#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i6a s VAL 4 N 0.00 1.71 0.66 0.44 -7.23 -1.26 -5.13 120.40 109.59 2i6a s VAL 4 Ca 0.00 -1.22 -0.02 0.00 -1.81 0.00 0.00 61.98 58.93 2i6a s VAL 4 Cb 0.00 -1.48 0.07 0.00 0.56 0.00 0.00 36.38 35.53 2i6a s VAL 4 CO 0.00 0.22 0.93 -0.13 -0.31 0.00 0.00 175.10 175.81 2i6a s ARG 5 N -1.18 2.12 0.63 4.82 3.00 -1.26 -4.64 118.95 122.44 2i6a s ARG 5 Ca 0.08 -0.70 -0.17 0.00 0.00 0.00 0.00 55.73 54.94 2i6a s ARG 5 Cb -0.09 -2.32 -0.01 0.00 0.00 0.00 0.00 34.95 32.53 2i6a s ARG 5 CO 0.02 -1.15 1.14 -1.83 0.00 0.00 0.00 175.30 173.49 2i6a s GLU 6 N -5.06 2.84 -0.52 3.54 -1.05 -1.26 -2.92 118.70 114.28 2i6a s GLU 6 Ca 0.61 1.56 0.00 0.00 -0.15 0.00 0.00 54.97 57.00 2i6a s GLU 6 Cb -0.09 -1.94 0.00 0.00 -0.44 0.00 0.00 34.13 31.66 2i6a s GLU 6 CO 0.42 -1.25 0.00 0.09 0.95 0.00 0.00 175.26 175.48 2i6a n ASN 7 N -2.09 -4.62 -0.01 0.83 4.13 0.39 -4.86 115.26 109.03 2i6a n ASN 7 Ca 0.12 0.12 -0.01 0.00 1.68 0.00 0.00 54.58 56.48 2i6a n ASN 7 Cb 0.51 -2.55 0.26 0.00 -1.54 0.00 0.00 39.78 36.46 2i6a n ASN 7 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 2i6a h ILE 8 N 0.00 1.22 -3.47 2.41 2.10 -1.11 -2.70 117.51 115.96 2i6a h ILE 8 Ca -0.10 -0.91 -0.62 0.00 1.08 0.00 0.00 64.86 64.31 2i6a h ILE 8 Cb 0.66 1.02 -0.16 0.00 -1.09 0.00 0.00 36.82 37.25 2i6a h ILE 8 CO 0.15 0.31 -0.55 -0.22 -1.08 0.00 0.00 178.15 176.76 2i6a s LEU 9 N -8.99 3.88 -0.12 2.19 0.20 -0.84 0.09 118.68 115.10 2i6a s LEU 9 Ca -0.08 0.05 0.02 0.00 0.69 0.00 0.00 54.13 54.82 2i6a s LEU 9 Cb 0.15 -2.02 -0.00 0.00 -0.43 0.00 0.00 46.19 43.89 2i6a s LEU 9 CO 0.78 0.10 -0.20 0.12 -0.29 0.00 0.00 176.35 176.85 2i6a s PHE 10 N 0.85 2.67 0.02 5.38 2.19 -0.14 0.14 117.98 129.09 2i6a s PHE 10 Ca 0.05 -0.93 -0.05 0.00 0.33 0.00 0.00 56.93 56.33 2i6a s PHE 10 Cb -0.13 -1.77 -0.01 0.00 -1.31 0.00 0.00 43.02 39.80 2i6a s PHE 10 CO 0.03 -0.37 0.09 0.20 1.83 0.00 0.00 175.22 177.00 2i6a s GLY 11 N 0.41 0.13 -0.14 13.12 0.00 -0.05 -0.16 107.32 120.63 2i6a s GLY 11 Ca -0.15 -0.37 -0.16 0.00 0.00 0.00 0.00 44.72 44.04 2i6a s GLY 11 CO 0.07 -0.50 0.45 -3.16 0.00 0.00 0.00 173.10 169.96 2i6a s MET 12 N -1.80 0.58 0.00 2.90 0.23 -1.23 -1.98 119.30 117.99 2i6a s MET 12 Ca -0.12 0.50 0.00 0.00 -1.03 0.00 0.00 55.69 55.04 2i6a s MET 12 Cb -0.06 0.28 0.00 0.00 -1.53 0.00 0.00 34.83 33.52 2i6a s MET 12 CO -0.01 -0.09 0.00 0.41 -2.03 0.00 0.00 175.02 173.30 2i6a n GLY 13 N 2.52 1.95 3.47 3.16 0.00 -1.03 -4.41 105.19 110.86 2i6a n GLY 13 Ca -0.15 -0.43 -0.43 0.00 0.00 0.00 0.00 46.02 45.02 2i6a n GLY 13 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2i6a s ASN 14 N 2.00 6.16 -0.36 1.61 0.01 -1.26 -4.48 114.94 118.63 2i6a s ASN 14 Ca 0.00 -0.78 -0.29 0.00 -0.71 0.00 0.00 52.86 51.08 2i6a s ASN 14 Cb 0.00 -2.20 0.00 0.00 0.41 0.00 0.00 41.25 39.46 2i6a s ASN 14 CO 0.00 -0.54 1.40 -2.84 -1.51 0.00 0.00 177.10 173.61 2i6a s PRO 15 N 1.96 3.70 0.19 -0.60 0.02 -1.26 -4.16 135.00 134.85 2i6a s PRO 15 Ca 0.09 1.11 0.08 0.00 0.02 0.00 0.00 61.00 62.30 2i6a s PRO 15 Cb -0.18 -3.98 -0.04 0.00 0.02 0.00 0.00 34.50 30.32 2i6a s PRO 15 CO 0.12 -1.40 -0.16 -0.51 -0.33 0.00 0.00 177.00 174.72 2i6a s LEU 16 N 5.09 2.51 -0.26 -5.54 1.43 -1.23 -4.23 118.68 116.45 2i6a s LEU 16 Ca 0.61 -0.95 -0.08 0.00 -1.03 0.00 0.00 54.13 52.68 2i6a s LEU 16 Cb -0.16 -0.73 -0.03 0.00 0.03 0.00 0.00 46.19 45.31 2i6a s LEU 16 CO 0.29 -0.12 0.09 -0.22 0.23 0.00 0.00 176.35 176.62 2i6a s LEU 17 N -3.04 3.58 0.11 1.79 2.96 -0.98 0.18 118.68 123.29 2i6a s LEU 17 Ca 0.19 -0.26 -0.30 0.00 -0.22 0.00 0.00 54.13 53.55 2i6a s LEU 17 Cb -0.03 -1.94 -0.06 0.00 0.50 0.00 0.00 46.19 44.66 2i6a s LEU 17 CO 0.07 -0.06 1.05 -1.81 -1.32 0.00 0.00 176.35 174.27 2i6a s ASP 18 N 1.62 7.34 -0.25 3.68 1.01 0.48 -1.99 116.67 128.56 2i6a s ASP 18 Ca 0.06 1.91 0.02 0.00 0.71 0.00 0.00 52.55 55.26 2i6a s ASP 18 Cb -0.15 -2.59 0.05 0.00 1.01 0.00 0.00 42.92 41.24 2i6a s ASP 18 CO 0.04 -0.20 -0.12 -0.63 0.21 0.00 0.00 175.17 174.48 2i6a s ILE 19 N 0.18 2.22 0.23 0.77 1.01 -0.15 -1.57 121.20 123.89 2i6a s ILE 19 Ca 0.50 -1.51 0.11 0.00 0.00 0.00 0.00 60.65 59.75 2i6a s ILE 19 Cb -0.26 -2.25 -0.05 0.00 0.01 0.00 0.00 42.46 39.91 2i6a s ILE 19 CO 0.31 0.05 -0.21 -0.94 0.00 0.00 0.00 174.94 174.16 2i6a s SER 20 N 1.14 3.59 -0.28 3.58 1.04 0.22 -0.51 113.70 122.49 2i6a s SER 20 Ca -0.07 -0.90 -0.28 0.00 0.48 0.00 0.00 55.95 55.19 2i6a s SER 20 Cb -0.19 -0.32 0.19 0.00 0.10 0.00 0.00 66.02 65.79 2i6a s SER 20 CO -0.06 0.09 1.34 0.00 0.98 0.00 0.00 173.24 175.59 2i6a s ALA 21 N -1.99 -2.13 -0.20 5.32 0.00 -1.10 -0.67 121.76 120.99 2i6a s ALA 21 Ca 0.25 1.82 -0.29 0.00 0.00 0.00 0.00 51.96 53.74 2i6a s ALA 21 Cb -0.07 -1.52 0.00 0.00 0.00 0.00 0.00 23.12 21.53 2i6a s ALA 21 CO 0.12 -0.21 1.09 0.08 0.00 0.00 0.00 175.76 176.84 2i6a s VAL 22 N -0.76 4.58 0.00 0.00 1.01 -1.26 -1.73 120.40 122.24 2i6a s VAL 22 Ca 0.08 1.91 0.00 0.00 0.00 0.00 0.00 61.98 63.96 2i6a s VAL 22 Cb -0.02 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.13 2i6a s VAL 22 CO -0.09 -0.15 0.00 1.33 0.00 0.00 0.00 175.10 176.19 2i6a n VAL 23 N 5.23 0.00 -4.32 2.92 0.24 0.24 -4.79 118.33 117.85 2i6a n VAL 23 Ca 0.12 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 62.25 2i6a n VAL 23 Cb 0.46 -0.46 -0.10 0.00 -1.47 0.00 0.00 33.84 32.27 2i6a n VAL 23 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 2i6a s ASP 24 N 0.06 1.78 0.49 -1.34 -4.77 -1.26 -4.76 116.67 106.87 2i6a s ASP 24 Ca 0.00 -1.21 0.14 0.00 -3.30 0.00 0.00 52.55 48.18 2i6a s ASP 24 Cb 0.00 0.02 1.16 0.00 -1.09 0.00 0.00 42.92 43.01 2i6a s ASP 24 CO 0.00 -0.51 2.12 0.50 0.70 0.00 0.00 175.17 177.98 2i6a h LYS 25 N 2.50 0.15 -0.72 2.11 3.64 -2.00 -1.70 116.57 120.55 2i6a h LYS 25 Ca -0.38 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.01 2i6a h LYS 25 Cb 1.22 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.97 2i6a h LYS 25 CO 0.64 0.10 0.48 -0.44 -2.27 0.00 0.00 179.45 177.96 2i6a h ASP 26 N 0.15 0.79 -0.14 4.20 3.45 -1.99 -0.12 116.42 122.77 2i6a h ASP 26 Ca 0.05 -0.02 -0.02 0.00 0.43 0.00 0.00 57.03 57.48 2i6a h ASP 26 Cb 0.03 -0.19 -0.01 0.00 -0.56 0.00 0.00 39.33 38.61 2i6a h ASP 26 CO -0.01 0.56 0.02 0.15 -1.57 0.00 0.00 179.24 178.39 2i6a h PHE 27 N 0.93 0.25 -0.71 4.55 3.57 -1.72 -1.10 116.94 122.71 2i6a h PHE 27 Ca 0.28 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.72 2i6a h PHE 27 Cb -0.03 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.61 2i6a h PHE 27 CO -0.00 0.42 0.35 -0.07 -2.23 0.00 0.00 178.31 176.78 2i6a h LEU 28 N 0.01 0.92 -0.40 0.59 3.38 -1.21 -3.01 115.31 115.60 2i6a h LEU 28 Ca 0.04 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 2i6a h LEU 28 Cb 0.31 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2i6a h LEU 28 CO 0.00 0.79 -0.06 0.44 0.09 0.00 0.00 178.44 179.71 2i6a h ASP 29 N 0.99 0.74 -1.18 -0.43 3.32 -1.05 0.86 116.42 119.67 2i6a h ASP 29 Ca 0.25 -0.34 0.34 0.00 0.02 0.00 0.00 57.03 57.29 2i6a h ASP 29 Cb 0.10 -0.20 -0.09 0.00 0.22 0.00 0.00 39.33 39.36 2i6a h ASP 29 CO -0.03 0.90 0.78 0.11 -1.72 0.00 0.00 179.24 179.28 2i6a h LYS 30 N 0.55 0.21 -0.20 3.56 6.56 -1.07 0.27 116.57 126.45 2i6a h LYS 30 Ca 0.11 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.68 2i6a h LYS 30 Cb 0.56 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 32.17 2i6a h LYS 30 CO 0.03 0.14 0.00 0.66 -2.06 0.00 0.00 179.45 178.22 2i6a n TYR 31 N -4.53 0.27 -3.76 -1.35 4.02 -1.10 -5.00 117.16 105.72 2i6a n TYR 31 Ca 0.29 -0.36 -0.23 0.00 -0.01 0.00 0.00 57.90 57.59 2i6a n TYR 31 Cb 1.14 -0.02 0.03 0.00 -0.02 0.00 0.00 39.34 40.46 2i6a n TYR 31 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 2i6a n SER 32 N 0.36 -1.45 -4.78 7.72 7.64 0.93 -4.98 113.62 119.07 2i6a n SER 32 Ca 0.08 -0.84 -0.34 0.00 1.01 0.00 0.00 58.87 58.78 2i6a n SER 32 Cb 0.34 -3.91 -0.07 0.00 -1.01 0.00 0.00 64.21 59.56 2i6a n SER 32 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2i6a s LEU 33 N -6.78 3.90 0.33 -3.43 1.43 0.27 -4.98 118.68 109.42 2i6a s LEU 33 Ca 0.08 0.19 -0.27 0.00 -1.03 0.00 0.00 54.13 53.10 2i6a s LEU 33 Cb -0.04 -2.16 -0.09 0.00 0.03 0.00 0.00 46.19 43.93 2i6a s LEU 33 CO 0.82 0.31 1.05 -0.54 0.23 0.00 0.00 176.35 178.23 2i6a s LYS 34 N -1.48 4.45 0.63 1.70 1.02 -1.26 -4.48 119.74 120.33 2i6a s LYS 34 Ca 0.20 1.62 0.38 0.00 0.02 0.00 0.00 55.97 58.19 2i6a s LYS 34 Cb -0.12 -2.90 2.16 0.00 -0.52 0.00 0.00 37.83 36.46 2i6a s LYS 34 CO 0.10 0.09 2.32 -1.35 -0.92 0.00 0.00 175.35 175.60 2i6a h PRO 35 N 3.25 0.00 -3.31 -1.68 0.11 -1.96 -3.37 132.00 125.04 2i6a h PRO 35 Ca -0.47 0.00 -0.47 0.00 0.11 0.00 0.00 66.00 65.17 2i6a h PRO 35 Cb 1.21 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 31.92 2i6a h PRO 35 CO 0.65 0.00 -0.75 1.21 -0.21 0.00 0.00 178.00 178.89 2i6a s ASN 36 N -5.61 2.30 0.29 -2.05 2.47 -1.26 -1.62 114.94 109.46 2i6a s ASN 36 Ca -0.05 -0.54 -0.19 0.00 0.42 0.00 0.00 52.86 52.50 2i6a s ASN 36 Cb 0.14 -0.36 0.06 0.00 -1.45 0.00 0.00 41.25 39.64 2i6a s ASN 36 CO 0.47 -0.31 0.89 -0.62 -3.72 0.00 0.00 177.10 173.82 2i6a s ASP 37 N 2.04 -0.03 -0.14 -4.21 -1.08 -0.94 -4.95 116.67 107.37 2i6a s ASP 37 Ca 0.02 -0.88 -0.04 0.00 -0.52 0.00 0.00 52.55 51.13 2i6a s ASP 37 Cb -0.15 0.69 0.07 0.00 -1.46 0.00 0.00 42.92 42.06 2i6a s ASP 37 CO -0.08 -1.35 0.21 -1.10 0.52 0.00 0.00 175.17 173.37 2i6a s GLN 38 N -2.44 0.12 0.07 4.34 -0.21 -1.26 -1.77 119.66 118.52 2i6a s GLN 38 Ca 0.17 0.47 -0.04 0.00 0.02 0.00 0.00 55.36 55.98 2i6a s GLN 38 Cb -0.04 -0.58 -0.03 0.00 1.00 0.00 0.00 33.01 33.36 2i6a s GLN 38 CO 0.08 -0.43 0.06 0.96 -2.12 0.00 0.00 175.29 173.84 2i6a s ILE 39 N 2.33 0.18 0.35 1.08 -4.36 0.41 -4.74 121.20 116.46 2i6a s ILE 39 Ca 0.04 -1.58 -0.14 0.00 -0.26 0.00 0.00 60.65 58.70 2i6a s ILE 39 Cb -0.13 -1.49 -0.08 0.00 1.25 0.00 0.00 42.46 42.00 2i6a s ILE 39 CO -0.09 -0.84 0.77 -0.76 0.24 0.00 0.00 174.94 174.26 2i6a s LEU 40 N -2.91 3.99 0.10 0.37 1.43 -1.26 -0.91 118.68 119.49 2i6a s LEU 40 Ca 0.07 1.28 -0.30 0.00 -1.03 0.00 0.00 54.13 54.15 2i6a s LEU 40 Cb 0.07 -4.11 -0.06 0.00 0.03 0.00 0.00 46.19 42.11 2i6a s LEU 40 CO -0.10 -0.27 1.17 0.00 0.23 0.00 0.00 176.35 177.38 2i6a s ALA 41 N -2.11 3.39 0.39 4.21 0.00 0.61 -4.75 121.76 123.50 2i6a s ALA 41 Ca 0.54 0.85 0.06 0.00 0.00 0.00 0.00 51.96 53.42 2i6a s ALA 41 Cb -0.10 -3.42 0.06 0.00 0.00 0.00 0.00 23.12 19.66 2i6a s ALA 41 CO 0.21 -0.37 0.53 0.39 0.00 0.00 0.00 175.76 176.51 2i6a n GLU 42 N 3.37 0.74 -0.31 0.00 -0.58 -1.26 -4.96 120.64 117.64 2i6a n GLU 42 Ca 0.07 -2.09 -0.02 0.00 -0.42 0.00 0.00 57.16 54.69 2i6a n GLU 42 Cb 0.46 -0.15 0.13 0.00 -0.57 0.00 0.00 31.44 31.32 2i6a n GLU 42 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 2i6a h ASP 43 N 0.08 1.06 0.08 1.62 3.32 -2.03 -2.80 116.42 117.74 2i6a h ASP 43 Ca -0.18 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.79 2i6a h ASP 43 Cb 0.83 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.12 2i6a h ASP 43 CO 0.26 0.83 0.00 2.29 -1.72 0.00 0.00 179.24 180.90 2i6a n LYS 44 N -4.35 0.02 -0.04 3.56 2.85 -1.26 -2.81 118.16 116.13 2i6a n LYS 44 Ca 0.09 0.48 -0.02 0.00 -1.05 0.00 0.00 58.31 57.81 2i6a n LYS 44 Cb 0.08 -1.55 -0.14 0.00 -0.65 0.00 0.00 35.03 32.77 2i6a n LYS 44 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 2i6a n HIS 45 N -1.59 0.36 -0.28 5.58 8.25 -1.06 -4.56 115.22 121.92 2i6a n HIS 45 Ca 0.00 0.12 0.27 0.00 -0.26 0.00 0.00 57.72 57.86 2i6a n HIS 45 Cb 0.03 -0.93 0.49 0.00 1.12 0.00 0.00 29.99 30.70 2i6a n HIS 45 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2i6a n LYS 46 N -2.70 -0.04 -0.30 -0.41 5.02 -1.12 0.78 118.16 119.38 2i6a n LYS 46 Ca -0.18 1.09 -0.04 0.00 -2.02 0.00 0.00 58.31 57.16 2i6a n LYS 46 Cb 0.92 -2.00 0.11 0.00 -0.02 0.00 0.00 35.03 34.04 2i6a n LYS 46 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 2i6a h GLU 47 N 0.00 1.20 -0.78 1.97 4.81 -1.83 -3.16 114.58 116.78 2i6a h GLU 47 Ca 0.69 -0.15 0.11 0.00 -0.13 0.00 0.00 59.36 59.88 2i6a h GLU 47 Cb 1.92 -0.23 -0.05 0.00 0.63 0.00 0.00 28.75 31.02 2i6a h GLU 47 CO -0.57 0.89 0.51 1.25 -0.73 0.00 0.00 179.01 180.36 2i6a h LEU 48 N 1.20 0.59 -0.92 1.64 6.46 0.06 -2.15 115.31 122.19 2i6a h LEU 48 Ca 0.30 0.02 -0.11 0.00 -0.12 0.00 0.00 57.88 57.97 2i6a h LEU 48 Cb 0.06 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 39.88 2i6a h LEU 48 CO -0.04 0.34 -0.51 -0.26 -0.62 0.00 0.00 178.44 177.34 2i6a h PHE 49 N 0.65 0.00 0.05 1.25 0.04 -1.64 -1.84 116.94 115.44 2i6a h PHE 49 Ca 0.37 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 61.05 2i6a h PHE 49 Cb 0.55 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.70 2i6a h PHE 49 CO -0.00 0.51 -0.41 -0.44 -0.60 0.00 0.00 178.31 177.37 2i6a h ASP 50 N 0.00 0.16 0.76 2.17 3.32 -1.56 -3.27 116.42 118.01 2i6a h ASP 50 Ca -0.01 -0.94 -0.09 0.00 0.02 0.00 0.00 57.03 56.02 2i6a h ASP 50 Cb 0.95 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.44 2i6a h ASP 50 CO 0.07 1.19 -0.41 1.05 -1.72 0.00 0.00 179.24 179.42 2i6a h GLU 51 N -0.77 0.00 -0.17 3.56 4.11 -1.53 -1.22 114.58 118.55 2i6a h GLU 51 Ca -0.08 0.00 0.02 0.00 0.07 0.00 0.00 59.36 59.36 2i6a h GLU 51 Cb 1.26 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.49 2i6a h GLU 51 CO 0.03 0.41 0.06 1.25 0.07 0.00 0.00 179.01 180.83 2i6a h LEU 52 N 0.00 0.06 -0.25 3.06 5.85 -1.49 0.65 115.31 123.20 2i6a h LEU 52 Ca -0.00 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 2i6a h LEU 52 Cb 0.90 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 2i6a h LEU 52 CO 0.05 0.06 0.08 0.58 -0.34 0.00 0.00 178.44 178.87 2i6a h VAL 53 N 0.14 1.20 0.11 1.05 2.07 -1.53 -2.47 116.25 116.82 2i6a h VAL 53 Ca 0.07 -0.63 -0.01 0.00 0.82 0.00 0.00 66.70 66.96 2i6a h VAL 53 Cb 0.05 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 2i6a h VAL 53 CO -0.08 0.20 -0.05 0.11 0.02 0.00 0.00 177.57 177.77 2i6a h LYS 54 N 0.24 -0.14 -0.03 1.57 1.57 -1.03 -3.37 116.57 115.38 2i6a h LYS 54 Ca 0.08 0.01 -0.20 0.00 -1.87 0.00 0.00 60.65 58.67 2i6a h LYS 54 Cb 0.24 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 2i6a h LYS 54 CO -0.00 0.21 -0.83 0.87 -0.57 0.00 0.00 179.45 179.13 2i6a h LYS 55 N -0.51 0.32 -5.99 3.15 1.57 0.25 -3.48 116.57 111.89 2i6a h LYS 55 Ca -0.01 -0.31 -0.58 0.00 -1.87 0.00 0.00 60.65 57.87 2i6a h LYS 55 Cb 0.42 0.08 -0.10 0.00 0.08 0.00 0.00 32.23 32.71 2i6a h LYS 55 CO 0.02 0.99 -0.58 -0.06 -0.57 0.00 0.00 179.45 179.25 2i6a s PHE 56 N -3.38 2.58 -0.99 -1.35 0.40 -0.93 -5.06 117.98 109.24 2i6a s PHE 56 Ca -0.05 -0.47 -0.22 0.00 -0.60 0.00 0.00 56.93 55.60 2i6a s PHE 56 Cb 0.10 -1.61 0.07 0.00 0.51 0.00 0.00 43.02 42.09 2i6a s PHE 56 CO 0.84 0.40 1.36 0.15 0.70 0.00 0.00 175.22 178.67 2i6a s LYS 57 N -3.77 3.59 0.41 0.44 1.02 -1.26 -4.76 119.74 115.41 2i6a s LYS 57 Ca 0.36 -1.29 -0.09 0.00 0.02 0.00 0.00 55.97 54.97 2i6a s LYS 57 Cb 0.01 -5.24 -0.06 0.00 -0.52 0.00 0.00 37.83 32.02 2i6a s LYS 57 CO 0.20 -2.09 0.76 0.54 -0.92 0.00 0.00 175.35 173.84 2i6a s VAL 58 N 4.35 4.82 0.02 3.17 0.11 -1.26 -4.61 120.40 127.01 2i6a s VAL 58 Ca 0.42 0.51 0.03 0.00 -2.93 0.00 0.00 61.98 60.02 2i6a s VAL 58 Cb -0.01 -3.75 -0.02 0.00 -1.53 0.00 0.00 36.38 31.07 2i6a s VAL 58 CO -0.10 -0.56 -0.09 -1.61 -3.33 0.00 0.00 175.10 169.41 2i6a s GLU 59 N -3.97 0.66 -0.09 1.54 2.02 0.15 -4.94 118.70 114.06 2i6a s GLU 59 Ca 0.50 -0.55 -0.00 0.00 0.02 0.00 0.00 54.97 54.94 2i6a s GLU 59 Cb -0.10 -0.58 -0.03 0.00 0.10 0.00 0.00 34.13 33.52 2i6a s GLU 59 CO 0.33 0.14 -0.08 0.71 0.02 0.00 0.00 175.26 176.39 2i6a s TYR 60 N -0.73 2.91 -0.01 1.61 2.02 -1.26 -0.61 117.35 121.28 2i6a s TYR 60 Ca -0.01 -0.16 -0.08 0.00 -0.37 0.00 0.00 57.07 56.44 2i6a s TYR 60 Cb -0.06 -1.77 0.01 0.00 -0.40 0.00 0.00 41.96 39.73 2i6a s TYR 60 CO 0.00 0.16 0.18 -1.01 -1.57 0.00 0.00 175.55 173.31 2i6a s HIS 61 N -0.38 -0.04 0.15 2.71 3.76 -0.61 -5.00 115.29 115.89 2i6a s HIS 61 Ca 0.05 0.05 -0.31 0.00 -0.15 0.00 0.00 55.06 54.70 2i6a s HIS 61 Cb -0.12 -0.00 -0.08 0.00 1.11 0.00 0.00 32.58 33.48 2i6a s HIS 61 CO 0.02 -0.27 1.36 0.00 -0.85 0.00 0.00 174.74 175.00 2i6a s ALA 62 N -1.11 3.56 0.00 -1.40 0.00 -1.26 -0.39 121.76 121.16 2i6a s ALA 62 Ca -0.12 1.12 0.00 0.00 0.00 0.00 0.00 51.96 52.96 2i6a s ALA 62 Cb -0.06 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.54 2i6a s ALA 62 CO 0.02 -0.58 0.00 0.41 0.00 0.00 0.00 175.76 175.60 2i6a n GLY 63 N 2.99 6.22 0.00 0.00 0.00 0.48 -4.72 105.19 110.16 2i6a n GLY 63 Ca 0.09 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.39 2i6a n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i6a n GLY 64 N 3.25 1.98 0.15 -0.02 0.00 -1.25 -3.47 105.19 105.84 2i6a n GLY 64 Ca 0.00 -1.39 -0.11 0.00 0.00 0.00 0.00 46.02 44.51 2i6a n GLY 64 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2i6a h SER 65 N 0.00 -0.24 -0.79 1.61 0.87 -1.98 -1.62 113.55 111.40 2i6a h SER 65 Ca 0.00 -0.29 -0.00 0.00 -1.23 0.00 0.00 61.79 60.27 2i6a h SER 65 Cb 0.00 0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 61.98 2i6a h SER 65 CO 0.00 0.26 0.49 0.74 -0.53 0.00 0.00 176.83 177.79 2i6a h THR 66 N -0.85 1.22 -0.39 2.23 2.02 -1.90 -2.18 112.91 113.06 2i6a h THR 66 Ca -0.03 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.69 2i6a h THR 66 Cb 0.51 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 2i6a h THR 66 CO 0.05 0.23 0.25 -0.61 0.37 0.00 0.00 175.52 175.80 2i6a h GLN 67 N 1.10 0.51 -0.27 6.66 4.15 -1.83 -1.43 115.11 124.01 2i6a h GLN 67 Ca 0.29 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.67 2i6a h GLN 67 Cb -0.06 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.51 2i6a h GLN 67 CO -0.06 0.36 0.16 -0.91 -1.93 0.00 0.00 178.83 176.45 2i6a h ASN 68 N 0.52 0.32 -0.68 -0.69 2.35 -0.69 -1.96 115.58 114.74 2i6a h ASN 68 Ca 0.14 -0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 55.78 2i6a h ASN 68 Cb -0.04 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.22 2i6a h ASN 68 CO -0.03 0.28 0.21 0.28 -1.65 0.00 0.00 177.43 176.53 2i6a h SER 69 N 0.33 1.01 -0.57 5.81 0.02 -1.22 -0.67 113.55 118.26 2i6a h SER 69 Ca 0.09 -0.19 -0.06 0.00 -0.84 0.00 0.00 61.79 60.80 2i6a h SER 69 Cb 0.02 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.27 2i6a h SER 69 CO -0.02 0.94 0.15 0.40 -1.14 0.00 0.00 176.83 177.17 2i6a h ILE 70 N 1.04 1.24 -0.16 3.27 1.08 -1.11 -0.26 117.51 122.61 2i6a h ILE 70 Ca 0.23 -0.88 -0.04 0.00 -0.39 0.00 0.00 64.86 63.78 2i6a h ILE 70 Cb 0.30 0.61 -0.00 0.00 -3.07 0.00 0.00 36.82 34.66 2i6a h ILE 70 CO -0.01 0.33 -0.05 0.11 -0.69 0.00 0.00 178.15 177.85 2i6a h LYS 71 N 0.91 0.32 -0.39 2.37 1.57 -0.93 -1.41 116.57 119.00 2i6a h LYS 71 Ca 0.20 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2i6a h LYS 71 Cb 0.32 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 2i6a h LYS 71 CO -0.00 0.60 0.25 0.28 -0.57 0.00 0.00 179.45 180.01 2i6a h VAL 72 N 0.01 1.11 -0.39 0.50 2.07 -0.93 0.59 116.25 119.21 2i6a h VAL 72 Ca 0.04 -0.22 -0.15 0.00 0.82 0.00 0.00 66.70 67.19 2i6a h VAL 72 Cb 0.49 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 2i6a h VAL 72 CO 0.02 0.11 -0.33 0.00 0.02 0.00 0.00 177.57 177.38 2i6a h ALA 73 N 1.74 0.56 -0.21 1.67 0.00 -0.99 -1.31 119.26 120.73 2i6a h ALA 73 Ca 0.14 -0.43 -0.15 0.00 0.00 0.00 0.00 54.91 54.47 2i6a h ALA 73 Cb -0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2i6a h ALA 73 CO -0.03 0.63 -0.49 0.37 0.00 0.00 0.00 179.25 179.73 2i6a h GLN 74 N 0.73 0.55 -0.54 0.00 5.75 -0.63 -0.89 115.11 120.08 2i6a h GLN 74 Ca 0.07 -0.32 -0.08 0.00 -0.15 0.00 0.00 58.65 58.16 2i6a h GLN 74 Cb 0.92 0.03 -0.02 0.00 1.07 0.00 0.00 27.48 29.48 2i6a h GLN 74 CO 0.09 0.92 0.01 2.35 -2.65 0.00 0.00 178.83 179.54 2i6a h TRP 75 N 0.44 1.03 -0.34 3.99 7.01 -0.82 -0.44 115.95 126.82 2i6a h TRP 75 Ca 0.02 -0.18 -0.12 0.00 2.11 0.00 0.00 58.89 60.72 2i6a h TRP 75 Cb 1.02 -0.27 -0.01 0.00 -2.10 0.00 0.00 29.16 27.80 2i6a h TRP 75 CO 0.04 0.94 -0.27 0.52 -2.79 0.00 0.00 178.44 176.88 2i6a h MET 76 N 0.83 0.79 -0.80 2.65 2.86 -1.04 -3.04 114.93 117.17 2i6a h MET 76 Ca 0.15 -0.39 -0.05 0.00 -2.06 0.00 0.00 59.70 57.36 2i6a h MET 76 Cb 0.52 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.15 2i6a h MET 76 CO 0.03 1.02 0.32 0.82 1.06 0.00 0.00 176.91 180.15 2i6a h ILE 77 N 0.56 1.26 0.00 -1.22 2.04 -1.07 -3.44 117.51 115.64 2i6a h ILE 77 Ca 0.06 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 65.09 2i6a h ILE 77 Cb 0.84 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.23 2i6a h ILE 77 CO 0.07 0.34 0.00 1.67 0.00 0.00 0.00 178.15 180.23 2i6a n GLN 78 N -4.27 0.00 0.00 2.37 -0.06 -0.18 -4.68 117.38 110.55 2i6a n GLN 78 Ca 0.07 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.07 2i6a n GLN 78 Cb 0.19 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.37 2i6a n GLN 78 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 2i6a n GLN 79 N 0.00 0.00 -2.75 3.69 3.00 -1.26 -4.34 117.38 115.71 2i6a n GLN 79 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.57 2i6a n GLN 79 Cb 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 30.24 30.19 2i6a n GLN 79 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 2i6a s PRO 80 N 0.00 4.49 0.76 -1.09 0.04 -1.26 -5.02 135.00 132.92 2i6a s PRO 80 Ca 0.00 1.33 -0.13 0.00 0.04 0.00 0.00 61.00 62.23 2i6a s PRO 80 Cb 0.00 -3.49 0.05 0.00 0.04 0.00 0.00 34.50 31.11 2i6a s PRO 80 CO 0.00 -0.13 1.16 -1.01 0.04 0.00 0.00 177.00 177.06 2i6a s HIS 81 N 1.33 2.17 -1.37 0.56 3.76 -1.26 -2.82 115.29 117.65 2i6a s HIS 81 Ca 0.49 1.62 -0.04 0.00 -0.15 0.00 0.00 55.06 56.98 2i6a s HIS 81 Cb -0.20 -3.32 0.00 0.00 1.11 0.00 0.00 32.58 30.18 2i6a s HIS 81 CO 0.23 -2.32 0.50 1.63 -0.85 0.00 0.00 174.74 173.93 2i6a n LYS 82 N -3.07 -4.13 0.11 1.40 5.02 -0.24 -4.77 118.16 112.49 2i6a n LYS 82 Ca 0.12 0.80 -0.01 0.00 -2.02 0.00 0.00 58.31 57.20 2i6a n LYS 82 Cb 0.51 -5.42 0.00 0.00 -0.02 0.00 0.00 35.03 30.11 2i6a n LYS 82 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2i6a h ALA 83 N 0.88 0.59 -3.38 7.82 0.00 -1.74 0.11 119.26 123.53 2i6a h ALA 83 Ca -0.46 -0.63 -0.65 0.00 0.00 0.00 0.00 54.91 53.17 2i6a h ALA 83 Cb 1.32 -0.11 -0.20 0.00 0.00 0.00 0.00 17.79 18.80 2i6a h ALA 83 CO 0.50 0.86 -0.67 0.00 0.00 0.00 0.00 179.25 179.94 2i6a s ALA 84 N -2.95 3.01 -0.02 0.00 0.00 -1.26 -1.43 121.76 119.12 2i6a s ALA 84 Ca 0.02 -0.83 -0.01 0.00 0.00 0.00 0.00 51.96 51.14 2i6a s ALA 84 Cb 0.09 -1.46 -0.04 0.00 0.00 0.00 0.00 23.12 21.71 2i6a s ALA 84 CO 0.77 0.33 0.06 0.99 0.00 0.00 0.00 175.76 177.92 2i6a s THR 85 N -0.03 4.65 -0.02 0.00 2.01 0.12 -1.21 115.64 121.16 2i6a s THR 85 Ca 0.01 -0.38 0.00 0.00 0.31 0.00 0.00 61.69 61.63 2i6a s THR 85 Cb -0.13 -3.09 0.02 0.00 0.01 0.00 0.00 72.50 69.31 2i6a s THR 85 CO 0.03 0.40 0.02 0.12 -0.69 0.00 0.00 174.62 174.49 2i6a s PHE 86 N -1.14 0.09 -0.02 4.92 5.36 -1.15 -0.87 117.98 125.17 2i6a s PHE 86 Ca 0.21 0.08 0.07 0.00 -0.96 0.00 0.00 56.93 56.33 2i6a s PHE 86 Cb -0.12 -0.24 -0.02 0.00 -0.34 0.00 0.00 43.02 42.31 2i6a s PHE 86 CO 0.12 -0.08 -0.22 -0.06 -1.46 0.00 0.00 175.22 173.51 2i6a s PHE 87 N 0.88 1.98 0.15 10.12 0.40 -0.84 -0.48 117.98 130.18 2i6a s PHE 87 Ca -0.08 -0.39 -0.24 0.00 -0.60 0.00 0.00 56.93 55.61 2i6a s PHE 87 Cb -0.11 -1.28 0.08 0.00 0.51 0.00 0.00 43.02 42.22 2i6a s PHE 87 CO -0.02 -0.05 1.03 0.20 0.70 0.00 0.00 175.22 177.08 2i6a s GLY 88 N -0.47 -0.12 -0.19 4.36 0.00 -1.17 -2.46 107.32 107.27 2i6a s GLY 88 Ca 0.07 0.01 -0.06 0.00 0.00 0.00 0.00 44.72 44.74 2i6a s GLY 88 CO -0.00 1.00 0.02 0.00 0.00 0.00 0.00 173.10 174.11 2i6a s ILE 90 N 0.82 1.78 0.52 0.00 -4.36 -0.01 -2.86 121.20 117.10 2i6a s ILE 90 Ca 0.01 -1.98 -0.04 0.00 -0.26 0.00 0.00 60.65 58.38 2i6a s ILE 90 Cb -0.14 -2.77 -0.00 0.00 1.25 0.00 0.00 42.46 40.80 2i6a s ILE 90 CO 0.02 0.00 0.80 -0.83 0.24 0.00 0.00 174.94 175.17 2i6a s GLY 91 N -3.77 1.57 -0.95 6.27 0.00 -1.26 -2.70 107.32 106.49 2i6a s GLY 91 Ca 0.27 -0.78 -0.15 0.00 0.00 0.00 0.00 44.72 44.06 2i6a s GLY 91 CO 0.14 -0.56 1.02 -0.42 0.00 0.00 0.00 173.10 173.28 2i6a s ILE 92 N -2.79 5.31 0.31 0.90 1.01 0.28 -4.44 121.20 121.77 2i6a s ILE 92 Ca 0.51 -2.34 -0.19 0.00 0.00 0.00 0.00 60.65 58.63 2i6a s ILE 92 Cb -0.10 -4.65 0.05 0.00 0.01 0.00 0.00 42.46 37.77 2i6a s ILE 92 CO 0.43 -1.29 0.81 1.51 0.00 0.00 0.00 174.94 176.40 2i6a s ASP 93 N 2.60 -0.09 0.13 3.58 3.84 -1.26 -4.91 116.67 120.56 2i6a s ASP 93 Ca 0.28 -0.87 -0.32 0.00 -0.00 0.00 0.00 52.55 51.63 2i6a s ASP 93 Cb -0.07 0.75 -0.10 0.00 -1.38 0.00 0.00 42.92 42.11 2i6a s ASP 93 CO -0.08 -1.45 1.55 0.50 -0.00 0.00 0.00 175.17 175.70 2i6a h LYS 94 N 2.00 -0.44 -0.76 2.11 3.64 -1.99 0.28 116.57 121.41 2i6a h LYS 94 Ca -0.27 0.03 0.17 0.00 -1.27 0.00 0.00 60.65 59.31 2i6a h LYS 94 Cb 1.24 0.10 -0.12 0.00 -0.41 0.00 0.00 32.23 33.05 2i6a h LYS 94 CO 0.34 -0.29 0.16 0.74 -2.27 0.00 0.00 179.45 178.13 2i6a h PHE 95 N -0.45 0.24 -0.30 1.91 0.04 -1.96 0.23 116.94 116.65 2i6a h PHE 95 Ca 0.07 0.05 0.04 0.00 2.80 0.00 0.00 57.97 60.93 2i6a h PHE 95 Cb 0.63 0.01 -0.04 0.00 2.20 0.00 0.00 35.95 38.75 2i6a h PHE 95 CO -0.66 -0.12 0.06 0.78 -0.60 0.00 0.00 178.31 177.77 2i6a h GLY 96 N 0.24 0.35 1.20 -1.45 0.00 -1.63 -0.91 103.07 100.87 2i6a h GLY 96 Ca 0.43 -0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.73 2i6a h GLY 96 CO -0.55 -0.01 0.45 -2.09 0.00 0.00 0.00 176.54 174.34 2i6a h GLU 97 N 0.18 1.05 -0.54 4.80 4.57 0.15 -1.86 114.58 122.94 2i6a h GLU 97 Ca 0.14 -0.10 -0.04 0.00 -1.18 0.00 0.00 59.36 58.18 2i6a h GLU 97 Cb 0.15 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.50 2i6a h GLU 97 CO -0.18 0.75 0.19 0.82 -1.18 0.00 0.00 179.01 179.40 2i6a h ILE 98 N 1.07 1.23 -0.19 2.32 2.04 -0.61 -2.13 117.51 121.24 2i6a h ILE 98 Ca 0.28 -0.75 0.03 0.00 1.00 0.00 0.00 64.86 65.42 2i6a h ILE 98 Cb -0.02 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 2i6a h ILE 98 CO -0.05 0.28 0.00 -0.07 0.00 0.00 0.00 178.15 178.31 2i6a h LEU 99 N 0.73 -0.07 0.50 1.44 3.38 -0.41 0.14 115.31 121.02 2i6a h LEU 99 Ca 0.18 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 2i6a h LEU 99 Cb 0.25 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2i6a h LEU 99 CO -0.01 -0.01 -0.32 0.11 0.09 0.00 0.00 178.44 178.31 2i6a h LYS 100 N 0.07 -0.75 -0.33 1.13 1.57 -1.26 0.34 116.57 117.32 2i6a h LYS 100 Ca 0.09 0.05 0.07 0.00 -1.87 0.00 0.00 60.65 59.00 2i6a h LYS 100 Cb 0.11 0.17 -0.08 0.00 0.08 0.00 0.00 32.23 32.51 2i6a h LYS 100 CO -0.15 -0.50 -0.24 -0.09 -0.57 0.00 0.00 179.45 177.89 2i6a h ARG 101 N -0.78 -0.20 -0.90 3.15 2.43 -1.30 0.12 114.38 116.90 2i6a h ARG 101 Ca -0.06 0.01 0.11 0.00 -0.81 0.00 0.00 59.98 59.24 2i6a h ARG 101 Cb 0.64 0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 30.16 2i6a h ARG 101 CO 0.05 -0.13 0.53 0.87 -1.51 0.00 0.00 179.97 179.79 2i6a h LYS 102 N -0.20 0.83 -0.72 0.20 1.79 -0.52 0.33 116.57 118.28 2i6a h LYS 102 Ca 0.17 -0.05 -0.03 0.00 -2.18 0.00 0.00 60.65 58.56 2i6a h LYS 102 Cb 0.47 -0.19 -0.03 0.00 -1.58 0.00 0.00 32.23 30.90 2i6a h LYS 102 CO -0.45 0.55 0.33 0.00 -1.08 0.00 0.00 179.45 178.80 2i6a h ALA 103 N 1.50 0.93 -0.43 3.86 0.00 0.75 -2.17 119.26 123.70 2i6a h ALA 103 Ca 0.45 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 55.08 2i6a h ALA 103 Cb 0.45 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2i6a h ALA 103 CO -0.27 0.51 -0.19 0.00 0.00 0.00 0.00 179.25 179.30 2i6a h ALA 104 N 1.16 0.60 0.00 0.00 0.00 0.18 -2.05 119.26 119.15 2i6a h ALA 104 Ca 0.25 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 2i6a h ALA 104 Cb 0.14 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2i6a h ALA 104 CO -0.03 0.56 -0.02 0.93 0.00 0.00 0.00 179.25 180.69 2i6a h GLU 105 N 0.71 0.00 -0.10 0.00 5.08 -0.74 0.19 114.58 119.71 2i6a h GLU 105 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2i6a h GLU 105 Cb 0.75 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 2i6a h GLU 105 CO 0.06 0.02 0.00 0.00 -1.00 0.00 0.00 179.01 178.09 2i6a n ALA 106 N -2.11 2.53 -2.99 3.43 0.00 -0.84 -4.95 120.51 115.59 2i6a n ALA 106 Ca -0.01 -0.53 -0.22 0.00 0.00 0.00 0.00 53.44 52.68 2i6a n ALA 106 Cb 0.20 -1.09 0.03 0.00 0.00 0.00 0.00 19.45 18.59 2i6a n ALA 106 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2i6a n HIS 107 N 0.40 -1.90 -3.83 0.00 8.25 0.66 -4.67 115.22 114.14 2i6a n HIS 107 Ca 0.17 0.50 -0.36 0.00 -0.26 0.00 0.00 57.72 57.78 2i6a n HIS 107 Cb 0.38 -4.41 -0.06 0.00 1.12 0.00 0.00 29.99 27.03 2i6a n HIS 107 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2i6a s VAL 108 N -3.16 5.41 -1.41 1.59 1.01 -0.79 -1.08 120.40 121.98 2i6a s VAL 108 Ca 0.29 0.15 -0.13 0.00 0.00 0.00 0.00 61.98 62.29 2i6a s VAL 108 Cb -0.13 -3.49 0.08 0.00 0.00 0.00 0.00 36.38 32.83 2i6a s VAL 108 CO 0.36 0.49 2.11 -0.67 0.00 0.00 0.00 175.10 177.39 2i6a n ASP 109 N 1.51 4.24 -4.73 3.32 2.03 -0.35 -4.53 116.55 118.05 2i6a n ASP 109 Ca -0.15 -2.91 -0.41 0.00 0.52 0.00 0.00 54.79 51.84 2i6a n ASP 109 Cb 0.54 -1.61 -0.04 0.00 -0.72 0.00 0.00 41.12 39.28 2i6a n ASP 109 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2i6a s ALA 110 N 2.48 3.28 -0.15 -1.67 0.00 -1.26 -2.94 121.76 121.51 2i6a s ALA 110 Ca 0.45 0.38 -0.02 0.00 0.00 0.00 0.00 51.96 52.78 2i6a s ALA 110 Cb 0.12 -3.14 0.04 0.00 0.00 0.00 0.00 23.12 20.15 2i6a s ALA 110 CO -0.06 -0.06 -0.00 -1.01 0.00 0.00 0.00 175.76 174.63 2i6a s HIS 111 N 0.39 1.14 0.19 0.00 3.76 0.37 -4.96 115.29 116.18 2i6a s HIS 111 Ca 0.44 -0.73 0.10 0.00 -0.15 0.00 0.00 55.06 54.72 2i6a s HIS 111 Cb -0.21 -1.06 -0.04 0.00 1.11 0.00 0.00 32.58 32.38 2i6a s HIS 111 CO 0.25 -0.53 -0.15 0.71 -0.85 0.00 0.00 174.74 174.17 2i6a s TYR 112 N 1.82 2.51 -0.23 1.40 1.51 -1.26 -3.02 117.35 120.07 2i6a s TYR 112 Ca 0.01 -0.27 -0.11 0.00 -1.01 0.00 0.00 57.07 55.69 2i6a s TYR 112 Cb -0.15 -1.23 -0.05 0.00 -0.11 0.00 0.00 41.96 40.42 2i6a s TYR 112 CO -0.07 0.51 0.19 -0.47 -1.11 0.00 0.00 175.55 174.60 2i6a s TYR 113 N -1.70 3.34 -0.07 2.71 5.04 0.55 -4.94 117.35 122.27 2i6a s TYR 113 Ca 0.23 0.30 0.02 0.00 -2.44 0.00 0.00 57.07 55.18 2i6a s TYR 113 Cb -0.08 -2.29 -0.02 0.00 0.35 0.00 0.00 41.96 39.92 2i6a s TYR 113 CO 0.13 0.09 -0.13 -1.21 -1.34 0.00 0.00 175.55 173.10 2i6a s GLU 114 N 0.97 2.78 0.12 4.97 2.02 -1.26 -0.83 118.70 127.48 2i6a s GLU 114 Ca 0.09 -0.67 -0.08 0.00 0.02 0.00 0.00 54.97 54.33 2i6a s GLU 114 Cb -0.13 -2.48 -0.01 0.00 0.10 0.00 0.00 34.13 31.61 2i6a s GLU 114 CO 0.04 0.52 0.22 1.14 0.02 0.00 0.00 175.26 177.20 2i6a s GLN 115 N -0.44 0.98 -0.15 1.61 1.03 -1.10 -4.93 119.66 116.65 2i6a s GLN 115 Ca 0.06 -1.07 0.15 0.00 0.04 0.00 0.00 55.36 54.53 2i6a s GLN 115 Cb -0.12 0.35 -0.24 0.00 0.03 0.00 0.00 33.01 33.03 2i6a s GLN 115 CO 0.02 -0.33 0.24 0.09 -2.54 0.00 0.00 175.29 172.77 2i6a n ASN 116 N -0.13 0.41 -0.25 12.60 3.02 -1.26 -0.56 115.26 129.10 2i6a n ASN 116 Ca -0.11 0.12 0.05 0.00 -0.03 0.00 0.00 54.58 54.61 2i6a n ASN 116 Cb 0.63 0.57 0.18 0.00 -0.61 0.00 0.00 39.78 40.54 2i6a n ASN 116 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2i6a h GLU 117 N 0.00 0.36 -6.18 3.52 3.07 -1.98 -3.41 114.58 109.96 2i6a h GLU 117 Ca -0.47 -0.02 -0.69 0.00 -0.50 0.00 0.00 59.36 57.68 2i6a h GLU 117 Cb 2.16 -0.08 -0.29 0.00 -0.84 0.00 0.00 28.75 29.70 2i6a h GLU 117 CO 0.04 0.24 -0.85 -0.65 -1.40 0.00 0.00 179.01 176.39 2i6a s GLN 118 N -6.04 2.50 0.24 2.33 -1.52 -1.26 -5.09 119.66 110.82 2i6a s GLN 118 Ca -0.13 -0.84 -0.23 0.00 -1.95 0.00 0.00 55.36 52.22 2i6a s GLN 118 Cb 0.20 -2.22 -0.09 0.00 -0.22 0.00 0.00 33.01 30.68 2i6a s GLN 118 CO 0.76 0.47 0.79 -1.25 -0.25 0.00 0.00 175.29 175.81 2i6a s PRO 119 N -0.37 4.41 0.01 2.91 0.04 -1.26 -3.99 135.00 136.75 2i6a s PRO 119 Ca 0.03 1.05 -0.39 0.00 0.04 0.00 0.00 61.00 61.72 2i6a s PRO 119 Cb -0.12 -2.94 -0.19 0.00 0.04 0.00 0.00 34.50 31.28 2i6a s PRO 119 CO 0.02 0.40 1.12 2.41 0.04 0.00 0.00 177.00 181.00 2i6a n THR 120 N 0.87 0.00 -0.65 1.26 -1.04 -1.26 -1.50 114.28 111.95 2i6a n THR 120 Ca -0.02 -0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.68 2i6a n THR 120 Cb 0.50 -0.15 0.18 0.00 -1.82 0.00 0.00 70.33 69.04 2i6a n THR 120 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2i6a n GLY 121 N 1.71 -1.24 3.21 3.41 0.00 -1.23 -4.70 105.19 106.34 2i6a n GLY 121 Ca 0.20 -0.83 -0.09 0.00 0.00 0.00 0.00 46.02 45.29 2i6a n GLY 121 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2i6a s THR 122 N -2.51 0.13 -0.02 2.61 -4.23 0.21 -2.31 115.64 109.52 2i6a s THR 122 Ca 0.64 -1.07 0.03 0.00 -1.18 0.00 0.00 61.69 60.11 2i6a s THR 122 Cb -0.22 -1.22 -0.00 0.00 1.34 0.00 0.00 72.50 72.39 2i6a s THR 122 CO 0.62 -0.59 -0.11 0.00 -0.54 0.00 0.00 174.62 174.00 2i6a s ALA 124 N 0.01 3.65 -0.68 0.00 0.00 0.66 -0.98 121.76 124.42 2i6a s ALA 124 Ca -0.01 -0.75 -0.08 0.00 0.00 0.00 0.00 51.96 51.12 2i6a s ALA 124 Cb -0.08 -2.20 0.18 0.00 0.00 0.00 0.00 23.12 21.02 2i6a s ALA 124 CO 0.00 0.06 0.55 0.00 0.00 0.00 0.00 175.76 176.37 2i6a s ALA 125 N 0.57 3.74 -0.61 0.00 0.00 0.34 -2.12 121.76 123.67 2i6a s ALA 125 Ca 0.08 -3.16 -0.24 0.00 0.00 0.00 0.00 51.96 48.63 2i6a s ALA 125 Cb -0.12 -3.02 0.05 0.00 0.00 0.00 0.00 23.12 20.03 2i6a s ALA 125 CO 0.00 -2.14 1.00 0.00 0.00 0.00 0.00 175.76 174.63 2i6a s ILE 127 N 4.26 5.05 -0.23 0.00 1.01 -0.70 -0.46 121.20 130.12 2i6a s ILE 127 Ca 0.29 1.04 -0.03 0.00 0.00 0.00 0.00 60.65 61.95 2i6a s ILE 127 Cb -0.13 -3.84 0.07 0.00 0.01 0.00 0.00 42.46 38.57 2i6a s ILE 127 CO 0.16 0.41 0.08 0.42 0.00 0.00 0.00 174.94 176.01 2i6a s THR 128 N -0.04 0.33 0.00 2.92 -4.23 -0.94 -0.60 115.64 113.09 2i6a s THR 128 Ca 0.27 -0.66 0.00 0.00 -1.18 0.00 0.00 61.69 60.13 2i6a s THR 128 Cb -0.17 -1.03 0.00 0.00 1.34 0.00 0.00 72.50 72.64 2i6a s THR 128 CO 0.14 -0.41 0.00 0.61 -0.54 0.00 0.00 174.62 174.42 2i6a n GLY 129 N 5.10 3.76 0.88 3.99 0.00 -1.26 0.19 105.19 117.85 2i6a n GLY 129 Ca -0.07 0.03 0.07 0.00 0.00 0.00 0.00 46.02 46.04 2i6a n GLY 129 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2i6a n ASP 130 N 6.01 2.55 -4.90 1.61 10.43 -1.26 -4.89 116.55 126.10 2i6a n ASP 130 Ca 0.00 -2.08 -0.28 0.00 2.57 0.00 0.00 54.79 54.99 2i6a n ASP 130 Cb 0.00 -0.34 -0.03 0.00 1.84 0.00 0.00 41.12 42.59 2i6a n ASP 130 CO 0.00 0.00 0.00 0.20 -1.07 0.00 0.00 177.20 176.33 2i6a s ASN 131 N -0.92 6.44 -0.12 -2.24 -0.87 0.13 -5.01 114.94 112.34 2i6a s ASN 131 Ca 0.30 0.77 -0.04 0.00 -1.57 0.00 0.00 52.86 52.32 2i6a s ASN 131 Cb 0.17 -2.17 0.06 0.00 -0.02 0.00 0.00 41.25 39.29 2i6a s ASN 131 CO 0.18 -0.25 0.19 -0.13 -2.57 0.00 0.00 177.10 174.52 2i6a s ARG 132 N -3.70 0.09 -0.31 -0.60 0.52 -0.64 -2.21 118.95 112.10 2i6a s ARG 132 Ca 0.45 0.50 -0.08 0.00 -0.52 0.00 0.00 55.73 56.07 2i6a s ARG 132 Cb -0.11 -0.49 0.01 0.00 0.52 0.00 0.00 34.95 34.88 2i6a s ARG 132 CO 0.31 -0.39 0.13 0.45 0.02 0.00 0.00 175.30 175.81 2i6a s SER 133 N 2.32 5.38 -0.24 0.23 0.15 0.39 -2.21 113.70 119.72 2i6a s SER 133 Ca 0.04 -0.71 -0.06 0.00 0.70 0.00 0.00 55.95 55.91 2i6a s SER 133 Cb -0.13 -1.94 -0.02 0.00 -1.71 0.00 0.00 66.02 62.21 2i6a s SER 133 CO -0.08 -0.23 0.04 -0.76 1.20 0.00 0.00 173.24 173.41 2i6a s LEU 134 N 1.54 3.32 -0.20 3.45 1.43 -0.73 0.26 118.68 127.76 2i6a s LEU 134 Ca 0.03 -0.23 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 2i6a s LEU 134 Cb -0.18 -1.88 0.03 0.00 0.03 0.00 0.00 46.19 44.20 2i6a s LEU 134 CO 0.04 -0.01 -0.17 -0.63 0.23 0.00 0.00 176.35 175.81 2i6a s ILE 135 N 1.47 2.14 -0.18 -0.59 1.09 -0.90 -0.44 121.20 123.79 2i6a s ILE 135 Ca 0.05 -1.09 -0.13 0.00 -1.10 0.00 0.00 60.65 58.39 2i6a s ILE 135 Cb -0.15 -1.99 -0.05 0.00 -1.06 0.00 0.00 42.46 39.22 2i6a s ILE 135 CO 0.02 0.40 0.26 0.00 -0.10 0.00 0.00 174.94 175.52 2i6a s ALA 136 N 1.25 3.61 -0.92 9.38 0.00 -0.09 -0.25 121.76 134.75 2i6a s ALA 136 Ca 0.02 -0.55 -0.08 0.00 0.00 0.00 0.00 51.96 51.36 2i6a s ALA 136 Cb -0.15 -2.36 0.23 0.00 0.00 0.00 0.00 23.12 20.84 2i6a s ALA 136 CO -0.11 0.04 0.85 1.21 0.00 0.00 0.00 175.76 177.75 2i6a s ASN 137 N 0.56 6.56 0.29 0.00 2.47 0.24 -0.28 114.94 124.77 2i6a s ASN 137 Ca 0.14 -3.30 0.03 0.00 0.42 0.00 0.00 52.86 50.15 2i6a s ASN 137 Cb -0.13 -2.08 0.65 0.00 -1.45 0.00 0.00 41.25 38.23 2i6a s ASN 137 CO 0.03 -0.34 1.78 -0.07 -3.72 0.00 0.00 177.10 174.77 2i6a h LEU 138 N 6.83 0.71 0.00 3.21 3.38 -1.94 0.62 115.31 128.11 2i6a h LEU 138 Ca 0.13 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2i6a h LEU 138 Cb 0.91 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.63 2i6a h LEU 138 CO 0.86 0.28 0.00 0.00 0.09 0.00 0.00 178.44 179.68 2i6a n ALA 139 N -2.37 0.00 -0.06 1.53 0.00 -1.26 -0.34 120.51 118.01 2i6a n ALA 139 Ca 0.21 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.74 2i6a n ALA 139 Cb 0.50 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.43 2i6a n ALA 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2i6a h ALA 140 N -0.03 1.93 -1.00 0.00 0.00 -1.51 -1.52 119.26 117.13 2i6a h ALA 140 Ca 0.00 -0.02 0.23 0.00 0.00 0.00 0.00 54.91 55.13 2i6a h ALA 140 Cb 0.00 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 17.60 2i6a h ALA 140 CO 0.00 -0.03 0.64 0.00 0.00 0.00 0.00 179.25 179.86 2i6a h ALA 141 N 1.71 2.13 0.00 0.00 0.00 -0.54 -2.11 119.26 120.45 2i6a h ALA 141 Ca 0.24 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.21 2i6a h ALA 141 Cb 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2i6a h ALA 141 CO -0.07 -0.49 0.00 -0.97 0.00 0.00 0.00 179.25 177.72 2i6a h ASN 142 N 0.46 0.00 0.79 0.00 -0.73 -1.36 -3.28 115.58 111.46 2i6a h ASN 142 Ca 0.56 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.73 2i6a h ASN 142 Cb 1.31 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.90 2i6a h ASN 142 CO -0.28 0.00 0.00 0.00 -0.37 0.00 0.00 177.43 176.78 2i6a n TYR 144 N -2.85 2.23 -4.41 0.00 9.36 -1.24 -4.97 117.16 115.29 2i6a n TYR 144 Ca 0.00 0.13 -0.30 0.00 3.32 0.00 0.00 57.90 61.06 2i6a n TYR 144 Cb 0.25 -2.61 -0.17 0.00 -0.63 0.00 0.00 39.34 36.18 2i6a n TYR 144 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 2i6a s LYS 145 N 4.10 2.53 0.36 2.98 -0.14 -1.26 -4.67 119.74 123.64 2i6a s LYS 145 Ca 0.95 -0.67 0.08 0.00 -1.36 0.00 0.00 55.97 54.98 2i6a s LYS 145 Cb -0.79 -2.14 0.80 0.00 -1.68 0.00 0.00 37.83 34.02 2i6a s LYS 145 CO 0.55 -0.09 1.91 1.57 -0.76 0.00 0.00 175.35 178.52 2i6a h LYS 146 N 7.56 0.68 0.00 1.68 2.10 -1.96 -0.99 116.57 125.63 2i6a h LYS 146 Ca -0.34 -0.04 -0.00 0.00 -2.00 0.00 0.00 60.65 58.27 2i6a h LYS 146 Cb 1.17 -0.15 -0.00 0.00 -0.90 0.00 0.00 32.23 32.35 2i6a h LYS 146 CO 0.53 0.45 -0.01 1.05 -2.00 0.00 0.00 179.45 179.47 2i6a h GLU 147 N 0.70 0.00 -0.48 0.07 9.09 -1.96 0.12 114.58 122.12 2i6a h GLU 147 Ca 0.39 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.80 2i6a h GLU 147 Cb 0.56 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.66 2i6a h GLU 147 CO -0.16 0.01 0.00 0.36 0.05 0.00 0.00 179.01 179.27 2i6a n LYS 148 N -3.10 3.10 0.00 1.06 2.85 -0.39 -4.67 118.16 117.00 2i6a n LYS 148 Ca 0.00 -2.51 0.00 0.00 -1.05 0.00 0.00 58.31 54.75 2i6a n LYS 148 Cb 0.30 -1.58 0.00 0.00 -0.65 0.00 0.00 35.03 33.10 2i6a n LYS 148 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 177.40 178.93 2i6a n HIS 149 N 0.72 -2.34 -0.31 5.58 -0.00 -1.16 -4.92 115.22 112.79 2i6a n HIS 149 Ca 0.19 0.00 0.30 0.00 -0.00 0.00 0.00 57.72 58.21 2i6a n HIS 149 Cb 0.66 0.50 0.66 0.00 -0.00 0.00 0.00 29.99 31.80 2i6a n HIS 149 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 2i6a h LEU 150 N 0.00 0.17 0.00 0.27 5.85 -1.66 -0.98 115.31 118.95 2i6a h LEU 150 Ca 0.00 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2i6a h LEU 150 Cb 0.00 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.04 2i6a h LEU 150 CO 0.00 0.03 -0.61 0.47 -0.34 0.00 0.00 178.44 177.99 2i6a n ASP 151 N -4.36 0.59 -4.70 1.25 8.00 0.39 -3.43 116.55 114.28 2i6a n ASP 151 Ca 0.25 -0.33 -0.42 0.00 0.71 0.00 0.00 54.79 54.99 2i6a n ASP 151 Cb 1.08 0.39 -0.03 0.00 -0.02 0.00 0.00 41.12 42.54 2i6a n ASP 151 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2i6a s LEU 152 N -3.12 4.35 0.20 0.64 1.43 -0.37 -4.79 118.68 117.02 2i6a s LEU 152 Ca 0.10 2.17 -0.20 0.00 -1.03 0.00 0.00 54.13 55.17 2i6a s LEU 152 Cb 0.17 -3.57 0.15 0.00 0.03 0.00 0.00 46.19 42.96 2i6a s LEU 152 CO 0.73 -0.64 1.57 -0.08 0.23 0.00 0.00 176.35 178.16 2i6a h GLU 153 N 7.19 -0.11 -0.71 1.70 4.81 -1.89 0.22 114.58 125.80 2i6a h GLU 153 Ca -0.40 0.01 0.16 0.00 -0.13 0.00 0.00 59.36 58.99 2i6a h GLU 153 Cb 1.20 0.02 -0.12 0.00 0.63 0.00 0.00 28.75 30.48 2i6a h GLU 153 CO 0.87 -0.07 0.07 1.57 -0.73 0.00 0.00 179.01 180.71 2i6a h LYS 154 N -0.11 0.16 -0.01 1.92 2.10 -1.94 0.12 116.57 118.80 2i6a h LYS 154 Ca 0.26 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.89 2i6a h LYS 154 Cb 0.57 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.86 2i6a h LYS 154 CO -0.80 0.10 -0.03 -0.91 -2.00 0.00 0.00 179.45 175.82 2i6a h ASN 155 N 0.16 0.05 0.15 7.07 -0.26 -1.40 -3.14 115.58 118.21 2i6a h ASN 155 Ca 0.39 -0.58 -0.01 0.00 -0.56 0.00 0.00 56.30 55.54 2i6a h ASN 155 Cb 0.68 -0.02 -0.00 0.00 -1.06 0.00 0.00 38.32 37.92 2i6a h ASN 155 CO -0.58 0.62 -0.06 -0.25 -1.06 0.00 0.00 177.43 176.10 2i6a h TRP 156 N -0.51 0.00 -0.31 1.19 2.91 -0.28 -2.44 115.95 116.51 2i6a h TRP 156 Ca 0.00 0.00 0.04 0.00 1.13 0.00 0.00 58.89 60.06 2i6a h TRP 156 Cb 0.61 0.00 -0.04 0.00 -0.51 0.00 0.00 29.16 29.22 2i6a h TRP 156 CO 0.13 0.06 0.08 1.98 -1.03 0.00 0.00 178.44 179.66 2i6a h MET 157 N 0.00 0.20 0.00 2.65 4.05 -0.72 -2.29 114.93 118.82 2i6a h MET 157 Ca -0.00 -0.01 -0.05 0.00 -0.28 0.00 0.00 59.70 59.35 2i6a h MET 157 Cb 0.15 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.90 2i6a h MET 157 CO 0.01 0.13 -0.25 -0.07 0.23 0.00 0.00 176.91 176.96 2i6a h LEU 158 N 0.21 0.00 -0.94 3.39 3.38 -1.45 -2.19 115.31 117.71 2i6a h LEU 158 Ca 0.14 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.04 2i6a h LEU 158 Cb 0.14 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2i6a h LEU 158 CO -0.17 0.25 -0.00 0.58 0.09 0.00 0.00 178.44 179.19 2i6a h VAL 159 N 0.00 1.24 0.00 1.22 2.07 -1.35 -2.41 116.25 117.02 2i6a h VAL 159 Ca -0.00 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.53 2i6a h VAL 159 Cb 0.48 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 2i6a h VAL 159 CO 0.03 0.35 0.00 -0.33 0.02 0.00 0.00 177.57 177.64 2i6a h GLU 160 N 0.72 0.00 0.00 1.57 5.08 -0.89 -2.99 114.58 118.06 2i6a h GLU 160 Ca 0.14 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.34 2i6a h GLU 160 Cb 0.44 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 2i6a h GLU 160 CO 0.02 0.00 -0.88 0.87 -1.00 0.00 0.00 179.01 178.02 2i6a h LYS 161 N 0.00 0.00 -6.87 2.33 1.57 -1.28 -3.47 116.57 108.85 2i6a h LYS 161 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 2i6a h LYS 161 Cb 0.37 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.77 2i6a h LYS 161 CO 0.00 0.66 0.82 0.00 -0.57 0.00 0.00 179.45 180.36 2i6a s ALA 162 N -2.84 3.65 -0.13 3.86 0.00 -1.02 -4.47 121.76 120.82 2i6a s ALA 162 Ca 0.01 1.55 -0.05 0.00 0.00 0.00 0.00 51.96 53.48 2i6a s ALA 162 Cb 0.09 -3.62 -0.25 0.00 0.00 0.00 0.00 23.12 19.33 2i6a s ALA 162 CO 0.79 -1.00 0.33 0.54 0.00 0.00 0.00 175.76 176.42 2i6a n ARG 163 N 1.33 0.75 -5.26 0.00 5.12 0.11 -4.90 116.66 113.80 2i6a n ARG 163 Ca 0.04 0.25 -0.31 0.00 -1.93 0.00 0.00 57.85 55.90 2i6a n ARG 163 Cb 0.39 -1.70 -0.16 0.00 -1.16 0.00 0.00 32.46 29.82 2i6a n ARG 163 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 2i6a s VAL 164 N -2.56 2.04 0.00 1.55 1.01 -1.16 -1.19 120.40 120.10 2i6a s VAL 164 Ca -0.22 -1.06 0.08 0.00 0.00 0.00 0.00 61.98 60.78 2i6a s VAL 164 Cb 0.07 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.70 2i6a s VAL 164 CO 0.76 0.57 -0.26 0.00 0.00 0.00 0.00 175.10 176.17 2i6a s TYR 166 N -0.66 0.54 -0.06 0.00 5.04 0.77 -1.39 117.35 121.59 2i6a s TYR 166 Ca 0.10 -0.10 -0.01 0.00 -2.44 0.00 0.00 57.07 54.63 2i6a s TYR 166 Cb -0.10 -0.59 0.03 0.00 0.35 0.00 0.00 41.96 41.65 2i6a s TYR 166 CO -0.00 -0.20 -0.02 0.42 -1.34 0.00 0.00 175.55 174.42 2i6a s ILE 167 N 1.24 0.45 0.44 3.14 1.01 -0.87 -3.50 121.20 123.11 2i6a s ILE 167 Ca -0.06 0.03 -0.24 0.00 0.00 0.00 0.00 60.65 60.37 2i6a s ILE 167 Cb -0.13 -0.56 -0.08 0.00 0.01 0.00 0.00 42.46 41.70 2i6a s ILE 167 CO -0.02 0.25 1.26 0.00 0.00 0.00 0.00 174.94 176.43 2i6a s ALA 168 N 1.63 3.09 -1.31 9.38 0.00 -1.26 -2.82 121.76 130.47 2i6a s ALA 168 Ca 0.00 1.13 0.03 0.00 0.00 0.00 0.00 51.96 53.13 2i6a s ALA 168 Cb -0.13 -3.46 0.16 0.00 0.00 0.00 0.00 23.12 19.69 2i6a s ALA 168 CO -0.04 -0.83 0.97 0.41 0.00 0.00 0.00 175.76 176.27 2i6a n GLY 169 N 0.61 -0.46 0.26 0.00 0.00 0.64 -1.81 105.19 104.44 2i6a n GLY 169 Ca 0.06 -0.01 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 2i6a n GLY 169 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2i6a h PHE 170 N 0.00 0.76 0.00 1.61 0.05 -1.86 -2.55 116.94 114.95 2i6a h PHE 170 Ca 0.00 -0.15 0.00 0.00 3.82 0.00 0.00 57.97 61.64 2i6a h PHE 170 Cb 0.04 -0.19 0.00 0.00 2.00 0.00 0.00 35.95 37.80 2i6a h PHE 170 CO 0.00 0.81 0.00 0.34 -0.18 0.00 0.00 178.31 179.28 2i6a n PHE 171 N -4.14 0.08 0.23 -0.55 7.35 -0.75 -2.16 117.46 117.53 2i6a n PHE 171 Ca 0.01 0.03 0.09 0.00 -0.76 0.00 0.00 57.45 56.82 2i6a n PHE 171 Cb 0.39 -0.56 0.58 0.00 0.35 0.00 0.00 39.48 40.24 2i6a n PHE 171 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2i6a h LEU 172 N 0.00 0.00 0.00 -2.13 3.38 -1.64 -1.94 115.31 112.98 2i6a h LEU 172 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2i6a h LEU 172 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2i6a h LEU 172 CO 0.00 0.20 0.00 0.35 0.09 0.00 0.00 178.44 179.08 2i6a n THR 173 N -3.84 0.38 -0.04 0.22 -2.24 -0.92 -3.85 114.28 103.99 2i6a n THR 173 Ca -0.02 0.09 -0.07 0.00 -2.27 0.00 0.00 64.05 61.78 2i6a n THR 173 Cb 0.30 -0.69 -0.02 0.00 -2.10 0.00 0.00 70.33 67.81 2i6a n THR 173 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2i6a n VAL 174 N -1.49 1.29 -3.33 2.28 0.31 -0.88 -4.94 118.33 111.56 2i6a n VAL 174 Ca 0.06 0.16 -0.26 0.00 -0.01 0.00 0.00 64.34 64.30 2i6a n VAL 174 Cb 0.27 -1.97 -0.09 0.00 -0.91 0.00 0.00 33.84 31.15 2i6a n VAL 174 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2i6a n SER 175 N -3.98 -0.48 -0.22 4.52 2.88 -0.78 -4.93 113.62 110.62 2i6a n SER 175 Ca -0.12 -2.45 0.07 0.00 -1.33 0.00 0.00 58.87 55.04 2i6a n SER 175 Cb 0.38 -0.48 0.34 0.00 -0.75 0.00 0.00 64.21 63.69 2i6a n SER 175 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2i6a h PRO 176 N 5.31 0.77 -0.87 -1.46 0.11 -1.75 -1.98 132.00 132.13 2i6a h PRO 176 Ca 0.23 -0.05 0.09 0.00 0.11 0.00 0.00 66.00 66.38 2i6a h PRO 176 Cb 0.91 -0.17 -0.07 0.00 0.11 0.00 0.00 31.00 31.77 2i6a h PRO 176 CO 0.38 0.51 0.51 0.93 -0.21 0.00 0.00 178.00 180.12 2i6a h GLU 177 N 0.79 0.84 0.19 1.05 3.07 -1.93 0.90 114.58 119.49 2i6a h GLU 177 Ca 0.35 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 59.16 2i6a h GLU 177 Cb 0.35 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 2i6a h GLU 177 CO -0.13 0.55 -0.09 0.77 -1.40 0.00 0.00 179.01 178.71 2i6a h SER 178 N 0.86 -0.22 -0.75 1.42 0.02 -1.78 -1.63 113.55 111.47 2i6a h SER 178 Ca 0.41 -0.27 0.16 0.00 -0.84 0.00 0.00 61.79 61.26 2i6a h SER 178 Cb 0.35 0.06 -0.11 0.00 0.14 0.00 0.00 62.40 62.84 2i6a h SER 178 CO -0.24 0.18 0.20 0.58 -1.14 0.00 0.00 176.83 176.41 2i6a h VAL 179 N -0.66 0.51 -0.56 2.27 2.07 -1.17 0.29 116.25 119.00 2i6a h VAL 179 Ca -0.03 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 2i6a h VAL 179 Cb 0.47 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 2i6a h VAL 179 CO 0.04 0.05 0.25 -0.07 0.02 0.00 0.00 177.57 177.87 2i6a h LEU 180 N 0.28 0.74 -0.70 2.57 3.38 -0.71 0.55 115.31 121.43 2i6a h LEU 180 Ca 0.43 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 2i6a h LEU 180 Cb 0.73 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 2i6a h LEU 180 CO -0.51 0.68 0.33 0.50 0.09 0.00 0.00 178.44 179.52 2i6a h LYS 181 N 0.75 1.01 -0.02 1.13 3.64 -0.24 0.21 116.57 123.05 2i6a h LYS 181 Ca 0.19 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2i6a h LYS 181 Cb 0.15 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2i6a h LYS 181 CO -0.02 0.80 -0.00 0.28 -2.27 0.00 0.00 179.45 178.23 2i6a h VAL 182 N 0.97 1.29 -0.46 2.00 2.07 -0.32 -2.30 116.25 119.50 2i6a h VAL 182 Ca 0.24 -0.87 -0.04 0.00 0.82 0.00 0.00 66.70 66.85 2i6a h VAL 182 Cb 0.13 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 2i6a h VAL 182 CO -0.03 0.23 0.14 0.00 0.02 0.00 0.00 177.57 177.93 2i6a h ALA 183 N 0.65 0.61 -0.92 1.67 0.00 0.18 -2.40 119.26 119.04 2i6a h ALA 183 Ca 0.01 -0.18 0.14 0.00 0.00 0.00 0.00 54.91 54.88 2i6a h ALA 183 Cb 0.38 -0.18 -0.09 0.00 0.00 0.00 0.00 17.79 17.90 2i6a h ALA 183 CO 0.00 0.26 0.53 1.25 0.00 0.00 0.00 179.25 181.30 2i6a h HIS 184 N 0.61 0.94 -0.54 0.00 6.17 -0.63 -1.71 115.15 120.00 2i6a h HIS 184 Ca 0.15 0.03 -0.08 0.00 0.71 0.00 0.00 60.37 61.19 2i6a h HIS 184 Cb 0.27 -0.28 -0.02 0.00 2.52 0.00 0.00 27.41 29.90 2i6a h HIS 184 CO 0.01 0.29 0.03 1.25 0.71 0.00 0.00 177.93 180.22 2i6a h HIS 185 N 0.77 0.96 0.47 5.26 6.17 -1.08 -2.08 115.15 125.62 2i6a h HIS 185 Ca 0.49 -0.14 -0.02 0.00 0.71 0.00 0.00 60.37 61.41 2i6a h HIS 185 Cb 0.62 -0.26 0.00 0.00 2.52 0.00 0.00 27.41 30.30 2i6a h HIS 185 CO -0.05 0.85 -0.23 0.00 0.71 0.00 0.00 177.93 179.22 2i6a h ALA 186 N 1.19 -0.63 0.08 5.26 0.00 -0.85 -2.92 119.26 121.40 2i6a h ALA 186 Ca 0.16 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2i6a h ALA 186 Cb 0.46 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2i6a h ALA 186 CO 0.02 -0.79 -0.28 1.03 0.00 0.00 0.00 179.25 179.23 2i6a h SER 187 N -0.76 -0.83 0.00 0.00 0.87 -1.25 0.24 113.55 111.82 2i6a h SER 187 Ca -0.06 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 2i6a h SER 187 Cb 0.54 0.30 0.00 0.00 -0.44 0.00 0.00 62.40 62.81 2i6a h SER 187 CO 0.11 -0.30 0.76 -0.33 -0.53 0.00 0.00 176.83 176.54 2i6a h GLU 188 N -0.41 0.00 0.00 2.24 5.08 -1.41 0.29 114.58 120.37 2i6a h GLU 188 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2i6a h GLU 188 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2i6a h GLU 188 CO -0.14 0.00 -0.11 0.09 -1.00 0.00 0.00 179.01 177.85 2i6a n ASN 189 N -2.38 0.89 -3.71 1.42 3.02 -0.87 -5.01 115.26 108.62 2i6a n ASN 189 Ca -0.00 -1.81 -0.22 0.00 -0.03 0.00 0.00 54.58 52.51 2i6a n ASN 189 Cb 0.77 -0.11 0.04 0.00 -0.61 0.00 0.00 39.78 39.87 2i6a n ASN 189 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2i6a n ASN 190 N -0.36 -1.65 -5.00 6.41 5.15 0.10 -5.00 115.26 114.90 2i6a n ASN 190 Ca 0.03 -0.80 -0.18 0.00 -0.60 0.00 0.00 54.58 53.03 2i6a n ASN 190 Cb 0.50 -4.12 0.01 0.00 -0.53 0.00 0.00 39.78 35.65 2i6a n ASN 190 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2i6a s ARG 191 N -6.01 2.80 -0.16 1.20 3.00 0.35 -5.01 118.95 115.11 2i6a s ARG 191 Ca 0.08 -1.13 -0.15 0.00 0.00 0.00 0.00 55.73 54.53 2i6a s ARG 191 Cb -0.04 -2.71 -0.04 0.00 0.00 0.00 0.00 34.95 32.16 2i6a s ARG 191 CO 0.81 -0.33 0.36 0.42 0.00 0.00 0.00 175.30 176.55 2i6a s ILE 192 N -2.42 5.26 -0.19 1.52 1.01 -0.33 -4.53 121.20 121.52 2i6a s ILE 192 Ca 0.55 0.68 -0.01 0.00 0.00 0.00 0.00 60.65 61.86 2i6a s ILE 192 Cb -0.10 -3.69 0.01 0.00 0.01 0.00 0.00 42.46 38.68 2i6a s ILE 192 CO 0.34 0.35 -0.13 0.12 0.00 0.00 0.00 174.94 175.62 2i6a s PHE 193 N 0.64 2.84 0.08 3.97 5.36 -1.26 -0.70 117.98 128.91 2i6a s PHE 193 Ca 0.19 -1.26 0.10 0.00 -0.96 0.00 0.00 56.93 55.00 2i6a s PHE 193 Cb -0.14 -1.98 -0.03 0.00 -0.34 0.00 0.00 43.02 40.53 2i6a s PHE 193 CO 0.06 -0.64 -0.26 0.95 -1.46 0.00 0.00 175.22 173.87 2i6a s THR 194 N 1.25 2.26 0.07 0.12 -4.23 -0.49 0.67 115.64 115.29 2i6a s THR 194 Ca 0.03 -1.54 -0.06 0.00 -1.18 0.00 0.00 61.69 58.94 2i6a s THR 194 Cb -0.14 -1.94 -0.02 0.00 1.34 0.00 0.00 72.50 71.75 2i6a s THR 194 CO -0.07 0.24 0.11 -0.22 -0.54 0.00 0.00 174.62 174.15 2i6a s LEU 195 N -1.63 1.80 0.03 4.79 2.96 -0.75 -2.05 118.68 123.82 2i6a s LEU 195 Ca 0.13 -0.77 0.09 0.00 -0.22 0.00 0.00 54.13 53.36 2i6a s LEU 195 Cb -0.10 0.74 -0.03 0.00 0.50 0.00 0.00 46.19 47.31 2i6a s LEU 195 CO 0.04 -0.68 -0.25 0.21 -1.32 0.00 0.00 176.35 174.35 2i6a s ASN 196 N -2.87 3.02 0.43 3.68 3.84 -1.13 -0.13 114.94 121.79 2i6a s ASN 196 Ca 0.06 -0.55 0.20 0.00 0.21 0.00 0.00 52.86 52.78 2i6a s ASN 196 Cb 0.06 -0.29 0.96 0.00 -0.55 0.00 0.00 41.25 41.44 2i6a s ASN 196 CO -0.11 0.26 1.88 -0.07 -2.79 0.00 0.00 177.10 176.27 2i6a h LEU 197 N 4.98 0.00 0.00 3.21 3.38 -1.63 0.18 115.31 125.43 2i6a h LEU 197 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 2i6a h LEU 197 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2i6a h LEU 197 CO 0.44 0.28 0.00 -1.20 0.09 0.00 0.00 178.44 178.05 2i6a n SER 198 N -3.74 0.00 -3.59 -0.43 7.64 -1.26 -4.69 113.62 107.56 2i6a n SER 198 Ca -0.01 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.78 2i6a n SER 198 Cb 0.38 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.53 2i6a n SER 198 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2i6a s ALA 199 N 0.00 -1.97 0.27 -0.43 0.00 -1.26 -5.01 121.76 113.35 2i6a s ALA 199 Ca 0.00 1.63 0.00 0.00 0.00 0.00 0.00 51.96 53.59 2i6a s ALA 199 Cb 0.00 -0.82 0.62 0.00 0.00 0.00 0.00 23.12 22.92 2i6a s ALA 199 CO 0.00 -0.32 1.70 -1.35 0.00 0.00 0.00 175.76 175.78 2i6a h PRO 200 N 2.41 0.35 -0.80 0.00 0.11 -1.88 -1.88 132.00 130.31 2i6a h PRO 200 Ca -0.16 -0.02 0.17 0.00 0.11 0.00 0.00 66.00 66.10 2i6a h PRO 200 Cb 1.17 -0.08 -0.05 0.00 0.11 0.00 0.00 31.00 32.15 2i6a h PRO 200 CO 0.29 0.23 0.53 0.27 -0.21 0.00 0.00 178.00 179.12 2i6a h PHE 201 N 0.36 0.44 -0.62 0.65 -5.15 -1.93 0.11 116.94 110.81 2i6a h PHE 201 Ca 0.50 0.01 -0.05 0.00 -0.20 0.00 0.00 57.97 58.23 2i6a h PHE 201 Cb 0.90 -0.14 -0.03 0.00 0.22 0.00 0.00 35.95 36.91 2i6a h PHE 201 CO -0.18 0.15 0.19 0.82 -2.00 0.00 0.00 178.31 177.28 2i6a h ILE 202 N 0.36 1.24 -0.22 0.88 1.08 -1.62 0.26 117.51 119.49 2i6a h ILE 202 Ca 0.40 -0.81 -0.19 0.00 -0.39 0.00 0.00 64.86 63.87 2i6a h ILE 202 Cb 1.01 0.56 0.00 0.00 -3.07 0.00 0.00 36.82 35.33 2i6a h ILE 202 CO -0.12 0.31 -0.59 0.28 -0.69 0.00 0.00 178.15 177.34 2i6a h SER 203 N 0.91 0.90 0.00 1.72 0.02 -0.88 -1.62 113.55 114.61 2i6a h SER 203 Ca 0.20 -0.57 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 2i6a h SER 203 Cb 0.27 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 62.55 2i6a h SER 203 CO -0.01 1.31 0.00 0.00 -1.14 0.00 0.00 176.83 177.00 2i6a n GLN 204 N -4.04 0.00 -0.07 3.45 6.02 -0.83 -4.02 117.38 117.89 2i6a n GLN 204 Ca -0.06 0.45 0.12 0.00 -0.01 0.00 0.00 57.00 57.50 2i6a n GLN 204 Cb 0.65 -1.29 0.36 0.00 1.02 0.00 0.00 30.24 30.97 2i6a n GLN 204 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 2i6a n PHE 205 N -1.86 0.18 -1.85 1.08 3.72 0.88 -4.22 117.46 115.39 2i6a n PHE 205 Ca 0.00 -0.09 0.05 0.00 -0.05 0.00 0.00 57.45 57.36 2i6a n PHE 205 Cb 0.00 0.00 0.09 0.00 -0.94 0.00 0.00 39.48 38.63 2i6a n PHE 205 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2i6a n TYR 206 N 0.59 0.00 0.05 1.38 4.02 -0.62 -4.88 117.16 117.71 2i6a n TYR 206 Ca 0.17 -0.75 0.03 0.00 -0.01 0.00 0.00 57.90 57.34 2i6a n TYR 206 Cb 0.41 -0.15 0.41 0.00 -0.02 0.00 0.00 39.34 39.99 2i6a n TYR 206 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 176.86 177.42 2i6a h LYS 207 N 0.56 0.42 0.34 -0.72 2.10 -1.67 -1.42 116.57 116.17 2i6a h LYS 207 Ca -0.07 -0.05 -0.00 0.00 -2.00 0.00 0.00 60.65 58.53 2i6a h LYS 207 Cb 1.36 -0.08 -0.03 0.00 -0.90 0.00 0.00 32.23 32.58 2i6a h LYS 207 CO 0.03 0.37 -0.48 1.49 -2.00 0.00 0.00 179.45 178.86 2i6a h GLU 208 N 0.42 -0.83 -0.65 0.07 4.81 -1.91 0.36 114.58 116.84 2i6a h GLU 208 Ca 0.10 0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.40 2i6a h GLU 208 Cb 0.13 0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.67 2i6a h GLU 208 CO -0.01 -0.55 0.43 0.77 -0.73 0.00 0.00 179.01 178.92 2i6a h SER 209 N -0.86 0.74 -0.54 1.04 0.02 -1.92 -0.27 113.55 111.76 2i6a h SER 209 Ca -0.03 -0.02 0.02 0.00 -0.84 0.00 0.00 61.79 60.93 2i6a h SER 209 Cb 0.80 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 63.12 2i6a h SER 209 CO -0.14 0.53 0.33 0.25 -1.14 0.00 0.00 176.83 176.65 2i6a h LEU 210 N 0.87 0.53 0.00 5.07 5.85 -0.84 0.12 115.31 126.91 2i6a h LEU 210 Ca 0.24 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.97 2i6a h LEU 210 Cb -0.08 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 40.84 2i6a h LEU 210 CO -0.06 0.38 -0.22 0.24 -0.34 0.00 0.00 178.44 178.43 2i6a h MET 211 N 0.65 0.00 0.00 1.25 2.86 0.08 0.28 114.93 120.05 2i6a h MET 211 Ca 0.21 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.72 2i6a h MET 211 Cb 0.01 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 2i6a h MET 211 CO -0.09 0.00 -0.66 -0.22 1.06 0.00 0.00 176.91 177.00 2i6a h LYS 212 N 0.00 0.00 0.01 1.72 3.64 -0.54 -3.27 116.57 118.13 2i6a h LYS 212 Ca 0.00 0.00 -0.30 0.00 -1.27 0.00 0.00 60.65 59.08 2i6a h LYS 212 Cb 0.85 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.62 2i6a h LYS 212 CO 0.00 0.60 -1.80 0.28 -2.27 0.00 0.00 179.45 176.26 2i6a n VAL 213 N -3.23 1.60 -0.30 2.00 0.31 0.36 -4.44 118.33 114.62 2i6a n VAL 213 Ca 0.01 -0.79 0.14 0.00 -0.01 0.00 0.00 64.34 63.69 2i6a n VAL 213 Cb 0.79 -1.04 0.31 0.00 -0.91 0.00 0.00 33.84 32.99 2i6a n VAL 213 CO 0.00 0.00 0.00 -0.03 -1.32 0.00 0.00 176.83 175.48 2i6a h MET 214 N 0.01 0.21 0.00 5.55 -1.53 -0.51 -0.64 114.93 118.02 2i6a h MET 214 Ca -0.32 -0.01 0.00 0.00 -3.44 0.00 0.00 59.70 55.93 2i6a h MET 214 Cb 2.04 -0.05 0.00 0.00 -0.55 0.00 0.00 31.60 33.04 2i6a h MET 214 CO 0.07 0.14 0.00 -2.30 0.14 0.00 0.00 176.91 174.96 2i6a n PRO 215 N -5.21 0.14 -0.00 0.39 -0.02 -1.26 -1.44 135.00 127.60 2i6a n PRO 215 Ca 0.23 0.10 0.06 0.00 -2.02 0.00 0.00 63.50 61.87 2i6a n PRO 215 Cb 0.73 -1.50 -0.09 0.00 -0.02 0.00 0.00 33.50 32.62 2i6a n PRO 215 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2i6a n TYR 216 N -1.12 0.00 -2.27 6.00 4.02 -0.25 0.29 117.16 123.84 2i6a n TYR 216 Ca 0.04 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.50 2i6a n TYR 216 Cb 0.03 -0.13 -0.02 0.00 -0.02 0.00 0.00 39.34 39.19 2i6a n TYR 216 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2i6a s VAL 217 N -2.55 3.92 0.02 -0.72 1.01 -0.52 -4.58 120.40 116.99 2i6a s VAL 217 Ca 0.01 1.04 0.07 0.00 0.00 0.00 0.00 61.98 63.10 2i6a s VAL 217 Cb 0.09 -3.93 -0.23 0.00 0.00 0.00 0.00 36.38 32.31 2i6a s VAL 217 CO 0.55 -0.38 0.91 0.44 0.00 0.00 0.00 175.10 176.63 2i6a h ASP 218 N 9.98 0.08 -3.29 3.32 3.32 -0.08 -3.45 116.42 126.30 2i6a h ASP 218 Ca -0.30 -0.12 -0.41 0.00 0.02 0.00 0.00 57.03 56.23 2i6a h ASP 218 Cb 1.13 -0.03 -0.38 0.00 0.22 0.00 0.00 39.33 40.27 2i6a h ASP 218 CO 1.02 1.10 -0.76 -0.63 -1.72 0.00 0.00 179.24 178.25 2i6a s ILE 219 N -2.64 0.17 -0.15 0.35 1.01 -0.95 -0.73 121.20 118.26 2i6a s ILE 219 Ca -0.04 0.25 -0.05 0.00 0.00 0.00 0.00 60.65 60.81 2i6a s ILE 219 Cb 0.08 -0.37 -0.04 0.00 0.01 0.00 0.00 42.46 42.15 2i6a s ILE 219 CO 0.83 0.22 0.02 -0.22 0.00 0.00 0.00 174.94 175.79 2i6a s LEU 220 N 2.02 3.63 0.43 2.97 2.96 0.41 -1.82 118.68 129.27 2i6a s LEU 220 Ca 0.04 0.05 0.07 0.00 -0.22 0.00 0.00 54.13 54.08 2i6a s LEU 220 Cb -0.12 -1.89 -0.02 0.00 0.50 0.00 0.00 46.19 44.66 2i6a s LEU 220 CO -0.04 0.22 0.35 -0.36 -1.32 0.00 0.00 176.35 175.20 2i6a s PHE 221 N 0.06 2.61 0.00 5.38 0.40 0.82 -1.18 117.98 126.07 2i6a s PHE 221 Ca 0.03 -0.53 0.00 0.00 -0.60 0.00 0.00 56.93 55.83 2i6a s PHE 221 Cb -0.13 -2.12 0.00 0.00 0.51 0.00 0.00 43.02 41.28 2i6a s PHE 221 CO 0.01 -0.10 0.00 0.41 0.70 0.00 0.00 175.22 176.25 2i6a n GLY 222 N -1.51 2.46 3.98 4.36 0.00 -1.02 -1.45 105.19 112.01 2i6a n GLY 222 Ca 0.03 -1.15 -0.21 0.00 0.00 0.00 0.00 46.02 44.68 2i6a n GLY 222 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i6a s ASN 223 N 0.00 5.04 0.30 1.61 6.03 -1.26 -0.35 114.94 126.31 2i6a s ASN 223 Ca 0.00 -0.88 -0.01 0.00 -1.03 0.00 0.00 52.86 50.93 2i6a s ASN 223 Cb 0.00 0.09 0.45 0.00 -3.03 0.00 0.00 41.25 38.76 2i6a s ASN 223 CO 0.00 -1.11 1.93 1.05 -2.03 0.00 0.00 177.10 176.94 2i6a h GLU 224 N 0.50 1.00 0.00 3.55 -0.00 -1.44 0.11 114.58 118.30 2i6a h GLU 224 Ca -0.34 -0.09 -0.11 0.00 -0.00 0.00 0.00 59.36 58.81 2i6a h GLU 224 Cb 1.29 -0.21 -0.02 0.00 -0.00 0.00 0.00 28.75 29.81 2i6a h GLU 224 CO 0.48 0.71 -0.53 1.79 -0.00 0.00 0.00 179.01 181.46 2i6a h THR 225 N 1.01 1.22 -0.05 -1.06 1.35 -1.96 -1.79 112.91 111.64 2i6a h THR 225 Ca 0.26 -1.93 -0.09 0.00 -0.55 0.00 0.00 66.41 64.10 2i6a h THR 225 Cb -0.02 2.09 0.00 0.00 -1.73 0.00 0.00 68.15 68.50 2i6a h THR 225 CO -0.05 0.52 -0.32 -0.33 -0.25 0.00 0.00 175.52 175.09 2i6a h GLU 226 N 0.00 0.30 -0.29 4.72 5.08 -1.84 -1.19 114.58 121.36 2i6a h GLU 226 Ca -0.01 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.09 2i6a h GLU 226 Cb 1.05 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 2i6a h GLU 226 CO 0.07 0.92 0.15 0.00 -1.00 0.00 0.00 179.01 179.15 2i6a h ALA 227 N 0.38 0.38 -0.22 3.43 0.00 -1.01 -0.19 119.26 122.03 2i6a h ALA 227 Ca -0.03 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.85 2i6a h ALA 227 Cb 1.00 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.61 2i6a h ALA 227 CO 0.07 -0.08 -0.16 0.00 0.00 0.00 0.00 179.25 179.08 2i6a h ALA 228 N 1.01 -0.01 -0.80 0.00 0.00 -1.33 0.18 119.26 118.31 2i6a h ALA 228 Ca 0.10 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2i6a h ALA 228 Cb 0.09 0.35 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 2i6a h ALA 228 CO -0.01 -0.58 0.43 1.15 0.00 0.00 0.00 179.25 180.23 2i6a h THR 229 N -0.16 1.24 0.02 0.00 2.02 -0.96 -2.74 112.91 112.33 2i6a h THR 229 Ca 0.13 -0.59 -0.00 0.00 0.77 0.00 0.00 66.41 66.71 2i6a h THR 229 Cb 0.35 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 66.92 2i6a h THR 229 CO -0.31 0.27 -0.01 0.15 0.37 0.00 0.00 175.52 175.98 2i6a h PHE 230 N 1.12 -0.02 -1.02 3.16 3.57 -0.08 -1.55 116.94 122.11 2i6a h PHE 230 Ca 0.28 -0.00 0.25 0.00 3.53 0.00 0.00 57.97 62.03 2i6a h PHE 230 Cb 0.03 0.01 -0.10 0.00 2.79 0.00 0.00 35.95 38.68 2i6a h PHE 230 CO 0.01 -0.00 0.65 0.00 -2.23 0.00 0.00 178.31 176.73 2i6a h ALA 231 N 0.95 2.11 0.22 2.41 0.00 -0.54 0.15 119.26 124.55 2i6a h ALA 231 Ca -0.00 0.07 -0.34 0.00 0.00 0.00 0.00 54.91 54.64 2i6a h ALA 231 Cb 0.03 0.01 0.03 0.00 0.00 0.00 0.00 17.79 17.86 2i6a h ALA 231 CO 0.00 -0.51 -1.56 -0.09 0.00 0.00 0.00 179.25 177.10 2i6a h ARG 232 N 0.46 0.47 0.00 0.00 2.43 -1.20 0.47 114.38 117.01 2i6a h ARG 232 Ca 0.59 -0.80 -0.01 0.00 -0.81 0.00 0.00 59.98 58.94 2i6a h ARG 232 Cb 1.37 0.30 -0.00 0.00 -0.42 0.00 0.00 29.97 31.22 2i6a h ARG 232 CO -0.32 1.38 -0.06 0.93 -1.51 0.00 0.00 179.97 180.39 2i6a h GLU 233 N 0.09 0.00 -0.09 0.20 4.39 -0.97 -2.08 114.58 116.13 2i6a h GLU 233 Ca -0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.41 2i6a h GLU 233 Cb 2.11 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.76 2i6a h GLU 233 CO 0.23 0.06 0.00 1.04 -1.16 0.00 0.00 179.01 179.18 2i6a n GLN 234 N -3.17 2.18 -3.76 2.33 1.13 0.01 -4.99 117.38 111.10 2i6a n GLN 234 Ca 0.01 -1.91 -0.26 0.00 -1.94 0.00 0.00 57.00 52.90 2i6a n GLN 234 Cb 0.36 -1.44 0.05 0.00 0.11 0.00 0.00 30.24 29.31 2i6a n GLN 234 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2i6a n GLY 235 N 1.29 -0.46 0.20 1.08 0.00 -0.78 -4.89 105.19 101.63 2i6a n GLY 235 Ca 0.14 0.19 0.03 0.00 0.00 0.00 0.00 46.02 46.38 2i6a n GLY 235 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2i6a h PHE 236 N -2.19 0.01 -4.96 1.61 -1.00 -0.33 -3.48 116.94 106.61 2i6a h PHE 236 Ca -0.58 -0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.12 2i6a h PHE 236 Cb 1.37 -0.00 0.06 0.00 3.61 0.00 0.00 35.95 40.99 2i6a h PHE 236 CO 0.52 0.34 -0.26 0.39 -1.61 0.00 0.00 178.31 177.69 2i6a n GLU 237 N -4.15 -1.36 -3.49 1.51 1.02 -1.25 -5.04 120.64 107.88 2i6a n GLU 237 Ca -0.02 1.09 0.03 0.00 -0.02 0.00 0.00 57.16 58.24 2i6a n GLU 237 Cb 0.37 -5.00 -0.05 0.00 -0.02 0.00 0.00 31.44 26.74 2i6a n GLU 237 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2i6a s THR 238 N -3.12 -0.01 -1.39 2.62 -1.32 -1.26 -5.03 115.64 106.13 2i6a s THR 238 Ca 0.14 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.86 2i6a s THR 238 Cb -0.02 -1.00 -0.00 0.00 -1.51 0.00 0.00 72.50 69.97 2i6a s THR 238 CO 0.61 0.00 1.24 0.29 -2.21 0.00 0.00 174.62 174.55 2i6a n LYS 239 N 3.56 0.45 -2.47 7.08 5.02 -1.26 -4.84 118.16 125.70 2i6a n LYS 239 Ca -0.13 -0.32 -0.43 0.00 -2.02 0.00 0.00 58.31 55.40 2i6a n LYS 239 Cb 0.56 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 34.05 2i6a n LYS 239 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2i6a s ASP 240 N -2.78 6.46 0.14 4.39 3.68 -1.26 -4.95 116.67 122.35 2i6a s ASP 240 Ca 0.15 0.62 -0.27 0.00 2.13 0.00 0.00 52.55 55.19 2i6a s ASP 240 Cb 0.18 -2.54 -0.06 0.00 -1.45 0.00 0.00 42.92 39.04 2i6a s ASP 240 CO 0.68 -1.37 1.47 -0.29 0.13 0.00 0.00 175.17 175.78 2i6a h ILE 241 N 6.36 0.00 -0.60 4.11 2.10 -1.97 0.18 117.51 127.68 2i6a h ILE 241 Ca -0.25 0.00 0.13 0.00 1.08 0.00 0.00 64.86 65.82 2i6a h ILE 241 Cb 1.08 0.00 -0.03 0.00 -1.09 0.00 0.00 36.82 36.78 2i6a h ILE 241 CO 1.11 0.00 0.41 0.11 -1.08 0.00 0.00 178.15 178.70 2i6a h LYS 242 N -0.01 0.23 0.08 2.19 1.57 -1.98 0.24 116.57 118.89 2i6a h LYS 242 Ca 0.14 -0.01 -0.25 0.00 -1.87 0.00 0.00 60.65 58.65 2i6a h LYS 242 Cb 0.36 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 2i6a h LYS 242 CO -0.80 0.15 -1.13 1.49 -0.57 0.00 0.00 179.45 178.59 2i6a h GLU 243 N 0.24 0.24 -0.25 3.15 4.57 -1.19 -1.44 114.58 119.90 2i6a h GLU 243 Ca 0.29 -0.37 -0.15 0.00 -1.18 0.00 0.00 59.36 57.94 2i6a h GLU 243 Cb 0.80 0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 29.52 2i6a h GLU 243 CO -0.06 1.14 -0.47 0.82 -1.18 0.00 0.00 179.01 179.27 2i6a h ILE 244 N 0.09 1.30 -0.52 2.32 2.04 0.65 -0.53 117.51 122.86 2i6a h ILE 244 Ca -0.10 -1.67 -0.09 0.00 1.00 0.00 0.00 64.86 64.00 2i6a h ILE 244 Cb 1.84 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 39.51 2i6a h ILE 244 CO 0.18 0.53 -0.05 0.00 0.00 0.00 0.00 178.15 178.81 2i6a h ALA 245 N 0.95 0.93 -0.16 1.87 0.00 -0.58 -1.62 119.26 120.65 2i6a h ALA 245 Ca 0.03 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 2i6a h ALA 245 Cb 1.01 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2i6a h ALA 245 CO 0.10 0.63 -0.18 -0.22 0.00 0.00 0.00 179.25 179.57 2i6a h LYS 246 N 0.84 0.41 -0.56 0.00 3.64 -1.09 -2.53 116.57 117.28 2i6a h LYS 246 Ca 0.15 -0.22 -0.06 0.00 -1.27 0.00 0.00 60.65 59.24 2i6a h LYS 246 Cb 0.56 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 2i6a h LYS 246 CO 0.03 0.79 0.10 0.87 -2.27 0.00 0.00 179.45 178.97 2i6a h LYS 247 N 0.04 0.89 -0.58 1.90 1.57 -1.07 -3.00 116.57 116.32 2i6a h LYS 247 Ca 0.02 -0.21 -0.09 0.00 -1.87 0.00 0.00 60.65 58.51 2i6a h LYS 247 Cb 0.73 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 2i6a h LYS 247 CO 0.04 0.82 0.02 1.15 -0.57 0.00 0.00 179.45 180.92 2i6a h THR 248 N 0.84 1.26 0.00 -0.16 2.02 -1.32 -2.12 112.91 113.44 2i6a h THR 248 Ca 0.18 -1.08 0.00 0.00 0.77 0.00 0.00 66.41 66.27 2i6a h THR 248 Cb 0.36 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 67.56 2i6a h THR 248 CO 0.01 0.39 0.00 0.00 0.37 0.00 0.00 175.52 176.29 2i6a n GLN 249 N -4.20 0.15 0.00 6.66 -0.00 -0.95 -2.55 117.38 116.49 2i6a n GLN 249 Ca 0.03 0.35 0.11 0.00 -0.00 0.00 0.00 57.00 57.49 2i6a n GLN 249 Cb 0.32 -1.77 -0.04 0.00 -0.00 0.00 0.00 30.24 28.75 2i6a n GLN 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2i6a n ALA 250 N -1.71 4.36 -1.35 2.61 0.00 -0.82 -4.48 120.51 119.12 2i6a n ALA 250 Ca 0.03 -0.58 -0.37 0.00 0.00 0.00 0.00 53.44 52.52 2i6a n ALA 250 Cb 0.24 -0.82 0.05 0.00 0.00 0.00 0.00 19.45 18.92 2i6a n ALA 250 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2i6a n LEU 251 N -1.19 0.23 -4.62 0.00 4.77 -1.06 -4.80 117.00 110.33 2i6a n LEU 251 Ca 0.05 0.65 -0.49 0.00 -0.03 0.00 0.00 56.01 56.19 2i6a n LEU 251 Cb 0.36 -1.15 -0.05 0.00 -2.33 0.00 0.00 43.42 40.25 2i6a n LEU 251 CO 0.39 -3.31 0.98 -2.65 -1.33 0.00 0.00 177.39 171.47 2i6a n PRO 252 N -0.13 1.54 -4.04 3.23 -0.02 -1.26 -4.98 135.00 129.34 2i6a n PRO 252 Ca 0.10 0.55 -0.34 0.00 -2.02 0.00 0.00 63.50 61.80 2i6a n PRO 252 Cb 0.49 -2.22 -0.15 0.00 -0.02 0.00 0.00 33.50 31.60 2i6a n PRO 252 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2i6a s LYS 253 N 0.43 3.14 0.20 -0.52 2.20 -1.26 -4.20 119.74 119.72 2i6a s LYS 253 Ca 0.80 -0.75 -0.15 0.00 -0.36 0.00 0.00 55.97 55.51 2i6a s LYS 253 Cb -0.83 -2.74 0.19 0.00 -1.51 0.00 0.00 37.83 32.94 2i6a s LYS 253 CO 0.45 -0.20 1.64 1.98 -0.36 0.00 0.00 175.35 178.85 2i6a h MET 254 N 8.00 -0.00 -4.81 4.03 1.85 -0.51 -3.39 114.93 120.10 2i6a h MET 254 Ca -0.44 0.00 -0.70 0.00 -0.61 0.00 0.00 59.70 57.95 2i6a h MET 254 Cb 1.15 0.00 -0.19 0.00 0.43 0.00 0.00 31.60 32.99 2i6a h MET 254 CO 0.63 -0.00 -0.00 1.21 -0.40 0.00 0.00 176.91 178.34 2i6a s ASN 255 N -5.23 6.21 0.17 1.39 2.47 -1.26 -4.95 114.94 113.74 2i6a s ASN 255 Ca -0.14 -1.07 0.16 0.00 0.42 0.00 0.00 52.86 52.23 2i6a s ASN 255 Cb 0.18 -2.27 0.76 0.00 -1.45 0.00 0.00 41.25 38.46 2i6a s ASN 255 CO 0.73 -0.89 1.50 -1.54 -3.72 0.00 0.00 177.10 173.18 2i6a n SER 256 N 6.03 0.37 0.23 -4.21 3.41 -1.26 -2.89 113.62 115.30 2i6a n SER 256 Ca -0.08 0.63 0.13 0.00 -0.26 0.00 0.00 58.87 59.29 2i6a n SER 256 Cb 0.45 -0.69 0.30 0.00 -0.26 0.00 0.00 64.21 64.01 2i6a n SER 256 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2i6a h LYS 257 N 0.00 0.00 -6.06 4.33 1.57 -1.96 -3.44 116.57 111.01 2i6a h LYS 257 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 2i6a h LYS 257 Cb 0.16 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 32.18 2i6a h LYS 257 CO 0.00 0.02 -0.85 1.03 -0.57 0.00 0.00 179.45 179.08 2i6a s ARG 258 N -3.33 1.64 -0.13 3.15 0.52 -1.14 -5.14 118.95 114.52 2i6a s ARG 258 Ca 0.05 -0.78 -0.09 0.00 -0.52 0.00 0.00 55.73 54.39 2i6a s ARG 258 Cb 0.06 -1.62 -0.04 0.00 0.52 0.00 0.00 34.95 33.87 2i6a s ARG 258 CO 0.64 0.44 0.17 -1.14 0.02 0.00 0.00 175.30 175.43 2i6a s GLN 259 N -0.62 3.71 1.02 3.54 2.00 -1.26 -4.89 119.66 123.16 2i6a s GLN 259 Ca 0.08 -0.09 -0.18 0.00 -2.00 0.00 0.00 55.36 53.17 2i6a s GLN 259 Cb -0.08 -3.26 -0.02 0.00 0.80 0.00 0.00 33.01 30.45 2i6a s GLN 259 CO -0.00 0.63 -0.30 -2.13 -0.50 0.00 0.00 175.29 172.99 2i6a n ARG 260 N 2.43 -0.62 -3.78 1.67 0.63 -1.26 -4.92 116.66 110.80 2i6a n ARG 260 Ca -0.18 -0.16 -0.13 0.00 -0.92 0.00 0.00 57.85 56.45 2i6a n ARG 260 Cb 0.54 -1.50 -0.14 0.00 0.45 0.00 0.00 32.46 31.81 2i6a n ARG 260 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 2i6a s ILE 261 N -2.20 -0.04 -0.10 5.15 1.01 0.09 -4.36 121.20 120.75 2i6a s ILE 261 Ca 0.50 0.14 0.01 0.00 0.00 0.00 0.00 60.65 61.29 2i6a s ILE 261 Cb -0.12 -0.19 0.02 0.00 0.01 0.00 0.00 42.46 42.18 2i6a s ILE 261 CO 0.70 0.06 -0.11 -0.69 0.00 0.00 0.00 174.94 174.89 2i6a s VAL 262 N 0.84 1.20 -0.07 2.92 1.01 -0.74 -0.45 120.40 125.12 2i6a s VAL 262 Ca -0.07 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 61.47 2i6a s VAL 262 Cb -0.09 -1.14 0.02 0.00 0.00 0.00 0.00 36.38 35.17 2i6a s VAL 262 CO -0.04 0.38 -0.10 -0.63 0.00 0.00 0.00 175.10 174.72 2i6a s ILE 263 N 1.13 0.97 -0.12 2.22 1.01 -0.32 -0.62 121.20 125.47 2i6a s ILE 263 Ca -0.05 -0.36 -0.00 0.00 0.00 0.00 0.00 60.65 60.24 2i6a s ILE 263 Cb -0.14 -0.93 0.02 0.00 0.01 0.00 0.00 42.46 41.42 2i6a s ILE 263 CO -0.02 0.33 -0.09 -0.36 0.00 0.00 0.00 174.94 174.80 2i6a s PHE 264 N 0.91 1.63 0.33 3.97 0.08 0.76 -2.43 117.98 123.22 2i6a s PHE 264 Ca -0.10 -0.84 -0.09 0.00 0.12 0.00 0.00 56.93 56.01 2i6a s PHE 264 Cb -0.15 -1.31 -0.06 0.00 -0.57 0.00 0.00 43.02 40.93 2i6a s PHE 264 CO 0.01 -0.55 0.65 0.95 -0.10 0.00 0.00 175.22 176.18 2i6a s THR 265 N 1.66 4.89 -0.17 0.64 -4.23 0.53 -0.47 115.64 118.48 2i6a s THR 265 Ca 0.05 0.42 0.22 0.00 -1.18 0.00 0.00 61.69 61.21 2i6a s THR 265 Cb -0.13 -3.70 0.47 0.00 1.34 0.00 0.00 72.50 70.49 2i6a s THR 265 CO -0.09 -0.34 1.14 0.00 -0.54 0.00 0.00 174.62 174.79 2i6a n GLN 266 N -0.89 1.27 0.00 3.99 6.02 -1.26 -1.07 117.38 125.44 2i6a n GLN 266 Ca 0.01 -3.03 0.00 0.00 -0.01 0.00 0.00 57.00 53.96 2i6a n GLN 266 Cb 0.54 -1.11 0.00 0.00 1.02 0.00 0.00 30.24 30.69 2i6a n GLN 266 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2i6a n GLY 267 N -0.26 1.48 0.01 1.08 0.00 -1.26 -1.00 105.19 105.24 2i6a n GLY 267 Ca 0.10 0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.31 2i6a n GLY 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i6a n ARG 268 N 0.00 0.10 -1.94 1.61 1.74 -1.26 -4.92 116.66 111.99 2i6a n ARG 268 Ca 0.00 -0.01 -0.30 0.00 -0.77 0.00 0.00 57.85 56.78 2i6a n ARG 268 Cb 0.00 -1.53 0.04 0.00 -1.02 0.00 0.00 32.46 29.96 2i6a n ARG 268 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2i6a s ASP 269 N -3.29 5.49 0.50 0.55 1.01 -0.17 -4.55 116.67 116.20 2i6a s ASP 269 Ca 0.07 1.10 -0.21 0.00 0.71 0.00 0.00 52.55 54.22 2i6a s ASP 269 Cb 0.16 -1.93 -0.09 0.00 1.01 0.00 0.00 42.92 42.08 2i6a s ASP 269 CO 0.80 -1.29 0.88 0.47 0.21 0.00 0.00 175.17 176.24 2i6a n ASP 270 N -2.95 0.58 -4.67 0.27 8.00 -1.26 -4.18 116.55 112.33 2i6a n ASP 270 Ca 0.07 0.91 -0.41 0.00 0.71 0.00 0.00 54.79 56.06 2i6a n ASP 270 Cb 0.57 -1.32 -0.04 0.00 -0.02 0.00 0.00 41.12 40.31 2i6a n ASP 270 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2i6a s THR 271 N -1.44 4.88 -0.03 -3.53 2.01 0.60 -4.13 115.64 114.01 2i6a s THR 271 Ca 0.68 1.66 -0.19 0.00 0.31 0.00 0.00 61.69 64.14 2i6a s THR 271 Cb -0.50 -4.15 -0.05 0.00 0.01 0.00 0.00 72.50 67.81 2i6a s THR 271 CO 0.53 0.04 0.55 -0.63 -0.69 0.00 0.00 174.62 174.43 2i6a s ILE 272 N 2.06 4.98 -0.07 1.82 1.09 0.38 -1.65 121.20 129.80 2i6a s ILE 272 Ca 0.39 1.15 0.02 0.00 -1.10 0.00 0.00 60.65 61.11 2i6a s ILE 272 Cb -0.17 -3.89 0.01 0.00 -1.06 0.00 0.00 42.46 37.36 2i6a s ILE 272 CO 0.13 0.41 -0.12 -0.32 -0.10 0.00 0.00 174.94 174.95 2i6a s MET 273 N -0.11 1.70 -0.12 2.79 1.75 -0.17 -0.17 119.30 124.98 2i6a s MET 273 Ca 0.29 -0.40 0.02 0.00 -1.25 0.00 0.00 55.69 54.35 2i6a s MET 273 Cb -0.17 -1.42 -0.00 0.00 2.84 0.00 0.00 34.83 36.07 2i6a s MET 273 CO 0.15 0.01 -0.20 0.00 -0.65 0.00 0.00 175.02 174.34 2i6a s ALA 274 N 0.73 2.34 0.25 4.11 0.00 0.21 0.27 121.76 129.67 2i6a s ALA 274 Ca -0.13 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 50.87 2i6a s ALA 274 Cb -0.16 -0.98 -0.00 0.00 0.00 0.00 0.00 23.12 21.98 2i6a s ALA 274 CO 0.03 0.23 0.01 0.25 0.00 0.00 0.00 175.76 176.28 2i6a n THR 275 N 3.60 0.00 -0.22 0.00 -2.24 0.13 -1.80 114.28 113.74 2i6a n THR 275 Ca -0.19 -1.23 -0.03 0.00 -2.27 0.00 0.00 64.05 60.33 2i6a n THR 275 Cb 0.53 0.27 0.14 0.00 -2.10 0.00 0.00 70.33 69.17 2i6a n THR 275 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2i6a h GLU 276 N 0.00 1.04 0.34 -0.78 4.81 -1.92 -3.17 114.58 114.89 2i6a h GLU 276 Ca -0.21 -0.17 -0.02 0.00 -0.13 0.00 0.00 59.36 58.84 2i6a h GLU 276 Cb 0.65 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.86 2i6a h GLU 276 CO 0.35 0.83 -0.16 0.77 -0.73 0.00 0.00 179.01 180.07 2i6a h SER 277 N 1.02 -0.39 0.00 1.04 0.02 -1.97 -3.50 113.55 109.78 2i6a h SER 277 Ca 0.24 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 2i6a h SER 277 Cb 0.17 0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.81 2i6a h SER 277 CO -0.02 0.07 0.00 -0.62 -1.14 0.00 0.00 176.83 175.12 2i6a n GLU 278 N -5.09 0.00 -3.98 3.45 1.02 -1.20 -5.15 120.64 109.69 2i6a n GLU 278 Ca -0.07 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.89 2i6a n GLU 278 Cb 0.24 0.00 -0.16 0.00 -0.02 0.00 0.00 31.44 31.50 2i6a n GLU 278 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2i6a s VAL 279 N -1.26 0.25 0.03 2.62 1.01 -1.26 0.18 120.40 121.96 2i6a s VAL 279 Ca 0.00 0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.02 2i6a s VAL 279 Cb 0.00 -0.32 -0.02 0.00 0.00 0.00 0.00 36.38 36.04 2i6a s VAL 279 CO 0.00 0.16 -0.04 -0.89 0.00 0.00 0.00 175.10 174.32 2i6a s THR 280 N 0.94 0.22 0.12 3.92 2.01 0.14 -4.98 115.64 118.02 2i6a s THR 280 Ca -0.10 -0.96 0.04 0.00 0.31 0.00 0.00 61.69 60.97 2i6a s THR 280 Cb -0.13 -0.36 -0.04 0.00 0.01 0.00 0.00 72.50 71.98 2i6a s THR 280 CO -0.01 -0.47 0.14 0.00 -0.69 0.00 0.00 174.62 173.58 2i6a s ALA 281 N -1.45 3.64 -0.04 7.40 0.00 -1.26 -0.99 121.76 129.05 2i6a s ALA 281 Ca -0.14 -1.09 -0.00 0.00 0.00 0.00 0.00 51.96 50.72 2i6a s ALA 281 Cb -0.10 -1.47 0.03 0.00 0.00 0.00 0.00 23.12 21.58 2i6a s ALA 281 CO -0.01 0.62 0.01 -0.06 0.00 0.00 0.00 175.76 176.32 2i6a s PHE 282 N -1.60 0.41 0.24 0.00 0.08 -0.66 -4.93 117.98 111.52 2i6a s PHE 282 Ca 0.31 -0.02 -0.30 0.00 0.12 0.00 0.00 56.93 57.04 2i6a s PHE 282 Cb -0.11 -0.55 -0.09 0.00 -0.57 0.00 0.00 43.02 41.69 2i6a s PHE 282 CO 0.24 -0.20 1.21 0.00 -0.10 0.00 0.00 175.22 176.36 2i6a s ALA 283 N 1.48 3.45 0.19 5.36 0.00 -1.26 -0.29 121.76 130.70 2i6a s ALA 283 Ca -0.03 1.01 -0.30 0.00 0.00 0.00 0.00 51.96 52.64 2i6a s ALA 283 Cb -0.13 -3.41 -0.08 0.00 0.00 0.00 0.00 23.12 19.50 2i6a s ALA 283 CO -0.03 -0.39 1.11 0.08 0.00 0.00 0.00 175.76 176.54 2i6a s VAL 284 N -0.50 3.78 0.07 0.00 1.01 -1.26 -4.94 120.40 118.56 2i6a s VAL 284 Ca 0.51 1.56 -0.37 0.00 0.00 0.00 0.00 61.98 63.68 2i6a s VAL 284 Cb -0.34 -4.00 -0.17 0.00 0.00 0.00 0.00 36.38 31.87 2i6a s VAL 284 CO 0.41 0.28 1.24 0.18 0.00 0.00 0.00 175.10 177.21 2i6a n LEU 285 N 2.21 1.17 -2.97 3.92 4.77 -1.26 -4.70 117.00 120.15 2i6a n LEU 285 Ca 0.02 1.13 0.00 0.00 -0.03 0.00 0.00 56.01 57.13 2i6a n LEU 285 Cb 0.46 -1.12 0.00 0.00 -2.33 0.00 0.00 43.42 40.43 2i6a n LEU 285 CO 0.54 -1.32 0.95 0.47 -1.33 0.00 0.00 177.39 176.71 2i6a n ASP 286 N 2.21 0.00 -1.70 -1.43 8.00 -1.26 -4.55 116.55 117.82 2i6a n ASP 286 Ca 0.18 -1.95 -0.10 0.00 0.71 0.00 0.00 54.79 53.64 2i6a n ASP 286 Cb 0.17 -0.46 0.03 0.00 -0.02 0.00 0.00 41.12 40.84 2i6a n ASP 286 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2i6a n GLN 287 N 4.83 1.48 -0.45 -1.24 10.64 -1.26 -4.96 117.38 126.42 2i6a n GLN 287 Ca 0.00 -0.96 -0.22 0.00 -1.83 0.00 0.00 57.00 53.99 2i6a n GLN 287 Cb 0.00 -1.37 0.19 0.00 -0.86 0.00 0.00 30.24 28.20 2i6a n GLN 287 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 2i6a n ASP 288 N 0.70 -3.26 0.00 2.61 8.00 -1.26 -3.48 116.55 119.86 2i6a n ASP 288 Ca 0.18 -0.50 0.00 0.00 0.71 0.00 0.00 54.79 55.18 2i6a n ASP 288 Cb 0.58 -0.86 0.00 0.00 -0.02 0.00 0.00 41.12 40.82 2i6a n ASP 288 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2i6a n GLN 289 N -3.04 0.00 0.28 -1.24 10.64 -1.26 -4.79 117.38 117.97 2i6a n GLN 289 Ca 0.08 0.00 0.16 0.00 -1.83 0.00 0.00 57.00 55.40 2i6a n GLN 289 Cb 0.44 -4.41 0.85 0.00 -0.86 0.00 0.00 30.24 26.25 2i6a n GLN 289 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.06 176.80 2i6a h LYS 290 N 0.07 0.00 0.00 2.61 5.09 -1.99 -3.45 116.57 118.90 2i6a h LYS 290 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.74 2i6a h LYS 290 Cb 0.00 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.33 2i6a h LYS 290 CO 0.00 0.06 0.00 -0.85 -2.09 0.00 0.00 179.45 176.57 2i6a n GLU 291 N -3.49 0.00 -1.29 0.07 0.28 -1.26 -3.63 120.64 111.32 2i6a n GLU 291 Ca -0.02 0.00 -0.41 0.00 -0.16 0.00 0.00 57.16 56.57 2i6a n GLU 291 Cb 0.19 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.01 2i6a n GLU 291 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 2i6a n ILE 292 N 0.00 1.86 -4.85 3.84 5.41 -1.26 -4.85 119.36 119.51 2i6a n ILE 292 Ca 0.00 -1.68 -0.33 0.00 1.00 0.00 0.00 62.75 61.75 2i6a n ILE 292 Cb 0.00 -2.30 -0.14 0.00 -0.71 0.00 0.00 39.64 36.49 2i6a n ILE 292 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 176.55 176.82 2i6a s ILE 293 N 5.81 2.99 -0.45 1.39 -4.36 -1.24 -4.98 121.20 120.35 2i6a s ILE 293 Ca 0.59 -0.71 -0.29 0.00 -0.26 0.00 0.00 60.65 59.98 2i6a s ILE 293 Cb 0.12 -2.21 0.03 0.00 1.25 0.00 0.00 42.46 41.65 2i6a s ILE 293 CO 0.12 0.55 1.12 -0.62 0.24 0.00 0.00 174.94 176.35 2i6a s ASP 294 N -0.10 6.67 0.43 4.36 3.68 -1.26 -4.90 116.67 125.55 2i6a s ASP 294 Ca -0.02 0.53 0.22 0.00 2.13 0.00 0.00 52.55 55.41 2i6a s ASP 294 Cb -0.14 -2.54 0.95 0.00 -1.45 0.00 0.00 42.92 39.74 2i6a s ASP 294 CO 0.04 -1.19 1.86 0.74 0.13 0.00 0.00 175.17 176.74 2i6a h THR 295 N 6.15 0.73 0.22 1.71 2.02 -1.97 -1.43 112.91 120.34 2i6a h THR 295 Ca -0.23 -1.12 -0.31 0.00 0.77 0.00 0.00 66.41 65.52 2i6a h THR 295 Cb 1.06 1.71 0.04 0.00 -1.74 0.00 0.00 68.15 69.21 2i6a h THR 295 CO 1.11 0.26 -1.33 0.78 0.37 0.00 0.00 175.52 176.70 2i6a h ASN 296 N 0.00 0.79 0.80 4.18 4.21 -1.99 -2.49 115.58 121.07 2i6a h ASN 296 Ca -0.00 -0.91 -0.03 0.00 1.21 0.00 0.00 56.30 56.57 2i6a h ASN 296 Cb 0.69 -0.26 -0.00 0.00 -1.12 0.00 0.00 38.32 37.63 2i6a h ASN 296 CO 0.03 1.64 -0.14 1.23 -1.29 0.00 0.00 177.43 178.91 2i6a h GLY 297 N 0.07 0.00 1.50 2.83 0.00 -1.95 -2.53 103.07 102.99 2i6a h GLY 297 Ca -0.23 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 46.87 2i6a h GLY 297 CO 0.25 0.00 -0.98 0.00 0.00 0.00 0.00 176.54 175.81 2i6a h ALA 298 N 1.86 0.31 0.64 3.60 0.00 -1.26 -2.16 119.26 122.26 2i6a h ALA 298 Ca -0.00 -0.72 -0.02 0.00 0.00 0.00 0.00 54.91 54.17 2i6a h ALA 298 Cb 0.57 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2i6a h ALA 298 CO 0.02 0.80 -0.46 0.78 0.00 0.00 0.00 179.25 180.39 2i6a h GLY 299 N 1.12 -1.22 0.28 0.00 0.00 -1.17 0.11 103.07 102.18 2i6a h GLY 299 Ca -0.09 0.52 0.16 0.00 0.00 0.00 0.00 47.33 47.92 2i6a h GLY 299 CO 0.17 -0.40 0.62 -0.55 0.00 0.00 0.00 176.54 176.38 2i6a h ASP 300 N -1.06 0.85 0.25 0.19 3.32 -1.51 -1.56 116.42 116.90 2i6a h ASP 300 Ca -0.08 0.08 -0.16 0.00 0.02 0.00 0.00 57.03 56.89 2i6a h ASP 300 Cb 0.88 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.34 2i6a h ASP 300 CO 0.04 0.37 -0.60 0.00 -1.72 0.00 0.00 179.24 177.32 2i6a h ALA 301 N 1.60 0.77 -0.48 3.45 0.00 -1.14 -2.68 119.26 120.79 2i6a h ALA 301 Ca 0.55 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2i6a h ALA 301 Cb 0.72 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2i6a h ALA 301 CO -0.33 0.72 0.24 0.35 0.00 0.00 0.00 179.25 180.23 2i6a h PHE 302 N 0.26 0.67 0.25 0.00 3.57 0.23 -0.13 116.94 121.80 2i6a h PHE 302 Ca -0.01 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 2i6a h PHE 302 Cb 1.13 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.66 2i6a h PHE 302 CO 0.03 0.52 -0.12 0.28 -2.23 0.00 0.00 178.31 176.79 2i6a h VAL 303 N 0.63 0.77 -0.75 1.41 2.07 -1.48 -0.68 116.25 118.22 2i6a h VAL 303 Ca 0.17 -0.11 0.15 0.00 0.82 0.00 0.00 66.70 67.73 2i6a h VAL 303 Cb 0.09 0.84 -0.10 0.00 -1.52 0.00 0.00 31.29 30.60 2i6a h VAL 303 CO -0.02 0.02 0.27 1.23 0.02 0.00 0.00 177.57 179.09 2i6a h GLY 304 N -0.39 1.11 0.86 2.17 0.00 -1.22 0.70 103.07 106.30 2i6a h GLY 304 Ca -0.03 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 2i6a h GLY 304 CO 0.06 -0.13 0.04 -1.33 0.00 0.00 0.00 176.54 175.17 2i6a h GLY 305 N 0.39 0.17 0.97 4.60 0.00 -0.70 -1.34 103.07 107.15 2i6a h GLY 305 Ca 0.42 -0.09 0.01 0.00 0.00 0.00 0.00 47.33 47.67 2i6a h GLY 305 CO -0.44 0.09 0.43 -2.75 0.00 0.00 0.00 176.54 173.87 2i6a h PHE 306 N 0.01 0.81 -0.85 5.60 3.04 0.01 -2.77 116.94 122.78 2i6a h PHE 306 Ca 0.03 0.02 0.01 0.00 3.98 0.00 0.00 57.97 62.01 2i6a h PHE 306 Cb 0.18 -0.27 -0.04 0.00 2.56 0.00 0.00 35.95 38.37 2i6a h PHE 306 CO -0.01 0.50 0.56 -0.07 -2.02 0.00 0.00 178.31 177.26 2i6a h LEU 307 N 0.86 0.98 -1.31 0.59 3.38 0.46 -1.46 115.31 118.81 2i6a h LEU 307 Ca 0.25 -0.03 0.18 0.00 0.09 0.00 0.00 57.88 58.36 2i6a h LEU 307 Cb -0.07 -0.25 -0.08 0.00 0.09 0.00 0.00 40.66 40.36 2i6a h LEU 307 CO -0.07 0.72 0.60 0.77 0.09 0.00 0.00 178.44 180.55 2i6a h SER 308 N 1.15 0.58 0.35 -0.43 4.64 -0.94 -2.02 113.55 116.88 2i6a h SER 308 Ca 0.31 0.05 -0.32 0.00 -0.47 0.00 0.00 61.79 61.37 2i6a h SER 308 Cb -0.12 -0.06 -0.05 0.00 -0.31 0.00 0.00 62.40 61.86 2i6a h SER 308 CO -0.07 0.25 -1.89 0.00 -0.87 0.00 0.00 176.83 174.26 2i6a n GLN 309 N -4.59 0.66 -0.20 4.77 1.13 -1.07 -4.15 117.38 113.92 2i6a n GLN 309 Ca 0.20 0.23 0.08 0.00 -1.94 0.00 0.00 57.00 55.57 2i6a n GLN 309 Cb 0.59 -1.73 0.36 0.00 0.11 0.00 0.00 30.24 29.57 2i6a n GLN 309 CO 0.00 0.00 0.00 1.25 -1.44 0.00 0.00 177.06 176.87 2i6a h LEU 310 N 0.01 0.66 -1.87 1.08 7.12 -0.58 -1.21 115.31 120.52 2i6a h LEU 310 Ca -0.36 0.01 -0.02 0.00 0.13 0.00 0.00 57.88 57.64 2i6a h LEU 310 Cb 2.06 -0.13 -0.00 0.00 -0.53 0.00 0.00 40.66 42.05 2i6a h LEU 310 CO 0.07 0.41 -0.09 1.62 -0.13 0.00 0.00 178.44 180.31 2i6a h VAL 311 N 0.74 0.37 -0.34 1.05 3.04 -1.58 -1.82 116.25 117.72 2i6a h VAL 311 Ca 0.34 -0.54 0.00 0.00 -1.01 0.00 0.00 66.70 65.50 2i6a h VAL 311 Cb 0.36 1.39 0.00 0.00 -2.01 0.00 0.00 31.29 31.03 2i6a h VAL 311 CO -0.12 0.09 0.00 -1.54 -1.01 0.00 0.00 177.57 174.99 2i6a n SER 312 N -3.42 4.28 -0.64 3.17 3.41 -0.48 -4.96 113.62 114.98 2i6a n SER 312 Ca -0.01 -2.96 -0.08 0.00 -0.26 0.00 0.00 58.87 55.55 2i6a n SER 312 Cb 0.25 -0.57 -0.04 0.00 -0.26 0.00 0.00 64.21 63.60 2i6a n SER 312 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2i6a n ASP 313 N -0.21 -4.41 -4.68 4.04 8.00 -0.69 -5.00 116.55 113.60 2i6a n ASP 313 Ca 0.23 0.21 -0.32 0.00 0.71 0.00 0.00 54.79 55.62 2i6a n ASP 313 Cb 0.95 -2.65 0.16 0.00 -0.02 0.00 0.00 41.12 39.55 2i6a n ASP 313 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2i6a s LYS 314 N -2.48 1.15 0.59 -1.24 -0.14 -1.09 -4.93 119.74 111.61 2i6a s LYS 314 Ca 0.00 1.60 -0.19 0.00 -1.36 0.00 0.00 55.97 56.02 2i6a s LYS 314 Cb 0.00 -1.74 -0.03 0.00 -1.68 0.00 0.00 37.83 34.38 2i6a s LYS 314 CO 0.00 -2.54 1.26 -2.14 -0.76 0.00 0.00 175.35 171.17 2i6a s PRO 315 N -4.54 2.91 0.34 -1.68 0.02 -1.26 -4.77 135.00 126.03 2i6a s PRO 315 Ca 0.68 1.98 0.09 0.00 0.02 0.00 0.00 61.00 63.78 2i6a s PRO 315 Cb -0.24 -1.99 0.83 0.00 0.02 0.00 0.00 34.50 33.12 2i6a s PRO 315 CO 0.56 -1.30 1.82 -0.07 -0.33 0.00 0.00 177.00 177.68 2i6a h LEU 316 N 0.95 0.67 -1.68 -5.54 3.38 -1.99 0.37 115.31 111.48 2i6a h LEU 316 Ca -0.51 0.07 0.10 0.00 0.09 0.00 0.00 57.88 57.63 2i6a h LEU 316 Cb 1.31 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.97 2i6a h LEU 316 CO 0.55 0.27 0.38 0.74 0.09 0.00 0.00 178.44 180.48 2i6a h THR 317 N 0.68 0.89 0.14 0.22 2.02 -2.00 -0.20 112.91 114.65 2i6a h THR 317 Ca 0.52 -0.13 -0.28 0.00 0.77 0.00 0.00 66.41 67.29 2i6a h THR 317 Cb 0.92 0.49 0.01 0.00 -1.74 0.00 0.00 68.15 67.83 2i6a h THR 317 CO -0.28 0.07 -1.28 -0.08 0.37 0.00 0.00 175.52 174.31 2i6a h GLU 318 N 0.37 0.29 -0.21 6.66 4.57 -0.64 -2.68 114.58 122.94 2i6a h GLU 318 Ca 0.26 -0.49 -0.01 0.00 -1.18 0.00 0.00 59.36 57.94 2i6a h GLU 318 Cb 0.54 0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 29.31 2i6a h GLU 318 CO -0.07 1.23 0.07 0.00 -1.18 0.00 0.00 179.01 179.06 2i6a h ILE 320 N 0.17 1.21 -0.43 0.00 2.04 -1.14 -1.96 117.51 117.39 2i6a h ILE 320 Ca 0.07 -0.46 0.06 0.00 1.00 0.00 0.00 64.86 65.52 2i6a h ILE 320 Cb 0.20 0.19 -0.05 0.00 -0.74 0.00 0.00 36.82 36.42 2i6a h ILE 320 CO -0.00 0.22 0.13 -0.09 0.00 0.00 0.00 178.15 178.41 2i6a h ARG 321 N 1.01 0.28 -0.18 2.37 2.43 -1.32 0.89 114.38 119.85 2i6a h ARG 321 Ca 0.26 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.36 2i6a h ARG 321 Cb -0.03 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.44 2i6a h ARG 321 CO -0.05 0.19 -0.16 0.00 -1.51 0.00 0.00 179.97 178.44 2i6a h ALA 322 N 1.29 1.39 -0.41 2.80 0.00 -1.26 -1.58 119.26 121.49 2i6a h ALA 322 Ca 0.20 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2i6a h ALA 322 Cb 0.21 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2i6a h ALA 322 CO -0.22 0.42 0.12 0.78 0.00 0.00 0.00 179.25 180.35 2i6a h GLY 323 N 0.86 0.69 1.01 0.00 0.00 -0.31 0.29 103.07 105.61 2i6a h GLY 323 Ca 0.05 -0.42 -0.05 0.00 0.00 0.00 0.00 47.33 46.92 2i6a h GLY 323 CO 0.03 0.39 0.20 0.45 0.00 0.00 0.00 176.54 177.61 2i6a h HIS 324 N 0.52 1.00 0.49 5.60 -0.00 -0.78 -1.89 115.15 120.10 2i6a h HIS 324 Ca 0.13 -0.10 -0.02 0.00 -0.00 0.00 0.00 60.37 60.38 2i6a h HIS 324 Cb 0.27 -0.29 0.00 0.00 -0.00 0.00 0.00 27.41 27.40 2i6a h HIS 324 CO 0.01 0.82 -0.24 -0.92 -0.00 0.00 0.00 177.93 177.60 2i6a h TYR 325 N 0.90 -0.61 -0.90 2.45 3.20 -0.79 -2.16 116.97 119.05 2i6a h TYR 325 Ca 0.20 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 62.12 2i6a h TYR 325 Cb 0.28 0.20 -0.06 0.00 1.54 0.00 0.00 36.73 38.69 2i6a h TYR 325 CO 0.02 -0.36 0.57 0.00 -1.64 0.00 0.00 178.16 176.75 2i6a h ALA 326 N -0.21 1.25 -0.88 1.82 0.00 -0.46 -2.23 119.26 118.54 2i6a h ALA 326 Ca -0.07 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.87 2i6a h ALA 326 Cb 0.53 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 2i6a h ALA 326 CO 0.11 0.33 0.57 0.00 0.00 0.00 0.00 179.25 180.26 2i6a h ALA 327 N 1.42 1.17 -0.00 0.00 0.00 -1.01 -0.80 119.26 120.02 2i6a h ALA 327 Ca 0.39 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 55.12 2i6a h ALA 327 Cb 0.17 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2i6a h ALA 327 CO -0.17 0.41 -0.71 0.66 0.00 0.00 0.00 179.25 179.43 2i6a h SER 328 N 1.10 0.04 0.00 0.00 4.64 -1.05 -3.38 113.55 114.88 2i6a h SER 328 Ca 0.35 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 2i6a h SER 328 Cb 0.02 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 2i6a h SER 328 CO -0.12 0.74 -0.16 0.40 -0.87 0.00 0.00 176.83 176.82 2i6a h ILE 329 N 0.02 0.00 -0.33 0.95 1.08 -1.20 -3.44 117.51 114.59 2i6a h ILE 329 Ca -0.01 -0.37 -0.00 0.00 -0.39 0.00 0.00 64.86 64.08 2i6a h ILE 329 Cb 1.26 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 35.01 2i6a h ILE 329 CO 0.10 0.00 0.02 -0.38 -0.69 0.00 0.00 178.15 177.19 2i6a n ILE 330 N -3.12 0.00 -4.03 -0.67 2.08 -0.33 -4.87 119.36 108.42 2i6a n ILE 330 Ca -0.02 -0.49 -0.31 0.00 0.56 0.00 0.00 62.75 62.49 2i6a n ILE 330 Cb 0.08 -1.98 -0.16 0.00 -0.75 0.00 0.00 39.64 36.83 2i6a n ILE 330 CO 0.00 0.00 0.00 -0.63 0.56 0.00 0.00 176.55 176.48 2i6a s ILE 331 N 14.87 1.77 0.22 1.39 1.01 -1.26 -4.78 121.20 134.43 2i6a s ILE 331 Ca 0.93 -1.04 -0.20 0.00 0.00 0.00 0.00 60.65 60.34 2i6a s ILE 331 Cb -0.13 -1.79 -0.08 0.00 0.01 0.00 0.00 42.46 40.46 2i6a s ILE 331 CO 0.09 0.24 0.73 -0.13 0.00 0.00 0.00 174.94 175.86 2i6a s ARG 332 N 1.35 4.26 0.36 2.79 0.52 -1.26 -5.07 118.95 121.90 2i6a s ARG 332 Ca -0.01 0.88 0.04 0.00 -0.52 0.00 0.00 55.73 56.12 2i6a s ARG 332 Cb -0.16 -2.89 -0.04 0.00 0.52 0.00 0.00 34.95 32.39 2i6a s ARG 332 CO -0.09 0.40 0.13 1.03 0.02 0.00 0.00 175.30 176.79 2i6a s ARG 333 N -1.96 1.76 0.09 3.54 1.81 -1.26 -4.66 118.95 118.27 2i6a s ARG 333 Ca 0.43 -2.04 0.01 0.00 -1.72 0.00 0.00 55.73 52.42 2i6a s ARG 333 Cb -0.17 -0.45 -0.04 0.00 -0.45 0.00 0.00 34.95 33.84 2i6a s ARG 333 CO 0.21 -0.42 0.20 0.99 -0.68 0.00 0.00 175.30 175.60 2i6a s THR 334 N -3.37 5.19 -1.13 0.02 2.01 -1.26 -4.63 115.64 112.47 2i6a s THR 334 Ca 0.30 -0.55 -0.07 0.00 0.31 0.00 0.00 61.69 61.69 2i6a s THR 334 Cb 0.04 -3.56 -0.04 0.00 0.01 0.00 0.00 72.50 68.96 2i6a s THR 334 CO 0.16 0.08 0.88 0.61 -0.69 0.00 0.00 174.62 175.66 2i6a n GLY 335 N 0.12 -0.88 0.70 4.40 0.00 -1.26 -4.94 105.19 103.33 2i6a n GLY 335 Ca -0.06 0.42 -0.08 0.00 0.00 0.00 0.00 46.02 46.30 2i6a n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i6a s THR 337 N -2.24 4.25 0.13 0.00 -4.23 -1.26 -5.11 115.64 107.18 2i6a s THR 337 Ca -0.12 -0.03 0.03 0.00 -1.18 0.00 0.00 61.69 60.38 2i6a s THR 337 Cb 0.04 -3.63 -0.04 0.00 1.34 0.00 0.00 72.50 70.21 2i6a s THR 337 CO 0.17 -0.59 0.22 -0.36 -0.54 0.00 0.00 174.62 173.52 2i6a s PHE 338 N -2.79 3.39 0.01 3.99 2.99 -1.26 -5.08 117.98 119.23 2i6a s PHE 338 Ca 0.50 0.10 -0.30 0.00 0.00 0.00 0.00 56.93 57.23 2i6a s PHE 338 Cb -0.10 -1.64 -0.08 0.00 0.00 0.00 0.00 43.02 41.20 2i6a s PHE 338 CO 0.43 0.53 1.82 -2.14 -0.00 0.00 0.00 175.22 175.86 2i6a s PRO 339 N -3.03 4.16 0.16 0.24 0.02 -1.26 -4.88 135.00 130.41 2i6a s PRO 339 Ca 0.33 2.44 -0.14 0.00 0.02 0.00 0.00 61.00 63.65 2i6a s PRO 339 Cb -0.11 -4.02 0.15 0.00 0.02 0.00 0.00 34.50 30.54 2i6a s PRO 339 CO 0.27 -0.89 1.15 0.39 -0.33 0.00 0.00 177.00 177.58 2i6a n GLU 340 N 7.11 -0.19 -4.95 5.54 1.02 -1.26 -4.00 120.64 123.91 2i6a n GLU 340 Ca 0.18 1.13 -0.32 0.00 -0.02 0.00 0.00 57.16 58.13 2i6a n GLU 340 Cb 0.41 -1.68 -0.15 0.00 -0.02 0.00 0.00 31.44 30.00 2i6a n GLU 340 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2i6a s LYS 341 N -5.66 3.10 0.71 3.49 -0.14 -1.26 -5.12 119.74 114.86 2i6a s LYS 341 Ca -0.10 -0.76 -0.13 0.00 -1.36 0.00 0.00 55.97 53.62 2i6a s LYS 341 Cb 0.14 -2.47 0.03 0.00 -1.68 0.00 0.00 37.83 33.85 2i6a s LYS 341 CO 0.52 0.28 1.11 -1.25 -0.76 0.00 0.00 175.35 175.24 2i6a s PRO 342 N 0.15 2.53 -0.55 -1.68 0.04 -1.26 -5.01 135.00 129.23 2i6a s PRO 342 Ca -0.09 1.32 0.07 0.00 0.04 0.00 0.00 61.00 62.33 2i6a s PRO 342 Cb -0.15 -1.92 0.29 0.00 0.04 0.00 0.00 34.50 32.75 2i6a s PRO 342 CO 0.06 -1.45 0.76 -3.47 0.04 0.00 0.00 177.00 172.93 2i6a n ASP 343 N -2.90 2.99 -0.98 6.66 2.03 -1.26 -4.78 116.55 118.31 2i6a n ASP 343 Ca 0.10 -3.33 0.11 0.00 0.52 0.00 0.00 54.79 52.19 2i6a n ASP 343 Cb 0.52 -0.63 0.14 0.00 -0.72 0.00 0.00 41.12 40.44 2i6a n ASP 343 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 2i6a n PHE 344 N 0.58 0.23 -0.19 -0.67 7.35 -1.26 -5.29 117.46 118.22 2i6a n PHE 344 Ca 0.28 -0.12 0.00 0.00 -0.76 0.00 0.00 57.45 56.85 2i6a n PHE 344 Cb 0.45 -0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.28 2i6a n PHE 344 CO 0.00 0.00 0.00 0.72 -0.76 0.00 0.00 176.76 176.72