#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i5h n ASP 17 N 0.00 1.60 -4.06 1.62 2.03 -1.26 -4.47 116.55 112.00 2i5h n ASP 17 Ca 0.00 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.18 2i5h n ASP 17 Cb 0.00 0.85 -0.12 0.00 -0.72 0.00 0.00 41.12 41.13 2i5h n ASP 17 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2i5h s TYR 18 N -2.34 0.68 0.11 -0.67 2.02 -1.26 -0.88 117.35 115.01 2i5h s TYR 18 Ca -0.07 -0.48 -0.04 0.00 -0.37 0.00 0.00 57.07 56.11 2i5h s TYR 18 Cb 0.04 -0.41 -0.03 0.00 -0.40 0.00 0.00 41.96 41.16 2i5h s TYR 18 CO 0.57 -0.08 0.09 0.00 -1.57 0.00 0.00 175.55 174.56 2i5h s ALA 19 N -1.33 0.45 -0.08 3.71 0.00 -0.39 -1.80 121.76 122.33 2i5h s ALA 19 Ca -0.09 -1.17 0.01 0.00 0.00 0.00 0.00 51.96 50.71 2i5h s ALA 19 Cb -0.10 0.63 -0.03 0.00 0.00 0.00 0.00 23.12 23.63 2i5h s ALA 19 CO 0.00 -0.48 -0.11 0.71 0.00 0.00 0.00 175.76 175.88 2i5h s TYR 20 N -3.97 2.82 0.07 0.00 2.02 0.24 -0.07 117.35 118.46 2i5h s TYR 20 Ca 0.15 -0.20 -0.31 0.00 -0.37 0.00 0.00 57.07 56.35 2i5h s TYR 20 Cb 0.07 -1.72 -0.07 0.00 -0.40 0.00 0.00 41.96 39.84 2i5h s TYR 20 CO -0.04 0.15 1.35 0.08 -1.57 0.00 0.00 175.55 175.52 2i5h s VAL 21 N -0.48 3.60 -0.20 0.71 1.01 -0.06 -1.24 120.40 123.74 2i5h s VAL 21 Ca 0.06 1.11 0.10 0.00 0.00 0.00 0.00 61.98 63.26 2i5h s VAL 21 Cb -0.12 -3.71 -0.20 0.00 0.00 0.00 0.00 36.38 32.35 2i5h s VAL 21 CO 0.02 0.06 -0.04 0.18 0.00 0.00 0.00 175.10 175.31 2i5h n LEU 22 N 4.39 1.18 -3.64 3.92 4.77 0.23 -1.19 117.00 126.68 2i5h n LEU 22 Ca 0.11 -0.05 -0.09 0.00 -0.03 0.00 0.00 56.01 55.96 2i5h n LEU 22 Cb 0.44 -0.05 -0.07 0.00 -2.33 0.00 0.00 43.42 41.40 2i5h n LEU 22 CO 0.58 0.63 0.55 -0.62 -1.33 0.00 0.00 177.39 177.19 2i5h s ASP 23 N -5.64 -0.66 -0.12 -1.43 2.15 -1.15 -4.30 116.67 105.52 2i5h s ASP 23 Ca -0.18 1.17 0.01 0.00 0.43 0.00 0.00 52.55 53.98 2i5h s ASP 23 Cb 0.06 1.22 -0.01 0.00 -0.30 0.00 0.00 42.92 43.90 2i5h s ASP 23 CO 0.66 -0.19 -0.17 0.12 -0.17 0.00 0.00 175.17 175.42 2i5h s PHE 24 N 0.83 2.72 -0.41 -5.34 5.36 -1.26 -1.17 117.98 118.71 2i5h s PHE 24 Ca -0.03 -0.88 0.04 0.00 -0.96 0.00 0.00 56.93 55.10 2i5h s PHE 24 Cb -0.05 -1.81 0.11 0.00 -0.34 0.00 0.00 43.02 40.94 2i5h s PHE 24 CO -0.09 -0.34 0.13 -1.64 -1.46 0.00 0.00 175.22 171.81 2i5h s MET 25 N 0.45 1.67 0.30 10.12 -1.94 0.13 -5.00 119.30 125.02 2i5h s MET 25 Ca -0.13 -2.16 0.05 0.00 -1.71 0.00 0.00 55.69 51.74 2i5h s MET 25 Cb -0.17 -3.24 0.80 0.00 2.01 0.00 0.00 34.83 34.23 2i5h s MET 25 CO 0.06 -1.01 1.67 -1.35 -0.01 0.00 0.00 175.02 174.38 2i5h h PRO 26 N 7.18 0.29 -0.35 2.03 0.11 -1.92 0.12 132.00 139.47 2i5h h PRO 26 Ca -0.06 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 66.00 2i5h h PRO 26 Cb 0.97 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.99 2i5h h PRO 26 CO 0.58 0.19 0.02 0.66 -0.21 0.00 0.00 178.00 179.25 2i5h n TYR 27 N -5.12 1.23 -4.28 0.65 0.53 -1.26 -3.24 117.16 105.67 2i5h n TYR 27 Ca 0.24 -0.95 0.00 0.00 -1.02 0.00 0.00 57.90 56.16 2i5h n TYR 27 Cb 0.74 -0.39 0.00 0.00 -1.03 0.00 0.00 39.34 38.66 2i5h n TYR 27 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2i5h n GLY 28 N -0.40 -0.84 3.73 2.72 0.00 -0.12 -4.68 105.19 105.60 2i5h n GLY 28 Ca 0.25 -1.18 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 2i5h n GLY 28 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2i5h s HIS 29 N 0.00 3.11 0.58 1.61 3.76 -1.26 -4.86 115.29 118.23 2i5h s HIS 29 Ca 0.00 0.88 0.28 0.00 -0.15 0.00 0.00 55.06 56.07 2i5h s HIS 29 Cb 0.00 -3.81 1.56 0.00 1.11 0.00 0.00 32.58 31.45 2i5h s HIS 29 CO 0.00 -2.80 2.04 -1.00 -0.85 0.00 0.00 174.74 172.13 2i5h h PRO 30 N 6.13 0.00 -0.22 8.40 0.13 -2.01 -1.11 132.00 143.32 2i5h h PRO 30 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2i5h h PRO 30 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2i5h h PRO 30 CO 0.85 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.37 2i5h n ASP 31 N -3.89 2.08 -4.64 1.44 8.00 -1.26 -4.95 116.55 113.33 2i5h n ASP 31 Ca 0.04 -1.78 -0.52 0.00 0.71 0.00 0.00 54.79 53.24 2i5h n ASP 31 Cb 0.44 -0.14 -0.06 0.00 -0.02 0.00 0.00 41.12 41.35 2i5h n ASP 31 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2i5h n ASP 32 N 0.60 2.22 -0.14 -2.24 -0.08 -0.42 -4.86 116.55 111.62 2i5h n ASP 32 Ca 0.17 1.09 0.13 0.00 -1.51 0.00 0.00 54.79 54.66 2i5h n ASP 32 Cb 0.39 -1.24 0.34 0.00 2.34 0.00 0.00 41.12 42.95 2i5h n ASP 32 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2i5h n LYS 33 N 3.66 0.49 -2.46 -0.67 5.02 -1.26 -4.92 118.16 118.02 2i5h n LYS 33 Ca 0.20 -0.28 -0.32 0.00 -2.02 0.00 0.00 58.31 55.89 2i5h n LYS 33 Cb 0.20 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.68 2i5h n LYS 33 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2i5h s ARG 34 N -2.70 3.95 0.52 1.97 0.52 -1.26 -5.01 118.95 116.95 2i5h s ARG 34 Ca 0.19 0.93 -0.22 0.00 -0.52 0.00 0.00 55.73 56.12 2i5h s ARG 34 Cb 0.19 -2.16 -0.07 0.00 0.52 0.00 0.00 34.95 33.43 2i5h s ARG 34 CO 0.59 -0.24 1.13 -2.30 0.02 0.00 0.00 175.30 174.50 2i5h n PRO 35 N -1.50 1.36 -0.35 3.54 -0.02 -1.26 -4.84 135.00 131.93 2i5h n PRO 35 Ca 0.06 0.50 0.16 0.00 -2.02 0.00 0.00 63.50 62.21 2i5h n PRO 35 Cb 0.54 -2.29 0.37 0.00 -0.02 0.00 0.00 33.50 32.10 2i5h n PRO 35 CO 0.00 0.00 0.00 -0.84 1.98 0.00 0.00 175.50 176.64 2i5h h ILE 36 N 1.19 0.59 0.00 4.25 3.07 -1.96 -0.87 117.51 123.78 2i5h h ILE 36 Ca -0.48 -0.22 0.00 0.00 1.55 0.00 0.00 64.86 65.71 2i5h h ILE 36 Cb 1.33 -0.10 0.00 0.00 -0.27 0.00 0.00 36.82 37.78 2i5h h ILE 36 CO 0.55 0.12 0.00 0.00 -1.05 0.00 0.00 178.15 177.77 2i5h n HIS 37 N -4.84 0.21 0.88 0.16 1.44 -1.26 -1.97 115.22 109.84 2i5h n HIS 37 Ca 0.26 0.09 0.09 0.00 -2.01 0.00 0.00 57.72 56.15 2i5h n HIS 37 Cb 0.70 -0.65 -0.03 0.00 0.12 0.00 0.00 29.99 30.13 2i5h n HIS 37 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2i5h n ARG 38 N -1.70 1.25 -2.88 -1.40 1.74 -0.33 -4.94 116.66 108.40 2i5h n ARG 38 Ca 0.02 -0.67 -0.40 0.00 -0.77 0.00 0.00 57.85 56.02 2i5h n ARG 38 Cb 0.12 -1.39 -0.05 0.00 -1.02 0.00 0.00 32.46 30.13 2i5h n ARG 38 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2i5h s ARG 39 N -2.38 4.56 0.24 5.56 0.52 -0.83 -5.03 118.95 121.59 2i5h s ARG 39 Ca 0.14 1.21 0.07 0.00 -0.52 0.00 0.00 55.73 56.63 2i5h s ARG 39 Cb 0.15 -3.39 -0.04 0.00 0.52 0.00 0.00 34.95 32.20 2i5h s ARG 39 CO 0.57 0.20 0.13 -1.83 0.02 0.00 0.00 175.30 174.39 2i5h s GLU 40 N 0.18 2.73 0.18 3.54 -1.05 -1.26 -4.89 118.70 118.13 2i5h s GLU 40 Ca 0.43 -1.13 -0.31 0.00 -0.15 0.00 0.00 54.97 53.82 2i5h s GLU 40 Cb -0.21 -2.46 -0.09 0.00 -0.44 0.00 0.00 34.13 30.93 2i5h s GLU 40 CO 0.25 0.40 1.37 -1.25 0.95 0.00 0.00 175.26 176.99 2i5h s PRO 41 N -3.66 4.34 0.15 -4.83 0.04 -1.20 -3.11 135.00 126.73 2i5h s PRO 41 Ca 0.32 2.11 0.07 0.00 0.04 0.00 0.00 61.00 63.55 2i5h s PRO 41 Cb -0.08 -3.20 -0.04 0.00 0.04 0.00 0.00 34.50 31.22 2i5h s PRO 41 CO 0.23 -0.36 -0.16 -0.51 0.04 0.00 0.00 177.00 176.24 2i5h s LEU 42 N 0.32 2.43 0.02 -3.56 1.43 -0.36 -0.91 118.68 118.05 2i5h s LEU 42 Ca 0.60 -0.85 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 2i5h s LEU 42 Cb -0.38 -0.71 -0.01 0.00 0.03 0.00 0.00 46.19 45.12 2i5h s LEU 42 CO 0.36 -0.09 -0.05 0.00 0.23 0.00 0.00 176.35 176.80 2i5h s ALA 43 N -2.16 0.40 -0.17 4.21 0.00 -0.03 0.19 121.76 124.20 2i5h s ALA 43 Ca 0.13 -0.48 -0.06 0.00 0.00 0.00 0.00 51.96 51.55 2i5h s ALA 43 Cb -0.05 0.00 -0.04 0.00 0.00 0.00 0.00 23.12 23.04 2i5h s ALA 43 CO 0.05 0.00 0.02 -0.65 0.00 0.00 0.00 175.76 175.19 2i5h s GLN 44 N -0.92 3.86 0.22 0.00 -0.21 -0.32 -1.15 119.66 121.15 2i5h s GLN 44 Ca -0.06 -0.41 0.05 0.00 0.02 0.00 0.00 55.36 54.96 2i5h s GLN 44 Cb -0.06 -3.10 -0.05 0.00 1.00 0.00 0.00 33.01 30.79 2i5h s GLN 44 CO -0.00 0.26 -0.05 0.14 -2.12 0.00 0.00 175.29 173.52 2i5h s VAL 45 N 0.36 1.24 -0.11 1.09 -7.23 0.45 -0.60 120.40 115.60 2i5h s VAL 45 Ca 0.00 -2.07 0.02 0.00 -1.81 0.00 0.00 61.98 58.12 2i5h s VAL 45 Cb -0.13 -2.22 0.01 0.00 0.56 0.00 0.00 36.38 34.60 2i5h s VAL 45 CO 0.01 -0.44 -0.17 0.54 -0.31 0.00 0.00 175.10 174.73 2i5h s VAL 46 N -3.29 1.62 0.34 1.32 0.11 -0.37 -1.09 120.40 119.04 2i5h s VAL 46 Ca 0.25 -0.72 -0.29 0.00 -2.93 0.00 0.00 61.98 58.30 2i5h s VAL 46 Cb 0.04 -1.46 -0.11 0.00 -1.53 0.00 0.00 36.38 33.32 2i5h s VAL 46 CO 0.07 0.46 1.43 -0.83 -3.33 0.00 0.00 175.10 172.90 2i5h s GLY 47 N 0.89 2.81 0.22 6.54 0.00 0.78 -0.59 107.32 117.97 2i5h s GLY 47 Ca -0.08 1.43 0.26 0.00 0.00 0.00 0.00 44.72 46.33 2i5h s GLY 47 CO -0.00 2.16 1.76 -1.84 0.00 0.00 0.00 173.10 175.18 2i5h n GLU 48 N 0.96 0.24 -0.10 2.90 0.28 -0.74 -1.56 120.64 122.63 2i5h n GLU 48 Ca 0.02 0.27 -0.16 0.00 -0.16 0.00 0.00 57.16 57.13 2i5h n GLU 48 Cb 0.40 -1.82 -0.07 0.00 1.43 0.00 0.00 31.44 31.38 2i5h n GLU 48 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 2i5h n ARG 49 N -2.25 0.53 -0.06 3.44 0.63 -1.26 -4.68 116.66 113.00 2i5h n ARG 49 Ca 0.05 0.46 0.02 0.00 -0.92 0.00 0.00 57.85 57.46 2i5h n ARG 49 Cb 0.38 -1.65 0.06 0.00 0.45 0.00 0.00 32.46 31.70 2i5h n ARG 49 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 2i5h n ASN 50 N -4.47 2.17 -3.45 6.15 5.03 -1.26 -4.91 115.26 114.52 2i5h n ASN 50 Ca -0.25 -1.81 -0.24 0.00 0.87 0.00 0.00 54.58 53.15 2i5h n ASN 50 Cb 0.56 -0.08 0.06 0.00 -1.02 0.00 0.00 39.78 39.30 2i5h n ASN 50 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 2i5h n PHE 51 N 0.03 -2.59 -2.35 3.10 3.72 -0.60 -4.37 117.46 114.40 2i5h n PHE 51 Ca 0.05 0.87 -0.41 0.00 -0.05 0.00 0.00 57.45 57.90 2i5h n PHE 51 Cb 0.28 -4.81 -0.03 0.00 -0.94 0.00 0.00 39.48 33.97 2i5h n PHE 51 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2i5h s THR 52 N -3.28 3.56 -0.16 4.37 2.01 -1.26 -4.57 115.64 116.32 2i5h s THR 52 Ca 0.51 1.27 -0.18 0.00 0.31 0.00 0.00 61.69 63.60 2i5h s THR 52 Cb -0.23 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.43 2i5h s THR 52 CO 0.63 0.18 0.48 -0.76 -0.69 0.00 0.00 174.62 174.46 2i5h s LEU 53 N 0.02 4.21 0.05 4.42 1.43 -1.26 -0.16 118.68 127.39 2i5h s LEU 53 Ca 0.55 0.71 0.03 0.00 -1.03 0.00 0.00 54.13 54.38 2i5h s LEU 53 Cb -0.33 -2.66 -0.03 0.00 0.03 0.00 0.00 46.19 43.20 2i5h s LEU 53 CO 0.36 -0.08 -0.09 -0.76 0.23 0.00 0.00 176.35 176.01 2i5h s LEU 54 N 1.12 2.28 -0.14 1.79 1.43 -0.25 -0.47 118.68 124.43 2i5h s LEU 54 Ca 0.24 -0.59 -0.01 0.00 -1.03 0.00 0.00 54.13 52.73 2i5h s LEU 54 Cb -0.15 -0.23 -0.02 0.00 0.03 0.00 0.00 46.19 45.82 2i5h s LEU 54 CO 0.09 -0.19 -0.10 -0.70 0.23 0.00 0.00 176.35 175.68 2i5h s GLU 55 N -1.75 3.47 0.08 1.70 2.12 -0.43 -0.41 118.70 123.47 2i5h s GLU 55 Ca -0.07 -0.64 0.03 0.00 0.36 0.00 0.00 54.97 54.66 2i5h s GLU 55 Cb -0.09 -2.73 -0.03 0.00 0.26 0.00 0.00 34.13 31.54 2i5h s GLU 55 CO 0.00 0.20 -0.10 0.14 -0.54 0.00 0.00 175.26 174.97 2i5h s VAL 56 N 0.41 0.86 0.36 3.70 -7.23 -0.30 -0.68 120.40 117.53 2i5h s VAL 56 Ca -0.08 -1.52 -0.09 0.00 -1.81 0.00 0.00 61.98 58.48 2i5h s VAL 56 Cb -0.15 -1.21 -0.06 0.00 0.56 0.00 0.00 36.38 35.51 2i5h s VAL 56 CO 0.04 -0.51 0.70 -0.94 -0.31 0.00 0.00 175.10 174.08 2i5h s SER 57 N -2.26 6.51 -0.01 4.85 1.04 0.47 -0.85 113.70 123.46 2i5h s SER 57 Ca 0.02 1.01 0.05 0.00 0.48 0.00 0.00 55.95 57.51 2i5h s SER 57 Cb -0.04 -2.27 -0.03 0.00 0.10 0.00 0.00 66.02 63.78 2i5h s SER 57 CO -0.00 -0.32 -0.14 -0.63 0.98 0.00 0.00 173.24 173.13 2i5h s ILE 58 N -2.25 3.07 0.72 -1.02 -1.09 -0.08 -0.29 121.20 120.25 2i5h s ILE 58 Ca 0.49 -0.91 -0.14 0.00 -2.23 0.00 0.00 60.65 57.86 2i5h s ILE 58 Cb -0.10 -2.26 0.03 0.00 -1.58 0.00 0.00 42.46 38.55 2i5h s ILE 58 CO 0.30 0.46 1.14 -0.13 -1.23 0.00 0.00 174.94 175.48 2i5h s ARG 59 N -1.13 2.37 0.53 2.79 0.52 -0.29 -4.59 118.95 119.15 2i5h s ARG 59 Ca 0.14 1.49 -0.22 0.00 -0.52 0.00 0.00 55.73 56.61 2i5h s ARG 59 Cb -0.11 -1.89 -0.06 0.00 0.52 0.00 0.00 34.95 33.42 2i5h s ARG 59 CO 0.04 -1.60 1.31 1.63 0.02 0.00 0.00 175.30 176.70 2i5h n LYS 60 N -2.81 1.69 -0.96 3.54 5.02 -1.26 -2.86 118.16 120.51 2i5h n LYS 60 Ca 0.11 0.62 0.00 0.00 -2.02 0.00 0.00 58.31 57.02 2i5h n LYS 60 Cb 0.52 -2.51 0.00 0.00 -0.02 0.00 0.00 35.03 33.02 2i5h n LYS 60 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2i5h n GLY 61 N 0.81 0.59 3.73 0.72 0.00 -1.26 -5.01 105.19 104.76 2i5h n GLY 61 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 2i5h n GLY 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i5h s LYS 62 N -0.27 2.91 -0.47 1.61 -0.14 -1.13 -5.05 119.74 117.19 2i5h s LYS 62 Ca 0.00 -0.56 0.06 0.00 -1.36 0.00 0.00 55.97 54.11 2i5h s LYS 62 Cb 0.00 -2.76 0.21 0.00 -1.68 0.00 0.00 37.83 33.60 2i5h s LYS 62 CO 0.00 0.63 0.49 1.04 -0.76 0.00 0.00 175.35 176.75 2i5h n GLN 63 N 1.24 0.92 -1.69 1.68 6.02 -1.26 -4.96 117.38 119.34 2i5h n GLN 63 Ca -0.14 -3.57 -0.41 0.00 -0.01 0.00 0.00 57.00 52.88 2i5h n GLN 63 Cb 0.53 -1.65 0.02 0.00 1.02 0.00 0.00 30.24 30.15 2i5h n GLN 63 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 2i5h n PRO 64 N 1.90 1.78 -4.13 -1.09 -0.02 -1.26 -5.02 135.00 127.16 2i5h n PRO 64 Ca 0.25 0.64 -0.29 0.00 -2.02 0.00 0.00 63.50 62.08 2i5h n PRO 64 Cb 0.47 -2.35 -0.07 0.00 -0.02 0.00 0.00 33.50 31.53 2i5h n PRO 64 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2i5h s LEU 65 N -1.75 3.53 0.36 2.45 1.43 -1.26 -4.77 118.68 118.67 2i5h s LEU 65 Ca 0.63 -0.19 -0.28 0.00 -1.03 0.00 0.00 54.13 53.25 2i5h s LEU 65 Cb -0.50 -2.22 -0.12 0.00 0.03 0.00 0.00 46.19 43.39 2i5h s LEU 65 CO 0.56 0.14 1.42 0.52 0.23 0.00 0.00 176.35 179.22 2i5h n VAL 66 N 0.25 1.93 -0.24 -1.59 0.31 -1.26 -1.46 118.33 116.28 2i5h n VAL 66 Ca -0.10 -0.48 0.00 0.00 -0.01 0.00 0.00 64.34 63.75 2i5h n VAL 66 Cb 0.53 -1.82 0.00 0.00 -0.91 0.00 0.00 33.84 31.63 2i5h n VAL 66 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 2i5h n MET 67 N 0.59 0.00 -2.09 5.55 2.81 -0.33 -4.96 117.12 118.70 2i5h n MET 67 Ca 0.03 0.00 -0.39 0.00 -1.81 0.00 0.00 57.70 55.53 2i5h n MET 67 Cb 0.38 -1.34 -0.00 0.00 -0.71 0.00 0.00 33.22 31.54 2i5h n MET 67 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2i5h s ASP 68 N -3.32 6.23 -0.25 7.83 1.11 -0.53 -4.69 116.67 123.04 2i5h s ASP 68 Ca 0.00 2.58 -0.11 0.00 0.18 0.00 0.00 52.55 55.20 2i5h s ASP 68 Cb 0.00 -2.63 -0.05 0.00 1.07 0.00 0.00 42.92 41.31 2i5h s ASP 68 CO 0.00 -0.90 0.17 -0.60 1.18 0.00 0.00 175.17 175.02 2i5h s ARG 69 N -2.36 4.02 0.08 8.23 3.52 -1.26 -0.89 118.95 130.29 2i5h s ARG 69 Ca 0.59 -0.29 0.09 0.00 -0.13 0.00 0.00 55.73 55.99 2i5h s ARG 69 Cb -0.36 -3.58 -0.03 0.00 -1.56 0.00 0.00 34.95 29.42 2i5h s ARG 69 CO 0.46 -0.03 -0.25 0.14 -0.81 0.00 0.00 175.30 174.81 2i5h s VAL 70 N 1.32 2.04 -0.09 7.11 -7.23 0.89 -4.95 120.40 119.48 2i5h s VAL 70 Ca 0.07 -1.48 -0.25 0.00 -1.81 0.00 0.00 61.98 58.50 2i5h s VAL 70 Cb -0.14 -1.78 -0.03 0.00 0.56 0.00 0.00 36.38 34.99 2i5h s VAL 70 CO 0.07 0.20 0.81 -0.47 -0.31 0.00 0.00 175.10 175.40 2i5h s TYR 71 N -0.92 3.54 -0.10 2.82 5.04 -1.26 -1.26 117.35 125.20 2i5h s TYR 71 Ca 0.11 1.34 0.15 0.00 -2.44 0.00 0.00 57.07 56.23 2i5h s TYR 71 Cb -0.10 -2.95 0.22 0.00 0.35 0.00 0.00 41.96 39.49 2i5h s TYR 71 CO 0.03 -0.05 1.12 0.44 -1.34 0.00 0.00 175.55 175.75 2i5h n ILE 72 N 4.16 1.46 -1.10 3.14 -5.35 -0.06 -4.50 119.36 117.11 2i5h n ILE 72 Ca 0.02 -1.75 -0.04 0.00 -0.27 0.00 0.00 62.75 60.71 2i5h n ILE 72 Cb 0.50 -0.07 0.03 0.00 -1.74 0.00 0.00 39.64 38.36 2i5h n ILE 72 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2i5h n GLY 73 N -1.11 -1.27 0.23 3.28 0.00 -1.14 -4.84 105.19 100.34 2i5h n GLY 73 Ca 0.12 -1.66 0.13 0.00 0.00 0.00 0.00 46.02 44.61 2i5h n GLY 73 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2i5h h LYS 74 N 0.00 0.00 0.00 1.61 1.79 -1.93 -3.46 116.57 114.57 2i5h h LYS 74 Ca -0.07 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 2i5h h LYS 74 Cb 0.18 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.83 2i5h h LYS 74 CO 0.05 0.10 0.00 0.41 -1.08 0.00 0.00 179.45 178.93 2i5h n GLY 75 N 0.50 -1.27 3.73 3.86 0.00 -1.26 -4.95 105.19 105.80 2i5h n GLY 75 Ca 0.02 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 2i5h n GLY 75 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2i5h s GLU 76 N -1.09 4.22 -0.19 1.61 2.12 -1.26 -5.00 118.70 119.12 2i5h s GLU 76 Ca 0.00 2.37 -0.04 0.00 0.36 0.00 0.00 54.97 57.66 2i5h s GLU 76 Cb 0.00 -3.12 -0.02 0.00 0.26 0.00 0.00 34.13 31.26 2i5h s GLU 76 CO 0.00 -0.53 -0.04 1.03 -0.54 0.00 0.00 175.26 175.17 2i5h s ARG 77 N 0.28 3.48 0.29 4.30 0.52 -1.26 -5.00 118.95 121.56 2i5h s ARG 77 Ca 0.65 -0.59 0.15 0.00 -0.52 0.00 0.00 55.73 55.42 2i5h s ARG 77 Cb -0.44 -2.96 0.20 0.00 0.52 0.00 0.00 34.95 32.27 2i5h s ARG 77 CO 0.39 -0.03 1.50 -0.44 0.02 0.00 0.00 175.30 176.74 2i5h h ASP 78 N 7.56 0.00 0.00 0.23 3.32 -1.94 -3.42 116.42 122.17 2i5h h ASP 78 Ca -0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.69 2i5h h ASP 78 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2i5h h ASP 78 CO 0.60 0.51 -0.85 0.52 -1.72 0.00 0.00 179.24 178.30 2i5h n VAL 79 N -3.30 0.00 -2.49 -1.35 0.31 -1.26 -4.93 118.33 105.31 2i5h n VAL 79 Ca 0.01 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 63.94 2i5h n VAL 79 Cb 0.70 -1.19 -0.04 0.00 -0.91 0.00 0.00 33.84 32.39 2i5h n VAL 79 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2i5h s VAL 80 N -1.97 3.51 0.00 2.52 1.01 -1.26 -1.14 120.40 123.07 2i5h s VAL 80 Ca 0.00 1.51 0.00 0.00 0.00 0.00 0.00 61.98 63.49 2i5h s VAL 80 Cb 0.00 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.42 2i5h s VAL 80 CO 0.00 0.35 0.00 0.00 0.00 0.00 0.00 175.10 175.45 2i5h n TYR 81 N 1.16 0.00 -4.27 5.22 9.36 0.60 -4.66 117.16 124.56 2i5h n TYR 81 Ca -0.01 0.00 -0.21 0.00 3.32 0.00 0.00 57.90 61.00 2i5h n TYR 81 Cb 0.45 -0.04 -0.12 0.00 -0.63 0.00 0.00 39.34 39.00 2i5h n TYR 81 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 2i5h s LYS 82 N -0.24 1.09 -0.26 2.98 -0.14 -1.23 -4.95 119.74 116.99 2i5h s LYS 82 Ca 0.00 -1.21 -0.22 0.00 -1.36 0.00 0.00 55.97 53.18 2i5h s LYS 82 Cb 0.00 -1.19 -0.01 0.00 -1.68 0.00 0.00 37.83 34.95 2i5h s LYS 82 CO 0.00 0.26 0.71 0.42 -0.76 0.00 0.00 175.35 175.97 2i5h s ILE 83 N -1.60 4.92 -0.15 2.17 1.01 -1.26 -0.39 121.20 125.89 2i5h s ILE 83 Ca 0.08 1.25 -0.21 0.00 0.00 0.00 0.00 60.65 61.77 2i5h s ILE 83 Cb -0.08 -4.01 -0.19 0.00 0.01 0.00 0.00 42.46 38.19 2i5h s ILE 83 CO 0.04 -0.04 0.46 0.11 0.00 0.00 0.00 174.94 175.51 2i5h h LYS 84 N 7.87 0.00 -1.58 2.79 1.79 -1.24 -3.48 116.57 122.71 2i5h h LYS 84 Ca -0.25 0.00 0.17 0.00 -2.18 0.00 0.00 60.65 58.38 2i5h h LYS 84 Cb 1.11 0.00 -0.21 0.00 -1.58 0.00 0.00 32.23 31.55 2i5h h LYS 84 CO 0.82 0.77 0.69 -0.98 -1.08 0.00 0.00 179.45 179.66 2i5h s ARG 85 N -2.14 0.46 0.37 3.15 1.70 -1.10 -5.01 118.95 116.37 2i5h s ARG 85 Ca -0.18 -0.04 -0.24 0.00 -0.47 0.00 0.00 55.73 54.81 2i5h s ARG 85 Cb -0.00 0.21 -0.10 0.00 -0.57 0.00 0.00 34.95 34.49 2i5h s ARG 85 CO 0.52 -0.17 0.97 0.50 -1.08 0.00 0.00 175.30 176.04 2i5h s ARG 86 N -1.85 4.40 0.19 3.89 3.52 -1.26 -1.31 118.95 126.53 2i5h s ARG 86 Ca 0.05 1.30 0.10 0.00 -0.13 0.00 0.00 55.73 57.04 2i5h s ARG 86 Cb -0.01 -2.57 -0.04 0.00 -1.56 0.00 0.00 34.95 30.77 2i5h s ARG 86 CO -0.04 0.11 -0.14 -0.51 -0.81 0.00 0.00 175.30 173.91 2i5h s LEU 87 N -2.50 2.81 0.44 -0.88 1.43 0.37 -4.90 118.68 115.46 2i5h s LEU 87 Ca 0.55 -0.68 0.02 0.00 -1.03 0.00 0.00 54.13 52.99 2i5h s LEU 87 Cb -0.16 -1.50 0.00 0.00 0.03 0.00 0.00 46.19 44.56 2i5h s LEU 87 CO 0.21 0.10 0.64 -0.13 0.23 0.00 0.00 176.35 177.40 2i5h s ARG 88 N -2.85 2.95 0.31 1.70 0.52 -1.26 -4.53 118.95 115.80 2i5h s ARG 88 Ca 0.24 -0.72 0.02 0.00 -0.52 0.00 0.00 55.73 54.76 2i5h s ARG 88 Cb -0.08 -2.62 0.59 0.00 0.52 0.00 0.00 34.95 33.36 2i5h s ARG 88 CO 0.14 -0.29 1.90 -0.92 0.02 0.00 0.00 175.30 176.15 2i5h h TYR 89 N 0.46 1.00 0.00 -0.53 3.20 -1.94 -1.70 116.97 117.47 2i5h h TYR 89 Ca -0.45 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.44 2i5h h TYR 89 Cb 1.26 -0.33 -0.00 0.00 1.54 0.00 0.00 36.73 39.21 2i5h h TYR 89 CO 0.43 0.49 -0.05 1.05 -1.64 0.00 0.00 178.16 178.43 2i5h h GLU 90 N 0.96 0.00 -0.00 1.82 4.11 -1.95 -2.38 114.58 117.13 2i5h h GLU 90 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.83 2i5h h GLU 90 Cb 0.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2i5h h GLU 90 CO -0.17 0.05 -0.02 -0.25 0.07 0.00 0.00 179.01 178.70 2i5h n ASP 91 N -3.29 0.02 -4.77 3.06 8.00 -0.64 -4.84 116.55 114.09 2i5h n ASP 91 Ca -0.01 0.42 -0.38 0.00 0.71 0.00 0.00 54.79 55.53 2i5h n ASP 91 Cb 0.23 -0.46 -0.02 0.00 -0.02 0.00 0.00 41.12 40.85 2i5h n ASP 91 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2i5h s LEU 92 N -2.96 4.14 0.92 0.64 1.43 -0.90 -4.97 118.68 116.97 2i5h s LEU 92 Ca 0.15 2.27 -0.12 0.00 -1.03 0.00 0.00 54.13 55.40 2i5h s LEU 92 Cb 0.19 -4.11 0.14 0.00 0.03 0.00 0.00 46.19 42.44 2i5h s LEU 92 CO 0.53 -0.70 1.09 0.42 0.23 0.00 0.00 176.35 177.93 2i5h s THR 93 N -1.50 2.53 0.23 5.49 -4.23 -1.26 -4.77 115.64 112.14 2i5h s THR 93 Ca 0.59 0.17 -0.08 0.00 -1.18 0.00 0.00 61.69 61.19 2i5h s THR 93 Cb -0.28 -2.67 0.22 0.00 1.34 0.00 0.00 72.50 71.10 2i5h s THR 93 CO 0.35 -0.22 1.91 -0.65 -0.54 0.00 0.00 174.62 175.47 2i5h h PRO 94 N -1.61 1.19 -0.55 3.99 0.11 -1.97 -0.73 132.00 132.43 2i5h h PRO 94 Ca -0.51 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 65.49 2i5h h PRO 94 Cb 1.29 -0.27 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 2i5h h PRO 94 CO 0.56 0.79 0.18 0.00 -0.21 0.00 0.00 178.00 179.31 2i5h h ALA 95 N 1.33 0.71 -0.78 -0.75 0.00 -1.94 -1.74 119.26 116.09 2i5h h ALA 95 Ca 0.33 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 2i5h h ALA 95 Cb -0.14 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 2i5h h ALA 95 CO -0.07 0.36 0.33 0.00 0.00 0.00 0.00 179.25 179.87 2i5h h ALA 96 N 1.04 1.01 -0.68 0.00 0.00 -1.60 -1.64 119.26 117.41 2i5h h ALA 96 Ca 0.18 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2i5h h ALA 96 Cb 0.26 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2i5h h ALA 96 CO -0.01 0.63 0.24 0.87 0.00 0.00 0.00 179.25 180.98 2i5h h LYS 97 N 1.13 1.03 -0.78 0.00 1.57 -0.87 0.07 116.57 118.72 2i5h h LYS 97 Ca 0.26 -0.21 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 2i5h h LYS 97 Cb 0.19 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 2i5h h LYS 97 CO -0.02 0.88 0.29 1.15 -0.57 0.00 0.00 179.45 181.17 2i5h h THR 98 N 0.97 1.26 0.00 -0.16 2.02 -0.98 -3.05 112.91 112.98 2i5h h THR 98 Ca 0.22 -0.87 -0.11 0.00 0.77 0.00 0.00 66.41 66.42 2i5h h THR 98 Cb 0.26 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 2i5h h THR 98 CO -0.01 0.35 -0.53 -0.33 0.37 0.00 0.00 175.52 175.37 2i5h h GLU 99 N 1.15 0.00 -0.63 6.66 4.39 -1.00 -3.38 114.58 121.76 2i5h h GLU 99 Ca 0.26 0.00 0.10 0.00 0.34 0.00 0.00 59.36 60.06 2i5h h GLU 99 Cb 0.26 0.00 -0.11 0.00 -0.10 0.00 0.00 28.75 28.79 2i5h h GLU 99 CO -0.02 0.53 -0.40 1.25 -1.16 0.00 0.00 179.01 179.22 2i5h h LEU 100 N 0.00 -1.37 -1.34 1.33 5.85 -0.87 -0.78 115.31 118.13 2i5h h LEU 100 Ca -0.01 0.25 0.02 0.00 0.84 0.00 0.00 57.88 58.98 2i5h h LEU 100 Cb 1.30 0.65 -0.04 0.00 0.37 0.00 0.00 40.66 42.95 2i5h h LEU 100 CO 0.07 -0.32 0.46 1.55 -0.34 0.00 0.00 178.44 179.86 2i5h h PRO 101 N -0.18 0.87 -0.37 5.25 0.13 -1.76 -0.41 132.00 135.54 2i5h h PRO 101 Ca 0.22 -0.05 -0.15 0.00 -0.87 0.00 0.00 66.00 65.15 2i5h h PRO 101 Cb 0.56 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 31.49 2i5h h PRO 101 CO -0.72 0.58 -0.36 1.88 -0.23 0.00 0.00 178.00 179.14 2i5h h TYR 102 N 0.90 1.02 -0.25 1.56 0.05 -1.50 -2.05 116.97 116.70 2i5h h TYR 102 Ca 0.26 -0.29 -0.14 0.00 0.05 0.00 0.00 58.73 58.60 2i5h h TYR 102 Cb -0.04 -0.22 -0.00 0.00 1.01 0.00 0.00 36.73 37.48 2i5h h TYR 102 CO -0.00 1.09 -0.41 0.28 -1.05 0.00 0.00 178.16 178.07 2i5h h VAL 103 N 0.71 1.31 -0.79 -2.88 2.07 -0.78 -2.10 116.25 113.78 2i5h h VAL 103 Ca 0.07 -1.61 -0.01 0.00 0.82 0.00 0.00 66.70 65.96 2i5h h VAL 103 Cb 0.93 1.73 -0.04 0.00 -1.52 0.00 0.00 31.29 32.39 2i5h h VAL 103 CO 0.09 0.51 0.46 0.40 0.02 0.00 0.00 177.57 179.05 2i5h h ILE 104 N 0.43 1.23 -0.89 4.57 2.04 -1.08 -0.66 117.51 123.16 2i5h h ILE 104 Ca 0.02 -0.54 0.00 0.00 1.00 0.00 0.00 64.86 65.34 2i5h h ILE 104 Cb 1.01 0.15 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 2i5h h ILE 104 CO 0.09 0.25 0.56 -0.08 0.00 0.00 0.00 178.15 178.97 2i5h h GLU 105 N 1.09 1.19 -0.32 2.37 4.81 -1.29 -1.26 114.58 121.17 2i5h h GLU 105 Ca 0.28 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2i5h h GLU 105 Cb -0.01 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.10 2i5h h GLU 105 CO -0.05 0.81 0.19 1.25 -0.73 0.00 0.00 179.01 180.48 2i5h h HIS 106 N 1.21 0.42 -0.12 0.92 2.76 -0.64 -2.24 115.15 117.47 2i5h h HIS 106 Ca 0.32 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.50 2i5h h HIS 106 Cb -0.10 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 28.71 2i5h h HIS 106 CO -0.00 0.32 0.04 0.82 -1.30 0.00 0.00 177.93 177.80 2i5h h ILE 107 N 0.40 0.97 -0.04 6.26 2.04 -0.53 -2.66 117.51 123.95 2i5h h ILE 107 Ca 0.11 -0.03 -0.06 0.00 1.00 0.00 0.00 64.86 65.88 2i5h h ILE 107 Cb 0.02 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 2i5h h ILE 107 CO -0.02 0.02 -0.24 0.16 0.00 0.00 0.00 178.15 178.06 2i5h h ILE 108 N 0.09 1.20 0.00 -0.67 3.07 -1.16 -1.93 117.51 118.11 2i5h h ILE 108 Ca 0.05 -0.92 -0.00 0.00 1.55 0.00 0.00 64.86 65.54 2i5h h ILE 108 Cb 0.03 1.44 -0.00 0.00 -0.27 0.00 0.00 36.82 38.02 2i5h h ILE 108 CO -0.05 0.27 -0.01 0.11 -1.05 0.00 0.00 178.15 177.41 2i5h h LYS 109 N 0.07 0.00 -0.01 0.16 1.57 -1.09 -1.59 116.57 115.68 2i5h h LYS 109 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2i5h h LYS 109 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 2i5h h LYS 109 CO 0.03 0.01 -0.13 1.04 -0.57 0.00 0.00 179.45 179.84 2i5h n GLN 110 N -3.11 0.98 -2.70 3.15 1.13 -0.73 -3.91 117.38 112.19 2i5h n GLN 110 Ca 0.01 -0.48 -0.06 0.00 -1.94 0.00 0.00 57.00 54.53 2i5h n GLN 110 Cb 0.32 -1.49 0.07 0.00 0.11 0.00 0.00 30.24 29.25 2i5h n GLN 110 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 2i5h n ASP 111 N -0.59 0.31 -0.28 1.08 2.03 -0.85 -4.96 116.55 113.28 2i5h n ASP 111 Ca 0.15 -2.47 0.07 0.00 0.52 0.00 0.00 54.79 53.06 2i5h n ASP 111 Cb 0.31 0.00 0.22 0.00 -0.72 0.00 0.00 41.12 40.93 2i5h n ASP 111 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 2i5h h GLU 112 N 2.47 0.52 -0.69 -0.67 4.81 -1.43 -2.40 114.58 117.18 2i5h h GLU 112 Ca -0.19 -0.03 0.13 0.00 -0.13 0.00 0.00 59.36 59.14 2i5h h GLU 112 Cb 1.24 -0.12 -0.13 0.00 0.63 0.00 0.00 28.75 30.37 2i5h h GLU 112 CO 0.23 0.34 -0.24 -0.22 -0.73 0.00 0.00 179.01 178.39 2i5h h LYS 113 N 0.53 -0.05 -0.46 1.92 1.63 -1.93 0.16 116.57 118.37 2i5h h LYS 113 Ca 0.46 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 60.23 2i5h h LYS 113 Cb 0.69 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 32.31 2i5h h LYS 113 CO -0.40 -0.03 0.14 0.87 -3.45 0.00 0.00 179.45 176.58 2i5h h LYS 114 N -0.05 0.68 0.13 1.90 1.79 -1.81 -2.36 116.57 116.85 2i5h h LYS 114 Ca 0.31 -0.11 -0.33 0.00 -2.18 0.00 0.00 60.65 58.34 2i5h h LYS 114 Cb 0.54 -0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 31.07 2i5h h LYS 114 CO -0.74 0.60 -1.75 1.88 -1.08 0.00 0.00 179.45 178.36 2i5h h TYR 115 N 0.67 0.49 0.00 -1.35 -1.99 -1.31 -3.19 116.97 110.28 2i5h h TYR 115 Ca 0.16 -0.36 0.00 0.00 2.00 0.00 0.00 58.73 60.53 2i5h h TYR 115 Cb 0.20 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 38.91 2i5h h TYR 115 CO 0.01 1.54 0.00 -0.39 -0.00 0.00 0.00 178.16 179.32 2i5h h VAL 116 N 0.07 0.00 -0.03 -2.88 -1.51 -0.75 0.11 116.25 111.26 2i5h h VAL 116 Ca -0.33 -0.21 -0.18 0.00 -1.23 0.00 0.00 66.70 64.76 2i5h h VAL 116 Cb 2.05 1.09 -0.01 0.00 -2.13 0.00 0.00 31.29 32.29 2i5h h VAL 116 CO 0.14 0.00 -0.76 -0.78 -1.23 0.00 0.00 177.57 174.94 2i5h h ASP 117 N 0.00 0.27 -0.74 4.19 1.82 -1.44 -3.01 116.42 117.51 2i5h h ASP 117 Ca 0.00 -0.19 0.00 0.00 -0.39 0.00 0.00 57.03 56.45 2i5h h ASP 117 Cb 0.23 -0.08 -0.04 0.00 0.68 0.00 0.00 39.33 40.12 2i5h h ASP 117 CO 0.00 0.93 0.48 0.15 -1.61 0.00 0.00 179.24 179.19 2i5h h PHE 118 N 0.14 0.95 0.59 0.28 3.57 -0.78 -3.13 116.94 118.56 2i5h h PHE 118 Ca -0.03 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 2i5h h PHE 118 Cb 1.34 -0.32 0.01 0.00 2.79 0.00 0.00 35.95 39.76 2i5h h PHE 118 CO 0.03 0.61 -0.28 0.74 -2.23 0.00 0.00 178.31 177.17 2i5h h PHE 119 N 1.01 -0.73 -2.04 0.41 -1.00 -1.49 -3.23 116.94 109.87 2i5h h PHE 119 Ca 0.27 -0.02 -0.79 0.00 2.81 0.00 0.00 57.97 60.25 2i5h h PHE 119 Cb -0.10 0.24 -0.22 0.00 3.61 0.00 0.00 35.95 39.49 2i5h h PHE 119 CO -0.02 -0.40 1.46 0.27 -1.61 0.00 0.00 178.31 178.01 2i5h n ASN 120 N -5.35 6.83 0.00 2.17 6.94 -1.14 -5.01 115.26 119.69 2i5h n ASN 120 Ca -0.12 -3.38 0.00 0.00 -0.02 0.00 0.00 54.58 51.06 2i5h n ASN 120 Cb 0.34 -1.30 0.00 0.00 -2.36 0.00 0.00 39.78 36.47 2i5h n ASN 120 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 2i5h n ASP 123 N 1.46 0.00 -3.12 0.53 4.64 -1.22 -4.91 116.55 113.93 2i5h n ASP 123 Ca 0.43 0.00 -0.09 0.00 -1.38 0.00 0.00 54.79 53.75 2i5h n ASP 123 Cb 0.30 0.00 0.09 0.00 -1.04 0.00 0.00 41.12 40.46 2i5h n ASP 123 CO 0.00 0.00 0.00 -1.54 -0.82 0.00 0.00 177.20 174.84 2i5h n SER 124 N 0.00 -2.37 -4.44 1.67 3.41 -1.26 -4.89 113.62 105.74 2i5h n SER 124 Ca 0.00 -0.25 -0.22 0.00 -0.26 0.00 0.00 58.87 58.13 2i5h n SER 124 Cb 0.00 -0.32 -0.10 0.00 -0.26 0.00 0.00 64.21 63.52 2i5h n SER 124 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 2i5h s ILE 125 N -1.26 2.15 0.00 -1.33 2.07 -1.26 -4.05 121.20 117.52 2i5h s ILE 125 Ca 0.19 -2.29 0.00 0.00 -1.41 0.00 0.00 60.65 57.14 2i5h s ILE 125 Cb -0.03 -2.30 0.00 0.00 0.13 0.00 0.00 42.46 40.26 2i5h s ILE 125 CO 0.16 -0.41 0.00 0.41 -1.91 0.00 0.00 174.94 173.19 2i5h n THR 126 N -0.58 0.00 0.00 4.00 -1.04 -0.88 -4.91 114.28 110.87 2i5h n THR 126 Ca -0.06 0.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 2i5h n THR 126 Cb 0.61 -0.93 0.00 0.00 -1.82 0.00 0.00 70.33 68.19 2i5h n THR 126 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 2i5h n THR 127 N -1.46 0.00 -0.68 12.58 5.66 -1.26 -4.90 114.28 124.23 2i5h n THR 127 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2i5h n THR 127 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 2i5h n THR 127 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2i5h n ARG 128 N 0.00 -0.46 -3.71 1.09 5.12 -1.26 -4.84 116.66 112.60 2i5h n ARG 128 Ca 0.00 0.12 -0.11 0.00 -1.93 0.00 0.00 57.85 55.92 2i5h n ARG 128 Cb 0.00 -4.39 -0.12 0.00 -1.16 0.00 0.00 32.46 26.79 2i5h n ARG 128 CO 0.00 0.00 0.00 1.41 -1.93 0.00 0.00 177.63 177.11 2i5h s MET 129 N -1.11 0.33 0.06 5.56 -2.45 -1.26 -5.16 119.30 115.26 2i5h s MET 129 Ca 0.00 0.67 0.03 0.00 -1.25 0.00 0.00 55.69 55.15 2i5h s MET 129 Cb 0.00 -0.04 -0.04 0.00 1.25 0.00 0.00 34.83 36.00 2i5h s MET 129 CO 0.00 -0.15 0.03 -1.58 1.05 0.00 0.00 175.02 174.37 2i5h s HIS 130 N 1.25 3.09 0.33 4.11 2.46 -1.26 -2.07 115.29 123.20 2i5h s HIS 130 Ca -0.09 0.05 0.06 0.00 0.47 0.00 0.00 55.06 55.55 2i5h s HIS 130 Cb -0.09 -1.61 0.72 0.00 -0.13 0.00 0.00 32.58 31.48 2i5h s HIS 130 CO -0.10 0.49 1.87 1.96 -2.47 0.00 0.00 174.74 176.49 2i5h h GLN 131 N 3.65 0.78 -0.21 2.88 4.20 -1.91 -0.20 115.11 124.31 2i5h h GLN 131 Ca -0.48 -0.05 0.06 0.00 0.06 0.00 0.00 58.65 58.25 2i5h h GLN 131 Cb 1.17 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 28.76 2i5h h GLN 131 CO 0.61 0.51 0.17 -0.07 -0.67 0.00 0.00 178.83 179.39 2i5h h LEU 132 N 0.80 0.00 -0.49 1.46 3.38 -1.92 0.27 115.31 118.81 2i5h h LEU 132 Ca 0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.42 2i5h h LEU 132 Cb 0.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2i5h h LEU 132 CO -0.21 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.70 2i5h n GLU 133 N -4.24 0.22 0.24 1.13 1.02 -0.09 -2.14 120.64 116.78 2i5h n GLU 133 Ca 0.02 0.36 0.11 0.00 -0.02 0.00 0.00 57.16 57.63 2i5h n GLU 133 Cb 0.31 -1.85 0.54 0.00 -0.02 0.00 0.00 31.44 30.41 2i5h n GLU 133 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2i5h h LEU 134 N 0.00 0.00 -9.08 -4.62 3.38 -0.52 -3.42 115.31 101.05 2i5h h LEU 134 Ca 0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 2i5h h LEU 134 Cb 0.48 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.19 2i5h h LEU 134 CO 0.00 0.18 0.95 -0.76 0.09 0.00 0.00 178.44 178.89 2i5h s LEU 135 N -6.76 4.07 -0.02 1.67 1.43 -0.91 -4.90 118.68 113.27 2i5h s LEU 135 Ca 0.00 1.55 -0.34 0.00 -1.03 0.00 0.00 54.13 54.32 2i5h s LEU 135 Cb 0.10 -3.54 -0.12 0.00 0.03 0.00 0.00 46.19 42.67 2i5h s LEU 135 CO 0.61 -0.90 1.83 -2.65 0.23 0.00 0.00 176.35 175.47 2i5h n PRO 136 N 6.92 2.27 -0.03 1.29 -0.02 -1.26 -1.44 135.00 142.73 2i5h n PRO 136 Ca 0.15 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 2i5h n PRO 136 Cb 0.45 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 2i5h n PRO 136 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2i5h n GLY 137 N 4.22 0.99 2.74 -1.23 0.00 -1.26 -4.80 105.19 105.84 2i5h n GLY 137 Ca 0.21 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 2i5h n GLY 137 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2i5h s VAL 138 N -2.00 0.74 0.00 1.61 1.01 -0.52 -4.89 120.40 116.35 2i5h s VAL 138 Ca 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 61.98 60.92 2i5h s VAL 138 Cb 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 36.38 34.96 2i5h s VAL 138 CO 0.00 -0.48 0.00 0.61 0.00 0.00 0.00 175.10 175.23 2i5h n GLY 139 N 4.93 2.67 0.28 4.51 0.00 -1.26 -4.20 105.19 112.12 2i5h n GLY 139 Ca -0.05 -2.13 -0.04 0.00 0.00 0.00 0.00 46.02 43.80 2i5h n GLY 139 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2i5h h LYS 140 N 0.00 -0.11 -0.13 1.61 1.79 -1.99 0.70 116.57 118.43 2i5h h LYS 140 Ca 0.00 0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.50 2i5h h LYS 140 Cb 0.00 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.66 2i5h h LYS 140 CO 0.00 -0.08 0.01 -0.22 -1.08 0.00 0.00 179.45 178.08 2i5h h LYS 141 N -0.12 0.06 -0.59 3.15 3.64 -2.00 -2.57 116.57 118.14 2i5h h LYS 141 Ca 0.23 -0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.56 2i5h h LYS 141 Cb 0.48 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 2i5h h LYS 141 CO -0.57 0.04 0.17 1.98 -2.27 0.00 0.00 179.45 178.80 2i5h h MET 142 N 0.06 0.92 -0.36 1.90 4.05 -1.77 -1.93 114.93 117.80 2i5h h MET 142 Ca 0.06 -0.21 0.01 0.00 -0.28 0.00 0.00 59.70 59.29 2i5h h MET 142 Cb 0.07 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 30.71 2i5h h MET 142 CO -0.10 0.84 0.21 0.00 0.23 0.00 0.00 176.91 178.09 2i5h h MET 143 N 0.84 0.42 -0.25 0.39 -0.00 -0.76 0.23 114.93 115.80 2i5h h MET 143 Ca 0.19 -0.03 -0.06 0.00 -0.00 0.00 0.00 59.70 59.81 2i5h h MET 143 Cb 0.30 -0.10 -0.01 0.00 -0.00 0.00 0.00 31.60 31.79 2i5h h MET 143 CO -0.00 0.28 -0.09 -1.49 -0.00 0.00 0.00 176.91 175.61 2i5h h TRP 144 N 0.44 0.43 -0.56 -0.10 4.06 -1.37 0.95 115.95 119.80 2i5h h TRP 144 Ca 0.14 -0.05 -0.08 0.00 2.06 0.00 0.00 58.89 60.96 2i5h h TRP 144 Cb -0.00 -0.12 -0.02 0.00 -1.00 0.00 0.00 29.16 28.01 2i5h h TRP 144 CO -0.07 0.50 0.04 0.00 -3.56 0.00 0.00 178.44 175.35 2i5h h ALA 145 N 1.52 1.02 -0.27 1.49 0.00 -0.53 0.23 119.26 122.73 2i5h h ALA 145 Ca 0.08 -0.27 -0.19 0.00 0.00 0.00 0.00 54.91 54.53 2i5h h ALA 145 Cb 0.40 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2i5h h ALA 145 CO 0.02 0.61 -0.56 0.82 0.00 0.00 0.00 179.25 180.14 2i5h h ILE 146 N 0.86 1.28 -0.39 0.00 2.04 -0.20 -2.94 117.51 118.17 2i5h h ILE 146 Ca 0.17 -1.75 -0.13 0.00 1.00 0.00 0.00 64.86 64.15 2i5h h ILE 146 Cb 0.46 1.69 -0.01 0.00 -0.74 0.00 0.00 36.82 38.21 2i5h h ILE 146 CO 0.02 0.57 -0.28 0.40 0.00 0.00 0.00 178.15 178.85 2i5h h ILE 147 N 0.63 1.28 -0.74 -0.67 2.04 -0.56 -1.70 117.51 117.78 2i5h h ILE 147 Ca 0.01 -1.43 -0.01 0.00 1.00 0.00 0.00 64.86 64.42 2i5h h ILE 147 Cb 1.18 1.28 -0.04 0.00 -0.74 0.00 0.00 36.82 38.50 2i5h h ILE 147 CO 0.12 0.48 0.40 -0.33 0.00 0.00 0.00 178.15 178.83 2i5h h GLU 148 N 0.71 1.03 0.08 2.37 5.08 -0.53 -2.66 114.58 120.66 2i5h h GLU 148 Ca 0.08 -0.11 -0.25 0.00 -1.00 0.00 0.00 59.36 58.08 2i5h h GLU 148 Cb 0.82 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2i5h h GLU 148 CO 0.07 0.76 -1.12 1.05 -1.00 0.00 0.00 179.01 178.77 2i5h h GLU 149 N 1.04 0.27 -0.77 2.33 9.09 -1.41 -3.28 114.58 121.85 2i5h h GLU 149 Ca 0.26 -0.40 0.07 0.00 0.05 0.00 0.00 59.36 59.34 2i5h h GLU 149 Cb 0.03 0.14 -0.05 0.00 -1.65 0.00 0.00 28.75 27.22 2i5h h GLU 149 CO -0.04 1.15 0.50 -0.09 0.05 0.00 0.00 179.01 180.58 2i5h h ARG 150 N 0.10 0.78 0.28 1.06 2.43 -0.97 -2.93 114.38 115.14 2i5h h ARG 150 Ca -0.10 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 2i5h h ARG 150 Cb 1.82 -0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 31.16 2i5h h ARG 150 CO 0.18 0.52 -0.49 0.87 -1.51 0.00 0.00 179.97 179.54 2i5h h LYS 151 N 0.81 -0.80 0.00 0.20 1.79 -1.56 -3.24 116.57 113.76 2i5h h LYS 151 Ca 0.33 0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.86 2i5h h LYS 151 Cb 0.26 0.18 0.00 0.00 -1.58 0.00 0.00 32.23 31.10 2i5h h LYS 151 CO -0.12 -0.53 0.00 1.63 -1.08 0.00 0.00 179.45 179.35 2i5h n LYS 152 N -5.51 0.00 -3.81 3.15 5.02 -1.11 -4.72 118.16 111.19 2i5h n LYS 152 Ca -0.10 0.64 -0.13 0.00 -2.02 0.00 0.00 58.31 56.71 2i5h n LYS 152 Cb 0.42 -1.17 -0.13 0.00 -0.02 0.00 0.00 35.03 34.13 2i5h n LYS 152 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2i5h s ARG 153 N -1.68 0.12 0.46 1.97 1.70 -1.22 -5.14 118.95 115.15 2i5h s ARG 153 Ca 0.00 0.22 -0.25 0.00 -0.47 0.00 0.00 55.73 55.23 2i5h s ARG 153 Cb 0.00 -0.01 -0.08 0.00 -0.57 0.00 0.00 34.95 34.29 2i5h s ARG 153 CO 0.00 -0.06 1.39 -0.35 -1.08 0.00 0.00 175.30 175.20 2i5h n PRO 154 N 3.39 2.10 -1.93 3.89 -0.04 -1.25 -4.61 135.00 136.55 2i5h n PRO 154 Ca -0.17 0.75 -0.39 0.00 -0.04 0.00 0.00 63.50 63.65 2i5h n PRO 154 Cb 0.57 -2.58 0.01 0.00 -0.04 0.00 0.00 33.50 31.46 2i5h n PRO 154 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2i5h s PHE 155 N -1.21 2.62 -1.51 0.54 0.40 -1.26 -4.93 117.98 112.64 2i5h s PHE 155 Ca 0.63 1.34 0.13 0.00 -0.60 0.00 0.00 56.93 58.44 2i5h s PHE 155 Cb -0.45 -3.78 0.19 0.00 0.51 0.00 0.00 43.02 39.49 2i5h s PHE 155 CO 0.56 -2.50 1.05 -0.85 0.70 0.00 0.00 175.22 174.18 2i5h n GLU 156 N -0.11 1.50 -3.07 0.44 0.00 -1.26 -4.95 120.64 113.19 2i5h n GLU 156 Ca 0.05 -1.58 0.00 0.00 0.00 0.00 0.00 57.16 55.63 2i5h n GLU 156 Cb 0.43 -1.28 0.00 0.00 0.00 0.00 0.00 31.44 30.59 2i5h n GLU 156 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 2i5h n SER 157 N 0.75 0.00 0.02 -1.84 3.41 -1.26 -4.97 113.62 109.73 2i5h n SER 157 Ca 0.10 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.52 2i5h n SER 157 Cb 0.38 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.19 2i5h n SER 157 CO 0.00 0.00 0.00 2.19 -0.16 0.00 0.00 175.04 177.07 2i5h h PHE 158 N 0.00 0.44 -0.51 7.33 -0.00 -1.97 -2.94 116.94 119.29 2i5h h PHE 158 Ca 0.00 -0.31 0.00 0.00 -0.00 0.00 0.00 57.97 57.66 2i5h h PHE 158 Cb 0.00 -0.02 -0.03 0.00 -0.00 0.00 0.00 35.95 35.90 2i5h h PHE 158 CO 0.00 1.22 0.32 1.49 -0.00 0.00 0.00 178.31 181.35 2i5h h GLU 159 N -0.47 0.69 -0.26 6.09 4.57 -1.98 -0.25 114.58 122.96 2i5h h GLU 159 Ca -0.11 -0.05 -0.06 0.00 -1.18 0.00 0.00 59.36 57.97 2i5h h GLU 159 Cb 1.47 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 29.90 2i5h h GLU 159 CO 0.12 0.47 -0.10 0.22 -1.18 0.00 0.00 179.01 178.54 2i5h h ASP 160 N 0.70 0.40 -0.03 1.04 3.58 -1.93 -1.10 116.42 119.08 2i5h h ASP 160 Ca 0.19 -0.09 -0.16 0.00 0.42 0.00 0.00 57.03 57.38 2i5h h ASP 160 Cb -0.05 -0.10 0.01 0.00 1.72 0.00 0.00 39.33 40.91 2i5h h ASP 160 CO -0.04 0.54 -0.62 0.40 -2.88 0.00 0.00 179.24 176.64 2i5h h ILE 161 N 0.39 1.39 0.00 2.25 2.04 -0.92 -2.15 117.51 120.52 2i5h h ILE 161 Ca 0.08 -2.02 -0.03 0.00 1.00 0.00 0.00 64.86 63.88 2i5h h ILE 161 Cb 0.42 2.45 -0.00 0.00 -0.74 0.00 0.00 36.82 38.95 2i5h h ILE 161 CO 0.02 0.60 -0.16 0.00 0.00 0.00 0.00 178.15 178.61 2i5h h ALA 162 N 0.38 1.12 0.13 1.87 0.00 -0.98 -0.85 119.26 120.92 2i5h h ALA 162 Ca -0.07 -0.15 -0.31 0.00 0.00 0.00 0.00 54.91 54.38 2i5h h ALA 162 Cb 1.31 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 2i5h h ALA 162 CO 0.12 0.21 -1.59 -0.56 0.00 0.00 0.00 179.25 177.43 2i5h h GLN 163 N 0.00 0.27 0.01 0.00 -0.00 -1.22 -3.41 115.11 110.76 2i5h h GLN 163 Ca -0.00 -0.46 -0.00 0.00 -0.00 0.00 0.00 58.65 58.18 2i5h h GLN 163 Cb 0.55 0.17 0.00 0.00 -0.00 0.00 0.00 27.48 28.20 2i5h h GLN 163 CO 0.02 1.22 -0.00 0.00 -0.00 0.00 0.00 178.83 180.07 2i5h h ARG 164 N -0.18 -0.01 -6.15 0.06 3.08 -1.37 -3.41 114.38 106.40 2i5h h ARG 164 Ca -0.34 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.20 2i5h h ARG 164 Cb 1.87 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 31.86 2i5h h ARG 164 CO 0.08 0.73 1.19 0.14 -1.07 0.00 0.00 179.97 181.03 2i5h s VAL 165 N -2.21 3.59 0.29 2.04 -7.23 -0.33 -4.96 120.40 111.59 2i5h s VAL 165 Ca -0.15 0.16 -0.30 0.00 -1.81 0.00 0.00 61.98 59.88 2i5h s VAL 165 Cb -0.02 -4.51 -0.10 0.00 0.56 0.00 0.00 36.38 32.30 2i5h s VAL 165 CO 0.53 -1.46 1.45 -0.54 -0.31 0.00 0.00 175.10 174.78 2i5h s LYS 166 N 6.23 4.23 0.00 4.82 3.01 -1.26 -2.67 119.74 134.10 2i5h s LYS 166 Ca 0.50 2.38 0.00 0.00 -1.01 0.00 0.00 55.97 57.84 2i5h s LYS 166 Cb -0.09 -3.07 0.00 0.00 -1.01 0.00 0.00 37.83 33.66 2i5h s LYS 166 CO 0.13 -0.44 0.00 0.41 0.51 0.00 0.00 175.35 175.96 2i5h n GLY 167 N 1.74 0.63 3.72 -3.33 0.00 -1.26 -4.99 105.19 101.71 2i5h n GLY 167 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2i5h n GLY 167 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2i5h s ILE 168 N -2.89 4.02 0.81 -0.61 2.07 -1.09 -5.00 121.20 118.50 2i5h s ILE 168 Ca 0.00 1.56 -0.12 0.00 -1.41 0.00 0.00 60.65 60.68 2i5h s ILE 168 Cb 0.00 -4.00 0.08 0.00 0.13 0.00 0.00 42.46 38.67 2i5h s ILE 168 CO 0.00 0.18 1.15 -1.58 -1.91 0.00 0.00 174.94 172.78 2i5h s GLN 169 N 0.47 1.79 -0.03 3.50 0.74 -1.26 -4.82 119.66 120.05 2i5h s GLN 169 Ca 0.54 1.50 -0.38 0.00 0.05 0.00 0.00 55.36 57.08 2i5h s GLN 169 Cb -0.29 -1.82 -0.17 0.00 1.10 0.00 0.00 33.01 31.83 2i5h s GLN 169 CO 0.32 -2.05 1.41 0.54 -0.55 0.00 0.00 175.29 174.96 2i5h n ARG 170 N -3.48 0.97 -0.11 1.67 5.12 -1.26 -4.82 116.66 114.76 2i5h n ARG 170 Ca 0.11 0.35 0.08 0.00 -1.93 0.00 0.00 57.85 56.47 2i5h n ARG 170 Cb 0.52 -1.98 0.43 0.00 -1.16 0.00 0.00 32.46 30.26 2i5h n ARG 170 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2i5h h PRO 171 N 4.99 0.56 -0.52 5.56 0.13 -1.87 -1.72 132.00 139.12 2i5h h PRO 171 Ca -0.48 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 64.59 2i5h h PRO 171 Cb 1.34 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 2i5h h PRO 171 CO 0.81 0.37 0.23 0.93 -0.23 0.00 0.00 178.00 180.11 2i5h h GLU 172 N 0.58 0.77 -0.68 0.86 3.07 -1.95 -1.23 114.58 116.00 2i5h h GLU 172 Ca 0.27 -0.13 -0.04 0.00 -0.50 0.00 0.00 59.36 58.97 2i5h h GLU 172 Cb 0.33 -0.13 -0.03 0.00 -0.84 0.00 0.00 28.75 28.08 2i5h h GLU 172 CO -0.08 0.66 0.28 -0.22 -1.40 0.00 0.00 179.01 178.24 2i5h h LYS 173 N 0.70 1.00 -0.43 2.33 3.64 -1.69 0.13 116.57 122.25 2i5h h LYS 173 Ca 0.18 -0.16 -0.03 0.00 -1.27 0.00 0.00 60.65 59.37 2i5h h LYS 173 Cb 0.16 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.79 2i5h h LYS 173 CO -0.02 0.81 0.16 -0.07 -2.27 0.00 0.00 179.45 178.06 2i5h h LEU 174 N 0.98 0.61 -0.16 5.20 3.38 -1.00 -0.49 115.31 123.83 2i5h h LEU 174 Ca 0.23 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 2i5h h LEU 174 Cb 0.18 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2i5h h LEU 174 CO -0.02 0.63 0.04 0.40 0.09 0.00 0.00 178.44 179.58 2i5h h ILE 175 N 0.55 1.20 -0.78 1.22 1.08 -0.69 -2.18 117.51 117.91 2i5h h ILE 175 Ca 0.14 -0.64 0.05 0.00 -0.39 0.00 0.00 64.86 64.03 2i5h h ILE 175 Cb 0.22 1.31 -0.06 0.00 -3.07 0.00 0.00 36.82 35.23 2i5h h ILE 175 CO -0.01 0.19 0.47 0.58 -0.69 0.00 0.00 178.15 178.70 2i5h h VAL 176 N 0.07 1.04 -0.83 1.67 2.07 -0.63 -0.64 116.25 119.01 2i5h h VAL 176 Ca 0.05 -0.30 0.01 0.00 0.82 0.00 0.00 66.70 67.28 2i5h h VAL 176 Cb 0.26 0.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.07 2i5h h VAL 176 CO 0.00 0.16 0.55 0.28 0.02 0.00 0.00 177.57 178.58 2i5h h SER 177 N 0.88 0.95 -0.22 0.57 0.02 -0.92 -0.82 113.55 114.02 2i5h h SER 177 Ca 0.33 -0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 61.20 2i5h h SER 177 Cb 0.13 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 2i5h h SER 177 CO -0.16 0.69 -0.08 -0.09 -1.14 0.00 0.00 176.83 176.05 2i5h h ARG 178 N 1.12 0.44 -0.27 3.45 9.65 -0.71 -1.37 114.38 126.69 2i5h h ARG 178 Ca 0.31 -0.18 0.02 0.00 -1.10 0.00 0.00 59.98 59.02 2i5h h ARG 178 Cb -0.12 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.42 2i5h h ARG 178 CO -0.07 0.70 0.13 0.82 2.80 0.00 0.00 179.97 184.35 2i5h h ILE 179 N 0.15 0.98 -0.80 1.20 2.04 -0.90 -0.53 117.51 119.65 2i5h h ILE 179 Ca 0.05 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 2i5h h ILE 179 Cb 0.56 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 37.29 2i5h h ILE 179 CO 0.03 0.05 0.47 0.40 0.00 0.00 0.00 178.15 179.09 2i5h h ILE 180 N 0.27 1.23 -0.46 -0.67 2.04 -1.14 -0.63 117.51 118.15 2i5h h ILE 180 Ca 0.11 -0.53 -0.00 0.00 1.00 0.00 0.00 64.86 65.44 2i5h h ILE 180 Cb 0.04 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.21 2i5h h ILE 180 CO -0.08 0.25 0.28 0.22 0.00 0.00 0.00 178.15 178.82 2i5h h TYR 181 N 1.11 0.60 -0.63 1.37 3.20 -0.40 -1.27 116.97 120.95 2i5h h TYR 181 Ca 0.29 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 62.08 2i5h h TYR 181 Cb -0.02 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.03 2i5h h TYR 181 CO 0.01 0.41 0.07 0.93 -1.64 0.00 0.00 178.16 177.94 2i5h h GLU 182 N 0.61 1.06 -0.81 1.82 5.08 -0.56 0.18 114.58 121.97 2i5h h GLU 182 Ca 0.17 -0.30 -0.02 0.00 -1.00 0.00 0.00 59.36 58.21 2i5h h GLU 182 Cb -0.02 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.07 2i5h h GLU 182 CO -0.03 1.00 0.44 0.82 -1.00 0.00 0.00 179.01 180.24 2i5h h ILE 183 N 0.97 1.24 0.00 3.13 2.04 -0.82 -2.36 117.51 121.71 2i5h h ILE 183 Ca 0.19 -0.60 -0.10 0.00 1.00 0.00 0.00 64.86 65.35 2i5h h ILE 183 Cb 0.47 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2i5h h ILE 183 CO 0.02 0.27 -0.46 0.11 0.00 0.00 0.00 178.15 178.09 2i5h h LYS 184 N 1.13 0.00 -2.48 2.37 1.57 -0.92 -3.39 116.57 114.85 2i5h h LYS 184 Ca 0.29 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.46 2i5h h LYS 184 Cb 0.03 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 31.93 2i5h h LYS 184 CO -0.05 0.46 -0.68 0.09 -0.57 0.00 0.00 179.45 178.71 2i5h n ASN 185 N -3.28 2.76 0.22 0.86 4.13 0.02 -4.91 115.26 115.06 2i5h n ASN 185 Ca 0.02 -3.19 0.15 0.00 1.68 0.00 0.00 54.58 53.23 2i5h n ASN 185 Cb 0.68 -0.69 0.80 0.00 -1.54 0.00 0.00 39.78 39.02 2i5h n ASN 185 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2i5h h PRO 186 N 4.68 0.00 -0.01 3.52 0.13 -1.73 -0.50 132.00 138.09 2i5h h PRO 186 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2i5h h PRO 186 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 2i5h h PRO 186 CO 0.72 0.00 -0.23 0.00 -0.23 0.00 0.00 178.00 178.26 2i5h n GLN 187 N -2.53 0.92 -1.71 0.86 0.00 -1.26 -4.92 117.38 108.75 2i5h n GLN 187 Ca -0.02 -0.54 -0.40 0.00 0.00 0.00 0.00 57.00 56.04 2i5h n GLN 187 Cb 0.05 -1.49 0.03 0.00 0.00 0.00 0.00 30.24 28.83 2i5h n GLN 187 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 2i5h n THR 188 N -0.56 3.05 0.19 -0.39 5.66 -0.20 -4.88 114.28 117.14 2i5h n THR 188 Ca 0.13 -0.50 0.04 0.00 -3.05 0.00 0.00 64.05 60.67 2i5h n THR 188 Cb 0.35 -1.57 0.43 0.00 -1.55 0.00 0.00 70.33 67.99 2i5h n THR 188 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 175.07 172.52 2i5h h LYS 189 N 1.75 0.03 -5.21 1.09 3.64 -1.91 -3.42 116.57 112.54 2i5h h LYS 189 Ca -0.49 -0.01 -0.66 0.00 -1.27 0.00 0.00 60.65 58.22 2i5h h LYS 189 Cb 1.30 -0.00 -0.30 0.00 -0.41 0.00 0.00 32.23 32.82 2i5h h LYS 189 CO 0.58 0.28 -0.80 0.71 -2.27 0.00 0.00 179.45 177.95 2i5h s TYR 190 N -4.48 2.78 -0.68 1.91 2.02 -1.26 -5.06 117.35 112.58 2i5h s TYR 190 Ca -0.04 -0.98 -0.01 0.00 -0.37 0.00 0.00 57.07 55.66 2i5h s TYR 190 Cb 0.15 -1.88 0.17 0.00 -0.40 0.00 0.00 41.96 40.01 2i5h s TYR 190 CO 0.71 -0.44 0.50 0.15 -1.57 0.00 0.00 175.55 174.91 2i5h s LYS 191 N 0.73 2.66 0.08 -0.62 -0.14 -1.26 -4.94 119.74 116.25 2i5h s LYS 191 Ca -0.07 -2.76 -0.16 0.00 -1.36 0.00 0.00 55.97 51.63 2i5h s LYS 191 Cb -0.15 -3.72 -0.11 0.00 -1.68 0.00 0.00 37.83 32.17 2i5h s LYS 191 CO 0.01 -1.20 1.38 -0.07 -0.76 0.00 0.00 175.35 174.72 2i5h h LEU 192 N 6.64 0.70 -0.34 3.17 3.38 -1.97 -3.33 115.31 123.57 2i5h h LEU 192 Ca 0.03 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2i5h h LEU 192 Cb 0.90 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.46 2i5h h LEU 192 CO 0.74 1.06 0.00 0.49 0.09 0.00 0.00 178.44 180.82 2i5h n PHE 193 N -4.28 0.00 -0.44 1.13 3.72 -1.26 -4.73 117.46 111.60 2i5h n PHE 193 Ca -0.05 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.40 2i5h n PHE 193 Cb 0.49 0.00 0.13 0.00 -0.94 0.00 0.00 39.48 39.15 2i5h n PHE 193 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2i5h n THR 194 N -0.59 1.41 0.33 4.37 -2.24 -1.26 -4.57 114.28 111.74 2i5h n THR 194 Ca 0.00 -1.39 0.03 0.00 -2.27 0.00 0.00 64.05 60.41 2i5h n THR 194 Cb 0.01 0.22 0.16 0.00 -2.10 0.00 0.00 70.33 68.62 2i5h n THR 194 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50