54 180.01 1i4h h ASN 25 N 1.17 0.25 -0.44 0.19 2.35 -0.26 -0.76 115.58 118.08 1i4h h ASN 25 Ca 0.30 -0.09 -0.08 0.00 -0.55 0.00 0.00 56.30 55.88 1i4h h ASN 25 Cb -0.04 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 1i4h h ASN 25 CO -0.06 0.58 -0.03 -0.07 -1.65 0.00 0.00 177.43 176.20 1i4h h LEU 26 N 0.21 0.79 -1.33 1.61 3.38 -0.62 0.20 115.31 119.55 1i4h h LEU 26 Ca 0.03 -0.33 -0.07 0.00 0.09 0.00 0.00 57.88 57.60 1i4h h LEU 26 Cb 0.70 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1i4h h LEU 26 CO 0.05 0.93 -0.28 0.50 0.09 0.00 0.00 178.44 179.73 1i4h h LYS 27 N 0.64 0.08 -0.14 1.13 3.64 -1.07 -0.52 116.57 120.33 1i4h h LYS 27 Ca 0.12 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1i4h h LYS 27 Cb 0.54 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 1i4h h LYS 27 CO 0.03 0.36 0.02 0.37 -2.27 0.00 0.00 179.45 177.96 1i4h h GLN 28 N 0.07 0.24 0.42 1.90 5.75 -0.60 -1.87 115.11 121.01 1i4h h GLN 28 Ca 0.01 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.43 1i4h h GLN 28 Cb 0.54 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.07 1i4h h GLN 28 CO 0.04 0.43 -0.20 0.82 -2.65 0.00 0.00 178.83 177.26 1i4h h ILE 29 N 0.02 0.59 -0.00 2.39 2.04 -0.31 0.78 117.51 123.02 1i4h h ILE 29 Ca 0.04 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.81 1i4h h ILE 29 Cb 0.30 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.03 1i4h h ILE 29 CO 0.00 0.02 -0.41 -1.22 0.00 0.00 0.00 178.15 176.54 1i4h n TYR 30 N -5.31 0.00 0.00 1.37 4.02 -0.27 -4.41 117.16 112.57 1i4h n TYR 30 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.78 1i4h n TYR 30 Cb 0.25 -0.26 0.00 0.00 -0.02 0.00 0.00 39.34 39.31 1i4h n TYR 30 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 176.86 176.83 1i4h n TYR 31 N -1.40 0.00 -0.08 -0.72 9.36 -0.72 -4.10 117.16 119.51 1i4h n TYR 31 Ca 0.07 0.00 -0.15 0.00 3.32 0.00 0.00 57.90 61.14 1i4h n TYR 31 Cb 0.33 0.10 -0.12 0.00 -0.63 0.00 0.00 39.34 39.02 1i4h n TYR 31 CO 0.00 0.00 0.00 1.88 0.22 0.00 0.00 176.86 178.96 1i4h h TYR 32 N 0.00 0.00 -4.25 2.98 0.99 -1.26 -3.48 116.97 111.94 1i4h h TYR 32 Ca 0.00 0.00 -0.52 0.00 2.00 0.00 0.00 58.73 60.21 1i4h h TYR 32 Cb 0.80 0.00 0.18 0.00 1.00 0.00 0.00 36.73 38.71 1i4h h TYR 32 CO 0.00 1.03 0.28 -0.80 -0.00 0.00 0.00 178.16 178.67 1i4h s ASN 33 N -6.31 3.39 0.32 3.88 0.01 0.23 -5.04 114.94 111.42 1i4h s ASN 33 Ca -0.20 2.21 -0.03 0.00 -0.71 0.00 0.00 52.86 54.13 1i4h s ASN 33 Cb -0.01 -2.57 -0.04 0.00 0.41 0.00 0.00 41.25 39.04 1i4h s ASN 33 CO 0.63 -2.80 0.56 -1.83 -1.51 0.00 0.00 177.10 172.15 1i4h s GLU 34 N -4.47 3.58 0.22 -0.60 -1.05 -1.26 -4.96 118.70 110.15 1i4h s GLU 34 Ca 0.68 -0.09 0.10 0.00 -0.15 0.00 0.00 54.97 55.51 1i4h s GLU 34 Cb -0.24 -2.64 -0.04 0.00 -0.44 0.00 0.00 34.13 30.76 1i4h s GLU 34 CO 0.54 0.17 -0.09 0.15 0.95 0.00 0.00 175.26 176.99 1i4h s LYS 35 N -3.85 2.06 0.07 -4.83 1.02 -1.26 -4.56 119.74 108.39 1i4h s LYS 35 Ca 0.43 -1.40 -0.23 0.00 0.02 0.00 0.00 55.97 54.79 1i4h s LYS 35 Cb -0.10 -2.09 -0.06 0.00 -0.52 0.00 0.00 37.83 35.05 1i4h s LYS 35 CO 0.33 0.40 0.68 0.00 -0.92 0.00 0.00 175.35 175.83 1i4h s ALA 36 N -2.02 3.47 -0.36 5.17 0.00 -0.04 -4.95 121.76 123.04 1i4h s ALA 36 Ca 0.27 0.18 0.06 0.00 0.00 0.00 0.00 51.96 52.47 1i4h s ALA 36 Cb -0.07 -2.84 0.18 0.00 0.00 0.00 0.00 23.12 20.38 1i4h s ALA 36 CO 0.16 0.23 0.53 0.15 0.00 0.00 0.00 175.76 176.84 1i4h s LYS 37 N -0.64 0.66 0.04 0.00 1.02 -1.25 -2.19 119.74 117.38 1i4h s LYS 37 Ca 0.34 -0.14 0.04 0.00 0.02 0.00 0.00 55.97 56.23 1i4h s LYS 37 Cb -0.20 -0.10 -0.02 0.00 -0.52 0.00 0.00 37.83 36.98 1i4h s LYS 37 CO 0.22 -1.13 -0.12 0.99 -0.92 0.00 0.00 175.35 174.38 1i4h s THR 38 N 2.10 0.90 0.11 2.17 2.01 -0.85 -5.00 115.64 117.08 1i4h s THR 38 Ca 0.14 -1.03 0.05 0.00 0.31 0.00 0.00 61.69 61.15 1i4h s THR 38 Cb -0.09 -0.86 -0.04 0.00 0.01 0.00 0.00 72.50 71.52 1i4h s THR 38 CO -0.14 -0.15 0.05 -1.61 -0.69 0.00 0.00 174.62 172.07 1i4h s GLU 39 N -1.32 2.69 -0.88 4.92 0.41 -1.26 -1.31 118.70 121.94 1i4h s GLU 39 Ca -0.02 -0.84 -0.05 0.00 -0.41 0.00 0.00 54.97 53.65 1i4h s GLU 39 Cb -0.08 -2.59 -0.01 0.00 -1.78 0.00 0.00 34.13 29.67 1i4h s GLU 39 CO 0.01 0.53 0.73 -1.71 -0.49 0.00 0.00 175.26 174.33 1i4h n ASN 40 N 0.27 -6.62 -4.27 -0.19 5.15 -1.13 -4.97 115.26 103.52 1i4h n ASN 40 Ca -0.10 -0.52 -0.26 0.00 -0.60 0.00 0.00 54.58 53.11 1i4h n ASN 40 Cb 0.53 -4.25 -0.14 0.00 -0.53 0.00 0.00 39.78 35.38 1i4h n ASN 40 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1i4h s LYS 41 N -4.14 1.45 0.04 1.20 -0.14 0.43 -4.86 119.74 113.73 1i4h s LYS 41 Ca 0.16 -0.98 0.00 0.00 -1.36 0.00 0.00 55.97 53.79 1i4h s LYS 41 Cb -0.04 -1.59 -0.03 0.00 -1.68 0.00 0.00 37.83 34.49 1i4h s LYS 41 CO 0.80 0.40 -0.04 -1.83 -0.76 0.00 0.00 175.35 173.92 1i4h s GLU 42 N -1.23 0.52 -0.29 1.68 -1.05 -1.26 0.13 118.70 117.20 1i4h s GLU 42 Ca 0.08 -0.95 -0.24 0.00 -0.15 0.00 0.00 54.97 53.71 1i4h s GLU 42 Cb -0.09 0.06 0.16 0.00 -0.44 0.00 0.00 34.13 33.82 1i4h s GLU 42 CO 0.02 -0.06 1.26 0.45 0.95 0.00 0.00 175.26 177.88 1i4h s SER 43 N -2.23 -0.23 -0.08 0.83 0.15 -1.26 -5.00 113.70 105.89 1i4h s SER 43 Ca -0.03 0.44 0.12 0.00 0.70 0.00 0.00 55.95 57.17 1i4h s SER 43 Cb -0.01 0.48 0.29 0.00 -1.71 0.00 0.00 66.02 65.07 1i4h s SER 43 CO -0.05 -0.07 1.21 0.00 1.20 0.00 0.00 173.24 175.53 1i4h n HIS 44 N 1.95 0.37 -2.80 3.44 1.44 -1.26 -1.33 115.22 117.03 1i4h n HIS 44 Ca -0.12 -0.72 -0.42 0.00 -2.01 0.00 0.00 57.72 54.46 1i4h n HIS 44 Cb 0.56 -0.14 -0.03 0.00 0.12 0.00 0.00 29.99 30.50 1i4h n HIS 44 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1i4h s ASP 45 N -1.70 7.16 0.47 4.39 1.01 -1.26 -4.94 116.67 121.80 1i4h s ASP 45 Ca 0.25 1.42 0.03 0.00 0.71 0.00 0.00 52.55 54.96 1i4h s ASP 45 Cb 0.19 -2.51 -0.04 0.00 1.01 0.00 0.00 42.92 41.57 1i4h s ASP 45 CO 0.07 -0.35 0.01 -1.10 0.21 0.00 0.00 175.17 174.01 1i4h s GLN 46 N 1.66 2.10 0.15 8.23 -0.21 -1.26 0.30 119.66 130.63 1i4h s GLN 46 Ca 0.45 -2.29 0.00 0.00 0.02 0.00 0.00 55.36 53.54 1i4h s GLN 46 Cb -0.18 -1.52 0.00 0.00 1.00 0.00 0.00 33.01 32.31 1i4h s GLN 46 CO 0.19 -0.26 0.00 0.34 -2.12 0.00 0.00 175.29 173.43 1i4h n PHE 47 N -1.15 -1.21 -4.25 0.91 7.35 -1.26 -4.66 117.46 113.19 1i4h n PHE 47 Ca -0.14 0.21 -0.28 0.00 -0.76 0.00 0.00 57.45 56.49 1i4h n PHE 47 Cb 0.67 0.43 -0.09 0.00 0.35 0.00 0.00 39.48 40.84 1i4h n PHE 47 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 1i4h s LEU 48 N -6.18 3.04 0.00 -2.13 1.43 -1.26 -5.03 118.68 108.55 1i4h s LEU 48 Ca 0.00 -0.48 0.03 0.00 -1.03 0.00 0.00 54.13 52.65 1i4h s LEU 48 Cb 0.00 -1.76 0.13 0.00 0.03 0.00 0.00 46.19 44.59 1i4h s LEU 48 CO 0.00 0.13 1.09 0.00 0.23 0.00 0.00 176.35 177.80 1i4h n GLN 49 N 0.29 0.00 -0.68 1.70 10.64 -1.26 -1.15 117.38 126.93 1i4h n GLN 49 Ca -0.12 0.43 0.03 0.00 -1.83 0.00 0.00 57.00 55.52 1i4h n GLN 49 Cb 0.54 -1.50 0.27 0.00 -0.86 0.00 0.00 30.24 28.70 1i4h n GLN 49 CO 0.00 0.00 0.00 -2.39 -1.83 0.00 0.00 177.06 172.84 1i4h n HIS 50 N -1.49 1.42 -4.23 2.61 1.44 -1.26 -3.99 115.22 109.72 1i4h n HIS 50 Ca 0.01 -1.06 -0.13 0.00 -2.01 0.00 0.00 57.72 54.53 1i4h n HIS 50 Cb 0.04 -0.45 -0.10 0.00 0.12 0.00 0.00 29.99 29.60 1i4h n HIS 50 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 1i4h s THR 51 N -2.94 0.50 -0.04 0.61 -4.23 -0.30 -0.28 115.64 108.96 1i4h s THR 51 Ca 0.47 -1.97 -0.01 0.00 -1.18 0.00 0.00 61.69 59.00 1i4h s THR 51 Cb 0.38 -2.22 0.03 0.00 1.34 0.00 0.00 72.50 72.03 1i4h s THR 51 CO 0.09 -0.36 0.03 -0.63 -0.54 0.00 0.00 174.62 173.22 1i4h s ILE 52 N -3.79 0.03 -0.24 2.99 1.01 -1.09 -4.49 121.20 115.63 1i4h s ILE 52 Ca 0.27 0.28 -0.15 0.00 0.00 0.00 0.00 60.65 61.05 1i4h s ILE 52 Cb 0.07 -0.22 -0.04 0.00 0.01 0.00 0.00 42.46 42.28 1i4h s ILE 52 CO 0.06 0.17 0.38 -0.22 0.00 0.00 0.00 174.94 175.33 1i4h s LEU 53 N 1.74 4.09 -0.47 2.97 2.96 0.89 -2.37 118.68 128.49 1i4h s LEU 53 Ca -0.00 0.40 -0.13 0.00 -0.22 0.00 0.00 54.13 54.18 1i4h s LEU 53 Cb -0.12 -2.47 0.09 0.00 0.50 0.00 0.00 46.19 44.19 1i4h s LEU 53 CO -0.03 -0.13 0.37 -0.36 -1.32 0.00 0.00 176.35 174.88 1i4h s PHE 54 N 1.70 3.30 0.14 5.38 0.40 0.16 -4.33 117.98 124.73 1i4h s PHE 54 Ca 0.17 -1.33 -0.27 0.00 -0.60 0.00 0.00 56.93 54.91 1i4h s PHE 54 Cb -0.15 -3.29 -0.07 0.00 0.51 0.00 0.00 43.02 40.02 1i4h s PHE 54 CO 0.09 -0.89 0.82 0.15 0.70 0.00 0.00 175.22 176.09 1i4h s LYS 55 N 1.53 4.62 -0.17 0.44 1.02 -1.26 -0.02 119.74 125.89 1i4h s LYS 55 Ca 0.04 1.23 0.00 0.00 0.02 0.00 0.00 55.97 57.26 1i4h s LYS 55 Cb -0.25 -3.30 0.00 0.00 -0.52 0.00 0.00 37.83 33.75 1i4h s LYS 55 CO 0.03 0.45 0.00 0.41 -0.92 0.00 0.00 175.35 175.32 1i4h n GLY 56 N 1.85 0.47 0.25 -3.33 0.00 -1.22 -4.90 105.19 98.31 1i4h n GLY 56 Ca -0.03 -0.16 0.02 0.00 0.00 0.00 0.00 46.02 45.85 1i4h n GLY 56 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1i4h h PHE 57 N 0.00 -0.10 -3.51 1.61 3.57 -1.41 -3.39 116.94 113.70 1i4h h PHE 57 Ca -0.03 0.05 -0.53 0.00 3.53 0.00 0.00 57.97 60.99 1i4h h PHE 57 Cb 0.36 0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.23 1i4h h PHE 57 CO 0.21 -0.21 -0.04 -0.06 -2.23 0.00 0.00 178.31 175.98 1i4h s PHE 58 N -6.15 3.44 0.00 0.41 0.40 -0.09 -4.97 117.98 111.02 1i4h s PHE 58 Ca -0.14 1.02 0.00 0.00 -0.60 0.00 0.00 56.93 57.22 1i4h s PHE 58 Cb 0.20 -2.37 0.00 0.00 0.51 0.00 0.00 43.02 41.36 1i4h s PHE 58 CO 0.74 0.24 0.00 0.25 0.70 0.00 0.00 175.22 177.16 1i4h n THR 59 N -0.04 0.00 -1.26 0.64 -2.24 -1.26 -4.80 114.28 105.32 1i4h n THR 59 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1i4h n THR 59 Cb 0.52 1.37 0.00 0.00 -2.10 0.00 0.00 70.33 70.13 1i4h n THR 59 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1i4h n ASP 60 N 0.00 0.00 -4.67 3.42 5.75 -1.26 -5.06 116.55 114.73 1i4h n ASP 60 Ca 0.00 -1.13 -0.38 0.00 -0.01 0.00 0.00 54.79 53.26 1i4h n ASP 60 Cb 0.16 -0.03 -0.07 0.00 -1.03 0.00 0.00 41.12 40.15 1i4h n ASP 60 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 1i4h s HIS 61 N 0.00 3.37 0.16 2.11 2.46 -1.26 -4.99 115.29 117.13 1i4h s HIS 61 Ca 0.00 0.66 -0.24 0.00 0.47 0.00 0.00 55.06 55.95 1i4h s HIS 61 Cb 0.00 -2.57 0.05 0.00 -0.13 0.00 0.00 32.58 29.93 1i4h s HIS 61 CO 0.00 -0.04 1.60 0.66 -2.47 0.00 0.00 174.74 174.49 1i4h h SER 62 N 7.42 -1.09 0.00 9.88 4.64 -2.02 -3.37 113.55 129.02 1i4h h SER 62 Ca -0.35 0.19 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1i4h h SER 62 Cb 1.16 0.50 0.00 0.00 -0.31 0.00 0.00 62.40 63.75 1i4h h SER 62 CO 0.72 -0.33 0.00 0.79 -0.87 0.00 0.00 176.83 177.14 1i4h n TRP 63 N -5.42 0.00 -1.55 4.77 7.02 -1.26 -4.99 117.44 116.01 1i4h n TRP 63 Ca 0.00 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 56.14 1i4h n TRP 63 Cb 0.34 -0.20 0.08 0.00 -2.42 0.00 0.00 31.31 29.11 1i4h n TRP 63 CO 0.00 0.00 0.00 0.71 -2.02 0.00 0.00 177.69 176.38 1i4h s TYR 64 N -0.40 2.23 0.12 -5.99 1.51 -1.26 -4.82 117.35 108.74 1i4h s TYR 64 Ca 0.00 1.59 0.00 0.00 -1.01 0.00 0.00 57.07 57.65 1i4h s TYR 64 Cb 0.00 -3.38 0.00 0.00 -0.11 0.00 0.00 41.96 38.47 1i4h s TYR 64 CO 0.00 -2.32 0.00 0.09 -1.11 0.00 0.00 175.55 172.21 1i4h n ASN 65 N -2.58 0.80 -4.97 2.29 3.02 0.12 -4.60 115.26 109.33 1i4h n ASN 65 Ca 0.13 0.19 -0.21 0.00 -0.03 0.00 0.00 54.58 54.65 1i4h n ASN 65 Cb 0.51 -0.18 -0.01 0.00 -0.61 0.00 0.00 39.78 39.48 1i4h n ASN 65 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1i4h s ASP 66 N -5.74 6.17 -0.08 6.41 -0.00 -1.12 -0.92 116.67 121.39 1i4h s ASP 66 Ca 0.00 0.02 -0.01 0.00 -0.00 0.00 0.00 52.55 52.56 1i4h s ASP 66 Cb 0.00 -1.63 0.03 0.00 -0.00 0.00 0.00 42.92 41.31 1i4h s ASP 66 CO 0.00 -0.25 -0.02 -0.22 -0.00 0.00 0.00 175.17 174.67 1i4h s LEU 67 N -4.11 0.81 -0.31 1.23 2.96 0.97 -1.74 118.68 118.50 1i4h s LEU 67 Ca 0.39 -0.15 -0.09 0.00 -0.22 0.00 0.00 54.13 54.07 1i4h s LEU 67 Cb -0.09 -0.55 -0.00 0.00 0.50 0.00 0.00 46.19 46.04 1i4h s LEU 67 CO 0.31 -0.16 0.13 -0.22 -1.32 0.00 0.00 176.35 175.09 1i4h s LEU 68 N 1.81 4.04 -0.22 -0.68 2.96 -0.33 0.38 118.68 126.64 1i4h s LEU 68 Ca 0.04 -0.59 -0.12 0.00 -0.22 0.00 0.00 54.13 53.24 1i4h s LEU 68 Cb -0.12 -1.97 -0.05 0.00 0.50 0.00 0.00 46.19 44.55 1i4h s LEU 68 CO -0.06 -0.20 0.21 -0.69 -1.32 0.00 0.00 176.35 174.30 1i4h s VAL 69 N 1.58 5.33 -0.05 1.68 1.01 -1.00 -2.00 120.40 126.95 1i4h s VAL 69 Ca 0.04 0.32 -0.12 0.00 0.00 0.00 0.00 61.98 62.22 1i4h s VAL 69 Cb -0.17 -3.55 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 1i4h s VAL 69 CO 0.05 0.34 0.30 -0.62 0.00 0.00 0.00 175.10 175.17 1i4h s ASP 70 N 0.90 6.63 0.44 3.32 2.15 0.30 -2.66 116.67 127.75 1i4h s ASP 70 Ca 0.11 0.76 0.03 0.00 0.43 0.00 0.00 52.55 53.88 1i4h s ASP 70 Cb -0.13 -2.18 -0.03 0.00 -0.30 0.00 0.00 42.92 40.28 1i4h s ASP 70 CO 0.04 0.35 0.05 -0.36 -0.17 0.00 0.00 175.17 175.09 1i4h s PHE 71 N -1.02 1.94 0.09 -5.34 0.40 0.61 -2.19 117.98 112.48 1i4h s PHE 71 Ca 0.20 -1.03 -0.15 0.00 -0.60 0.00 0.00 56.93 55.35 1i4h s PHE 71 Cb -0.15 -1.43 -0.10 0.00 0.51 0.00 0.00 43.02 41.85 1i4h s PHE 71 CO 0.09 0.05 1.40 -0.44 0.70 0.00 0.00 175.22 177.02 1i4h h ASP 72 N 1.67 0.73 -5.37 1.36 3.45 -1.78 -3.46 116.42 113.01 1i4h h ASP 72 Ca -0.41 -0.49 -0.21 0.00 0.43 0.00 0.00 57.03 56.35 1i4h h ASP 72 Cb 1.28 -0.21 -0.05 0.00 -0.56 0.00 0.00 39.33 39.80 1i4h h ASP 72 CO 0.69 1.07 -0.03 -0.94 -1.57 0.00 0.00 179.24 178.46 1i4h s SER 73 N -6.55 0.74 0.26 6.45 1.04 -1.26 -5.03 113.70 109.36 1i4h s SER 73 Ca -0.12 -1.45 0.01 0.00 0.48 0.00 0.00 55.95 54.87 1i4h s SER 73 Cb 0.08 0.75 0.35 0.00 0.10 0.00 0.00 66.02 67.30 1i4h s SER 73 CO 0.83 -1.47 1.69 0.50 0.98 0.00 0.00 173.24 175.77 1i4h h LYS 74 N 2.04 0.56 0.03 4.02 1.63 -1.91 -3.14 116.57 119.80 1i4h h LYS 74 Ca -0.30 -0.22 0.03 0.00 -0.85 0.00 0.00 60.65 59.31 1i4h h LYS 74 Cb 1.24 -0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 32.80 1i4h h LYS 74 CO 0.40 0.76 -0.25 -0.44 -3.45 0.00 0.00 179.45 176.47 1i4h h ASP 75 N 0.49 -0.73 -0.94 4.20 3.32 -1.96 -2.33 116.42 118.47 1i4h h ASP 75 Ca 0.07 0.10 0.05 0.00 0.02 0.00 0.00 57.03 57.26 1i4h h ASP 75 Cb 0.69 0.29 -0.06 0.00 0.22 0.00 0.00 39.33 40.48 1i4h h ASP 75 CO 0.05 -0.32 0.61 0.40 -1.72 0.00 0.00 179.24 178.25 1i4h h ILE 76 N -0.40 1.12 -0.25 0.35 2.04 -1.96 -2.65 117.51 115.75 1i4h h ILE 76 Ca 0.05 -0.39 0.05 0.00 1.00 0.00 0.00 64.86 65.57 1i4h h ILE 76 Cb 0.47 -0.12 -0.05 0.00 -0.74 0.00 0.00 36.82 36.38 1i4h h ILE 76 CO -0.20 0.21 -0.08 0.58 0.00 0.00 0.00 178.15 178.66 1i4h h VAL 77 N 1.14 0.71 -0.70 1.67 2.07 -1.38 -1.82 116.25 117.94 1i4h h VAL 77 Ca 0.39 0.00 0.20 0.00 0.82 0.00 0.00 66.70 68.11 1i4h h VAL 77 Cb 0.07 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 1i4h h VAL 77 CO -0.14 0.00 0.61 0.44 0.02 0.00 0.00 177.57 178.50 1i4h h ASP 78 N -0.03 0.00 0.58 0.57 3.45 -1.08 0.17 116.42 120.08 1i4h h ASP 78 Ca 0.13 0.00 -0.12 0.00 0.43 0.00 0.00 57.03 57.46 1i4h h ASP 78 Cb 0.22 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 38.97 1i4h h ASP 78 CO -0.27 0.00 -0.58 0.11 -1.57 0.00 0.00 179.24 176.93 1i4h h LYS 79 N 0.00 0.00 0.00 3.56 1.57 -1.34 -3.32 116.57 117.05 1i4h h LYS 79 Ca 0.33 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.08 1i4h h LYS 79 Cb 1.55 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.85 1i4h h LYS 79 CO -0.00 0.58 -1.52 0.66 -0.57 0.00 0.00 179.45 178.59 1i4h n TYR 80 N -3.85 0.00 -1.63 -1.35 4.02 -0.49 -4.82 117.16 109.05 1i4h n TYR 80 Ca -0.01 0.00 -0.48 0.00 -0.01 0.00 0.00 57.90 57.40 1i4h n TYR 80 Cb 0.58 -0.28 -0.05 0.00 -0.02 0.00 0.00 39.34 39.57 1i4h n TYR 80 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1i4h n LYS 81 N -1.95 1.95 0.00 -0.72 4.81 0.46 -0.96 118.16 121.75 1i4h n LYS 81 Ca -0.04 0.67 0.00 0.00 -0.87 0.00 0.00 58.31 58.07 1i4h n LYS 81 Cb 0.36 -2.69 0.00 0.00 0.02 0.00 0.00 35.03 32.72 1i4h n LYS 81 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1i4h n GLY 82 N 4.98 3.01 3.80 3.14 0.00 -0.44 -4.94 105.19 114.75 1i4h n GLY 82 Ca 0.27 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.00 1i4h n GLY 82 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i4h s LYS 83 N -0.25 1.68 -0.26 1.61 -0.14 -0.13 -4.63 119.74 117.61 1i4h s LYS 83 Ca 0.00 0.45 -0.20 0.00 -1.36 0.00 0.00 55.97 54.86 1i4h s LYS 83 Cb 0.00 -1.89 -0.02 0.00 -1.68 0.00 0.00 37.83 34.24 1i4h s LYS 83 CO 0.00 -1.86 0.62 0.21 -0.76 0.00 0.00 175.35 173.56 1i4h s LYS 84 N -5.24 4.08 0.23 1.68 2.47 -1.26 -4.20 119.74 117.49 1i4h s LYS 84 Ca 0.62 0.50 0.07 0.00 -1.56 0.00 0.00 55.97 55.60 1i4h s LYS 84 Cb -0.14 -3.66 -0.05 0.00 -1.46 0.00 0.00 37.83 32.51 1i4h s LYS 84 CO 0.53 -0.44 -0.11 0.14 0.16 0.00 0.00 175.35 175.64 1i4h s VAL 85 N 2.51 1.66 0.00 4.02 -7.23 0.34 -0.71 120.40 121.00 1i4h s VAL 85 Ca 0.26 -2.17 0.02 0.00 -1.81 0.00 0.00 61.98 58.28 1i4h s VAL 85 Cb -0.15 -2.18 -0.03 0.00 0.56 0.00 0.00 36.38 34.57 1i4h s VAL 85 CO 0.09 -0.50 -0.04 -1.81 -0.31 0.00 0.00 175.10 172.54 1i4h s ASP 86 N -3.35 4.86 -0.03 4.85 1.01 -0.57 -0.43 116.67 123.01 1i4h s ASP 86 Ca 0.25 -0.08 0.06 0.00 0.71 0.00 0.00 52.55 53.48 1i4h s ASP 86 Cb 0.01 -1.20 -0.01 0.00 1.01 0.00 0.00 42.92 42.73 1i4h s ASP 86 CO 0.08 0.28 -0.20 -0.76 0.21 0.00 0.00 175.17 174.78 1i4h s LEU 87 N -1.49 2.01 -0.27 1.23 1.02 -0.43 -1.89 118.68 118.86 1i4h s LEU 87 Ca 0.18 -0.38 -0.00 0.00 0.02 0.00 0.00 54.13 53.95 1i4h s LEU 87 Cb -0.11 -1.07 0.16 0.00 0.02 0.00 0.00 46.19 45.19 1i4h s LEU 87 CO 0.09 0.23 0.47 -0.47 0.02 0.00 0.00 176.35 176.69 1i4h s TYR 88 N -0.33 -1.20 -0.05 0.29 6.04 0.57 -2.01 117.35 120.67 1i4h s TYR 88 Ca 0.04 1.00 -0.30 0.00 0.04 0.00 0.00 57.07 57.85 1i4h s TYR 88 Cb -0.09 0.17 0.11 0.00 -1.04 0.00 0.00 41.96 41.11 1i4h s TYR 88 CO 0.00 -0.86 1.34 0.20 -1.54 0.00 0.00 175.55 174.69 1i4h s GLY 89 N 2.66 -0.27 -0.05 8.97 0.00 -0.93 -4.44 107.32 113.26 1i4h s GLY 89 Ca 0.14 0.36 -0.17 0.00 0.00 0.00 0.00 44.72 45.05 1i4h s GLY 89 CO -0.21 3.88 0.47 0.00 0.00 0.00 0.00 173.10 177.23 1i4h s ALA 90 N -2.09 3.57 0.33 3.20 0.00 -1.26 -0.86 121.76 124.65 1i4h s ALA 90 Ca 0.25 -0.16 0.10 0.00 0.00 0.00 0.00 51.96 52.14 1i4h s ALA 90 Cb 0.02 -2.55 -0.06 0.00 0.00 0.00 0.00 23.12 20.53 1i4h s ALA 90 CO -0.03 0.24 -0.12 1.52 0.00 0.00 0.00 175.76 177.37 1i4h s TYR 91 N -0.26 2.35 0.13 0.00 1.13 -1.26 -4.42 117.35 115.01 1i4h s TYR 91 Ca 0.26 -0.47 -0.06 0.00 -1.41 0.00 0.00 57.07 55.39 1i4h s TYR 91 Cb -0.16 -1.27 -0.02 0.00 -1.10 0.00 0.00 41.96 39.40 1i4h s TYR 91 CO 0.13 0.60 0.17 1.52 -2.51 0.00 0.00 175.55 175.46 1i4h s TYR 92 N -2.61 0.47 -0.01 -3.49 -0.85 0.27 -4.92 117.35 106.21 1i4h s TYR 92 Ca 0.32 -0.87 0.06 0.00 -0.52 0.00 0.00 57.07 56.05 1i4h s TYR 92 Cb 0.01 -0.20 -0.09 0.00 0.38 0.00 0.00 41.96 42.06 1i4h s TYR 92 CO 0.16 -0.59 0.12 0.41 -1.52 0.00 0.00 175.55 174.13 1i4h n GLY 93 N -0.11 -0.26 3.70 5.49 0.00 -1.26 0.46 105.19 113.21 1i4h n GLY 93 Ca -0.09 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 1i4h n GLY 93 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1i4h s TYR 94 N -2.38 2.86 -1.47 1.61 5.04 -1.26 -2.72 117.35 119.02 1i4h s TYR 94 Ca -0.02 0.64 -0.12 0.00 -2.44 0.00 0.00 57.07 55.13 1i4h s TYR 94 Cb 0.04 -3.83 0.06 0.00 0.35 0.00 0.00 41.96 38.57 1i4h s TYR 94 CO 0.24 -3.15 1.05 1.04 -1.34 0.00 0.00 175.55 173.39 1i4h n GLN 95 N 4.73 -6.36 -5.05 4.97 6.02 -1.26 -4.68 117.38 115.75 1i4h n GLN 95 Ca 0.14 0.68 -0.30 0.00 -0.01 0.00 0.00 57.00 57.51 1i4h n GLN 95 Cb 0.41 -5.62 -0.17 0.00 1.02 0.00 0.00 30.24 25.88 1i4h n GLN 95 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1i4h n ALA 97 N 3.48 0.00 0.00 0.00 0.00 -1.26 -4.81 120.51 117.91 1i4h n ALA 97 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1i4h n ALA 97 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1i4h n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i4h n GLY 98 N 0.00 1.20 0.00 0.00 0.00 -1.26 -4.94 105.19 100.19 1i4h n GLY 98 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1i4h n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i4h n GLY 99 N -0.07 5.22 3.59 -0.02 0.00 -1.26 -4.89 105.19 107.76 1i4h n GLY 99 Ca 0.00 -1.57 -0.50 0.00 0.00 0.00 0.00 46.02 43.95 1i4h n GLY 99 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1i4h n THR 100 N 0.00 0.36 -1.62 2.61 -1.04 -1.26 -4.81 114.28 108.53 1i4h n THR 100 Ca 0.00 -0.20 -0.53 0.00 -2.04 0.00 0.00 64.05 61.28 1i4h n THR 100 Cb 0.00 -1.76 -0.06 0.00 -1.82 0.00 0.00 70.33 66.69 1i4h n THR 100 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1i4h n PRO 101 N 7.30 1.18 -0.80 -2.82 -0.04 -1.26 -1.47 135.00 137.09 1i4h n PRO 101 Ca 0.31 0.43 0.00 0.00 -0.04 0.00 0.00 63.50 64.20 1i4h n PRO 101 Cb 0.26 -2.08 0.00 0.00 -0.04 0.00 0.00 33.50 31.64 1i4h n PRO 101 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1i4h n ASN 102 N 3.24 -0.62 -0.89 3.54 4.13 -1.26 -4.81 115.26 118.59 1i4h n ASN 102 Ca 0.20 0.00 0.05 0.00 1.68 0.00 0.00 54.58 56.51 1i4h n ASN 102 Cb 0.18 -1.26 0.09 0.00 -1.54 0.00 0.00 39.78 37.24 1i4h n ASN 102 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 1i4h n LYS 103 N -1.88 0.63 -4.69 3.52 5.02 -0.54 -4.89 118.16 115.33 1i4h n LYS 103 Ca 0.00 -2.30 -0.34 0.00 -2.02 0.00 0.00 58.31 53.66 1i4h n LYS 103 Cb 0.03 -0.75 -0.12 0.00 -0.02 0.00 0.00 35.03 34.18 1i4h n LYS 103 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1i4h s THR 104 N -1.31 3.55 0.04 -0.18 2.01 -1.20 0.11 115.64 118.65 1i4h s THR 104 Ca 0.29 -0.54 0.05 0.00 0.31 0.00 0.00 61.69 61.81 1i4h s THR 104 Cb 0.31 -2.44 -0.03 0.00 0.01 0.00 0.00 72.50 70.34 1i4h s THR 104 CO -0.09 0.59 -0.11 0.00 -0.69 0.00 0.00 174.62 174.32 1i4h s ALA 105 N -0.74 2.86 0.23 7.40 0.00 -0.71 -4.71 121.76 126.08 1i4h s ALA 105 Ca 0.11 -1.13 0.08 0.00 0.00 0.00 0.00 51.96 51.03 1i4h s ALA 105 Cb -0.11 -0.94 -0.04 0.00 0.00 0.00 0.00 23.12 22.02 1i4h s ALA 105 CO 0.01 0.61 0.04 0.00 0.00 0.00 0.00 175.76 176.42 1i4h s MET 107 N -3.41 0.73 -0.08 0.00 0.00 -0.85 -0.57 119.30 115.12 1i4h s MET 107 Ca 0.30 0.91 -0.14 0.00 0.00 0.00 0.00 55.69 56.76 1i4h s MET 107 Cb -0.08 0.34 -0.05 0.00 0.00 0.00 0.00 34.83 35.04 1i4h s MET 107 CO 0.20 -0.09 0.33 0.71 0.00 0.00 0.00 175.02 176.18 1i4h s TYR 108 N 0.48 3.60 0.00 4.11 1.51 -1.26 -0.54 117.35 125.25 1i4h s TYR 108 Ca -0.00 0.78 0.00 0.00 -1.01 0.00 0.00 57.07 56.84 1i4h s TYR 108 Cb -0.05 -2.28 0.00 0.00 -0.11 0.00 0.00 41.96 39.52 1i4h s TYR 108 CO -0.03 0.48 0.00 0.41 -1.11 0.00 0.00 175.55 175.30 1i4h n GLY 109 N 2.51 1.83 2.15 0.71 0.00 -0.93 -4.60 105.19 106.86 1i4h n GLY 109 Ca -0.13 -0.42 -0.06 0.00 0.00 0.00 0.00 46.02 45.41 1i4h n GLY 109 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i4h n GLY 110 N 0.00 0.50 3.15 -0.02 0.00 -1.26 -4.89 105.19 102.66 1i4h n GLY 110 Ca 0.00 -0.70 -0.28 0.00 0.00 0.00 0.00 46.02 45.03 1i4h n GLY 110 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i4h s VAL 111 N -2.27 1.63 0.13 1.61 1.01 -1.26 -0.32 120.40 120.94 1i4h s VAL 111 Ca 0.00 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.23 1i4h s VAL 111 Cb 0.00 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 1i4h s VAL 111 CO 0.00 0.46 -0.10 0.42 0.00 0.00 0.00 175.10 175.88 1i4h s THR 112 N 0.31 1.13 0.14 3.92 -4.23 -0.79 -4.94 115.64 111.18 1i4h s THR 112 Ca -0.12 -1.96 -0.30 0.00 -1.18 0.00 0.00 61.69 58.12 1i4h s THR 112 Cb -0.15 -1.74 -0.08 0.00 1.34 0.00 0.00 72.50 71.87 1i4h s THR 112 CO 0.05 -0.70 1.25 -0.76 -0.54 0.00 0.00 174.62 173.92 1i4h s LEU 113 N -2.99 4.41 -0.00 4.79 1.43 -1.26 -1.51 118.68 123.54 1i4h s LEU 113 Ca 0.14 2.22 -0.01 0.00 -1.03 0.00 0.00 54.13 55.46 1i4h s LEU 113 Cb 0.01 -3.60 -0.00 0.00 0.03 0.00 0.00 46.19 42.63 1i4h s LEU 113 CO 0.00 -0.47 0.51 -0.74 0.23 0.00 0.00 176.35 175.88 1i4h h HIS 114 N 5.92 -0.02 -0.99 0.29 -0.00 -1.22 -3.42 115.15 115.70 1i4h h HIS 114 Ca -0.43 -0.00 -0.86 0.00 -0.00 0.00 0.00 60.37 59.07 1i4h h HIS 114 Cb 1.21 0.01 0.01 0.00 -0.00 0.00 0.00 27.41 28.64 1i4h h HIS 114 CO 0.64 -0.01 0.63 -0.25 -0.00 0.00 0.00 177.93 178.93 1i4h n ASP 115 N -2.12 1.09 -2.74 3.26 10.43 -1.26 -2.08 116.55 123.13 1i4h n ASP 115 Ca -0.00 1.17 -0.18 0.00 2.57 0.00 0.00 54.79 58.35 1i4h n ASP 115 Cb 0.01 -0.87 0.05 0.00 1.84 0.00 0.00 41.12 42.15 1i4h n ASP 115 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 1i4h n ASN 116 N 3.73 -5.26 -0.03 -2.24 3.02 -1.26 -4.92 115.26 108.30 1i4h n ASN 116 Ca 0.30 -0.37 0.01 0.00 -0.03 0.00 0.00 54.58 54.48 1i4h n ASN 116 Cb -0.05 -3.90 0.01 0.00 -0.61 0.00 0.00 39.78 35.24 1i4h n ASN 116 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1i4h n ASN 117 N -1.82 1.38 -4.81 6.41 5.15 -0.88 -4.90 115.26 115.79 1i4h n ASN 117 Ca -0.01 -1.82 -0.37 0.00 -0.60 0.00 0.00 54.58 51.79 1i4h n ASN 117 Cb 0.55 -0.05 -0.06 0.00 -0.53 0.00 0.00 39.78 39.70 1i4h n ASN 117 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1i4h s ARG 118 N -0.84 4.24 -0.11 1.20 1.81 -1.26 -1.45 118.95 122.53 1i4h s ARG 118 Ca 0.03 0.81 -0.01 0.00 -1.72 0.00 0.00 55.73 54.83 1i4h s ARG 118 Cb 0.02 -3.04 -0.03 0.00 -0.45 0.00 0.00 34.95 31.46 1i4h s ARG 118 CO 0.00 0.50 -0.06 -0.51 -0.68 0.00 0.00 175.30 174.55 1i4h s LEU 119 N -1.62 3.15 0.32 2.53 1.43 -0.78 -4.79 118.68 118.92 1i4h s LEU 119 Ca 0.37 -0.10 0.10 0.00 -1.03 0.00 0.00 54.13 53.47 1i4h s LEU 119 Cb -0.18 -1.72 0.95 0.00 0.03 0.00 0.00 46.19 45.27 1i4h s LEU 119 CO 0.21 0.26 1.64 0.74 0.23 0.00 0.00 176.35 179.42 1i4h h THR 120 N 4.77 0.24 -3.97 5.49 2.02 -1.98 -3.40 112.91 116.09 1i4h h THR 120 Ca -0.38 -0.07 -0.34 0.00 0.77 0.00 0.00 66.41 66.38 1i4h h THR 120 Cb 1.19 0.01 -0.23 0.00 -1.74 0.00 0.00 68.15 67.38 1i4h h THR 120 CO 0.57 0.04 -0.76 -1.61 0.37 0.00 0.00 175.52 174.13 1i4h s GLU 121 N -5.78 0.65 -0.04 6.66 2.02 -1.26 -5.12 118.70 115.83 1i4h s GLU 121 Ca -0.11 -0.73 -0.32 0.00 0.02 0.00 0.00 54.97 53.82 1i4h s GLU 121 Cb 0.29 -0.54 -0.10 0.00 0.10 0.00 0.00 34.13 33.87 1i4h s GLU 121 CO 0.78 0.12 1.93 -1.91 0.02 0.00 0.00 175.26 176.20 1i4h n GLU 122 N 1.67 2.45 -2.93 1.61 2.13 -1.26 -4.91 120.64 119.40 1i4h n GLU 122 Ca -0.20 0.89 -0.41 0.00 0.66 0.00 0.00 57.16 58.10 1i4h n GLU 122 Cb 0.55 -2.81 -0.04 0.00 0.27 0.00 0.00 31.44 29.41 1i4h n GLU 122 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1i4h s LYS 123 N 4.32 4.36 -0.31 5.31 2.47 0.08 -4.90 119.74 131.08 1i4h s LYS 123 Ca 0.92 0.99 -0.13 0.00 -1.56 0.00 0.00 55.97 56.19 1i4h s LYS 123 Cb -0.58 -3.53 -0.03 0.00 -1.46 0.00 0.00 37.83 32.23 1i4h s LYS 123 CO 0.48 -0.18 0.27 0.15 0.16 0.00 0.00 175.35 176.23 1i4h s LYS 124 N 1.63 3.75 -0.32 4.03 1.02 -1.26 -1.24 119.74 127.36 1i4h s LYS 124 Ca 0.39 -0.37 -0.24 0.00 0.02 0.00 0.00 55.97 55.77 1i4h s LYS 124 Cb -0.17 -3.73 0.00 0.00 -0.52 0.00 0.00 37.83 33.41 1i4h s LYS 124 CO 0.15 -0.34 0.81 0.08 -0.92 0.00 0.00 175.35 175.13 1i4h s VAL 125 N 1.86 4.76 0.25 3.17 1.01 0.34 -5.00 120.40 126.79 1i4h s VAL 125 Ca 0.09 1.17 -0.31 0.00 0.00 0.00 0.00 61.98 62.93 1i4h s VAL 125 Cb -0.16 -4.18 -0.13 0.00 0.00 0.00 0.00 36.38 31.90 1i4h s VAL 125 CO 0.11 -0.31 1.48 -2.65 0.00 0.00 0.00 175.10 173.73 1i4h n PRO 126 N 6.31 2.28 -4.36 2.72 -0.02 -1.26 -4.57 135.00 136.09 1i4h n PRO 126 Ca 0.04 0.81 -0.29 0.00 -2.02 0.00 0.00 63.50 62.05 1i4h n PRO 126 Cb 0.48 -2.52 -0.17 0.00 -0.02 0.00 0.00 33.50 31.28 1i4h n PRO 126 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1i4h s ILE 127 N 0.02 1.49 -0.21 4.25 1.01 -1.26 -0.80 121.20 125.70 1i4h s ILE 127 Ca 0.67 -0.63 -0.06 0.00 0.00 0.00 0.00 60.65 60.64 1i4h s ILE 127 Cb -0.60 -1.37 -0.03 0.00 0.01 0.00 0.00 42.46 40.47 1i4h s ILE 127 CO 0.48 0.44 0.03 0.20 0.00 0.00 0.00 174.94 176.10 1i4h s ASN 128 N 1.10 5.08 -0.05 3.58 0.01 -0.02 -4.51 114.94 120.12 1i4h s ASN 128 Ca -0.04 -0.15 0.03 0.00 -0.71 0.00 0.00 52.86 52.00 1i4h s ASN 128 Cb -0.14 -1.88 0.00 0.00 0.41 0.00 0.00 41.25 39.64 1i4h s ASN 128 CO -0.03 0.06 -0.14 -0.22 -1.51 0.00 0.00 177.10 175.25 1i4h s LEU 129 N 1.04 1.83 0.01 0.60 0.20 -1.26 -0.73 118.68 120.37 1i4h s LEU 129 Ca 0.03 -0.31 0.08 0.00 0.69 0.00 0.00 54.13 54.62 1i4h s LEU 129 Cb -0.14 -0.85 -0.02 0.00 -0.43 0.00 0.00 46.19 44.74 1i4h s LEU 129 CO 0.02 0.11 -0.24 0.26 -0.29 0.00 0.00 176.35 176.21 1i4h s TRP 130 N 0.23 2.09 -0.27 5.38 0.51 -0.48 -1.11 118.94 125.30 1i4h s TRP 130 Ca -0.07 -0.40 0.01 0.00 -2.12 0.00 0.00 56.10 53.53 1i4h s TRP 130 Cb -0.12 -1.30 0.08 0.00 -0.81 0.00 0.00 33.47 31.31 1i4h s TRP 130 CO 0.02 0.03 0.00 -1.17 -0.51 0.00 0.00 176.95 175.33 1i4h s LEU 131 N -0.85 2.78 -1.52 2.99 2.96 -0.16 -0.42 118.68 124.47 1i4h s LEU 131 Ca 0.09 -1.42 -0.13 0.00 -0.22 0.00 0.00 54.13 52.46 1i4h s LEU 131 Cb -0.09 -1.15 0.08 0.00 0.50 0.00 0.00 46.19 45.53 1i4h s LEU 131 CO 0.00 -0.30 0.96 0.47 -1.32 0.00 0.00 176.35 176.16 1i4h n ASP 132 N 4.66 -4.51 0.00 3.68 8.00 0.32 -1.92 116.55 126.78 1i4h n ASP 132 Ca -0.07 -0.79 0.00 0.00 0.71 0.00 0.00 54.79 54.64 1i4h n ASP 132 Cb 0.43 -3.87 0.00 0.00 -0.02 0.00 0.00 41.12 37.66 1i4h n ASP 132 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1i4h n GLY 133 N -1.69 2.38 3.71 0.44 0.00 -1.26 -5.02 105.19 103.75 1i4h n GLY 133 Ca 0.02 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 1i4h n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i4h s LYS 134 N 0.00 4.33 0.48 1.61 1.02 -0.81 -4.91 119.74 121.46 1i4h s LYS 134 Ca 0.00 1.98 -0.23 0.00 0.02 0.00 0.00 55.97 57.74 1i4h s LYS 134 Cb 0.00 -3.36 -0.07 0.00 -0.52 0.00 0.00 37.83 33.88 1i4h s LYS 134 CO 0.00 -0.44 1.22 -1.14 -0.92 0.00 0.00 175.35 174.07 1i4h s GLN 135 N 1.46 3.62 -0.05 1.68 0.74 -1.26 -0.99 119.66 124.86 1i4h s GLN 135 Ca 0.63 1.91 -0.00 0.00 0.05 0.00 0.00 55.36 57.95 1i4h s GLN 135 Cb -0.34 -2.39 0.03 0.00 1.10 0.00 0.00 33.01 31.41 1i4h s GLN 135 CO 0.29 -0.70 -0.02 -0.80 -0.55 0.00 0.00 175.29 173.51 1i4h s ASN 136 N -1.23 1.09 0.18 6.67 0.02 -0.26 -4.90 114.94 116.51 1i4h s ASN 136 Ca 0.65 -0.09 -0.30 0.00 -1.02 0.00 0.00 52.86 52.10 1i4h s ASN 136 Cb -0.32 -0.40 -0.08 0.00 0.02 0.00 0.00 41.25 40.47 1i4h s ASN 136 CO 0.39 -0.12 1.26 -0.89 0.02 0.00 0.00 177.10 177.76 1i4h s THR 137 N 1.35 3.39 -0.11 1.60 2.01 -1.26 -4.12 115.64 118.50 1i4h s THR 137 Ca -0.05 1.14 0.03 0.00 0.31 0.00 0.00 61.69 63.13 1i4h s THR 137 Cb -0.13 -3.73 0.00 0.00 0.01 0.00 0.00 72.50 68.65 1i4h s THR 137 CO -0.02 0.17 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.16 1i4h s VAL 138 N 0.14 2.11 0.37 3.82 1.01 -1.26 -5.07 120.40 121.53 1i4h s VAL 138 Ca 0.56 -0.99 -0.26 0.00 0.00 0.00 0.00 61.98 61.28 1i4h s VAL 138 Cb -0.35 -1.82 -0.11 0.00 0.00 0.00 0.00 36.38 34.10 1i4h s VAL 138 CO 0.37 0.55 1.16 -2.65 0.00 0.00 0.00 175.10 174.54 1i4h n PRO 139 N 3.70 1.75 0.22 2.72 -0.02 -1.26 -4.80 135.00 137.30 1i4h n PRO 139 Ca -0.19 0.62 0.08 0.00 -2.02 0.00 0.00 63.50 61.99 1i4h n PRO 139 Cb 0.53 -2.19 0.49 0.00 -0.02 0.00 0.00 33.50 32.31 1i4h n PRO 139 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1i4h h LEU 140 N 2.07 0.00 0.00 2.45 3.38 -1.97 -2.90 115.31 118.34 1i4h h LEU 140 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1i4h h LEU 140 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 1i4h h LEU 140 CO 0.60 0.26 0.00 -1.84 0.09 0.00 0.00 178.44 177.55 1i4h n GLU 141 N -3.61 0.61 -0.15 1.13 -0.00 -1.26 -3.96 120.64 113.39 1i4h n GLU 141 Ca -0.01 0.01 -0.03 0.00 -0.00 0.00 0.00 57.16 57.14 1i4h n GLU 141 Cb 0.39 -1.50 0.06 0.00 -0.00 0.00 0.00 31.44 30.39 1i4h n GLU 141 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.13 178.28 1i4h h THR 142 N 0.00 0.73 -3.36 3.84 2.02 -1.87 -3.41 112.91 110.87 1i4h h THR 142 Ca 0.00 -0.08 -0.51 0.00 0.77 0.00 0.00 66.41 66.59 1i4h h THR 142 Cb 0.16 0.48 -0.34 0.00 -1.74 0.00 0.00 68.15 66.71 1i4h h THR 142 CO 0.00 0.04 -0.81 -0.69 0.37 0.00 0.00 175.52 174.43 1i4h s VAL 143 N -6.14 1.06 0.09 3.16 1.01 -1.25 -4.77 120.40 113.55 1i4h s VAL 143 Ca -0.13 -0.40 -0.18 0.00 0.00 0.00 0.00 61.98 61.26 1i4h s VAL 143 Cb 0.15 -1.01 0.04 0.00 0.00 0.00 0.00 36.38 35.57 1i4h s VAL 143 CO 0.72 0.35 0.44 -1.59 0.00 0.00 0.00 175.10 175.02 1i4h s LYS 144 N 0.96 1.03 0.18 2.72 -2.85 -1.26 -0.50 119.74 120.02 1i4h s LYS 144 Ca -0.09 -0.50 -0.13 0.00 -1.00 0.00 0.00 55.97 54.25 1i4h s LYS 144 Cb -0.15 0.46 0.01 0.00 -2.06 0.00 0.00 37.83 36.09 1i4h s LYS 144 CO 0.00 -0.39 0.40 -0.08 0.10 0.00 0.00 175.35 175.38 1i4h s THR 145 N -3.14 0.05 -0.80 3.79 -1.32 -0.37 -4.97 115.64 108.88 1i4h s THR 145 Ca -0.01 -1.09 0.09 0.00 -1.21 0.00 0.00 61.69 59.47 1i4h s THR 145 Cb 0.00 -1.70 0.24 0.00 -1.51 0.00 0.00 72.50 69.53 1i4h s THR 145 CO -0.07 -0.22 1.18 0.59 -2.21 0.00 0.00 174.62 173.89 1i4h n ASN 146 N -0.27 2.69 -4.70 8.08 4.13 -1.26 -0.74 115.26 123.18 1i4h n ASN 146 Ca -0.09 -1.95 -0.35 0.00 1.68 0.00 0.00 54.58 53.87 1i4h n ASN 146 Cb 0.63 -0.18 -0.09 0.00 -1.54 0.00 0.00 39.78 38.60 1i4h n ASN 146 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1i4h s LYS 147 N -0.98 3.13 0.02 3.52 1.02 -1.25 -1.87 119.74 123.32 1i4h s LYS 147 Ca 0.19 -0.37 -0.23 0.00 0.02 0.00 0.00 55.97 55.58 1i4h s LYS 147 Cb 0.10 -2.88 -0.17 0.00 -0.52 0.00 0.00 37.83 34.36 1i4h s LYS 147 CO 0.13 0.67 1.35 0.87 -0.92 0.00 0.00 175.35 177.45 1i4h h LYS 148 N 5.27 0.16 -4.94 1.68 1.57 -1.56 -3.40 116.57 115.37 1i4h h LYS 148 Ca -0.50 -0.08 -0.65 0.00 -1.87 0.00 0.00 60.65 57.55 1i4h h LYS 148 Cb 1.20 -0.00 -0.23 0.00 0.08 0.00 0.00 32.23 33.27 1i4h h LYS 148 CO 0.56 0.56 -0.63 -0.80 -0.57 0.00 0.00 179.45 178.56 1i4h s ASN 149 N -5.83 5.05 0.02 0.86 0.01 -1.26 -1.21 114.94 112.58 1i4h s ASN 149 Ca -0.15 -0.28 0.08 0.00 -0.71 0.00 0.00 52.86 51.81 1i4h s ASN 149 Cb 0.04 -1.90 -0.02 0.00 0.41 0.00 0.00 41.25 39.77 1i4h s ASN 149 CO 0.71 -0.05 -0.25 0.54 -1.51 0.00 0.00 177.10 176.53 1i4h s VAL 150 N 1.59 2.02 0.43 1.60 0.11 -0.45 -4.94 120.40 120.76 1i4h s VAL 150 Ca 0.06 -1.25 -0.23 0.00 -2.93 0.00 0.00 61.98 57.64 1i4h s VAL 150 Cb -0.15 -1.71 -0.09 0.00 -1.53 0.00 0.00 36.38 32.90 1i4h s VAL 150 CO 0.03 0.42 1.06 0.42 -3.33 0.00 0.00 175.10 173.69 1i4h s THR 151 N -0.72 3.68 0.41 5.04 -4.23 -1.26 -1.17 115.64 117.39 1i4h s THR 151 Ca 0.10 1.21 0.08 0.00 -1.18 0.00 0.00 61.69 61.91 1i4h s THR 151 Cb -0.10 -3.58 0.23 0.00 1.34 0.00 0.00 72.50 70.39 1i4h s THR 151 CO 0.01 -0.07 2.02 0.58 -0.54 0.00 0.00 174.62 176.62 1i4h h VAL 152 N 1.96 1.12 -0.69 2.29 2.07 -1.67 -2.69 116.25 118.64 1i4h h VAL 152 Ca -0.49 -0.36 0.12 0.00 0.82 0.00 0.00 66.70 66.80 1i4h h VAL 152 Cb 1.22 0.77 -0.09 0.00 -1.52 0.00 0.00 31.29 31.67 1i4h h VAL 152 CO 0.61 0.14 0.27 -0.61 0.02 0.00 0.00 177.57 177.99 1i4h h GLN 153 N 0.41 0.42 -0.27 1.57 4.15 -1.91 0.25 115.11 119.72 1i4h h GLN 153 Ca 0.10 -0.03 0.02 0.00 0.77 0.00 0.00 58.65 59.51 1i4h h GLN 153 Cb 0.08 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 1i4h h GLN 153 CO -0.01 0.28 0.14 1.49 -1.93 0.00 0.00 178.83 178.80 1i4h h GLU 154 N 0.43 0.29 -0.33 1.69 4.81 -1.69 -0.00 114.58 119.78 1i4h h GLU 154 Ca 0.37 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.47 1i4h h GLU 154 Cb 0.51 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1i4h h GLU 154 CO -0.36 0.19 -0.23 -0.07 -0.73 0.00 0.00 179.01 177.81 1i4h h LEU 155 N 0.30 0.77 -0.35 1.64 3.38 -1.48 -3.15 115.31 116.42 1i4h h LEU 155 Ca 0.11 -0.44 0.01 0.00 0.09 0.00 0.00 57.88 57.65 1i4h h LEU 155 Cb 0.02 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1i4h h LEU 155 CO -0.07 1.05 0.22 -0.78 0.09 0.00 0.00 178.44 178.94 1i4h h ASP 156 N 0.51 0.36 -0.39 -0.43 3.58 -0.24 -0.91 116.42 118.90 1i4h h ASP 156 Ca 0.06 -0.00 0.05 0.00 0.42 0.00 0.00 57.03 57.56 1i4h h ASP 156 Cb 0.79 -0.08 -0.04 0.00 1.72 0.00 0.00 39.33 41.72 1i4h h ASP 156 CO 0.06 0.26 0.13 -0.07 -2.88 0.00 0.00 179.24 176.74 1i4h h LEU 157 N 0.44 0.12 -0.08 2.28 3.38 -1.04 -1.62 115.31 118.79 1i4h h LEU 157 Ca 0.14 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 1i4h h LEU 157 Cb -0.02 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1i4h h LEU 157 CO -0.05 0.10 0.03 1.56 0.09 0.00 0.00 178.44 180.17 1i4h h GLN 158 N 0.28 0.11 -0.21 1.13 4.20 -1.45 -2.65 115.11 116.51 1i4h h GLN 158 Ca 0.18 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.89 1i4h h GLN 158 Cb 0.17 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 1i4h h GLN 158 CO -0.19 0.22 0.10 0.00 -0.67 0.00 0.00 178.83 178.28 1i4h h ALA 159 N 0.88 0.25 0.00 3.87 0.00 -0.99 -2.63 119.26 120.64 1i4h h ALA 159 Ca 0.03 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1i4h h ALA 159 Cb 0.15 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1i4h h ALA 159 CO -0.00 -0.32 -0.12 0.00 0.00 0.00 0.00 179.25 178.81 1i4h h ARG 160 N 0.21 0.00 -0.21 0.00 3.08 -1.30 -1.54 114.38 114.63 1i4h h ARG 160 Ca 0.09 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 60.00 1i4h h ARG 160 Cb 0.03 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1i4h h ARG 160 CO -0.07 0.12 -0.46 -0.09 -1.07 0.00 0.00 179.97 178.41 1i4h h ARG 161 N 0.00 0.53 -0.48 0.04 2.43 -1.11 -0.70 114.38 115.08 1i4h h ARG 161 Ca -0.00 -0.29 -0.13 0.00 -0.81 0.00 0.00 59.98 58.74 1i4h h ARG 161 Cb 0.34 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1i4h h ARG 161 CO 0.02 0.88 -0.23 -0.92 -1.51 0.00 0.00 179.97 178.21 1i4h h TYR 162 N 0.43 1.14 -0.13 2.20 3.20 -1.07 -2.00 116.97 120.74 1i4h h TYR 162 Ca 0.03 -0.28 -0.03 0.00 3.14 0.00 0.00 58.73 61.59 1i4h h TYR 162 Cb 0.97 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.96 1i4h h TYR 162 CO 0.04 1.11 -0.05 -0.07 -1.64 0.00 0.00 178.16 177.54 1i4h h LEU 163 N 0.85 0.18 0.20 2.82 3.38 -0.97 0.86 115.31 122.64 1i4h h LEU 163 Ca 0.11 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1i4h h LEU 163 Cb 0.81 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1i4h h LEU 163 CO 0.07 0.27 -0.10 -0.61 0.09 0.00 0.00 178.44 178.16 1i4h h GLN 164 N 0.19 -0.26 -0.03 1.13 5.75 -0.79 -0.06 115.11 121.04 1i4h h GLN 164 Ca 0.04 0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.59 1i4h h GLN 164 Cb 0.23 0.06 -0.04 0.00 1.07 0.00 0.00 27.48 28.79 1i4h h GLN 164 CO 0.01 0.11 -0.19 0.93 -2.65 0.00 0.00 178.83 177.04 1i4h h GLU 165 N -0.91 -0.28 -0.04 1.69 5.08 -1.24 1.01 114.58 119.87 1i4h h GLU 165 Ca -0.03 0.02 -0.25 0.00 -1.00 0.00 0.00 59.36 58.10 1i4h h GLU 165 Cb 0.49 0.06 0.02 0.00 0.50 0.00 0.00 28.75 29.83 1i4h h GLU 165 CO 0.05 -0.19 -0.97 -0.22 -1.00 0.00 0.00 179.01 176.68 1i4h h LYS 166 N -0.30 0.69 0.00 2.33 3.11 -0.95 -3.38 116.57 118.07 1i4h h LYS 166 Ca 0.07 -0.70 0.00 0.00 -2.81 0.00 0.00 60.65 57.21 1i4h h LYS 166 Cb 0.39 0.19 0.00 0.00 -1.00 0.00 0.00 32.23 31.80 1i4h h LYS 166 CO -0.20 1.28 0.00 0.66 -2.81 0.00 0.00 179.45 178.38 1i4h n TYR 167 N -3.86 0.00 -4.19 1.91 4.02 -0.05 -5.00 117.16 109.99 1i4h n TYR 167 Ca -0.10 -0.47 -0.35 0.00 -0.01 0.00 0.00 57.90 56.97 1i4h n TYR 167 Cb 0.84 -0.05 -0.03 0.00 -0.02 0.00 0.00 39.34 40.09 1i4h n TYR 167 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1i4h n ASN 168 N -0.47 -2.69 -0.26 7.72 3.02 0.35 -4.58 115.26 118.34 1i4h n ASN 168 Ca 0.00 -1.02 0.04 0.00 -0.03 0.00 0.00 54.58 53.57 1i4h n ASN 168 Cb 0.24 -2.74 0.14 0.00 -0.61 0.00 0.00 39.78 36.81 1i4h n ASN 168 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1i4h h LEU 169 N -1.55 -0.49 -3.69 3.41 5.85 -1.65 -2.31 115.31 114.87 1i4h h LEU 169 Ca -0.60 0.21 -0.31 0.00 0.84 0.00 0.00 57.88 58.02 1i4h h LEU 169 Cb 1.38 0.40 -0.18 0.00 0.37 0.00 0.00 40.66 42.63 1i4h h LEU 169 CO 0.76 -0.22 0.30 -1.22 -0.34 0.00 0.00 178.44 177.72 1i4h n TYR 170 N -5.41 2.19 -2.80 1.25 0.53 -1.26 -4.92 117.16 106.73 1i4h n TYR 170 Ca 0.13 -1.55 -0.23 0.00 -1.02 0.00 0.00 57.90 55.23 1i4h n TYR 170 Cb 0.45 -0.71 0.02 0.00 -1.03 0.00 0.00 39.34 38.08 1i4h n TYR 170 CO 0.00 0.00 0.00 -0.80 -1.02 0.00 0.00 176.86 175.04 1i4h s ASN 171 N -1.65 5.61 0.64 7.72 -0.87 -0.87 -4.59 114.94 120.93 1i4h s ASN 171 Ca 0.52 0.24 -0.11 0.00 -1.57 0.00 0.00 52.86 51.94 1i4h s ASN 171 Cb 0.44 -1.34 -0.03 0.00 -0.02 0.00 0.00 41.25 40.30 1i4h s ASN 171 CO 0.08 -0.89 1.04 -0.94 -2.57 0.00 0.00 177.10 173.82 1i4h s SER 172 N -4.30 6.02 0.43 -1.22 1.04 -1.26 -4.65 113.70 109.77 1i4h s SER 172 Ca 0.52 1.33 0.17 0.00 0.48 0.00 0.00 55.95 58.44 1i4h s SER 172 Cb -0.10 -2.32 1.08 0.00 0.10 0.00 0.00 66.02 64.78 1i4h s SER 172 CO 0.39 -0.99 1.92 0.44 0.98 0.00 0.00 173.24 175.98 1i4h h ASP 173 N -0.39 0.36 0.38 7.02 3.32 -1.96 -1.96 116.42 123.19 1i4h h ASP 173 Ca -0.44 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 56.62 1i4h h ASP 173 Cb 1.21 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.69 1i4h h ASP 173 CO 0.62 0.18 -0.36 0.58 -1.72 0.00 0.00 179.24 178.55 1i4h h VAL 174 N 0.38 0.27 -0.01 -1.35 2.07 -1.91 -3.08 116.25 112.63 1i4h h VAL 174 Ca 0.37 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.82 1i4h h VAL 174 Cb 0.89 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1i4h h VAL 174 CO -0.11 0.00 -0.12 0.49 0.02 0.00 0.00 177.57 177.85 1i4h n PHE 175 N -5.46 0.03 -3.17 1.57 3.72 -0.76 -4.74 117.46 108.65 1i4h n PHE 175 Ca -0.10 -1.18 -0.14 0.00 -0.05 0.00 0.00 57.45 55.98 1i4h n PHE 175 Cb 0.37 -0.86 0.07 0.00 -0.94 0.00 0.00 39.48 38.12 1i4h n PHE 175 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1i4h n ASP 176 N 1.80 -2.40 -4.09 4.37 8.00 -1.16 -4.74 116.55 118.33 1i4h n ASP 176 Ca 0.14 -0.52 -0.36 0.00 0.71 0.00 0.00 54.79 54.76 1i4h n ASP 176 Cb 0.63 -4.37 -0.09 0.00 -0.02 0.00 0.00 41.12 37.28 1i4h n ASP 176 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1i4h s GLY 177 N -4.06 2.68 0.06 0.44 0.00 -1.06 -4.63 107.32 100.75 1i4h s GLY 177 Ca 0.04 -3.46 -0.12 0.00 0.00 0.00 0.00 44.72 41.18 1i4h s GLY 177 CO 0.61 1.12 1.09 0.50 0.00 0.00 0.00 173.10 176.43 1i4h h LYS 178 N 6.66 0.51 -6.54 2.90 1.57 -1.85 -3.38 116.57 116.44 1i4h h LYS 178 Ca 0.04 -0.76 -0.53 0.00 -1.87 0.00 0.00 60.65 57.53 1i4h h LYS 178 Cb 0.90 0.27 0.04 0.00 0.08 0.00 0.00 32.23 33.52 1i4h h LYS 178 CO 0.75 1.35 1.03 0.08 -0.57 0.00 0.00 179.45 182.08 1i4h s VAL 179 N -2.80 2.56 -0.15 0.50 1.01 -1.26 -4.40 120.40 115.86 1i4h s VAL 179 Ca -0.08 0.21 0.10 0.00 0.00 0.00 0.00 61.98 62.21 1i4h s VAL 179 Cb 0.06 -3.14 -0.16 0.00 0.00 0.00 0.00 36.38 33.14 1i4h s VAL 179 CO 0.92 0.01 -0.00 0.00 0.00 0.00 0.00 175.10 176.03 1i4h n GLN 180 N 5.02 1.40 -3.97 2.72 1.13 0.14 -4.90 117.38 118.93 1i4h n GLN 180 Ca 0.16 0.02 -0.11 0.00 -1.94 0.00 0.00 57.00 55.13 1i4h n GLN 180 Cb 0.38 -1.36 -0.12 0.00 0.11 0.00 0.00 30.24 29.25 1i4h n GLN 180 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1i4h s ARG 181 N -2.34 0.25 -0.01 -1.09 0.52 -0.72 -0.09 118.95 115.46 1i4h s ARG 181 Ca -0.11 -0.40 -0.25 0.00 -0.52 0.00 0.00 55.73 54.44 1i4h s ARG 181 Cb 0.05 -0.01 0.06 0.00 0.52 0.00 0.00 34.95 35.56 1i4h s ARG 181 CO 0.53 -0.01 0.56 0.20 0.02 0.00 0.00 175.30 176.60 1i4h s GLY 182 N -0.92 -0.45 -0.02 -3.53 0.00 -1.26 -0.71 107.32 100.43 1i4h s GLY 182 Ca -0.09 0.90 0.01 0.00 0.00 0.00 0.00 44.72 45.54 1i4h s GLY 182 CO -0.00 0.59 -0.02 -2.27 0.00 0.00 0.00 173.10 171.39 1i4h s LEU 183 N -1.48 1.57 -0.09 0.66 2.96 -0.52 -1.41 118.68 120.36 1i4h s LEU 183 Ca -0.10 -0.06 0.04 0.00 -0.22 0.00 0.00 54.13 53.79 1i4h s LEU 183 Cb -0.01 -0.24 -0.01 0.00 0.50 0.00 0.00 46.19 46.43 1i4h s LEU 183 CO 0.05 -0.03 -0.21 -0.51 -1.32 0.00 0.00 176.35 174.34 1i4h s ILE 184 N 0.50 2.41 -0.10 6.68 2.07 -0.36 -1.32 121.20 131.08 1i4h s ILE 184 Ca -0.05 -0.92 0.03 0.00 -1.41 0.00 0.00 60.65 58.30 1i4h s ILE 184 Cb -0.08 -1.93 0.01 0.00 0.13 0.00 0.00 42.46 40.58 1i4h s ILE 184 CO -0.01 0.56 -0.19 -0.69 -1.91 0.00 0.00 174.94 172.70 1i4h s VAL 185 N 0.07 1.75 -0.46 4.00 1.01 0.18 -0.23 120.40 126.71 1i4h s VAL 185 Ca -0.09 -0.82 -0.11 0.00 0.00 0.00 0.00 61.98 60.97 1i4h s VAL 185 Cb -0.15 -1.55 0.10 0.00 0.00 0.00 0.00 36.38 34.78 1i4h s VAL 185 CO 0.06 0.49 0.34 -0.36 0.00 0.00 0.00 175.10 175.62 1i4h s PHE 186 N 0.66 3.35 -0.12 5.22 0.40 0.16 -0.41 117.98 127.23 1i4h s PHE 186 Ca -0.13 -1.58 -0.11 0.00 -0.60 0.00 0.00 56.93 54.51 1i4h s PHE 186 Cb -0.16 -3.30 -0.05 0.00 0.51 0.00 0.00 43.02 40.02 1i4h s PHE 186 CO 0.03 -0.92 0.25 0.00 0.70 0.00 0.00 175.22 175.28 1i4h s ALA 187 N 1.44 3.71 0.06 5.36 0.00 -0.46 -2.04 121.76 129.83 1i4h s ALA 187 Ca 0.04 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 51.51 1i4h s ALA 187 Cb -0.25 -2.24 -0.04 0.00 0.00 0.00 0.00 23.12 20.59 1i4h s ALA 187 CO 0.02 0.33 -0.05 0.95 0.00 0.00 0.00 175.76 177.00 1i4h s THR 188 N -0.27 0.39 -0.13 0.00 -4.23 -1.26 -2.25 115.64 107.89 1i4h s THR 188 Ca 0.16 -1.68 -0.04 0.00 -1.18 0.00 0.00 61.69 58.95 1i4h s THR 188 Cb -0.13 -1.35 -0.25 0.00 1.34 0.00 0.00 72.50 72.11 1i4h s THR 188 CO 0.05 -0.85 0.31 -1.54 -0.54 0.00 0.00 174.62 172.05 1i4h n SER 189 N 0.35 1.99 0.10 3.99 3.41 -1.26 -4.11 113.62 118.09 1i4h n SER 189 Ca -0.15 0.18 0.08 0.00 -0.26 0.00 0.00 58.87 58.72 1i4h n SER 189 Cb 0.60 -0.72 0.40 0.00 -0.26 0.00 0.00 64.21 64.23 1i4h n SER 189 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1i4h n THR 190 N -3.41 1.17 -3.98 6.66 -2.24 -1.26 -4.81 114.28 106.41 1i4h n THR 190 Ca -0.33 0.48 -0.09 0.00 -2.27 0.00 0.00 64.05 61.83 1i4h n THR 190 Cb 1.04 -1.42 -0.04 0.00 -2.10 0.00 0.00 70.33 67.81 1i4h n THR 190 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1i4h s GLU 191 N -3.29 1.68 0.52 -0.78 -1.05 -1.26 -5.15 118.70 109.36 1i4h s GLU 191 Ca 0.01 -1.29 -0.20 0.00 -0.15 0.00 0.00 54.97 53.35 1i4h s GLU 191 Cb 0.06 0.50 -0.07 0.00 -0.44 0.00 0.00 34.13 34.18 1i4h s GLU 191 CO 0.22 -0.72 1.08 -2.14 0.95 0.00 0.00 175.26 174.65 1i4h s PRO 192 N -3.76 3.58 0.81 -4.83 0.02 -1.26 -4.41 135.00 125.15 1i4h s PRO 192 Ca 0.21 1.45 -0.11 0.00 0.02 0.00 0.00 61.00 62.57 1i4h s PRO 192 Cb -0.02 -2.05 0.08 0.00 0.02 0.00 0.00 34.50 32.53 1i4h s PRO 192 CO 0.10 -0.63 1.10 -1.54 -0.33 0.00 0.00 177.00 175.70 1i4h s SER 193 N -1.97 4.12 -0.13 2.53 1.04 -1.26 -4.81 113.70 113.22 1i4h s SER 193 Ca 0.69 1.83 0.02 0.00 0.48 0.00 0.00 55.95 58.97 1i4h s SER 193 Cb -0.19 -2.48 0.01 0.00 0.10 0.00 0.00 66.02 63.46 1i4h s SER 193 CO 0.24 -2.28 -0.19 -0.69 0.98 0.00 0.00 173.24 171.30 1i4h s VAL 194 N -2.87 1.83 0.01 5.02 1.01 -0.87 -4.97 120.40 119.56 1i4h s VAL 194 Ca 0.62 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.79 1i4h s VAL 194 Cb -0.18 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.55 1i4h s VAL 194 CO 0.56 0.50 -0.06 0.54 0.00 0.00 0.00 175.10 176.64 1i4h s ASN 195 N 0.96 0.75 -0.04 3.32 2.20 -1.26 0.35 114.94 121.22 1i4h s ASN 195 Ca -0.05 -0.21 0.06 0.00 -0.94 0.00 0.00 52.86 51.72 1i4h s ASN 195 Cb -0.15 -0.05 -0.02 0.00 -2.00 0.00 0.00 41.25 39.03 1i4h s ASN 195 CO -0.03 0.01 -0.22 -0.31 -2.94 0.00 0.00 177.10 173.61 1i4h s TYR 196 N -0.41 2.47 -0.41 1.54 4.12 0.67 -4.95 117.35 120.39 1i4h s TYR 196 Ca -0.00 -0.49 -0.29 0.00 0.02 0.00 0.00 57.07 56.31 1i4h s TYR 196 Cb -0.04 -1.58 0.01 0.00 -1.52 0.00 0.00 41.96 38.83 1i4h s TYR 196 CO -0.00 -0.06 1.36 0.34 0.02 0.00 0.00 175.55 177.21 1i4h s ASP 197 N -0.43 6.42 0.34 2.29 3.68 -1.26 -1.22 116.67 126.47 1i4h s ASP 197 Ca 0.05 0.80 0.17 0.00 2.13 0.00 0.00 52.55 55.69 1i4h s ASP 197 Cb -0.12 -2.54 0.91 0.00 -1.45 0.00 0.00 42.92 39.72 1i4h s ASP 197 CO 0.01 -1.37 1.45 -0.07 0.13 0.00 0.00 175.17 175.32 1i4h h LEU 198 N 11.92 0.00 -2.95 -1.34 3.38 -1.60 0.12 115.31 124.84 1i4h h LEU 198 Ca -0.27 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 1i4h h LEU 198 Cb 1.10 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.78 1i4h h LEU 198 CO 1.09 0.00 -0.52 0.49 0.09 0.00 0.00 178.44 179.59 1i4h n PHE 199 N -2.15 0.00 0.55 1.13 3.01 -1.26 -4.78 117.46 113.96 1i4h n PHE 199 Ca -0.01 -1.17 0.09 0.00 1.01 0.00 0.00 57.45 57.37 1i4h n PHE 199 Cb 0.22 -0.21 0.12 0.00 -0.01 0.00 0.00 39.48 39.60 1i4h n PHE 199 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1i4h n GLY 200 N -0.83 0.92 3.51 1.37 0.00 0.40 -4.68 105.19 105.88 1i4h n GLY 200 Ca 0.15 -0.56 -0.38 0.00 0.00 0.00 0.00 46.02 45.23 1i4h n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i4h n ALA 201 N 1.09 -0.78 -2.79 4.61 0.00 -1.26 -4.95 120.51 116.43 1i4h n ALA 201 Ca 0.13 0.01 -0.35 0.00 0.00 0.00 0.00 53.44 53.22 1i4h n ALA 201 Cb 0.49 -1.90 -0.08 0.00 0.00 0.00 0.00 19.45 17.95 1i4h n ALA 201 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1i4h s GLN 202 N -2.21 3.92 0.43 0.00 -1.52 -1.26 -5.00 119.66 114.01 1i4h s GLN 202 Ca 0.70 -0.27 0.00 0.00 -1.95 0.00 0.00 55.36 53.84 1i4h s GLN 202 Cb -0.45 -3.26 0.00 0.00 -0.22 0.00 0.00 33.01 29.08 1i4h s GLN 202 CO 0.53 0.38 0.00 0.41 -0.25 0.00 0.00 175.29 176.36 1i4h n GLY 203 N 3.21 -1.80 0.00 3.09 0.00 -1.26 -3.06 105.19 105.37 1i4h n GLY 203 Ca -0.17 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.02 1i4h n GLY 203 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1i4h n GLN 204 N 0.00 2.17 -3.94 1.61 6.02 -1.26 -4.74 117.38 117.24 1i4h n GLN 204 Ca 0.00 0.00 -0.24 0.00 -0.01 0.00 0.00 57.00 56.75 1i4h n GLN 204 Cb 0.00 -0.93 -0.05 0.00 1.02 0.00 0.00 30.24 30.28 1i4h n GLN 204 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1i4h s TYR 205 N -1.78 2.54 0.00 1.08 1.51 -1.26 -4.01 117.35 115.42 1i4h s TYR 205 Ca 0.00 -0.59 0.00 0.00 -1.01 0.00 0.00 57.07 55.47 1i4h s TYR 205 Cb 0.00 -2.02 0.00 0.00 -0.11 0.00 0.00 41.96 39.83 1i4h s TYR 205 CO 0.00 0.03 0.91 0.43 -1.11 0.00 0.00 175.55 175.81 1i4h n SER 206 N -1.38 0.00 -0.36 2.29 7.64 -1.26 -1.08 113.62 119.47 1i4h n SER 206 Ca -0.00 0.91 0.28 0.00 1.01 0.00 0.00 58.87 61.07 1i4h n SER 206 Cb 0.64 -0.41 0.43 0.00 -1.01 0.00 0.00 64.21 63.86 1i4h n SER 206 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1i4h n ASN 207 N -2.16 0.00 -0.10 6.43 6.94 -1.26 0.91 115.26 126.02 1i4h n ASN 207 Ca 0.00 0.55 -0.13 0.00 -0.02 0.00 0.00 54.58 54.98 1i4h n ASN 207 Cb 0.00 -0.26 -0.12 0.00 -2.36 0.00 0.00 39.78 37.04 1i4h n ASN 207 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1i4h n THR 208 N -2.97 1.23 -0.10 5.53 -2.24 -1.07 -4.21 114.28 110.45 1i4h n THR 208 Ca 0.23 -0.59 -0.11 0.00 -2.27 0.00 0.00 64.05 61.31 1i4h n THR 208 Cb 1.12 -0.98 -0.03 0.00 -2.10 0.00 0.00 70.33 68.33 1i4h n THR 208 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1i4h h LEU 209 N 0.00 0.59 0.00 3.22 3.38 0.22 -3.01 115.31 119.71 1i4h h LEU 209 Ca -0.48 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.12 1i4h h LEU 209 Cb 1.89 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 42.48 1i4h h LEU 209 CO -0.03 0.82 0.00 0.18 0.09 0.00 0.00 178.44 179.49 1i4h n LEU 210 N -4.47 0.00 0.03 1.67 4.77 -0.06 -3.77 117.00 115.16 1i4h n LEU 210 Ca -0.03 0.20 0.02 0.00 -0.03 0.00 0.00 56.01 56.17 1i4h n LEU 210 Cb 0.32 -0.20 0.10 0.00 -2.33 0.00 0.00 43.42 41.30 1i4h n LEU 210 CO 0.40 -0.05 0.56 0.54 -1.33 0.00 0.00 177.39 177.52 1i4h n ARG 211 N -1.20 0.02 0.20 3.23 1.74 -1.14 -1.78 116.66 117.73 1i4h n ARG 211 Ca 0.13 0.49 0.14 0.00 -0.77 0.00 0.00 57.85 57.84 1i4h n ARG 211 Cb 0.16 -1.62 0.46 0.00 -1.02 0.00 0.00 32.46 30.43 1i4h n ARG 211 CO 0.00 0.00 0.00 -0.84 -1.52 0.00 0.00 177.63 175.27 1i4h h ILE 212 N 0.00 0.00 -0.14 0.55 3.07 -1.82 -3.00 117.51 116.17 1i4h h ILE 212 Ca 0.00 -0.57 0.00 0.00 1.55 0.00 0.00 64.86 65.84 1i4h h ILE 212 Cb 0.09 1.51 0.00 0.00 -0.27 0.00 0.00 36.82 38.16 1i4h h ILE 212 CO 0.00 0.00 0.00 -1.22 -1.05 0.00 0.00 178.15 175.88 1i4h n TYR 213 N -2.75 0.17 0.24 0.16 4.02 -0.73 -4.42 117.16 113.84 1i4h n TYR 213 Ca 0.03 -0.08 0.08 0.00 -0.01 0.00 0.00 57.90 57.91 1i4h n TYR 213 Cb 0.37 0.00 0.60 0.00 -0.02 0.00 0.00 39.34 40.29 1i4h n TYR 213 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 1i4h h ARG 214 N 3.59 0.00 0.00 -0.72 2.43 -1.69 -1.25 114.38 116.74 1i4h h ARG 214 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1i4h h ARG 214 Cb 0.77 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 1i4h h ARG 214 CO 0.00 0.11 0.00 -0.40 -1.51 0.00 0.00 179.97 178.17 1i4h n ASP 215 N -4.28 0.00 -2.58 -3.80 3.85 -1.26 -2.87 116.55 105.61 1i4h n ASP 215 Ca -0.03 0.14 -0.14 0.00 -0.71 0.00 0.00 54.79 54.05 1i4h n ASP 215 Cb 0.19 -0.32 -0.00 0.00 -1.35 0.00 0.00 41.12 39.63 1i4h n ASP 215 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 1i4h n ASN 216 N -1.32 -4.03 -4.57 -1.12 5.15 -0.48 -4.82 115.26 104.07 1i4h n ASN 216 Ca 0.07 0.10 -0.53 0.00 -0.60 0.00 0.00 54.58 53.61 1i4h n ASN 216 Cb 0.13 -3.41 -0.06 0.00 -0.53 0.00 0.00 39.78 35.91 1i4h n ASN 216 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1i4h n LYS 217 N -2.98 0.92 -4.92 1.20 3.00 -1.26 -4.87 118.16 109.25 1i4h n LYS 217 Ca -0.13 0.33 -0.28 0.00 -0.00 0.00 0.00 58.31 58.23 1i4h n LYS 217 Cb 0.61 -1.93 -0.16 0.00 0.00 0.00 0.00 35.03 33.54 1i4h n LYS 217 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1i4h s THR 218 N 0.33 1.58 0.19 3.15 2.01 -1.26 -1.70 115.64 119.94 1i4h s THR 218 Ca 0.85 -0.78 0.07 0.00 0.31 0.00 0.00 61.69 62.14 1i4h s THR 218 Cb -1.01 -1.37 -0.05 0.00 0.01 0.00 0.00 72.50 70.09 1i4h s THR 218 CO 0.49 0.45 -0.14 0.27 -0.69 0.00 0.00 174.62 175.00 1i4h s ILE 219 N 0.16 1.64 -0.18 1.82 -4.36 -0.32 -4.94 121.20 115.03 1i4h s ILE 219 Ca -0.08 -2.15 -0.24 0.00 -0.26 0.00 0.00 60.65 57.92 1i4h s ILE 219 Cb -0.14 -1.98 -0.02 0.00 1.25 0.00 0.00 42.46 41.58 1i4h s ILE 219 CO 0.04 -0.59 0.80 0.21 0.24 0.00 0.00 174.94 175.63 1i4h s ASN 220 N -3.21 6.90 0.38 4.36 3.84 -1.26 -1.34 114.94 124.61 1i4h s ASN 220 Ca 0.21 1.11 0.19 0.00 0.21 0.00 0.00 52.86 54.57 1i4h s ASN 220 Cb -0.01 -2.43 0.74 0.00 -0.55 0.00 0.00 41.25 38.99 1i4h s ASN 220 CO 0.06 -0.38 1.76 0.77 -2.79 0.00 0.00 177.10 176.52 1i4h h SER 221 N 7.36 0.00 -2.33 -4.21 4.64 -1.39 -3.43 113.55 114.18 1i4h h SER 221 Ca -0.30 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.46 1i4h h SER 221 Cb 1.13 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 63.27 1i4h h SER 221 CO 0.83 0.36 0.95 1.21 -0.87 0.00 0.00 176.83 179.31 1i4h n GLU 222 N -3.59 2.39 -3.66 4.77 4.07 -1.26 -3.21 120.64 120.15 1i4h n GLU 222 Ca -0.00 0.87 -0.25 0.00 -0.06 0.00 0.00 57.16 57.71 1i4h n GLU 222 Cb 0.48 -2.69 0.01 0.00 -0.06 0.00 0.00 31.44 29.18 1i4h n GLU 222 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1i4h n ASN 223 N 4.58 -5.27 -3.77 4.31 5.15 -1.26 -4.97 115.26 114.03 1i4h n ASN 223 Ca 0.18 -0.72 -0.11 0.00 -0.60 0.00 0.00 54.58 53.34 1i4h n ASN 223 Cb 0.32 -2.04 -0.07 0.00 -0.53 0.00 0.00 39.78 37.46 1i4h n ASN 223 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1i4h s MET 224 N -4.28 0.84 0.26 1.20 0.23 -1.20 -4.57 119.30 111.79 1i4h s MET 224 Ca 0.08 -0.65 -0.02 0.00 -1.03 0.00 0.00 55.69 54.06 1i4h s MET 224 Cb -0.01 0.36 -0.02 0.00 -1.53 0.00 0.00 34.83 33.63 1i4h s MET 224 CO 0.88 -0.28 0.29 -3.38 -2.03 0.00 0.00 175.02 170.50 1i4h s HIS 225 N -3.04 1.08 -0.06 3.16 -3.43 -0.95 -4.34 115.29 107.71 1i4h s HIS 225 Ca -0.02 -1.28 0.06 0.00 -0.80 0.00 0.00 55.06 53.02 1i4h s HIS 225 Cb 0.01 -0.34 -0.01 0.00 -1.43 0.00 0.00 32.58 30.80 1i4h s HIS 225 CO -0.06 -0.85 -0.24 0.42 -2.00 0.00 0.00 174.74 172.01 1i4h s ILE 226 N -3.80 2.17 -0.12 -5.38 1.01 0.01 -1.36 121.20 113.74 1i4h s ILE 226 Ca 0.34 -1.03 -0.00 0.00 0.00 0.00 0.00 60.65 59.97 1i4h s ILE 226 Cb 0.03 -1.79 -0.02 0.00 0.01 0.00 0.00 42.46 40.69 1i4h s ILE 226 CO 0.16 0.57 -0.13 -1.81 0.00 0.00 0.00 174.94 173.73 1i4h s ASP 227 N -0.19 4.06 -0.05 3.58 1.01 0.45 -0.84 116.67 124.69 1i4h s ASP 227 Ca -0.03 -0.30 0.03 0.00 0.71 0.00 0.00 52.55 52.96 1i4h s ASP 227 Cb -0.14 -1.56 0.00 0.00 1.01 0.00 0.00 42.92 42.23 1i4h s ASP 227 CO 0.03 0.18 -0.14 -0.63 0.21 0.00 0.00 175.17 174.82 1i4h s ILE 228 N 0.26 1.23 -0.14 0.77 1.01 0.09 0.51 121.20 124.94 1i4h s ILE 228 Ca -0.09 -0.58 0.00 0.00 0.00 0.00 0.00 60.65 59.98 1i4h s ILE 228 Cb -0.15 -1.09 0.02 0.00 0.01 0.00 0.00 42.46 41.25 1i4h s ILE 228 CO 0.05 0.37 -0.14 -0.31 0.00 0.00 0.00 174.94 174.91 1i4h s TYR 229 N 0.30 2.04 0.03 3.97 1.51 -0.43 -1.38 117.35 123.39 1i4h s TYR 229 Ca -0.08 -1.10 0.07 0.00 -1.01 0.00 0.00 57.07 54.94 1i4h s TYR 229 Cb -0.13 -1.52 -0.03 0.00 -0.11 0.00 0.00 41.96 40.17 1i4h s TYR 229 CO 0.03 -0.61 -0.17 -0.51 -1.11 0.00 0.00 175.55 173.17 1i4h s LEU 230 N 1.42 2.66 -0.04 -1.29 1.43 0.45 -1.45 118.68 121.86 1i4h s LEU 230 Ca 0.03 -0.39 0.01 0.00 -1.03 0.00 0.00 54.13 52.75 1i4h s LEU 230 Cb -0.13 -1.55 0.02 0.00 0.03 0.00 0.00 46.19 44.56 1i4h s LEU 230 CO -0.09 0.26 -0.03 -0.31 0.23 0.00 0.00 176.35 176.41 1i4h s TYR 231 N -0.92 0.68 -0.95 0.29 1.51 0.11 -0.52 117.35 117.55 1i4h s TYR 231 Ca 0.15 -0.17 0.07 0.00 -1.01 0.00 0.00 57.07 56.10 1i4h s TYR 231 Cb -0.11 -0.64 0.35 0.00 -0.11 0.00 0.00 41.96 41.45 1i4h s TYR 231 CO 0.05 -0.20 1.09 0.25 -1.11 0.00 0.00 175.55 175.64 1i4h n THR 232 N 4.17 1.06 -1.83 -0.71 -2.24 -1.26 0.24 114.28 113.71 1i4h n THR 232 Ca -0.23 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 60.96 1i4h n THR 232 Cb 0.51 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 1i4h n THR 232 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96