#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 1.88 0.87 -3.33 -7.23 -1.26 -5.14 120.40 106.20 2i6a s VAL 4 Ca 0.00 -0.94 -0.13 0.00 -1.81 0.00 0.00 61.98 59.09 2i6a s VAL 4 Cb 0.00 -1.62 0.13 0.00 0.56 0.00 0.00 36.38 35.45 2i6a s VAL 4 CO 0.00 0.52 1.22 0.00 -0.31 0.00 0.00 175.10 176.54 2i6a s ARG 5 N 0.14 1.41 0.54 4.82 3.03 -1.26 -4.61 118.95 123.02 2i6a s ARG 5 Ca -0.11 -0.06 -0.20 0.00 2.03 0.00 0.00 55.73 57.40 2i6a s ARG 5 Cb -0.15 -1.90 -0.06 0.00 -1.03 0.00 0.00 34.95 31.81 2i6a s ARG 5 CO 0.06 -1.95 1.14 -1.83 -1.13 0.00 0.00 175.30 171.59 2i6a s GLU 6 N -5.66 3.35 -0.99 3.89 -1.05 -1.26 -3.41 118.70 113.56 2i6a s GLU 6 Ca 0.66 1.65 0.00 0.00 -0.15 0.00 0.00 54.97 57.14 2i6a s GLU 6 Cb -0.09 -2.03 0.00 0.00 -0.44 0.00 0.00 34.13 31.57 2i6a s GLU 6 CO 0.51 -0.86 0.00 0.09 0.95 0.00 0.00 175.26 175.95 2i6a n ASN 7 N -1.25 -3.79 0.16 0.83 4.13 0.35 -4.89 115.26 110.80 2i6a n ASN 7 Ca 0.11 0.08 0.04 0.00 1.68 0.00 0.00 54.58 56.49 2i6a n ASN 7 Cb 0.50 -2.76 0.15 0.00 -1.54 0.00 0.00 39.78 36.14 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 0.89 -3.28 2.41 2.10 -0.73 -2.73 117.51 116.17 2i6a h ILE 8 Ca -0.24 -1.97 -0.66 0.00 1.08 0.00 0.00 64.86 63.06 2i6a h ILE 8 Cb 1.02 2.23 -0.30 0.00 -1.09 0.00 0.00 36.82 38.69 2i6a h ILE 8 CO 0.31 0.46 -0.80 -0.22 -1.08 0.00 0.00 178.15 176.82 2i6a s LEU 9 N -6.69 2.51 -0.09 2.19 0.20 -0.75 -0.49 118.68 115.56 2i6a s LEU 9 Ca 0.02 -0.46 0.04 0.00 0.69 0.00 0.00 54.13 54.42 2i6a s LEU 9 Cb 0.09 -1.58 -0.01 0.00 -0.43 0.00 0.00 46.19 44.27 2i6a s LEU 9 CO 0.72 0.08 -0.22 0.12 -0.29 0.00 0.00 176.35 176.76 2i6a s PHE 10 N 0.86 2.59 0.01 5.38 2.19 -0.19 -0.03 117.98 128.78 2i6a s PHE 10 Ca -0.04 -0.86 -0.00 0.00 0.33 0.00 0.00 56.93 56.35 2i6a s PHE 10 Cb -0.15 -1.71 -0.01 0.00 -1.31 0.00 0.00 43.02 39.84 2i6a s PHE 10 CO -0.01 -0.31 -0.02 0.20 1.83 0.00 0.00 175.22 176.92 2i6a s GLY 11 N 0.19 0.16 -0.06 13.12 0.00 -0.30 -0.37 107.32 120.05 2i6a s GLY 11 Ca -0.13 -0.39 -0.13 0.00 0.00 0.00 0.00 44.72 44.08 2i6a s GLY 11 CO 0.07 -0.44 0.30 -3.16 0.00 0.00 0.00 173.10 169.87 2i6a s MET 12 N -1.00 0.51 0.00 2.90 0.23 -1.22 -1.38 119.30 119.36 2i6a s MET 12 Ca -0.11 0.10 0.00 0.00 -1.03 0.00 0.00 55.69 54.65 2i6a s MET 12 Cb -0.07 0.24 0.00 0.00 -1.53 0.00 0.00 34.83 33.47 2i6a s MET 12 CO -0.01 -0.11 0.00 0.41 -2.03 0.00 0.00 175.02 173.28 2i6a n GLY 13 N 2.08 1.36 3.38 3.16 0.00 -0.93 -4.48 105.19 109.75 2i6a n GLY 13 Ca -0.17 -0.33 -0.45 0.00 0.00 0.00 0.00 46.02 45.07 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 6.30 -0.49 1.61 0.01 -1.26 -4.50 114.94 118.61 2i6a s ASN 14 Ca 0.00 -1.65 -0.27 0.00 -0.71 0.00 0.00 52.86 50.23 2i6a s ASN 14 Cb 0.00 -2.31 -0.03 0.00 0.41 0.00 0.00 41.25 39.32 2i6a s ASN 14 CO 0.00 -1.06 2.01 -2.84 -1.51 0.00 0.00 177.10 173.70 2i6a s PRO 15 N 2.43 2.69 0.23 -0.60 0.02 -1.26 -4.27 135.00 134.24 2i6a s PRO 15 Ca 0.15 1.09 0.10 0.00 0.02 0.00 0.00 61.00 62.36 2i6a s PRO 15 Cb -0.20 -4.39 -0.04 0.00 0.02 0.00 0.00 34.50 29.88 2i6a s PRO 15 CO 0.03 -2.63 -0.10 -0.51 -0.33 0.00 0.00 177.00 173.46 2i6a s LEU 16 N 9.32 2.93 -0.26 -5.54 1.43 -1.22 -4.21 118.68 121.13 2i6a s LEU 16 Ca 0.80 -0.71 -0.05 0.00 -1.03 0.00 0.00 54.13 53.13 2i6a s LEU 16 Cb -0.17 -1.53 0.00 0.00 0.03 0.00 0.00 46.19 44.52 2i6a s LEU 16 CO 0.26 0.06 0.03 -0.22 0.23 0.00 0.00 176.35 176.71 2i6a s LEU 17 N -3.24 3.46 -0.05 1.79 2.96 -0.53 0.75 118.68 123.82 2i6a s LEU 17 Ca 0.28 -0.57 -0.30 0.00 -0.22 0.00 0.00 54.13 53.31 2i6a s LEU 17 Cb -0.07 -1.82 -0.03 0.00 0.50 0.00 0.00 46.19 44.76 2i6a s LEU 17 CO 0.16 -0.12 1.15 -1.81 -1.32 0.00 0.00 176.35 174.42 2i6a s ASP 18 N 1.49 7.11 -0.43 3.68 1.01 0.15 -2.10 116.67 127.58 2i6a s ASP 18 Ca 0.04 1.78 -0.03 0.00 0.71 0.00 0.00 52.55 55.04 2i6a s ASP 18 Cb -0.16 -2.56 0.11 0.00 1.01 0.00 0.00 42.92 41.32 2i6a s ASP 18 CO 0.00 -0.52 0.23 -0.63 0.21 0.00 0.00 175.17 174.46 2i6a s ILE 19 N 1.94 3.38 0.06 0.77 1.01 0.17 -1.58 121.20 126.94 2i6a s ILE 19 Ca 0.55 -2.09 0.07 0.00 0.00 0.00 0.00 60.65 59.18 2i6a s ILE 19 Cb -0.24 -3.30 -0.04 0.00 0.01 0.00 0.00 42.46 38.89 2i6a s ILE 19 CO 0.23 -0.71 -0.16 -0.94 0.00 0.00 0.00 174.94 173.35 2i6a s SER 20 N 1.82 3.95 -0.10 3.58 1.04 -0.55 -1.14 113.70 122.31 2i6a s SER 20 Ca 0.09 -0.43 -0.30 0.00 0.48 0.00 0.00 55.95 55.78 2i6a s SER 20 Cb -0.23 -0.66 0.11 0.00 0.10 0.00 0.00 66.02 65.34 2i6a s SER 20 CO -0.04 0.23 0.89 0.00 0.98 0.00 0.00 173.24 175.30 2i6a s ALA 21 N -1.02 -1.86 -0.08 5.32 0.00 -1.07 0.08 121.76 123.12 2i6a s ALA 21 Ca 0.16 1.40 -0.29 0.00 0.00 0.00 0.00 51.96 53.23 2i6a s ALA 21 Cb -0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.69 2i6a s ALA 21 CO 0.08 -0.40 0.98 0.08 0.00 0.00 0.00 175.76 176.50 2i6a s VAL 22 N -1.51 4.82 0.47 0.00 1.01 -1.26 -1.23 120.40 122.70 2i6a s VAL 22 Ca -0.03 2.01 0.02 0.00 0.00 0.00 0.00 61.98 63.98 2i6a s VAL 22 Cb -0.00 -4.30 -0.01 0.00 0.00 0.00 0.00 36.38 32.06 2i6a s VAL 22 CO 0.02 0.06 0.06 0.68 0.00 0.00 0.00 175.10 175.91 2i6a s VAL 23 N 1.70 0.88 0.18 2.92 -7.23 0.15 -4.73 120.40 114.26 2i6a s VAL 23 Ca 0.49 -2.00 0.10 0.00 -1.81 0.00 0.00 61.98 58.76 2i6a s VAL 23 Cb -0.19 -2.20 -0.04 0.00 0.56 0.00 0.00 36.38 34.50 2i6a s VAL 23 CO 0.21 0.00 -0.19 1.51 -0.31 0.00 0.00 175.10 176.32 2i6a s ASP 24 N -3.77 3.75 0.33 4.85 -4.77 -1.26 -4.54 116.67 111.25 2i6a s ASP 24 Ca 0.12 -0.73 0.11 0.00 -3.30 0.00 0.00 52.55 48.76 2i6a s ASP 24 Cb 0.02 -0.44 0.62 0.00 -1.09 0.00 0.00 42.92 42.02 2i6a s ASP 24 CO 0.08 0.13 1.22 1.17 0.70 0.00 0.00 175.17 178.46 2i6a n LYS 25 N 0.30 0.08 0.19 2.11 4.81 -1.26 0.15 118.16 124.54 2i6a n LYS 25 Ca -0.13 0.56 0.09 0.00 -0.87 0.00 0.00 58.31 57.96 2i6a n LYS 25 Cb 0.55 -2.12 0.12 0.00 0.02 0.00 0.00 35.03 33.60 2i6a n LYS 25 CO 0.00 0.00 0.00 -0.44 1.17 0.00 0.00 177.40 178.13 2i6a h ASP 26 N 0.00 0.00 0.16 3.14 3.45 -1.99 -2.79 116.42 118.40 2i6a h ASP 26 Ca 0.00 0.00 -0.21 0.00 0.43 0.00 0.00 57.03 57.25 2i6a h ASP 26 Cb 0.73 0.00 0.03 0.00 -0.56 0.00 0.00 39.33 39.53 2i6a h ASP 26 CO 0.00 0.15 -0.94 0.15 -1.57 0.00 0.00 179.24 177.03 2i6a h PHE 27 N 0.00 0.63 -0.21 4.55 3.57 0.95 -2.41 116.94 124.02 2i6a h PHE 27 Ca -0.00 -0.46 -0.06 0.00 3.53 0.00 0.00 57.97 60.97 2i6a h PHE 27 Cb 1.11 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.81 2i6a h PHE 27 CO 0.00 1.36 -0.15 -0.07 -2.23 0.00 0.00 178.31 177.22 2i6a h LEU 28 N -0.27 0.34 0.00 0.59 3.38 -1.60 -2.96 115.31 114.79 2i6a h LEU 28 Ca -0.16 -0.08 -0.16 0.00 0.09 0.00 0.00 57.88 57.56 2i6a h LEU 28 Cb 1.74 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 42.38 2i6a h LEU 28 CO 0.18 0.52 -0.90 0.44 0.09 0.00 0.00 178.44 178.76 2i6a h ASP 29 N 0.33 0.00 0.52 -0.43 5.19 -1.56 1.26 116.42 121.72 2i6a h ASP 29 Ca 0.06 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.43 2i6a h ASP 29 Cb 0.47 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.97 2i6a h ASP 29 CO 0.03 0.70 -0.21 0.11 -3.12 0.00 0.00 179.24 176.75 2i6a h LYS 30 N 0.00 0.00 -0.01 3.56 6.56 -1.26 -2.60 116.57 122.82 2i6a h LYS 30 Ca -0.05 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.54 2i6a h LYS 30 Cb 1.58 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.24 2i6a h LYS 30 CO 0.08 0.21 -0.04 0.66 -2.06 0.00 0.00 179.45 178.31 2i6a n TYR 31 N -3.68 0.00 -3.53 -1.35 4.02 -1.19 -5.00 117.16 106.44 2i6a n TYR 31 Ca -0.01 0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.67 2i6a n TYR 31 Cb 0.33 0.00 0.08 0.00 -0.02 0.00 0.00 39.34 39.74 2i6a n TYR 31 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2i6a n SER 32 N 0.33 -4.52 -4.95 7.72 3.41 -0.00 -5.01 113.62 110.60 2i6a n SER 32 Ca 0.05 -0.58 -0.23 0.00 -0.26 0.00 0.00 58.87 57.85 2i6a n SER 32 Cb 0.21 -5.06 0.00 0.00 -0.26 0.00 0.00 64.21 59.10 2i6a n SER 32 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2i6a s LEU 33 N -6.91 3.78 -0.10 1.04 1.43 0.41 -4.99 118.68 113.35 2i6a s LEU 33 Ca 0.34 0.34 -0.03 0.00 -1.03 0.00 0.00 54.13 53.75 2i6a s LEU 33 Cb -0.15 -3.22 -0.03 0.00 0.03 0.00 0.00 46.19 42.82 2i6a s LEU 33 CO 0.73 -0.55 0.02 -0.54 0.23 0.00 0.00 176.35 176.24 2i6a s LYS 34 N -4.46 3.16 0.34 1.70 1.02 -1.26 -4.66 119.74 115.58 2i6a s LYS 34 Ca 0.45 -0.37 0.14 0.00 0.02 0.00 0.00 55.97 56.21 2i6a s LYS 34 Cb -0.10 -2.88 1.09 0.00 -0.52 0.00 0.00 37.83 35.42 2i6a s LYS 34 CO 0.37 0.65 1.66 -1.00 -0.92 0.00 0.00 175.35 176.11 2i6a h PRO 35 N 5.35 0.29 -3.73 -1.68 0.13 -1.96 -3.36 132.00 127.04 2i6a h PRO 35 Ca -0.49 -0.02 -0.52 0.00 -0.87 0.00 0.00 66.00 64.10 2i6a h PRO 35 Cb 1.19 -0.06 -0.39 0.00 0.13 0.00 0.00 31.00 31.87 2i6a h PRO 35 CO 0.57 0.19 -0.77 1.21 -0.23 0.00 0.00 178.00 178.96 2i6a s ASN 36 N -4.88 2.89 -0.02 1.44 2.47 -1.26 -1.68 114.94 113.89 2i6a s ASN 36 Ca -0.10 -0.77 -0.30 0.00 0.42 0.00 0.00 52.86 52.10 2i6a s ASN 36 Cb 0.30 -0.69 0.12 0.00 -1.45 0.00 0.00 41.25 39.53 2i6a s ASN 36 CO 0.79 -0.27 1.30 -0.62 -3.72 0.00 0.00 177.10 174.58 2i6a s ASP 37 N 1.79 -0.04 -0.05 -4.21 2.15 -0.95 -4.94 116.67 110.42 2i6a s ASP 37 Ca -0.01 -0.14 -0.02 0.00 0.43 0.00 0.00 52.55 52.81 2i6a s ASP 37 Cb -0.17 0.15 0.04 0.00 -0.30 0.00 0.00 42.92 42.64 2i6a s ASP 37 CO -0.07 -0.27 0.12 -1.10 -0.17 0.00 0.00 175.17 173.67 2i6a s GLN 38 N -2.28 0.06 0.18 4.34 -0.21 -1.25 0.90 119.66 121.40 2i6a s GLN 38 Ca 0.18 0.32 -0.17 0.00 0.02 0.00 0.00 55.36 55.71 2i6a s GLN 38 Cb 0.04 -0.20 0.03 0.00 1.00 0.00 0.00 33.01 33.88 2i6a s GLN 38 CO -0.03 -0.17 0.50 0.96 -2.12 0.00 0.00 175.29 174.43 2i6a s ILE 39 N 1.15 0.03 0.12 1.08 -4.36 0.27 -4.81 121.20 114.68 2i6a s ILE 39 Ca -0.09 -0.75 -0.11 0.00 -0.26 0.00 0.00 60.65 59.44 2i6a s ILE 39 Cb -0.12 -1.51 -0.06 0.00 1.25 0.00 0.00 42.46 42.02 2i6a s ILE 39 CO -0.05 -0.15 0.47 -0.76 0.24 0.00 0.00 174.94 174.69 2i6a s LEU 40 N -2.86 4.33 0.24 0.37 1.43 -1.26 -1.01 118.68 119.91 2i6a s LEU 40 Ca 0.08 0.91 -0.31 0.00 -1.03 0.00 0.00 54.13 53.78 2i6a s LEU 40 Cb -0.00 -3.16 -0.12 0.00 0.03 0.00 0.00 46.19 42.94 2i6a s LEU 40 CO -0.04 0.12 1.68 0.00 0.23 0.00 0.00 176.35 178.34 2i6a s ALA 41 N -1.47 3.87 0.54 4.21 0.00 0.01 -4.84 121.76 124.08 2i6a s ALA 41 Ca 0.36 1.59 0.04 0.00 0.00 0.00 0.00 51.96 53.95 2i6a s ALA 41 Cb -0.14 -3.68 0.04 0.00 0.00 0.00 0.00 23.12 19.34 2i6a s ALA 41 CO 0.19 -0.96 0.31 0.39 0.00 0.00 0.00 175.76 175.69 2i6a n GLU 42 N 3.28 0.70 0.10 0.00 -0.58 -1.26 -4.99 120.64 117.87 2i6a n GLU 42 Ca 0.13 -3.52 0.11 0.00 -0.42 0.00 0.00 57.16 53.45 2i6a n GLU 42 Cb 0.36 0.53 0.59 0.00 -0.57 0.00 0.00 31.44 32.35 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 0.80 0.14 0.00 1.62 3.32 -2.03 0.07 116.42 120.34 2i6a h ASP 43 Ca -0.37 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.68 2i6a h ASP 43 Cb 1.28 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.80 2i6a h ASP 43 CO 0.59 0.09 0.00 2.29 -1.72 0.00 0.00 179.24 180.49 2i6a n LYS 44 N -4.48 0.70 -0.01 3.56 2.85 -1.26 -3.15 118.16 116.38 2i6a n LYS 44 Ca 0.03 0.00 0.04 0.00 -1.05 0.00 0.00 58.31 57.33 2i6a n LYS 44 Cb 0.26 -1.26 -0.06 0.00 -0.65 0.00 0.00 35.03 33.31 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 -0.76 0.00 -0.29 5.58 8.25 0.01 -4.66 115.22 123.35 2i6a n HIS 45 Ca 0.09 0.00 0.26 0.00 -0.26 0.00 0.00 57.72 57.81 2i6a n HIS 45 Cb 0.04 -0.20 0.48 0.00 1.12 0.00 0.00 29.99 31.43 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 -1.82 -0.06 0.02 -0.41 5.02 -1.19 0.21 118.16 119.94 2i6a n LYS 46 Ca -0.02 1.25 0.13 0.00 -2.02 0.00 0.00 58.31 57.65 2i6a n LYS 46 Cb 0.25 -2.20 0.56 0.00 -0.02 0.00 0.00 35.03 33.62 2i6a n LYS 46 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2i6a n GLU 47 N -5.07 0.05 0.14 1.97 2.13 -1.26 -3.26 120.64 115.35 2i6a n GLU 47 Ca 0.32 0.06 0.02 0.00 0.66 0.00 0.00 57.16 58.22 2i6a n GLU 47 Cb 1.07 -1.56 0.08 0.00 0.27 0.00 0.00 31.44 31.29 2i6a n GLU 47 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 2i6a h LEU 48 N 0.00 0.00 0.14 4.31 6.46 0.22 -3.13 115.31 123.30 2i6a h LEU 48 Ca 0.00 0.00 -0.20 0.00 -0.12 0.00 0.00 57.88 57.56 2i6a h LEU 48 Cb 0.53 0.00 0.02 0.00 -0.73 0.00 0.00 40.66 40.48 2i6a h LEU 48 CO 0.00 0.52 -0.89 -0.26 -0.62 0.00 0.00 178.44 177.19 2i6a h PHE 49 N 0.00 0.52 -0.23 1.25 0.04 -1.58 -2.93 116.94 114.01 2i6a h PHE 49 Ca -0.01 -0.38 0.03 0.00 2.80 0.00 0.00 57.97 60.41 2i6a h PHE 49 Cb 1.32 -0.02 -0.03 0.00 2.20 0.00 0.00 35.95 39.42 2i6a h PHE 49 CO 0.00 1.34 0.06 -0.44 -0.60 0.00 0.00 178.31 178.67 2i6a h ASP 50 N -0.37 0.04 1.45 2.17 3.32 -1.70 -2.90 116.42 118.42 2i6a h ASP 50 Ca -0.17 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 56.88 2i6a h ASP 50 Cb 1.65 0.04 -0.00 0.00 0.22 0.00 0.00 39.33 41.23 2i6a h ASP 50 CO 0.14 0.05 -0.15 1.05 -1.72 0.00 0.00 179.24 178.61 2i6a h GLU 51 N 0.16 0.00 0.13 3.56 4.11 -1.68 -2.34 114.58 118.52 2i6a h GLU 51 Ca 0.10 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.53 2i6a h GLU 51 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2i6a h GLU 51 CO -0.13 0.15 -0.06 1.25 0.07 0.00 0.00 179.01 180.30 2i6a h LEU 52 N 0.00 -0.14 -0.86 3.06 5.85 -1.32 0.40 115.31 122.31 2i6a h LEU 52 Ca -0.00 -0.15 -0.08 0.00 0.84 0.00 0.00 57.88 58.49 2i6a h LEU 52 Cb 0.92 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.97 2i6a h LEU 52 CO 0.02 0.07 -0.38 0.58 -0.34 0.00 0.00 178.44 178.39 2i6a h VAL 53 N -0.36 0.87 0.16 1.05 2.07 -1.50 -1.74 116.25 116.80 2i6a h VAL 53 Ca -0.02 -1.57 -0.32 0.00 0.82 0.00 0.00 66.70 65.61 2i6a h VAL 53 Cb 0.29 1.97 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 2i6a h VAL 53 CO 0.03 0.37 -1.56 0.11 0.02 0.00 0.00 177.57 176.54 2i6a h LYS 54 N 0.00 0.33 -0.01 1.57 1.57 -1.39 -3.38 116.57 115.25 2i6a h LYS 54 Ca -0.00 -0.56 0.00 0.00 -1.87 0.00 0.00 60.65 58.21 2i6a h LYS 54 Cb 0.94 0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2i6a h LYS 54 CO 0.05 1.22 -0.47 1.63 -0.57 0.00 0.00 179.45 181.31 2i6a n LYS 55 N -3.53 1.02 -4.25 3.15 5.02 0.13 -5.01 118.16 114.68 2i6a n LYS 55 Ca -0.18 -0.79 -0.14 0.00 -2.02 0.00 0.00 58.31 55.18 2i6a n LYS 55 Cb 1.06 -1.48 -0.10 0.00 -0.02 0.00 0.00 35.03 34.48 2i6a n LYS 55 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2i6a s PHE 56 N -2.53 1.32 -1.20 2.13 0.40 -0.66 -5.03 117.98 112.41 2i6a s PHE 56 Ca 0.19 -1.30 -0.12 0.00 -0.60 0.00 0.00 56.93 55.10 2i6a s PHE 56 Cb 0.18 -0.71 0.19 0.00 0.51 0.00 0.00 43.02 43.20 2i6a s PHE 56 CO 0.58 -0.51 1.46 1.63 0.70 0.00 0.00 175.22 179.09 2i6a n LYS 57 N -0.36 3.49 -2.61 0.44 5.02 -1.26 -4.75 118.16 118.13 2i6a n LYS 57 Ca 0.01 -3.92 -0.33 0.00 -2.02 0.00 0.00 58.31 52.05 2i6a n LYS 57 Cb 0.66 -2.92 -0.05 0.00 -0.02 0.00 0.00 35.03 32.70 2i6a n LYS 57 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2i6a s VAL 58 N 0.74 4.27 0.13 -0.18 0.11 -1.26 -4.61 120.40 119.60 2i6a s VAL 58 Ca 0.40 1.31 0.07 0.00 -2.93 0.00 0.00 61.98 60.82 2i6a s VAL 58 Cb -0.02 -3.59 -0.04 0.00 -1.53 0.00 0.00 36.38 31.21 2i6a s VAL 58 CO -0.01 -0.41 -0.16 -1.61 -3.33 0.00 0.00 175.10 169.59 2i6a s GLU 59 N -3.47 1.08 -0.17 1.54 2.02 0.11 -4.94 118.70 114.86 2i6a s GLU 59 Ca 0.62 -1.25 -0.01 0.00 0.02 0.00 0.00 54.97 54.35 2i6a s GLU 59 Cb -0.11 -1.05 -0.01 0.00 0.10 0.00 0.00 34.13 33.06 2i6a s GLU 59 CO 0.20 0.21 -0.11 0.71 0.02 0.00 0.00 175.26 176.30 2i6a s TYR 60 N -1.94 2.86 -0.03 1.61 2.02 -1.26 -1.48 117.35 119.13 2i6a s TYR 60 Ca 0.09 -0.92 0.01 0.00 -0.37 0.00 0.00 57.07 55.88 2i6a s TYR 60 Cb -0.06 -1.95 0.02 0.00 -0.40 0.00 0.00 41.96 39.57 2i6a s TYR 60 CO 0.04 -0.44 -0.03 -1.01 -1.57 0.00 0.00 175.55 172.54 2i6a s HIS 61 N 0.93 0.57 0.17 2.71 3.76 -0.62 -4.98 115.29 117.82 2i6a s HIS 61 Ca -0.02 -0.12 -0.32 0.00 -0.15 0.00 0.00 55.06 54.45 2i6a s HIS 61 Cb -0.15 -0.52 -0.11 0.00 1.11 0.00 0.00 32.58 32.91 2i6a s HIS 61 CO -0.01 -0.14 1.78 0.00 -0.85 0.00 0.00 174.74 175.52 2i6a s ALA 62 N 0.77 3.86 0.00 -1.40 0.00 -1.26 0.32 121.76 124.05 2i6a s ALA 62 Ca -0.09 1.52 0.00 0.00 0.00 0.00 0.00 51.96 53.39 2i6a s ALA 62 Cb -0.12 -3.73 0.00 0.00 0.00 0.00 0.00 23.12 19.27 2i6a s ALA 62 CO -0.00 -1.07 0.00 0.41 0.00 0.00 0.00 175.76 175.10 2i6a n GLY 63 N 4.10 5.66 0.07 0.00 0.00 0.23 -4.76 105.19 110.49 2i6a n GLY 63 Ca 0.17 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.56 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 3.10 0.67 0.10 -0.02 0.00 -1.25 -3.37 105.19 104.43 2i6a n GLY 64 Ca 0.00 -1.09 -0.03 0.00 0.00 0.00 0.00 46.02 44.89 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 -0.37 -0.94 1.61 0.87 -1.97 -0.45 113.55 112.31 2i6a h SER 65 Ca 0.00 0.04 0.15 0.00 -1.23 0.00 0.00 61.79 60.75 2i6a h SER 65 Cb 0.00 0.14 -0.09 0.00 -0.44 0.00 0.00 62.40 62.01 2i6a h SER 65 CO 0.00 -0.10 0.55 0.74 -0.53 0.00 0.00 176.83 177.48 2i6a h THR 66 N -0.12 0.78 -0.18 2.23 2.02 -1.91 -0.35 112.91 115.38 2i6a h THR 66 Ca 0.01 -0.27 0.04 0.00 0.77 0.00 0.00 66.41 66.96 2i6a h THR 66 Cb 0.14 -0.06 -0.04 0.00 -1.74 0.00 0.00 68.15 66.45 2i6a h THR 66 CO -0.09 0.14 -0.08 -0.61 0.37 0.00 0.00 175.52 175.25 2i6a h GLN 67 N 0.78 -0.05 -0.58 6.66 4.15 -1.78 -0.91 115.11 123.38 2i6a h GLN 67 Ca 0.51 0.00 0.06 0.00 0.77 0.00 0.00 58.65 59.99 2i6a h GLN 67 Cb 0.67 0.01 -0.06 0.00 0.21 0.00 0.00 27.48 28.32 2i6a h GLN 67 CO -0.34 -0.03 0.28 -0.91 -1.93 0.00 0.00 178.83 175.90 2i6a h ASN 68 N -0.05 0.37 0.25 -0.69 2.35 0.58 -0.31 115.58 118.08 2i6a h ASN 68 Ca 0.09 0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.88 2i6a h ASN 68 Cb 0.19 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.55 2i6a h ASN 68 CO -0.21 0.24 -0.12 0.28 -1.65 0.00 0.00 177.43 175.97 2i6a h SER 69 N 0.52 -0.29 -0.72 5.81 0.02 -0.94 0.06 113.55 118.01 2i6a h SER 69 Ca 0.27 0.01 0.15 0.00 -0.84 0.00 0.00 61.79 61.38 2i6a h SER 69 Cb 0.22 0.08 -0.10 0.00 0.14 0.00 0.00 62.40 62.73 2i6a h SER 69 CO -0.21 -0.21 0.19 0.40 -1.14 0.00 0.00 176.83 175.86 2i6a h ILE 70 N -0.34 0.56 -0.52 3.27 1.08 -0.52 0.31 117.51 121.34 2i6a h ILE 70 Ca -0.03 -0.10 -0.06 0.00 -0.39 0.00 0.00 64.86 64.28 2i6a h ILE 70 Cb 0.26 0.24 -0.02 0.00 -3.07 0.00 0.00 36.82 34.23 2i6a h ILE 70 CO 0.06 0.05 0.09 0.11 -0.69 0.00 0.00 178.15 177.77 2i6a h LYS 71 N 0.29 0.85 -0.22 2.37 1.57 -0.82 -0.66 116.57 119.95 2i6a h LYS 71 Ca 0.40 -0.22 -0.02 0.00 -1.87 0.00 0.00 60.65 58.94 2i6a h LYS 71 Cb 0.66 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 2i6a h LYS 71 CO -0.48 0.83 0.07 0.28 -0.57 0.00 0.00 179.45 179.58 2i6a h VAL 72 N 0.73 1.20 0.23 0.50 2.07 0.14 -1.24 116.25 119.88 2i6a h VAL 72 Ca 0.16 -0.63 0.01 0.00 0.82 0.00 0.00 66.70 67.06 2i6a h VAL 72 Cb 0.39 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 31.31 2i6a h VAL 72 CO 0.01 0.20 -0.51 0.00 0.02 0.00 0.00 177.57 177.29 2i6a h ALA 73 N 0.89 -1.01 -0.81 1.67 0.00 -0.43 0.11 119.26 119.68 2i6a h ALA 73 Ca 0.07 -0.13 0.13 0.00 0.00 0.00 0.00 54.91 54.98 2i6a h ALA 73 Cb 0.25 0.84 -0.06 0.00 0.00 0.00 0.00 17.79 18.82 2i6a h ALA 73 CO -0.00 -1.13 0.53 0.37 0.00 0.00 0.00 179.25 179.01 2i6a h GLN 74 N -0.82 0.57 0.53 0.00 5.75 -1.10 0.41 115.11 120.45 2i6a h GLN 74 Ca -0.02 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.42 2i6a h GLN 74 Cb 0.79 -0.13 0.01 0.00 1.07 0.00 0.00 27.48 29.22 2i6a h GLN 74 CO -0.22 0.38 -0.26 2.35 -2.65 0.00 0.00 178.83 178.43 2i6a h TRP 75 N 0.59 -0.67 -0.46 3.99 7.01 -0.43 0.42 115.95 126.41 2i6a h TRP 75 Ca 0.39 -0.02 0.07 0.00 2.11 0.00 0.00 58.89 61.45 2i6a h TRP 75 Cb 0.70 0.22 -0.06 0.00 -2.10 0.00 0.00 29.16 27.92 2i6a h TRP 75 CO -0.00 -0.39 0.11 0.52 -2.79 0.00 0.00 178.44 175.89 2i6a h MET 76 N -0.78 0.24 -0.39 2.65 2.86 0.35 -1.04 114.93 118.83 2i6a h MET 76 Ca -0.07 -0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.61 2i6a h MET 76 Cb 0.58 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.13 2i6a h MET 76 CO 0.12 0.16 0.10 0.82 1.06 0.00 0.00 176.91 179.17 2i6a h ILE 77 N 0.25 0.84 0.00 -1.22 2.04 -0.12 -3.43 117.51 115.87 2i6a h ILE 77 Ca 0.23 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 66.00 2i6a h ILE 77 Cb 0.28 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.93 2i6a h ILE 77 CO -0.28 0.04 0.00 1.67 0.00 0.00 0.00 178.15 179.58 2i6a n GLN 78 N -5.06 0.00 0.00 2.37 -0.06 0.15 -4.68 117.38 110.10 2i6a n GLN 78 Ca 0.02 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.02 2i6a n GLN 78 Cb 0.16 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.34 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 -2.94 3.69 3.00 -1.26 -4.31 117.38 115.56 2i6a n GLN 79 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.59 2i6a n GLN 79 Cb 0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 30.24 30.14 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 4.48 0.81 -1.09 0.04 -1.26 -5.02 135.00 132.95 2i6a s PRO 80 Ca 0.00 1.05 -0.12 0.00 0.04 0.00 0.00 61.00 61.98 2i6a s PRO 80 Cb 0.00 -3.45 0.08 0.00 0.04 0.00 0.00 34.50 31.17 2i6a s PRO 80 CO 0.00 0.03 1.14 -1.01 0.04 0.00 0.00 177.00 177.19 2i6a s HIS 81 N 0.87 2.10 -1.50 0.56 3.76 -1.26 -3.08 115.29 116.75 2i6a s HIS 81 Ca 0.42 1.66 -0.05 0.00 -0.15 0.00 0.00 55.06 56.94 2i6a s HIS 81 Cb -0.19 -3.25 0.01 0.00 1.11 0.00 0.00 32.58 30.25 2i6a s HIS 81 CO 0.21 -2.34 0.64 1.63 -0.85 0.00 0.00 174.74 174.03 2i6a n LYS 82 N -3.57 -5.03 0.02 1.40 5.02 0.11 -4.78 118.16 111.33 2i6a n LYS 82 Ca 0.11 0.88 -0.12 0.00 -2.02 0.00 0.00 58.31 57.16 2i6a n LYS 82 Cb 0.52 -5.70 -0.01 0.00 -0.02 0.00 0.00 35.03 29.82 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 0.98 0.50 -3.29 7.82 0.00 -1.76 0.10 119.26 123.61 2i6a h ALA 83 Ca -0.52 -0.60 -0.62 0.00 0.00 0.00 0.00 54.91 53.17 2i6a h ALA 83 Cb 1.36 -0.05 -0.17 0.00 0.00 0.00 0.00 17.79 18.93 2i6a h ALA 83 CO 0.55 0.73 -0.59 0.00 0.00 0.00 0.00 179.25 179.95 2i6a s ALA 84 N -3.68 3.30 0.13 0.00 0.00 -1.26 -0.38 121.76 119.87 2i6a s ALA 84 Ca -0.07 -0.76 0.03 0.00 0.00 0.00 0.00 51.96 51.16 2i6a s ALA 84 Cb 0.10 -1.82 -0.04 0.00 0.00 0.00 0.00 23.12 21.36 2i6a s ALA 84 CO 0.86 0.20 0.16 0.99 0.00 0.00 0.00 175.76 177.97 2i6a s THR 85 N 0.34 4.78 -0.17 0.00 2.01 0.95 -1.86 115.64 121.68 2i6a s THR 85 Ca 0.01 -0.83 -0.08 0.00 0.31 0.00 0.00 61.69 61.11 2i6a s THR 85 Cb -0.13 -3.39 0.07 0.00 0.01 0.00 0.00 72.50 69.06 2i6a s THR 85 CO 0.01 -0.01 0.38 0.12 -0.69 0.00 0.00 174.62 174.43 2i6a s PHE 86 N -1.62 -0.63 0.15 4.92 5.36 -1.16 -1.15 117.98 123.84 2i6a s PHE 86 Ca 0.32 1.30 0.06 0.00 -0.96 0.00 0.00 56.93 57.65 2i6a s PHE 86 Cb -0.11 0.23 -0.04 0.00 -0.34 0.00 0.00 43.02 42.76 2i6a s PHE 86 CO 0.25 -0.39 0.01 -0.06 -1.46 0.00 0.00 175.22 173.56 2i6a s PHE 87 N 1.96 2.90 0.00 10.12 0.08 -0.48 -1.01 117.98 131.55 2i6a s PHE 87 Ca -0.05 -0.10 0.00 0.00 0.12 0.00 0.00 56.93 56.90 2i6a s PHE 87 Cb -0.10 -1.43 0.00 0.00 -0.57 0.00 0.00 43.02 40.91 2i6a s PHE 87 CO -0.12 0.50 0.00 0.41 -0.10 0.00 0.00 175.22 175.91 2i6a n GLY 88 N 0.08 1.10 3.64 4.36 0.00 -1.18 -2.20 105.19 111.00 2i6a n GLY 88 Ca -0.10 -0.92 -0.35 0.00 0.00 0.00 0.00 46.02 44.65 2i6a n GLY 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i6a s ILE 90 N -0.16 0.80 0.57 0.00 -4.36 -0.53 -3.37 121.20 114.15 2i6a s ILE 90 Ca 0.06 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.47 2i6a s ILE 90 Cb -0.12 -2.69 0.05 0.00 1.25 0.00 0.00 42.46 40.95 2i6a s ILE 90 CO 0.02 0.00 0.80 -0.83 0.24 0.00 0.00 174.94 175.16 2i6a s GLY 91 N -3.39 1.82 -0.86 6.27 0.00 -1.26 -2.68 107.32 107.22 2i6a s GLY 91 Ca 0.37 -1.49 -0.12 0.00 0.00 0.00 0.00 44.72 43.48 2i6a s GLY 91 CO 0.15 -1.15 0.80 -0.42 0.00 0.00 0.00 173.10 172.47 2i6a s ILE 92 N -2.79 5.49 0.24 0.90 1.01 -0.55 -4.50 121.20 121.01 2i6a s ILE 92 Ca 0.59 -2.72 -0.12 0.00 0.00 0.00 0.00 60.65 58.40 2i6a s ILE 92 Cb -0.09 -4.38 0.05 0.00 0.01 0.00 0.00 42.46 38.04 2i6a s ILE 92 CO 0.39 -1.05 0.61 -0.90 0.00 0.00 0.00 174.94 173.99 2i6a n ASP 93 N 3.66 -1.53 0.04 3.58 3.85 -1.26 -4.93 116.55 119.96 2i6a n ASP 93 Ca 0.15 -2.00 -0.15 0.00 -0.71 0.00 0.00 54.79 52.08 2i6a n ASP 93 Cb 0.45 2.53 -0.09 0.00 -1.35 0.00 0.00 41.12 42.66 2i6a n ASP 93 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.20 176.69 2i6a h LYS 94 N 0.00 -0.60 -0.94 0.11 3.64 -1.99 -0.21 116.57 116.59 2i6a h LYS 94 Ca -0.23 0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.24 2i6a h LYS 94 Cb 0.87 0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 32.77 2i6a h LYS 94 CO 0.29 -0.40 0.61 0.74 -2.27 0.00 0.00 179.45 178.42 2i6a h PHE 95 N -0.62 1.12 0.27 1.91 0.04 -1.98 -1.47 116.94 116.21 2i6a h PHE 95 Ca 0.03 0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.84 2i6a h PHE 95 Cb 0.69 -0.37 -0.03 0.00 2.20 0.00 0.00 35.95 38.44 2i6a h PHE 95 CO -0.50 0.63 -0.33 0.78 -0.60 0.00 0.00 178.31 178.29 2i6a h GLY 96 N 1.14 -0.72 0.27 -1.45 0.00 -1.64 -1.09 103.07 99.58 2i6a h GLY 96 Ca 0.38 0.38 0.19 0.00 0.00 0.00 0.00 47.33 48.28 2i6a h GLY 96 CO -0.13 -0.27 0.61 -2.09 0.00 0.00 0.00 176.54 174.65 2i6a h GLU 97 N -0.64 0.60 -0.15 4.80 4.57 -0.45 -1.92 114.58 121.39 2i6a h GLU 97 Ca -0.00 -0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.11 2i6a h GLU 97 Cb 0.61 -0.14 -0.00 0.00 -0.16 0.00 0.00 28.75 29.06 2i6a h GLU 97 CO -0.10 0.40 -0.02 0.82 -1.18 0.00 0.00 179.01 178.93 2i6a h ILE 98 N 0.62 1.27 -0.57 2.32 2.04 -0.79 -2.17 117.51 120.23 2i6a h ILE 98 Ca 0.51 -0.92 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 2i6a h ILE 98 Cb 0.97 1.59 -0.03 0.00 -0.74 0.00 0.00 36.82 38.62 2i6a h ILE 98 CO -0.26 0.27 0.33 -0.07 0.00 0.00 0.00 178.15 178.42 2i6a h LEU 99 N -0.01 0.69 -0.38 1.44 3.38 -0.53 0.12 115.31 120.02 2i6a h LEU 99 Ca 0.04 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 57.96 2i6a h LEU 99 Cb 0.42 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2i6a h LEU 99 CO 0.01 0.56 0.20 0.11 0.09 0.00 0.00 178.44 179.41 2i6a h LYS 100 N 0.77 0.39 0.18 1.13 1.57 -1.37 -1.17 116.57 118.06 2i6a h LYS 100 Ca 0.20 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 2i6a h LYS 100 Cb 0.01 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.23 2i6a h LYS 100 CO -0.04 0.26 -0.09 -0.09 -0.57 0.00 0.00 179.45 178.93 2i6a h ARG 101 N 0.40 -0.23 -0.06 3.15 2.43 -0.77 -1.33 114.38 117.97 2i6a h ARG 101 Ca 0.16 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.36 2i6a h ARG 101 Cb 0.05 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.65 2i6a h ARG 101 CO -0.10 -0.15 0.06 0.87 -1.51 0.00 0.00 179.97 179.14 2i6a h LYS 102 N -0.24 0.00 0.01 0.20 1.79 -0.65 -1.87 116.57 115.81 2i6a h LYS 102 Ca -0.02 0.00 -0.21 0.00 -2.18 0.00 0.00 60.65 58.24 2i6a h LYS 102 Cb 0.18 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.83 2i6a h LYS 102 CO 0.04 0.00 -0.92 0.00 -1.08 0.00 0.00 179.45 177.49 2i6a h ALA 103 N 1.93 0.44 -0.12 3.86 0.00 -0.32 -2.86 119.26 122.20 2i6a h ALA 103 Ca 0.03 -0.74 -0.21 0.00 0.00 0.00 0.00 54.91 53.99 2i6a h ALA 103 Cb 0.15 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 17.89 2i6a h ALA 103 CO -0.00 0.91 -0.75 0.00 0.00 0.00 0.00 179.25 179.40 2i6a h ALA 104 N 0.89 0.25 0.00 0.00 0.00 -0.52 -2.13 119.26 117.75 2i6a h ALA 104 Ca -0.06 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.26 2i6a h ALA 104 Cb 1.57 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.36 2i6a h ALA 104 CO 0.15 0.61 0.00 0.39 0.00 0.00 0.00 179.25 180.39 2i6a n GLU 105 N -4.00 0.16 0.06 0.00 1.02 -0.78 -0.36 120.64 116.74 2i6a n GLU 105 Ca -0.08 0.44 0.12 0.00 -0.02 0.00 0.00 57.16 57.62 2i6a n GLU 105 Cb 0.73 -1.84 0.23 0.00 -0.02 0.00 0.00 31.44 30.54 2i6a n GLU 105 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2i6a n ALA 106 N -1.74 2.89 -1.83 0.62 0.00 -1.08 -4.93 120.51 114.43 2i6a n ALA 106 Ca 0.02 -0.22 -0.12 0.00 0.00 0.00 0.00 53.44 53.12 2i6a n ALA 106 Cb 0.19 -1.22 -0.03 0.00 0.00 0.00 0.00 19.45 18.40 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 -2.04 -0.31 -3.24 0.00 8.25 0.52 -4.66 115.22 113.73 2i6a n HIS 107 Ca 0.04 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.11 2i6a n HIS 107 Cb 0.42 -2.44 -0.06 0.00 1.12 0.00 0.00 29.99 29.03 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 -2.52 4.69 -1.28 1.59 1.01 -0.81 0.07 120.40 123.16 2i6a s VAL 108 Ca 0.00 1.27 -0.13 0.00 0.00 0.00 0.00 61.98 63.12 2i6a s VAL 108 Cb 0.00 -3.93 0.14 0.00 0.00 0.00 0.00 36.38 32.59 2i6a s VAL 108 CO 0.00 0.55 1.71 -0.67 0.00 0.00 0.00 175.10 176.69 2i6a n ASP 109 N 1.70 4.97 -4.79 3.32 2.03 -0.78 -4.54 116.55 118.47 2i6a n ASP 109 Ca -0.10 -2.99 -0.36 0.00 0.52 0.00 0.00 54.79 51.86 2i6a n ASP 109 Cb 0.50 -1.59 -0.05 0.00 -0.72 0.00 0.00 41.12 39.26 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 1.92 3.13 -0.15 -1.67 0.00 -1.26 -3.00 121.76 120.73 2i6a s ALA 110 Ca 0.44 0.60 -0.04 0.00 0.00 0.00 0.00 51.96 52.96 2i6a s ALA 110 Cb 0.04 -3.22 0.07 0.00 0.00 0.00 0.00 23.12 20.01 2i6a s ALA 110 CO 0.01 -0.02 0.19 -1.01 0.00 0.00 0.00 175.76 174.92 2i6a s HIS 111 N -1.70 -0.20 0.22 0.00 3.76 -0.18 -4.94 115.29 112.25 2i6a s HIS 111 Ca 0.55 0.34 0.08 0.00 -0.15 0.00 0.00 55.06 55.89 2i6a s HIS 111 Cb -0.19 -0.34 -0.04 0.00 1.11 0.00 0.00 32.58 33.11 2i6a s HIS 111 CO 0.24 -0.46 0.03 0.71 -0.85 0.00 0.00 174.74 174.41 2i6a s TYR 112 N 2.30 2.84 -0.42 1.40 1.51 -1.26 -3.13 117.35 120.60 2i6a s TYR 112 Ca 0.05 -0.16 -0.16 0.00 -1.01 0.00 0.00 57.07 55.79 2i6a s TYR 112 Cb -0.14 -1.32 0.02 0.00 -0.11 0.00 0.00 41.96 40.41 2i6a s TYR 112 CO -0.09 0.56 0.34 -0.47 -1.11 0.00 0.00 175.55 174.78 2i6a s TYR 113 N -2.01 3.22 -0.10 2.71 5.04 0.57 -4.93 117.35 121.85 2i6a s TYR 113 Ca 0.30 -0.55 -0.06 0.00 -2.44 0.00 0.00 57.07 54.32 2i6a s TYR 113 Cb -0.08 -2.71 -0.04 0.00 0.35 0.00 0.00 41.96 39.49 2i6a s TYR 113 CO 0.20 -0.63 0.13 -1.21 -1.34 0.00 0.00 175.55 172.69 2i6a s GLU 114 N 1.80 3.37 0.16 4.97 2.02 -1.26 -1.46 118.70 128.31 2i6a s GLU 114 Ca 0.07 -0.19 -0.09 0.00 0.02 0.00 0.00 54.97 54.77 2i6a s GLU 114 Cb -0.19 -3.12 -0.01 0.00 0.10 0.00 0.00 34.13 30.91 2i6a s GLU 114 CO 0.11 0.76 0.28 1.14 0.02 0.00 0.00 175.26 177.56 2i6a s GLN 115 N -1.13 1.13 -0.01 1.61 1.03 -1.09 -4.97 119.66 116.23 2i6a s GLN 115 Ca 0.16 -1.16 0.22 0.00 0.04 0.00 0.00 55.36 54.62 2i6a s GLN 115 Cb -0.12 0.37 -0.28 0.00 0.03 0.00 0.00 33.01 33.01 2i6a s GLN 115 CO 0.06 -0.41 0.61 0.09 -2.54 0.00 0.00 175.29 173.10 2i6a n ASN 116 N -0.20 0.26 0.13 12.60 3.02 -1.26 -1.48 115.26 128.33 2i6a n ASN 116 Ca -0.08 -0.19 -0.14 0.00 -0.03 0.00 0.00 54.58 54.15 2i6a n ASN 116 Cb 0.63 1.68 -0.08 0.00 -0.61 0.00 0.00 39.78 41.40 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 -0.25 -6.26 3.52 3.07 -1.98 -3.43 114.58 109.25 2i6a h GLU 117 Ca 0.00 0.02 -0.67 0.00 -0.50 0.00 0.00 59.36 58.20 2i6a h GLU 117 Cb 0.89 0.06 -0.17 0.00 -0.84 0.00 0.00 28.75 28.69 2i6a h GLU 117 CO 0.00 -0.16 -0.69 -0.65 -1.40 0.00 0.00 179.01 176.10 2i6a s GLN 118 N -6.14 2.60 0.44 2.33 -1.52 -1.26 -5.08 119.66 111.04 2i6a s GLN 118 Ca -0.14 -0.69 -0.18 0.00 -1.95 0.00 0.00 55.36 52.40 2i6a s GLN 118 Cb 0.05 -2.54 -0.10 0.00 -0.22 0.00 0.00 33.01 30.21 2i6a s GLN 118 CO 0.65 0.61 0.92 -1.25 -0.25 0.00 0.00 175.29 175.97 2i6a s PRO 119 N -1.38 4.09 0.43 2.91 0.04 -1.26 -4.06 135.00 135.76 2i6a s PRO 119 Ca 0.17 0.97 -0.21 0.00 0.04 0.00 0.00 61.00 61.97 2i6a s PRO 119 Cb -0.11 -2.22 -0.15 0.00 0.04 0.00 0.00 34.50 32.06 2i6a s PRO 119 CO 0.07 -0.07 0.15 2.41 0.04 0.00 0.00 177.00 179.60 2i6a n THR 120 N -0.90 0.80 -2.98 1.26 -1.04 -1.26 -1.05 114.28 109.11 2i6a n THR 120 Ca 0.06 -0.50 -0.28 0.00 -2.04 0.00 0.00 64.05 61.29 2i6a n THR 120 Cb 0.54 -0.11 -0.02 0.00 -1.82 0.00 0.00 70.33 68.92 2i6a n THR 120 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2i6a s GLY 121 N -1.00 1.72 0.16 3.41 0.00 -1.24 -4.49 107.32 105.89 2i6a s GLY 121 Ca 0.60 -0.47 0.02 0.00 0.00 0.00 0.00 44.72 44.87 2i6a s GLY 121 CO 0.62 -0.32 -0.00 -0.51 0.00 0.00 0.00 173.10 172.89 2i6a s THR 122 N -2.39 0.65 -0.05 0.90 -4.23 0.00 -1.46 115.64 109.06 2i6a s THR 122 Ca 0.47 -1.97 0.01 0.00 -1.18 0.00 0.00 61.69 59.02 2i6a s THR 122 Cb -0.10 -2.06 0.02 0.00 1.34 0.00 0.00 72.50 71.70 2i6a s THR 122 CO 0.35 -0.52 -0.06 0.00 -0.54 0.00 0.00 174.62 173.85 2i6a s ALA 124 N 0.91 3.58 -0.60 0.00 0.00 -0.29 0.43 121.76 125.79 2i6a s ALA 124 Ca -0.11 -0.37 0.02 0.00 0.00 0.00 0.00 51.96 51.50 2i6a s ALA 124 Cb -0.14 -2.45 0.15 0.00 0.00 0.00 0.00 23.12 20.68 2i6a s ALA 124 CO 0.00 0.12 0.37 0.00 0.00 0.00 0.00 175.76 176.25 2i6a s ALA 125 N 0.33 3.51 -0.66 0.00 0.00 -0.30 -1.43 121.76 123.22 2i6a s ALA 125 Ca 0.20 -3.40 -0.26 0.00 0.00 0.00 0.00 51.96 48.50 2i6a s ALA 125 Cb -0.14 -2.32 0.04 0.00 0.00 0.00 0.00 23.12 20.70 2i6a s ALA 125 CO 0.06 -2.06 1.14 0.00 0.00 0.00 0.00 175.76 174.90 2i6a s ILE 127 N 4.94 4.73 -0.27 0.00 1.01 -0.37 -2.13 121.20 129.11 2i6a s ILE 127 Ca 0.33 0.97 -0.00 0.00 0.00 0.00 0.00 60.65 61.95 2i6a s ILE 127 Cb -0.11 -3.75 0.14 0.00 0.01 0.00 0.00 42.46 38.76 2i6a s ILE 127 CO 0.17 0.13 0.34 0.42 0.00 0.00 0.00 174.94 176.00 2i6a s THR 128 N -1.60 -0.51 0.00 2.92 -4.23 -1.06 0.30 115.64 111.46 2i6a s THR 128 Ca 0.43 -0.32 0.00 0.00 -1.18 0.00 0.00 61.69 60.62 2i6a s THR 128 Cb -0.14 -0.93 0.00 0.00 1.34 0.00 0.00 72.50 72.76 2i6a s THR 128 CO 0.20 -0.32 0.00 0.61 -0.54 0.00 0.00 174.62 174.57 2i6a n GLY 129 N 5.34 2.75 0.77 3.99 0.00 -1.26 -1.66 105.19 115.11 2i6a n GLY 129 Ca -0.02 -0.08 0.08 0.00 0.00 0.00 0.00 46.02 46.01 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 9.64 2.72 -4.89 1.61 10.43 -1.26 -4.98 116.55 129.82 2i6a n ASP 130 Ca 0.00 -1.80 -0.29 0.00 2.57 0.00 0.00 54.79 55.27 2i6a n ASP 130 Cb 0.00 -0.11 -0.03 0.00 1.84 0.00 0.00 41.12 42.82 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 -1.28 6.45 -0.22 -2.24 -0.87 -0.67 -4.98 114.94 111.13 2i6a s ASN 131 Ca 0.25 0.98 -0.03 0.00 -1.57 0.00 0.00 52.86 52.48 2i6a s ASN 131 Cb 0.15 -2.26 0.11 0.00 -0.02 0.00 0.00 41.25 39.23 2i6a s ASN 131 CO 0.22 -0.38 0.27 -0.13 -2.57 0.00 0.00 177.10 174.51 2i6a s ARG 132 N -3.96 0.25 -0.36 -0.60 0.52 -0.68 -2.56 118.95 111.56 2i6a s ARG 132 Ca 0.49 0.24 -0.11 0.00 -0.52 0.00 0.00 55.73 55.82 2i6a s ARG 132 Cb -0.10 -0.96 0.02 0.00 0.52 0.00 0.00 34.95 34.42 2i6a s ARG 132 CO 0.34 -0.70 0.21 0.45 0.02 0.00 0.00 175.30 175.62 2i6a s SER 133 N 2.38 5.76 -0.15 0.23 0.15 -0.90 -2.23 113.70 118.94 2i6a s SER 133 Ca 0.09 -0.84 -0.08 0.00 0.70 0.00 0.00 55.95 55.81 2i6a s SER 133 Cb -0.15 -2.04 -0.04 0.00 -1.71 0.00 0.00 66.02 62.07 2i6a s SER 133 CO -0.16 -0.34 0.14 -0.76 1.20 0.00 0.00 173.24 173.32 2i6a s LEU 134 N 1.59 4.33 -0.17 3.45 1.43 0.26 -1.37 118.68 128.21 2i6a s LEU 134 Ca 0.03 0.39 -0.03 0.00 -1.03 0.00 0.00 54.13 53.49 2i6a s LEU 134 Cb -0.19 -2.08 0.05 0.00 0.03 0.00 0.00 46.19 44.01 2i6a s LEU 134 CO 0.07 0.33 0.04 -0.63 0.23 0.00 0.00 176.35 176.39 2i6a s ILE 135 N -0.55 0.37 0.09 -0.59 1.09 -0.51 -0.57 121.20 120.53 2i6a s ILE 135 Ca 0.13 -0.35 -0.20 0.00 -1.10 0.00 0.00 60.65 59.13 2i6a s ILE 135 Cb -0.12 -0.85 -0.07 0.00 -1.06 0.00 0.00 42.46 40.37 2i6a s ILE 135 CO 0.02 -0.14 0.59 0.00 -0.10 0.00 0.00 174.94 175.31 2i6a s ALA 136 N 1.94 3.57 -0.76 9.38 0.00 -0.18 -1.14 121.76 134.57 2i6a s ALA 136 Ca 0.01 0.06 0.01 0.00 0.00 0.00 0.00 51.96 52.04 2i6a s ALA 136 Cb -0.16 -2.67 0.19 0.00 0.00 0.00 0.00 23.12 20.48 2i6a s ALA 136 CO -0.08 0.39 0.58 1.21 0.00 0.00 0.00 175.76 177.87 2i6a s ASN 137 N -1.16 5.30 0.26 0.00 2.47 0.18 -0.81 114.94 121.18 2i6a s ASN 137 Ca 0.30 -3.63 -0.04 0.00 0.42 0.00 0.00 52.86 49.92 2i6a s ASN 137 Cb -0.20 -1.77 0.53 0.00 -1.45 0.00 0.00 41.25 38.36 2i6a s ASN 137 CO 0.20 -0.17 1.64 -0.07 -3.72 0.00 0.00 177.10 174.98 2i6a h LEU 138 N 5.91 -0.21 0.00 3.21 3.38 -1.94 0.04 115.31 125.71 2i6a h LEU 138 Ca 0.11 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.28 2i6a h LEU 138 Cb 0.81 0.31 0.00 0.00 0.09 0.00 0.00 40.66 41.87 2i6a h LEU 138 CO 0.77 -0.16 0.00 0.00 0.09 0.00 0.00 178.44 179.14 2i6a n ALA 139 N -2.85 0.00 0.10 1.53 0.00 -1.26 -0.07 120.51 117.96 2i6a n ALA 139 Ca 0.16 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.65 2i6a n ALA 139 Cb 0.54 0.00 0.50 0.00 0.00 0.00 0.00 19.45 20.49 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 -0.34 1.80 0.00 0.00 0.00 -1.32 -2.58 119.26 116.82 2i6a h ALA 140 Ca 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2i6a h ALA 140 Cb 0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 2i6a h ALA 140 CO 0.00 0.18 -0.03 0.00 0.00 0.00 0.00 179.25 179.41 2i6a h ALA 141 N 1.83 1.29 0.00 0.00 0.00 -0.49 -1.08 119.26 120.81 2i6a h ALA 141 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2i6a h ALA 141 Cb -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2i6a h ALA 141 CO -0.02 0.03 0.00 -1.71 0.00 0.00 0.00 179.25 177.56 2i6a n ASN 142 N -3.54 0.00 -0.20 0.00 4.05 -0.97 -3.70 115.26 110.90 2i6a n ASN 142 Ca -0.03 0.22 0.15 0.00 0.45 0.00 0.00 54.58 55.38 2i6a n ASN 142 Cb 0.12 -0.39 0.75 0.00 1.23 0.00 0.00 39.78 41.50 2i6a n ASN 142 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2i6a s TYR 144 N -2.04 2.13 -0.09 0.00 5.04 -1.24 -4.99 117.35 116.15 2i6a s TYR 144 Ca 0.42 0.23 0.04 0.00 -2.44 0.00 0.00 57.07 55.32 2i6a s TYR 144 Cb 0.21 -3.94 -0.00 0.00 0.35 0.00 0.00 41.96 38.59 2i6a s TYR 144 CO 0.37 -3.89 -0.23 0.15 -1.34 0.00 0.00 175.55 170.61 2i6a s LYS 145 N 3.49 2.86 0.15 4.97 -0.14 -1.26 -4.67 119.74 125.13 2i6a s LYS 145 Ca 0.74 -0.84 -0.13 0.00 -1.36 0.00 0.00 55.97 54.37 2i6a s LYS 145 Cb -0.36 -2.20 0.03 0.00 -1.68 0.00 0.00 37.83 33.63 2i6a s LYS 145 CO 0.31 0.20 1.68 1.57 -0.76 0.00 0.00 175.35 178.35 2i6a h LYS 146 N 6.64 0.78 -0.59 1.68 2.10 -1.96 -2.96 116.57 122.27 2i6a h LYS 146 Ca -0.22 -0.17 0.17 0.00 -2.00 0.00 0.00 60.65 58.43 2i6a h LYS 146 Cb 1.23 -0.11 -0.02 0.00 -0.90 0.00 0.00 32.23 32.42 2i6a h LYS 146 CO 0.47 0.73 0.42 1.05 -2.00 0.00 0.00 179.45 180.12 2i6a h GLU 147 N 0.69 0.02 -0.34 0.07 9.09 -1.95 0.13 114.58 122.28 2i6a h GLU 147 Ca 0.16 -0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.57 2i6a h GLU 147 Cb 0.27 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 27.37 2i6a h GLU 147 CO -0.01 0.01 0.00 0.36 0.05 0.00 0.00 179.01 179.43 2i6a n LYS 148 N -4.37 3.13 0.04 1.06 2.85 -1.13 -4.60 118.16 115.14 2i6a n LYS 148 Ca 0.11 -2.66 0.00 0.00 -1.05 0.00 0.00 58.31 54.71 2i6a n LYS 148 Cb 0.65 -1.73 0.00 0.00 -0.65 0.00 0.00 35.03 33.30 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 -0.01 -2.35 0.26 5.58 -0.00 -0.68 -4.91 115.22 113.11 2i6a n HIS 149 Ca 0.20 0.25 0.11 0.00 -0.00 0.00 0.00 57.72 58.28 2i6a n HIS 149 Cb 0.79 1.01 0.72 0.00 -0.00 0.00 0.00 29.99 32.52 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 0.00 0.00 0.27 5.85 -1.56 -2.37 115.31 117.50 2i6a h LEU 150 Ca 0.00 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.58 2i6a h LEU 150 Cb 0.00 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2i6a h LEU 150 CO 0.00 0.09 -0.70 0.44 -0.34 0.00 0.00 178.44 177.93 2i6a h ASP 151 N 0.00 0.00 -2.48 1.25 3.32 -1.04 -3.18 116.42 114.29 2i6a h ASP 151 Ca -0.00 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.44 2i6a h ASP 151 Cb 0.21 0.00 0.11 0.00 0.22 0.00 0.00 39.33 39.88 2i6a h ASP 151 CO 0.01 0.62 0.12 0.18 -1.72 0.00 0.00 179.24 178.45 2i6a n LEU 152 N -3.22 1.78 -0.11 1.55 4.77 -0.89 -4.65 117.00 116.22 2i6a n LEU 152 Ca 0.00 1.17 -0.10 0.00 -0.03 0.00 0.00 56.01 57.05 2i6a n LEU 152 Cb 0.79 -1.29 -0.02 0.00 -2.33 0.00 0.00 43.42 40.57 2i6a n LEU 152 CO 0.42 -1.44 0.85 -0.08 -1.33 0.00 0.00 177.39 175.82 2i6a h GLU 153 N 1.94 0.53 -0.53 3.23 4.81 -1.89 0.10 114.58 122.78 2i6a h GLU 153 Ca -0.40 -0.13 0.07 0.00 -0.13 0.00 0.00 59.36 58.77 2i6a h GLU 153 Cb 1.34 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.62 2i6a h GLU 153 CO 0.60 0.59 0.35 1.57 -0.73 0.00 0.00 179.01 181.39 2i6a h LYS 154 N 0.39 0.44 0.00 1.92 2.10 -1.94 -1.09 116.57 118.39 2i6a h LYS 154 Ca 0.11 -0.03 -0.00 0.00 -2.00 0.00 0.00 60.65 58.73 2i6a h LYS 154 Cb 0.29 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 31.52 2i6a h LYS 154 CO 0.00 0.29 -0.00 -0.91 -2.00 0.00 0.00 179.45 176.83 2i6a h ASN 155 N 0.45 -0.00 0.12 7.07 -0.26 -1.73 -3.30 115.58 117.93 2i6a h ASN 155 Ca 0.23 -0.70 -0.00 0.00 -0.56 0.00 0.00 56.30 55.27 2i6a h ASN 155 Cb 0.34 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.60 2i6a h ASN 155 CO -0.06 0.84 -0.00 -0.25 -1.06 0.00 0.00 177.43 176.90 2i6a h TRP 156 N -0.99 0.00 -0.50 1.19 2.91 -0.76 -1.90 115.95 115.91 2i6a h TRP 156 Ca -0.00 0.00 -0.11 0.00 1.13 0.00 0.00 58.89 59.91 2i6a h TRP 156 Cb 0.70 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.34 2i6a h TRP 156 CO 0.20 0.00 -0.11 1.98 -1.03 0.00 0.00 178.44 179.48 2i6a h MET 157 N 0.00 0.95 -0.05 2.65 4.05 -1.29 -2.17 114.93 119.07 2i6a h MET 157 Ca -0.00 -0.36 -0.11 0.00 -0.28 0.00 0.00 59.70 58.95 2i6a h MET 157 Cb 0.06 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 30.79 2i6a h MET 157 CO 0.00 1.02 -0.46 -0.07 0.23 0.00 0.00 176.91 177.64 2i6a h LEU 158 N 0.81 0.14 -0.58 3.39 3.38 -1.41 -2.84 115.31 118.20 2i6a h LEU 158 Ca 0.13 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.92 2i6a h LEU 158 Cb 0.67 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 2i6a h LEU 158 CO 0.05 0.58 -0.12 0.58 0.09 0.00 0.00 178.44 179.61 2i6a h VAL 159 N 0.11 1.27 0.00 1.22 2.07 -1.45 -2.53 116.25 116.93 2i6a h VAL 159 Ca 0.01 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.25 2i6a h VAL 159 Cb 0.85 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 2i6a h VAL 159 CO 0.07 0.45 0.00 -0.62 0.02 0.00 0.00 177.57 177.49 2i6a n GLU 160 N -4.14 0.01 0.07 1.57 1.02 -0.84 -2.21 120.64 116.13 2i6a n GLU 160 Ca 0.01 0.40 0.09 0.00 -0.02 0.00 0.00 57.16 57.65 2i6a n GLU 160 Cb 0.41 -1.53 -0.04 0.00 -0.02 0.00 0.00 31.44 30.25 2i6a n GLU 160 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2i6a n LYS 161 N -1.56 0.62 -2.74 3.49 5.02 -0.95 -4.97 118.16 117.05 2i6a n LYS 161 Ca 0.01 0.08 -0.36 0.00 -2.02 0.00 0.00 58.31 56.02 2i6a n LYS 161 Cb 0.08 -1.77 -0.06 0.00 -0.02 0.00 0.00 35.03 33.25 2i6a n LYS 161 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2i6a s ALA 162 N -3.31 3.17 -0.14 7.82 0.00 -0.94 -4.48 121.76 123.88 2i6a s ALA 162 Ca -0.02 0.54 0.12 0.00 0.00 0.00 0.00 51.96 52.60 2i6a s ALA 162 Cb 0.10 -3.20 -0.24 0.00 0.00 0.00 0.00 23.12 19.79 2i6a s ALA 162 CO 0.81 0.10 0.28 0.54 0.00 0.00 0.00 175.76 177.50 2i6a n ARG 163 N 0.32 0.67 -4.95 0.00 5.12 0.36 -4.89 116.66 113.29 2i6a n ARG 163 Ca 0.03 0.15 -0.27 0.00 -1.93 0.00 0.00 57.85 55.82 2i6a n ARG 163 Cb 0.50 -1.64 -0.16 0.00 -1.16 0.00 0.00 32.46 30.00 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 -2.54 1.59 0.02 1.55 1.01 -1.05 -1.04 120.40 119.95 2i6a s VAL 164 Ca -0.12 -0.81 0.08 0.00 0.00 0.00 0.00 61.98 61.13 2i6a s VAL 164 Cb 0.07 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.06 2i6a s VAL 164 CO 0.80 0.45 -0.23 0.00 0.00 0.00 0.00 175.10 176.12 2i6a s TYR 166 N -0.79 -0.09 -0.04 0.00 5.04 0.50 -1.00 117.35 120.97 2i6a s TYR 166 Ca 0.12 0.33 -0.02 0.00 -2.44 0.00 0.00 57.07 55.07 2i6a s TYR 166 Cb -0.10 -0.12 0.03 0.00 0.35 0.00 0.00 41.96 42.13 2i6a s TYR 166 CO 0.02 -0.12 0.07 0.42 -1.34 0.00 0.00 175.55 174.60 2i6a s ILE 167 N 0.98 -0.12 0.54 3.14 1.01 -0.98 -3.37 121.20 122.40 2i6a s ILE 167 Ca -0.08 0.40 -0.21 0.00 0.00 0.00 0.00 60.65 60.76 2i6a s ILE 167 Cb -0.10 -0.16 -0.05 0.00 0.01 0.00 0.00 42.46 42.16 2i6a s ILE 167 CO -0.04 0.17 1.27 0.00 0.00 0.00 0.00 174.94 176.34 2i6a s ALA 168 N 2.05 2.78 0.25 9.38 0.00 -1.26 -2.81 121.76 132.15 2i6a s ALA 168 Ca 0.03 1.16 0.36 0.00 0.00 0.00 0.00 51.96 53.51 2i6a s ALA 168 Cb -0.12 -3.50 1.77 0.00 0.00 0.00 0.00 23.12 21.27 2i6a s ALA 168 CO -0.03 -1.16 2.09 0.78 0.00 0.00 0.00 175.76 177.44 2i6a h GLY 169 N 1.45 0.00 0.09 0.00 0.00 -1.50 -2.26 103.07 100.85 2i6a h GLY 169 Ca -0.50 0.00 0.21 0.00 0.00 0.00 0.00 47.33 47.04 2i6a h GLY 169 CO 0.57 0.00 0.75 0.74 0.00 0.00 0.00 176.54 178.60 2i6a h PHE 170 N 0.00 0.00 0.00 5.60 0.05 -1.88 0.47 116.94 121.18 2i6a h PHE 170 Ca 0.00 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 2i6a h PHE 170 Cb 0.22 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.17 2i6a h PHE 170 CO 0.00 0.00 -0.21 0.35 -0.18 0.00 0.00 178.31 178.27 2i6a h PHE 171 N 0.00 0.00 0.00 -0.55 3.57 -1.78 -3.19 116.94 114.99 2i6a h PHE 171 Ca 0.35 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.84 2i6a h PHE 171 Cb 1.84 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.58 2i6a h PHE 171 CO 0.00 0.00 -0.02 -0.07 -2.23 0.00 0.00 178.31 175.99 2i6a h LEU 172 N 0.00 0.00 -0.03 0.59 3.38 -1.11 0.39 115.31 118.53 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 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2i6a h LEU 172 CO 0.00 0.02 -0.05 0.35 0.09 0.00 0.00 178.44 178.85 2i6a n THR 173 N -3.49 0.00 -0.05 0.22 -2.24 -1.21 -4.04 114.28 103.48 2i6a n THR 173 Ca -0.03 -0.01 -0.10 0.00 -2.27 0.00 0.00 64.05 61.65 2i6a n THR 173 Cb 0.12 -0.39 -0.03 0.00 -2.10 0.00 0.00 70.33 67.92 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 -1.35 1.18 -3.27 2.28 0.31 0.12 -4.96 118.33 112.64 2i6a n VAL 174 Ca 0.11 0.08 -0.20 0.00 -0.01 0.00 0.00 64.34 64.31 2i6a n VAL 174 Cb 0.30 -1.90 -0.07 0.00 -0.91 0.00 0.00 33.84 31.25 2i6a n VAL 174 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2i6a s SER 175 N -6.12 0.93 0.52 4.52 0.15 -0.41 -4.90 113.70 108.39 2i6a s SER 175 Ca -0.18 -2.38 0.17 0.00 0.70 0.00 0.00 55.95 54.26 2i6a s SER 175 Cb 0.05 0.26 1.31 0.00 -1.71 0.00 0.00 66.02 65.93 2i6a s SER 175 CO 0.25 -0.18 2.15 -0.65 1.20 0.00 0.00 173.24 176.01 2i6a h PRO 176 N 5.98 0.00 -0.41 5.44 0.11 -1.77 -2.23 132.00 139.12 2i6a h PRO 176 Ca 0.16 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.24 2i6a h PRO 176 Cb 0.99 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 2i6a h PRO 176 CO 0.25 0.00 0.14 0.93 -0.21 0.00 0.00 178.00 179.11 2i6a h GLU 177 N 0.00 0.63 -0.33 1.05 3.07 -1.94 0.38 114.58 117.44 2i6a h GLU 177 Ca 0.01 -0.13 -0.02 0.00 -0.50 0.00 0.00 59.36 58.72 2i6a h GLU 177 Cb 0.04 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 27.84 2i6a h GLU 177 CO -0.00 0.62 0.14 0.77 -1.40 0.00 0.00 179.01 179.13 2i6a h SER 178 N 0.52 0.45 -0.07 1.42 0.02 -1.82 -1.85 113.55 112.23 2i6a h SER 178 Ca 0.13 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2i6a h SER 178 Cb 0.24 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 2i6a h SER 178 CO -0.01 0.48 0.03 0.58 -1.14 0.00 0.00 176.83 176.78 2i6a h VAL 179 N 0.38 1.10 -0.27 2.27 2.07 -1.32 -2.38 116.25 118.10 2i6a h VAL 179 Ca 0.11 -0.29 0.06 0.00 0.82 0.00 0.00 66.70 67.40 2i6a h VAL 179 Cb 0.17 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 31.06 2i6a h VAL 179 CO -0.01 0.08 -0.08 -0.07 0.02 0.00 0.00 177.57 177.51 2i6a h LEU 180 N -0.01 -0.29 -0.47 2.57 3.38 -0.84 0.78 115.31 120.43 2i6a h LEU 180 Ca 0.02 0.09 0.09 0.00 0.09 0.00 0.00 57.88 58.17 2i6a h LEU 180 Cb 0.11 0.18 -0.09 0.00 0.09 0.00 0.00 40.66 40.95 2i6a h LEU 180 CO -0.00 -0.11 -0.11 0.50 0.09 0.00 0.00 178.44 178.81 2i6a h LYS 181 N -0.02 0.01 -0.20 1.13 3.64 -1.30 1.07 116.57 120.90 2i6a h LYS 181 Ca 0.13 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.50 2i6a h LYS 181 Cb 0.22 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 2i6a h LYS 181 CO -0.29 0.00 0.07 0.28 -2.27 0.00 0.00 179.45 177.24 2i6a h VAL 182 N 0.01 1.17 0.04 2.00 2.07 -0.59 -1.58 116.25 119.37 2i6a h VAL 182 Ca 0.23 -0.54 0.02 0.00 0.82 0.00 0.00 66.70 67.23 2i6a h VAL 182 Cb 0.34 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 2i6a h VAL 182 CO -0.48 0.17 -0.14 0.00 0.02 0.00 0.00 177.57 177.15 2i6a h ALA 183 N 0.90 -0.19 -0.76 1.67 0.00 0.17 -1.66 119.26 119.38 2i6a h ALA 183 Ca 0.06 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.04 2i6a h ALA 183 Cb 0.20 0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 2i6a h ALA 183 CO -0.00 -0.64 0.50 1.25 0.00 0.00 0.00 179.25 180.35 2i6a h HIS 184 N -0.25 0.80 -0.56 0.00 6.17 0.12 -2.11 115.15 119.32 2i6a h HIS 184 Ca 0.03 0.02 -0.05 0.00 0.71 0.00 0.00 60.37 61.08 2i6a h HIS 184 Cb 0.29 -0.26 -0.02 0.00 2.52 0.00 0.00 27.41 29.93 2i6a h HIS 184 CO -0.17 0.41 0.14 1.25 0.71 0.00 0.00 177.93 180.27 2i6a h HIS 185 N 0.78 0.95 -0.71 5.26 6.17 -0.63 -1.76 115.15 125.21 2i6a h HIS 185 Ca 0.33 -0.11 0.03 0.00 0.71 0.00 0.00 60.37 61.33 2i6a h HIS 185 Cb 0.30 -0.27 -0.04 0.00 2.52 0.00 0.00 27.41 29.92 2i6a h HIS 185 CO -0.00 0.81 0.45 0.00 0.71 0.00 0.00 177.93 179.90 2i6a h ALA 186 N 1.02 0.92 0.74 5.26 0.00 -0.67 -2.26 119.26 124.28 2i6a h ALA 186 Ca 0.18 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 2i6a h ALA 186 Cb 0.34 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.90 2i6a h ALA 186 CO 0.00 0.24 -0.36 1.03 0.00 0.00 0.00 179.25 180.17 2i6a h SER 187 N 0.89 -0.84 -0.11 0.00 0.87 -1.24 0.79 113.55 113.91 2i6a h SER 187 Ca 0.28 0.02 0.03 0.00 -1.23 0.00 0.00 61.79 60.89 2i6a h SER 187 Cb -0.01 0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.16 2i6a h SER 187 CO -0.10 -0.58 0.09 -0.33 -0.53 0.00 0.00 176.83 175.39 2i6a h GLU 188 N -1.04 0.00 -0.19 2.24 5.08 -1.30 -2.15 114.58 117.21 2i6a h GLU 188 Ca -0.10 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 2i6a h GLU 188 Cb 0.78 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 2i6a h GLU 188 CO 0.17 0.00 -0.02 0.09 -1.00 0.00 0.00 179.01 178.25 2i6a n ASN 189 N -4.13 3.30 -4.03 1.42 3.02 -0.85 -4.99 115.26 109.00 2i6a n ASN 189 Ca -0.00 -3.13 -0.28 0.00 -0.03 0.00 0.00 54.58 51.14 2i6a n ASN 189 Cb 0.21 -0.52 -0.03 0.00 -0.61 0.00 0.00 39.78 38.82 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 -0.84 -0.58 -4.87 6.41 5.15 0.38 -4.97 115.26 115.95 2i6a n ASN 190 Ca 0.21 -1.09 -0.21 0.00 -0.60 0.00 0.00 54.58 52.89 2i6a n ASN 190 Cb 0.83 -2.66 -0.03 0.00 -0.53 0.00 0.00 39.78 37.39 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 -6.75 2.97 -0.20 1.20 3.00 0.25 -5.01 118.95 114.40 2i6a s ARG 191 Ca 0.06 -1.07 -0.24 0.00 0.00 0.00 0.00 55.73 54.48 2i6a s ARG 191 Cb -0.03 -2.61 -0.01 0.00 0.00 0.00 0.00 34.95 32.30 2i6a s ARG 191 CO 0.92 0.30 0.81 0.42 0.00 0.00 0.00 175.30 177.75 2i6a s ILE 192 N -2.16 4.88 -0.28 1.52 1.01 -0.21 -4.50 121.20 121.46 2i6a s ILE 192 Ca 0.36 1.56 -0.05 0.00 0.00 0.00 0.00 60.65 62.52 2i6a s ILE 192 Cb -0.08 -4.11 0.02 0.00 0.01 0.00 0.00 42.46 38.30 2i6a s ILE 192 CO 0.26 -0.00 0.04 0.12 0.00 0.00 0.00 174.94 175.36 2i6a s PHE 193 N 2.39 3.13 0.13 3.97 5.36 -1.26 -0.62 117.98 131.09 2i6a s PHE 193 Ca 0.36 -1.16 0.11 0.00 -0.96 0.00 0.00 56.93 55.27 2i6a s PHE 193 Cb -0.16 -2.20 -0.04 0.00 -0.34 0.00 0.00 43.02 40.28 2i6a s PHE 193 CO 0.10 -0.63 -0.24 0.95 -1.46 0.00 0.00 175.22 173.94 2i6a s THR 194 N 1.45 2.42 0.16 0.12 -4.23 -0.17 0.52 115.64 115.90 2i6a s THR 194 Ca 0.02 -1.72 -0.03 0.00 -1.18 0.00 0.00 61.69 58.78 2i6a s THR 194 Cb -0.17 -2.09 -0.03 0.00 1.34 0.00 0.00 72.50 71.55 2i6a s THR 194 CO 0.01 0.08 0.14 -0.22 -0.54 0.00 0.00 174.62 174.09 2i6a s LEU 195 N -2.13 1.39 0.12 4.79 2.96 -1.04 -2.31 118.68 122.46 2i6a s LEU 195 Ca 0.15 -1.16 0.08 0.00 -0.22 0.00 0.00 54.13 52.99 2i6a s LEU 195 Cb -0.10 0.59 -0.04 0.00 0.50 0.00 0.00 46.19 47.14 2i6a s LEU 195 CO 0.07 -0.81 -0.21 0.21 -1.32 0.00 0.00 176.35 174.30 2i6a s ASN 196 N -3.05 2.61 0.28 3.68 3.84 -1.12 -1.95 114.94 119.22 2i6a s ASN 196 Ca 0.26 -0.73 0.25 0.00 0.21 0.00 0.00 52.86 52.85 2i6a s ASN 196 Cb 0.06 -0.15 0.69 0.00 -0.55 0.00 0.00 41.25 41.30 2i6a s ASN 196 CO 0.04 0.05 1.73 -0.07 -2.79 0.00 0.00 177.10 176.06 2i6a h LEU 197 N 3.89 0.00 0.00 3.21 3.38 -1.57 -1.14 115.31 123.08 2i6a h LEU 197 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2i6a h LEU 197 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2i6a h LEU 197 CO 0.42 0.00 0.00 -1.20 0.09 0.00 0.00 178.44 177.75 2i6a n SER 198 N -2.51 0.00 -3.56 -0.43 7.64 -1.26 -4.66 113.62 108.84 2i6a n SER 198 Ca 0.05 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.87 2i6a n SER 198 Cb 0.45 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.63 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 -1.98 0.36 -0.43 0.00 -1.26 -4.98 121.76 113.46 2i6a s ALA 199 Ca 0.00 1.37 0.07 0.00 0.00 0.00 0.00 51.96 53.40 2i6a s ALA 199 Cb 0.00 0.09 0.67 0.00 0.00 0.00 0.00 23.12 23.88 2i6a s ALA 199 CO 0.00 -0.64 1.87 -1.35 0.00 0.00 0.00 175.76 175.64 2i6a h PRO 200 N 2.00 0.34 0.00 0.00 0.11 -1.89 -2.44 132.00 130.12 2i6a h PRO 200 Ca -0.14 -0.09 -0.01 0.00 0.11 0.00 0.00 66.00 65.88 2i6a h PRO 200 Cb 1.19 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 2i6a h PRO 200 CO 0.26 0.47 -0.04 0.27 -0.21 0.00 0.00 178.00 178.75 2i6a h PHE 201 N 0.32 0.00 -0.32 0.65 -5.15 -1.92 -2.00 116.94 108.53 2i6a h PHE 201 Ca 0.06 0.00 -0.12 0.00 -0.20 0.00 0.00 57.97 57.71 2i6a h PHE 201 Cb 0.42 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.57 2i6a h PHE 201 CO 0.01 0.04 -0.29 0.82 -2.00 0.00 0.00 178.31 176.88 2i6a h ILE 202 N 0.00 1.28 0.00 0.88 1.08 -1.70 -0.35 117.51 118.70 2i6a h ILE 202 Ca -0.00 -1.41 0.00 0.00 -0.39 0.00 0.00 64.86 63.06 2i6a h ILE 202 Cb 0.13 1.35 0.00 0.00 -3.07 0.00 0.00 36.82 35.22 2i6a h ILE 202 CO 0.00 0.46 -0.24 0.28 -0.69 0.00 0.00 178.15 177.96 2i6a h SER 203 N 0.58 0.00 0.04 1.72 0.02 -1.51 -2.65 113.55 111.74 2i6a h SER 203 Ca 0.07 -0.05 -0.28 0.00 -0.84 0.00 0.00 61.79 60.69 2i6a h SER 203 Cb 0.79 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.30 2i6a h SER 203 CO 0.07 0.03 -1.51 0.00 -1.14 0.00 0.00 176.83 174.28 2i6a n GLN 204 N -2.43 0.62 -0.02 3.45 6.02 -0.94 -4.35 117.38 119.73 2i6a n GLN 204 Ca 0.04 0.48 0.04 0.00 -0.01 0.00 0.00 57.00 57.55 2i6a n GLN 204 Cb 0.46 -1.73 0.04 0.00 1.02 0.00 0.00 30.24 30.04 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 -4.16 0.06 -0.97 1.08 3.72 -0.18 -4.65 117.46 112.35 2i6a n PHE 205 Ca -0.33 -0.09 0.02 0.00 -0.05 0.00 0.00 57.45 57.00 2i6a n PHE 205 Cb 0.79 -0.01 0.03 0.00 -0.94 0.00 0.00 39.48 39.35 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 0.37 0.00 -0.38 1.38 4.02 -1.01 -4.87 117.16 116.67 2i6a n TYR 206 Ca 0.05 -0.36 0.30 0.00 -0.01 0.00 0.00 57.90 57.88 2i6a n TYR 206 Cb 0.22 -0.06 0.58 0.00 -0.02 0.00 0.00 39.34 40.06 2i6a n TYR 206 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 176.86 176.72 2i6a h LYS 207 N 0.00 0.21 -0.08 -0.72 1.57 -1.74 -1.07 116.57 114.76 2i6a h LYS 207 Ca 0.00 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2i6a h LYS 207 Cb 0.95 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 33.21 2i6a h LYS 207 CO 0.00 0.14 0.04 1.49 -0.57 0.00 0.00 179.45 180.55 2i6a h GLU 208 N 0.22 0.11 -0.59 3.15 4.81 -1.91 0.45 114.58 120.83 2i6a h GLU 208 Ca 0.73 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.84 2i6a h GLU 208 Cb 2.08 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 31.42 2i6a h GLU 208 CO -0.40 0.16 -0.02 0.77 -0.73 0.00 0.00 179.01 178.79 2i6a h SER 209 N 0.02 1.03 -0.26 1.04 0.02 -1.63 -2.34 113.55 111.43 2i6a h SER 209 Ca 0.03 -0.30 -0.05 0.00 -0.84 0.00 0.00 61.79 60.62 2i6a h SER 209 Cb 0.09 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.34 2i6a h SER 209 CO -0.00 1.09 -0.04 0.25 -1.14 0.00 0.00 176.83 176.98 2i6a h LEU 210 N 0.95 0.49 -0.69 5.07 5.85 -0.99 -2.46 115.31 123.53 2i6a h LEU 210 Ca 0.16 -0.35 -0.06 0.00 0.84 0.00 0.00 57.88 58.47 2i6a h LEU 210 Cb 0.58 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 2i6a h LEU 210 CO 0.03 0.72 -0.29 0.24 -0.34 0.00 0.00 178.44 178.80 2i6a h MET 211 N 0.25 0.00 0.00 1.25 2.86 -0.14 0.20 114.93 119.35 2i6a h MET 211 Ca 0.07 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.55 2i6a h MET 211 Cb 0.50 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.13 2i6a h MET 211 CO 0.02 0.29 -0.76 -0.22 1.06 0.00 0.00 176.91 177.31 2i6a h LYS 212 N 0.00 0.00 0.00 1.72 3.64 -1.42 -3.19 116.57 117.31 2i6a h LYS 212 Ca -0.00 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.21 2i6a h LYS 212 Cb 0.96 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.75 2i6a h LYS 212 CO 0.04 0.76 -1.14 0.28 -2.27 0.00 0.00 179.45 177.12 2i6a h VAL 213 N 0.00 0.79 -0.31 2.00 2.07 -0.99 -3.40 116.25 116.41 2i6a h VAL 213 Ca -0.01 -2.31 0.09 0.00 0.82 0.00 0.00 66.70 65.29 2i6a h VAL 213 Cb 1.46 2.28 -0.01 0.00 -1.52 0.00 0.00 31.29 33.50 2i6a h VAL 213 CO 0.10 0.45 0.29 -0.03 0.02 0.00 0.00 177.57 178.39 2i6a h MET 214 N 0.00 0.00 0.00 1.57 -1.53 -0.95 -1.94 114.93 112.08 2i6a h MET 214 Ca -0.11 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.15 2i6a h MET 214 Cb 1.60 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 32.65 2i6a h MET 214 CO 0.07 0.00 0.00 -2.30 0.14 0.00 0.00 176.91 174.82 2i6a n PRO 215 N -3.98 0.14 0.00 0.39 -0.02 -1.25 -2.62 135.00 127.66 2i6a n PRO 215 Ca 0.05 0.11 0.05 0.00 -2.02 0.00 0.00 63.50 61.68 2i6a n PRO 215 Cb 0.44 -1.50 -0.01 0.00 -0.02 0.00 0.00 33.50 32.42 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 -1.40 0.00 -2.54 6.00 4.02 -0.73 0.19 117.16 122.69 2i6a n TYR 216 Ca 0.08 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.54 2i6a n TYR 216 Cb 0.22 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.52 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 -1.47 4.28 -0.02 -0.72 1.01 -1.08 -4.58 120.40 117.82 2i6a s VAL 217 Ca 0.08 1.42 -0.11 0.00 0.00 0.00 0.00 61.98 63.38 2i6a s VAL 217 Cb 0.09 -4.37 -0.31 0.00 0.00 0.00 0.00 36.38 31.78 2i6a s VAL 217 CO 0.28 -0.63 0.77 0.44 0.00 0.00 0.00 175.10 175.96 2i6a h ASP 218 N 8.91 0.63 -3.30 3.32 3.32 -0.26 -3.45 116.42 125.59 2i6a h ASP 218 Ca -0.23 -0.86 -0.49 0.00 0.02 0.00 0.00 57.03 55.47 2i6a h ASP 218 Cb 1.07 -0.20 -0.36 0.00 0.22 0.00 0.00 39.33 40.06 2i6a h ASP 218 CO 1.06 1.72 -0.79 -0.63 -1.72 0.00 0.00 179.24 178.87 2i6a s ILE 219 N -2.59 0.86 -0.09 0.35 1.01 -1.18 -0.21 121.20 119.35 2i6a s ILE 219 Ca -0.13 -0.24 -0.05 0.00 0.00 0.00 0.00 60.65 60.23 2i6a s ILE 219 Cb 0.05 -0.87 -0.04 0.00 0.01 0.00 0.00 42.46 41.61 2i6a s ILE 219 CO 0.87 0.32 0.10 -0.22 0.00 0.00 0.00 174.94 176.02 2i6a s LEU 220 N 1.35 4.12 0.28 2.97 2.96 0.15 -2.50 118.68 128.01 2i6a s LEU 220 Ca -0.03 0.34 0.07 0.00 -0.22 0.00 0.00 54.13 54.29 2i6a s LEU 220 Cb -0.14 -2.08 -0.06 0.00 0.50 0.00 0.00 46.19 44.42 2i6a s LEU 220 CO -0.03 0.37 -0.06 -0.36 -1.32 0.00 0.00 176.35 174.95 2i6a s PHE 221 N -1.04 1.96 0.00 5.38 0.40 -0.82 -0.40 117.98 123.46 2i6a s PHE 221 Ca 0.17 -0.68 0.00 0.00 -0.60 0.00 0.00 56.93 55.81 2i6a s PHE 221 Cb -0.12 -1.11 0.00 0.00 0.51 0.00 0.00 43.02 42.30 2i6a s PHE 221 CO 0.06 0.30 0.00 0.41 0.70 0.00 0.00 175.22 176.69 2i6a n GLY 222 N -0.59 1.17 2.12 4.36 0.00 -1.08 -1.29 105.19 109.88 2i6a n GLY 222 Ca -0.05 -1.26 -0.17 0.00 0.00 0.00 0.00 46.02 44.54 2i6a n GLY 222 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2i6a n ASN 223 N 0.00 2.39 -0.04 1.61 2.04 -1.26 -1.88 115.26 118.12 2i6a n ASN 223 Ca 0.00 -2.17 -0.08 0.00 -0.44 0.00 0.00 54.58 51.89 2i6a n ASN 223 Cb 0.00 0.09 -0.03 0.00 -2.53 0.00 0.00 39.78 37.31 2i6a n ASN 223 CO 0.00 0.00 0.00 1.05 -0.44 0.00 0.00 177.26 177.87 2i6a h GLU 224 N 0.00 -0.03 -0.55 -3.83 -0.00 -1.56 0.46 114.58 109.07 2i6a h GLU 224 Ca -0.22 0.00 -0.04 0.00 -0.00 0.00 0.00 59.36 59.10 2i6a h GLU 224 Cb 0.72 0.01 -0.02 0.00 -0.00 0.00 0.00 28.75 29.46 2i6a h GLU 224 CO 0.35 -0.02 0.18 1.79 -0.00 0.00 0.00 179.01 181.32 2i6a h THR 225 N -0.03 1.23 -0.56 -1.06 1.35 -1.97 0.66 112.91 112.54 2i6a h THR 225 Ca 0.10 -0.78 -0.07 0.00 -0.55 0.00 0.00 66.41 65.11 2i6a h THR 225 Cb 0.18 0.70 -0.02 0.00 -1.73 0.00 0.00 68.15 67.28 2i6a h THR 225 CO -0.22 0.29 0.06 -0.33 -0.25 0.00 0.00 175.52 175.07 2i6a h GLU 226 N 0.77 0.91 -0.22 4.72 5.08 -1.89 -1.71 114.58 122.24 2i6a h GLU 226 Ca 0.18 -0.23 -0.13 0.00 -1.00 0.00 0.00 59.36 58.17 2i6a h GLU 226 Cb 0.27 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 2i6a h GLU 226 CO -0.01 0.86 -0.42 0.00 -1.00 0.00 0.00 179.01 178.44 2i6a h ALA 227 N 1.21 0.86 -0.32 3.43 0.00 -0.56 -1.02 119.26 122.85 2i6a h ALA 227 Ca 0.17 -0.45 -0.11 0.00 0.00 0.00 0.00 54.91 54.52 2i6a h ALA 227 Cb 0.42 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2i6a h ALA 227 CO 0.01 0.65 -0.24 0.00 0.00 0.00 0.00 179.25 179.67 2i6a h ALA 228 N 1.11 0.46 -0.59 0.00 0.00 -0.61 -1.55 119.26 118.08 2i6a h ALA 228 Ca 0.03 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.48 2i6a h ALA 228 Cb 0.92 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2i6a h ALA 228 CO 0.08 0.44 0.05 1.15 0.00 0.00 0.00 179.25 180.96 2i6a h THR 229 N 0.49 1.26 -0.42 0.00 2.02 -1.30 -1.55 112.91 113.41 2i6a h THR 229 Ca 0.06 -1.05 -0.08 0.00 0.77 0.00 0.00 66.41 66.11 2i6a h THR 229 Cb 0.79 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.94 2i6a h THR 229 CO 0.06 0.38 -0.05 0.15 0.37 0.00 0.00 175.52 176.43 2i6a h PHE 230 N 0.92 0.77 -0.04 3.16 3.57 -1.05 -1.65 116.94 122.61 2i6a h PHE 230 Ca 0.18 -0.12 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 2i6a h PHE 230 Cb 0.47 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.00 2i6a h PHE 230 CO 0.03 0.75 -0.04 0.00 -2.23 0.00 0.00 178.31 176.83 2i6a h ALA 231 N 1.28 0.06 -0.38 2.41 0.00 -1.10 -1.92 119.26 119.60 2i6a h ALA 231 Ca 0.12 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2i6a h ALA 231 Cb 0.49 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2i6a h ALA 231 CO 0.03 -0.17 0.25 -0.09 0.00 0.00 0.00 179.25 179.27 2i6a h ARG 232 N -0.34 0.50 0.00 0.00 2.43 -1.18 0.10 114.38 115.88 2i6a h ARG 232 Ca 0.01 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 59.01 2i6a h ARG 232 Cb 0.52 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.94 2i6a h ARG 232 CO 0.01 0.33 -0.96 0.93 -1.51 0.00 0.00 179.97 178.78 2i6a h GLU 233 N 0.51 0.00 0.00 0.20 4.39 -1.30 -3.24 114.58 115.15 2i6a h GLU 233 Ca 0.14 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.84 2i6a h GLU 233 Cb -0.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.59 2i6a h GLU 233 CO -0.03 0.40 -0.35 1.04 -1.16 0.00 0.00 179.01 178.91 2i6a n GLN 234 N -3.06 0.21 -0.74 2.33 1.13 -0.73 -4.94 117.38 111.59 2i6a n GLN 234 Ca -0.04 0.10 0.00 0.00 -1.94 0.00 0.00 57.00 55.13 2i6a n GLN 234 Cb 0.78 -1.68 0.00 0.00 0.11 0.00 0.00 30.24 29.46 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 1.37 0.72 0.33 1.08 0.00 -0.23 -4.98 105.19 103.48 2i6a n GLY 235 Ca 0.05 -0.63 0.10 0.00 0.00 0.00 0.00 46.02 45.54 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 0.00 0.32 -5.26 1.61 -1.00 -1.34 -3.47 116.94 107.79 2i6a h PHE 236 Ca 0.00 0.01 -0.26 0.00 2.81 0.00 0.00 57.97 60.53 2i6a h PHE 236 Cb 0.14 -0.10 0.17 0.00 3.61 0.00 0.00 35.95 39.77 2i6a h PHE 236 CO 0.00 0.17 -0.75 0.39 -1.61 0.00 0.00 178.31 176.51 2i6a n GLU 237 N -4.47 -3.69 -3.65 1.51 1.02 -1.26 -5.01 120.64 105.08 2i6a n GLU 237 Ca 0.05 0.78 -0.03 0.00 -0.02 0.00 0.00 57.16 57.95 2i6a n GLU 237 Cb 0.26 -5.49 -0.07 0.00 -0.02 0.00 0.00 31.44 26.12 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 -3.34 0.00 -1.55 2.62 -1.32 -1.26 -5.01 115.64 105.77 2i6a s THR 238 Ca 0.24 0.00 0.16 0.00 -1.21 0.00 0.00 61.69 60.88 2i6a s THR 238 Cb -0.03 -1.00 0.02 0.00 -1.51 0.00 0.00 72.50 69.97 2i6a s THR 238 CO 0.67 0.00 0.87 0.29 -2.21 0.00 0.00 174.62 174.24 2i6a n LYS 239 N 2.03 1.63 -2.28 7.08 5.02 -1.26 -4.78 118.16 125.60 2i6a n LYS 239 Ca -0.12 -0.91 -0.43 0.00 -2.02 0.00 0.00 58.31 54.83 2i6a n LYS 239 Cb 0.57 -1.27 -0.02 0.00 -0.02 0.00 0.00 35.03 34.28 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 -1.80 6.42 0.23 4.39 -1.08 -1.26 -4.90 116.67 118.68 2i6a s ASP 240 Ca 0.14 1.19 -0.07 0.00 -0.52 0.00 0.00 52.55 53.30 2i6a s ASP 240 Cb 0.13 -2.54 0.41 0.00 -1.46 0.00 0.00 42.92 39.46 2i6a s ASP 240 CO 0.37 -1.30 1.69 -0.29 0.52 0.00 0.00 175.17 176.16 2i6a h ILE 241 N 6.25 0.55 -0.41 4.11 6.09 -1.98 0.26 117.51 132.37 2i6a h ILE 241 Ca -0.29 -0.09 -0.07 0.00 -1.37 0.00 0.00 64.86 63.04 2i6a h ILE 241 Cb 1.12 0.26 -0.02 0.00 0.47 0.00 0.00 36.82 38.65 2i6a h ILE 241 CO 1.04 0.05 -0.03 0.11 -3.07 0.00 0.00 178.15 176.25 2i6a h LYS 242 N 0.27 0.68 -0.26 2.19 1.57 -1.99 0.16 116.57 119.19 2i6a h LYS 242 Ca 0.38 -0.18 -0.11 0.00 -1.87 0.00 0.00 60.65 58.87 2i6a h LYS 242 Cb 0.63 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 2i6a h LYS 242 CO -0.48 0.72 -0.30 1.49 -0.57 0.00 0.00 179.45 180.31 2i6a h GLU 243 N 0.64 0.54 -0.24 3.15 4.57 -1.72 -1.93 114.58 119.58 2i6a h GLU 243 Ca 0.13 -0.23 -0.11 0.00 -1.18 0.00 0.00 59.36 57.96 2i6a h GLU 243 Cb 0.44 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.01 2i6a h GLU 243 CO 0.02 0.78 -0.29 0.82 -1.18 0.00 0.00 179.01 179.16 2i6a h ILE 244 N 0.46 1.31 -0.74 2.32 2.04 -0.29 -1.84 117.51 120.77 2i6a h ILE 244 Ca 0.06 -1.48 -0.00 0.00 1.00 0.00 0.00 64.86 64.44 2i6a h ILE 244 Cb 0.76 1.70 -0.04 0.00 -0.74 0.00 0.00 36.82 38.50 2i6a h ILE 244 CO 0.06 0.46 0.46 0.00 0.00 0.00 0.00 178.15 179.13 2i6a h ALA 245 N 0.66 1.41 0.01 1.87 0.00 -0.56 0.39 119.26 123.04 2i6a h ALA 245 Ca 0.03 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2i6a h ALA 245 Cb 0.87 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2i6a h ALA 245 CO 0.07 0.52 -0.00 -0.22 0.00 0.00 0.00 179.25 179.61 2i6a h LYS 246 N 1.02 -0.01 -0.24 0.00 3.64 -1.24 -0.35 116.57 119.39 2i6a h LYS 246 Ca 0.27 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.58 2i6a h LYS 246 Cb -0.06 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 2i6a h LYS 246 CO -0.05 0.47 -0.13 0.87 -2.27 0.00 0.00 179.45 178.33 2i6a h LYS 247 N -0.49 0.40 -0.57 1.90 1.57 -1.12 -2.32 116.57 115.94 2i6a h LYS 247 Ca -0.00 -0.11 -0.10 0.00 -1.87 0.00 0.00 60.65 58.57 2i6a h LYS 247 Cb 0.48 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.73 2i6a h LYS 247 CO 0.00 0.54 -0.04 1.15 -0.57 0.00 0.00 179.45 180.53 2i6a h THR 248 N 0.38 1.27 0.00 -0.16 2.02 -0.87 -2.80 112.91 112.75 2i6a h THR 248 Ca 0.07 -1.19 -0.04 0.00 0.77 0.00 0.00 66.41 66.02 2i6a h THR 248 Cb 0.46 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 2i6a h THR 248 CO 0.03 0.43 -0.18 -0.61 0.37 0.00 0.00 175.52 175.56 2i6a h GLN 249 N 0.93 0.00 -0.01 6.66 5.75 -0.53 -2.68 115.11 125.23 2i6a h GLN 249 Ca 0.16 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.66 2i6a h GLN 249 Cb 0.60 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.15 2i6a h GLN 249 CO 0.04 0.18 -0.07 0.00 -2.65 0.00 0.00 178.83 176.33 2i6a n ALA 250 N -2.32 2.72 -0.69 3.38 0.00 -0.99 -4.52 120.51 118.11 2i6a n ALA 250 Ca -0.02 -0.35 -0.31 0.00 0.00 0.00 0.00 53.44 52.77 2i6a n ALA 250 Cb 0.29 -1.27 0.16 0.00 0.00 0.00 0.00 19.45 18.63 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 -0.47 2.58 -4.71 0.00 4.77 -1.01 -4.82 117.00 113.34 2i6a n LEU 251 Ca 0.18 0.39 -0.42 0.00 -0.03 0.00 0.00 56.01 56.12 2i6a n LEU 251 Cb 0.29 -1.43 -0.03 0.00 -2.33 0.00 0.00 43.42 39.92 2i6a n LEU 251 CO 0.20 -2.45 1.41 -2.65 -1.33 0.00 0.00 177.39 172.58 2i6a n PRO 252 N -3.84 2.79 -5.21 3.23 -0.02 -1.26 -4.96 135.00 125.72 2i6a n PRO 252 Ca 0.11 1.01 -0.32 0.00 -2.02 0.00 0.00 63.50 62.28 2i6a n PRO 252 Cb 0.52 -2.87 -0.16 0.00 -0.02 0.00 0.00 33.50 30.97 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 1.71 2.68 -0.03 -0.52 2.20 -1.26 -3.87 119.74 120.64 2i6a s LYS 253 Ca 0.77 -0.88 -0.20 0.00 -0.36 0.00 0.00 55.97 55.31 2i6a s LYS 253 Cb -0.50 -2.22 -0.13 0.00 -1.51 0.00 0.00 37.83 33.47 2i6a s LYS 253 CO 0.34 0.35 0.84 1.98 -0.36 0.00 0.00 175.35 178.50 2i6a h MET 254 N 6.17 -0.40 -5.28 4.03 1.85 0.18 -3.42 114.93 118.06 2i6a h MET 254 Ca -0.30 0.03 -0.65 0.00 -0.61 0.00 0.00 59.70 58.17 2i6a h MET 254 Cb 1.19 0.09 -0.16 0.00 0.43 0.00 0.00 31.60 33.15 2i6a h MET 254 CO 0.48 -0.10 0.36 1.21 -0.40 0.00 0.00 176.91 178.46 2i6a s ASN 255 N -5.14 6.22 0.47 1.39 2.47 -1.26 -4.92 114.94 114.16 2i6a s ASN 255 Ca -0.11 -0.94 0.32 0.00 0.42 0.00 0.00 52.86 52.55 2i6a s ASN 255 Cb 0.01 -2.37 1.48 0.00 -1.45 0.00 0.00 41.25 38.92 2i6a s ASN 255 CO 0.39 -1.22 1.95 0.77 -3.72 0.00 0.00 177.10 175.27 2i6a h SER 256 N 9.32 0.00 0.09 -4.21 4.64 -1.97 -3.02 113.55 118.40 2i6a h SER 256 Ca -0.28 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.02 2i6a h SER 256 Cb 1.08 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.17 2i6a h SER 256 CO 1.10 0.00 -0.10 0.11 -0.87 0.00 0.00 176.83 177.07 2i6a h LYS 257 N 0.00 0.02 -6.42 4.77 1.57 -1.99 -3.40 116.57 111.12 2i6a h LYS 257 Ca 0.00 -0.00 -0.69 0.00 -1.87 0.00 0.00 60.65 58.09 2i6a h LYS 257 Cb 0.28 -0.00 -0.23 0.00 0.08 0.00 0.00 32.23 32.36 2i6a h LYS 257 CO 0.00 0.13 -0.78 1.03 -0.57 0.00 0.00 179.45 179.26 2i6a s ARG 258 N -4.83 2.35 0.03 3.15 0.52 -1.14 -5.11 118.95 113.92 2i6a s ARG 258 Ca -0.04 -0.80 -0.01 0.00 -0.52 0.00 0.00 55.73 54.35 2i6a s ARG 258 Cb 0.16 -2.31 -0.04 0.00 0.52 0.00 0.00 34.95 33.28 2i6a s ARG 258 CO 0.69 0.59 0.18 -1.14 0.02 0.00 0.00 175.30 175.64 2i6a s GLN 259 N -1.02 3.38 0.58 3.54 2.00 -1.26 -4.88 119.66 121.99 2i6a s GLN 259 Ca 0.13 -0.42 -0.17 0.00 -2.00 0.00 0.00 55.36 52.90 2i6a s GLN 259 Cb -0.11 -3.03 -0.04 0.00 0.80 0.00 0.00 33.01 30.64 2i6a s GLN 259 CO 0.03 0.63 1.10 0.50 -0.50 0.00 0.00 175.29 177.05 2i6a s ARG 260 N -2.25 3.24 -0.05 1.67 3.52 -1.26 -4.91 118.95 118.91 2i6a s ARG 260 Ca 0.31 1.43 0.04 0.00 -0.13 0.00 0.00 55.73 57.38 2i6a s ARG 260 Cb -0.13 -2.01 0.00 0.00 -1.56 0.00 0.00 34.95 31.26 2i6a s ARG 260 CO 0.23 -0.91 -0.17 0.42 -0.81 0.00 0.00 175.30 174.07 2i6a s ILE 261 N -2.11 1.41 -0.05 4.11 1.01 0.70 -4.19 121.20 122.09 2i6a s ILE 261 Ca 0.68 -0.68 0.04 0.00 0.00 0.00 0.00 60.65 60.69 2i6a s ILE 261 Cb -0.20 -1.23 -0.02 0.00 0.01 0.00 0.00 42.46 41.01 2i6a s ILE 261 CO 0.32 0.41 -0.17 -0.69 0.00 0.00 0.00 174.94 174.82 2i6a s VAL 262 N 0.22 2.84 -0.18 2.92 1.01 -0.67 0.32 120.40 126.86 2i6a s VAL 262 Ca -0.08 -0.80 -0.05 0.00 0.00 0.00 0.00 61.98 61.05 2i6a s VAL 262 Cb -0.13 -2.10 0.06 0.00 0.00 0.00 0.00 36.38 34.21 2i6a s VAL 262 CO 0.03 0.58 0.08 -0.63 0.00 0.00 0.00 175.10 175.17 2i6a s ILE 263 N -0.62 0.02 -0.24 2.22 1.01 0.46 -1.56 121.20 122.49 2i6a s ILE 263 Ca 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 60.65 60.49 2i6a s ILE 263 Cb -0.11 -0.66 0.03 0.00 0.01 0.00 0.00 42.46 41.73 2i6a s ILE 263 CO 0.01 -0.28 -0.08 -0.36 0.00 0.00 0.00 174.94 174.23 2i6a s PHE 264 N 2.09 3.07 0.29 3.97 0.08 0.02 -2.62 117.98 124.87 2i6a s PHE 264 Ca 0.02 -1.66 -0.23 0.00 0.12 0.00 0.00 56.93 55.18 2i6a s PHE 264 Cb -0.16 -2.03 -0.09 0.00 -0.57 0.00 0.00 43.02 40.16 2i6a s PHE 264 CO -0.09 -0.76 0.85 0.95 -0.10 0.00 0.00 175.22 176.07 2i6a s THR 265 N 1.30 4.37 -0.25 0.64 -4.23 -0.79 -0.60 115.64 116.08 2i6a s THR 265 Ca -0.01 1.58 0.12 0.00 -1.18 0.00 0.00 61.69 62.20 2i6a s THR 265 Cb -0.17 -3.93 0.46 0.00 1.34 0.00 0.00 72.50 70.20 2i6a s THR 265 CO -0.05 0.14 1.18 0.00 -0.54 0.00 0.00 174.62 175.35 2i6a n GLN 266 N 0.56 2.63 0.00 3.99 6.02 -1.23 -1.40 117.38 127.95 2i6a n GLN 266 Ca 0.00 -3.73 0.00 0.00 -0.01 0.00 0.00 57.00 53.26 2i6a n GLN 266 Cb 0.51 -1.88 0.00 0.00 1.02 0.00 0.00 30.24 29.89 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 -0.71 3.05 0.13 1.08 0.00 -1.26 -2.12 105.19 105.37 2i6a n GLY 267 Ca 0.30 -0.07 0.03 0.00 0.00 0.00 0.00 46.02 46.28 2i6a n GLY 267 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2i6a h ARG 268 N 0.00 0.00 -7.32 1.61 3.08 -2.01 -3.46 114.38 106.27 2i6a h ARG 268 Ca 0.00 0.00 -0.45 0.00 0.07 0.00 0.00 59.98 59.60 2i6a h ARG 268 Cb 0.00 0.00 0.17 0.00 0.08 0.00 0.00 29.97 30.22 2i6a h ARG 268 CO 0.00 0.41 0.16 -0.51 -1.07 0.00 0.00 179.97 178.95 2i6a s ASP 269 N -6.27 2.23 0.74 7.04 1.01 -0.90 -4.45 116.67 116.07 2i6a s ASP 269 Ca 0.03 1.21 -0.16 0.00 0.71 0.00 0.00 52.55 54.34 2i6a s ASP 269 Cb 0.08 -1.90 0.01 0.00 1.01 0.00 0.00 42.92 42.12 2i6a s ASP 269 CO 0.76 -3.38 0.95 0.47 0.21 0.00 0.00 175.17 174.17 2i6a n ASP 270 N -4.34 0.37 -4.86 0.27 8.00 -1.26 -4.07 116.55 110.65 2i6a n ASP 270 Ca 0.05 0.65 -0.34 0.00 0.71 0.00 0.00 54.79 55.85 2i6a n ASP 270 Cb 0.57 -1.40 -0.06 0.00 -0.02 0.00 0.00 41.12 40.21 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 -1.87 4.91 -0.17 -3.53 2.01 -0.42 -3.47 115.64 113.11 2i6a s THR 271 Ca 0.72 0.64 0.01 0.00 0.31 0.00 0.00 61.69 63.37 2i6a s THR 271 Cb -0.34 -3.68 0.01 0.00 0.01 0.00 0.00 72.50 68.51 2i6a s THR 271 CO 0.51 0.12 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.75 2i6a s ILE 272 N -1.60 2.28 -0.17 1.82 1.01 0.23 -0.82 121.20 123.94 2i6a s ILE 272 Ca 0.41 -0.88 -0.02 0.00 0.00 0.00 0.00 60.65 60.17 2i6a s ILE 272 Cb -0.13 -1.95 -0.01 0.00 0.01 0.00 0.00 42.46 40.38 2i6a s ILE 272 CO 0.20 0.53 -0.10 -0.32 0.00 0.00 0.00 174.94 175.24 2i6a s MET 273 N 1.10 3.33 -0.06 2.79 1.75 -0.33 -0.80 119.30 127.07 2i6a s MET 273 Ca 0.00 -0.68 0.03 0.00 -1.25 0.00 0.00 55.69 53.80 2i6a s MET 273 Cb -0.14 -2.78 -0.02 0.00 2.84 0.00 0.00 34.83 34.73 2i6a s MET 273 CO -0.07 -0.02 -0.16 0.00 -0.65 0.00 0.00 175.02 174.13 2i6a s ALA 274 N 0.95 2.58 0.23 4.11 0.00 -0.60 -0.52 121.76 128.50 2i6a s ALA 274 Ca -0.02 -0.98 0.01 0.00 0.00 0.00 0.00 51.96 50.97 2i6a s ALA 274 Cb -0.15 -0.96 -0.05 0.00 0.00 0.00 0.00 23.12 21.97 2i6a s ALA 274 CO -0.01 0.49 0.10 0.95 0.00 0.00 0.00 175.76 177.29 2i6a s THR 275 N -0.49 0.38 0.26 0.00 -4.23 0.53 -1.67 115.64 110.42 2i6a s THR 275 Ca 0.06 -1.99 -0.02 0.00 -1.18 0.00 0.00 61.69 58.56 2i6a s THR 275 Cb -0.12 -2.52 0.27 0.00 1.34 0.00 0.00 72.50 71.48 2i6a s THR 275 CO 0.02 -0.07 1.67 -0.08 -0.54 0.00 0.00 174.62 175.61 2i6a h GLU 276 N 2.51 0.24 0.62 3.99 4.81 -1.93 -2.90 114.58 121.91 2i6a h GLU 276 Ca -0.37 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 58.81 2i6a h GLU 276 Cb 1.24 -0.05 0.01 0.00 0.63 0.00 0.00 28.75 30.57 2i6a h GLU 276 CO 0.59 0.16 -0.30 0.77 -0.73 0.00 0.00 179.01 179.49 2i6a h SER 277 N 0.24 -0.71 -1.83 1.04 0.02 -1.96 -3.49 113.55 106.87 2i6a h SER 277 Ca 0.47 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.41 2i6a h SER 277 Cb 0.88 0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.59 2i6a h SER 277 CO -0.58 -0.48 -0.00 -0.62 -1.14 0.00 0.00 176.83 174.00 2i6a n GLU 278 N -4.37 0.16 -4.46 3.45 1.02 -1.10 -5.15 120.64 110.19 2i6a n GLU 278 Ca -0.10 -0.50 -0.33 0.00 -0.02 0.00 0.00 57.16 56.21 2i6a n GLU 278 Cb 0.33 0.52 -0.16 0.00 -0.02 0.00 0.00 31.44 32.11 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 -2.61 2.07 0.10 2.62 1.01 -1.26 -0.35 120.40 121.99 2i6a s VAL 279 Ca 0.05 -0.96 0.09 0.00 0.00 0.00 0.00 61.98 61.16 2i6a s VAL 279 Cb -0.00 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.50 2i6a s VAL 279 CO 0.03 0.55 -0.23 -0.89 0.00 0.00 0.00 175.10 174.56 2i6a s THR 280 N 1.00 1.93 0.01 3.92 2.01 0.32 -4.98 115.64 119.85 2i6a s THR 280 Ca -0.02 -1.56 0.02 0.00 0.31 0.00 0.00 61.69 60.44 2i6a s THR 280 Cb -0.15 -1.71 -0.04 0.00 0.01 0.00 0.00 72.50 70.61 2i6a s THR 280 CO -0.06 0.06 0.01 0.00 -0.69 0.00 0.00 174.62 173.94 2i6a s ALA 281 N -1.05 3.30 -0.12 7.40 0.00 -1.26 -1.19 121.76 128.84 2i6a s ALA 281 Ca 0.10 -0.96 -0.01 0.00 0.00 0.00 0.00 51.96 51.09 2i6a s ALA 281 Cb -0.10 -1.34 0.03 0.00 0.00 0.00 0.00 23.12 21.71 2i6a s ALA 281 CO 0.04 0.65 -0.04 -0.06 0.00 0.00 0.00 175.76 176.36 2i6a s PHE 282 N -1.11 1.29 0.37 0.00 0.08 0.00 -4.93 117.98 113.67 2i6a s PHE 282 Ca 0.20 -0.68 -0.27 0.00 0.12 0.00 0.00 56.93 56.30 2i6a s PHE 282 Cb -0.12 -1.13 -0.10 0.00 -0.57 0.00 0.00 43.02 41.11 2i6a s PHE 282 CO 0.11 -0.50 1.32 0.00 -0.10 0.00 0.00 175.22 176.05 2i6a s ALA 283 N 1.77 3.40 0.54 5.36 0.00 -1.26 -1.30 121.76 130.28 2i6a s ALA 283 Ca 0.04 1.27 -0.11 0.00 0.00 0.00 0.00 51.96 53.16 2i6a s ALA 283 Cb -0.13 -3.49 -0.05 0.00 0.00 0.00 0.00 23.12 19.45 2i6a s ALA 283 CO -0.07 -0.75 0.94 0.08 0.00 0.00 0.00 175.76 175.96 2i6a s VAL 284 N -1.19 4.73 0.26 0.00 1.01 -1.26 -4.93 120.40 119.01 2i6a s VAL 284 Ca 0.53 0.77 -0.31 0.00 0.00 0.00 0.00 61.98 62.97 2i6a s VAL 284 Cb -0.39 -3.82 -0.12 0.00 0.00 0.00 0.00 36.38 32.05 2i6a s VAL 284 CO 0.52 -0.92 1.65 -0.76 0.00 0.00 0.00 175.10 175.58 2i6a s LEU 285 N -4.71 4.35 0.00 3.92 1.43 -1.26 -4.79 118.68 117.62 2i6a s LEU 285 Ca 0.54 2.92 0.00 0.00 -1.03 0.00 0.00 54.13 56.56 2i6a s LEU 285 Cb -0.11 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.49 2i6a s LEU 285 CO 0.45 -0.94 0.41 0.47 0.23 0.00 0.00 176.35 176.97 2i6a n ASP 286 N 2.88 0.00 -1.62 2.29 8.00 -1.26 -4.48 116.55 122.36 2i6a n ASP 286 Ca 0.11 -1.32 -0.02 0.00 0.71 0.00 0.00 54.79 54.27 2i6a n ASP 286 Cb 0.36 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.44 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 2.77 1.10 -0.15 -1.24 10.64 -1.26 -4.91 117.38 124.33 2i6a n GLN 287 Ca 0.00 -0.17 -0.06 0.00 -1.83 0.00 0.00 57.00 54.94 2i6a n GLN 287 Cb 0.00 -1.20 0.06 0.00 -0.86 0.00 0.00 30.24 28.24 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 1.71 -1.95 -0.45 2.61 8.00 -1.26 -3.54 116.55 121.67 2i6a n ASP 288 Ca 0.07 -0.19 -0.01 0.00 0.71 0.00 0.00 54.79 55.37 2i6a n ASP 288 Cb 0.54 -0.28 -0.01 0.00 -0.02 0.00 0.00 41.12 41.35 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 -1.59 -1.62 0.00 -1.24 10.64 -1.26 -4.70 117.38 117.60 2i6a n GLN 289 Ca 0.03 0.13 0.12 0.00 -1.83 0.00 0.00 57.00 55.44 2i6a n GLN 289 Cb 0.13 -3.46 0.54 0.00 -0.86 0.00 0.00 30.24 26.59 2i6a n GLN 289 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59 2i6a n LYS 290 N -0.41 0.08 0.00 2.61 -0.00 -1.23 -4.85 118.16 114.36 2i6a n LYS 290 Ca -0.01 0.08 0.00 0.00 -0.00 0.00 0.00 58.31 58.38 2i6a n LYS 290 Cb 0.09 -1.50 0.00 0.00 -0.00 0.00 0.00 35.03 33.62 2i6a n LYS 290 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 2i6a n GLU 291 N -1.45 0.00 -2.02 -1.58 0.28 -1.26 -3.37 120.64 111.24 2i6a n GLU 291 Ca 0.07 0.00 -0.27 0.00 -0.16 0.00 0.00 57.16 56.80 2i6a n GLU 291 Cb 0.26 0.00 -0.07 0.00 1.43 0.00 0.00 31.44 33.06 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 1.75 -3.87 3.84 5.41 -1.26 -4.83 119.36 120.40 2i6a n ILE 292 Ca 0.00 -1.82 -0.30 0.00 1.00 0.00 0.00 62.75 61.63 2i6a n ILE 292 Cb 0.00 -2.16 -0.15 0.00 -0.71 0.00 0.00 39.64 36.62 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 11.65 1.36 -0.85 1.39 -4.36 -1.22 -4.99 121.20 124.19 2i6a s ILE 293 Ca 0.70 -1.46 -0.24 0.00 -0.26 0.00 0.00 60.65 59.39 2i6a s ILE 293 Cb -0.01 -1.87 -0.20 0.00 1.25 0.00 0.00 42.46 41.63 2i6a s ILE 293 CO 0.14 -0.41 2.47 -0.67 0.24 0.00 0.00 174.94 176.70 2i6a n ASP 294 N 4.68 0.60 -0.23 4.36 4.64 -1.26 -4.80 116.55 124.53 2i6a n ASP 294 Ca -0.05 -0.40 0.03 0.00 -1.38 0.00 0.00 54.79 53.00 2i6a n ASP 294 Cb 0.43 -1.10 0.15 0.00 -1.04 0.00 0.00 41.12 39.56 2i6a n ASP 294 CO 0.00 0.00 0.00 0.74 -0.82 0.00 0.00 177.20 177.12 2i6a h THR 295 N 7.66 0.64 0.24 5.18 2.02 -1.97 0.47 112.91 127.15 2i6a h THR 295 Ca -0.07 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 66.98 2i6a h THR 295 Cb 1.21 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2i6a h THR 295 CO 1.33 0.06 -0.12 0.78 0.37 0.00 0.00 175.52 177.95 2i6a h ASN 296 N 0.35 -0.29 -0.41 4.18 -0.26 -1.99 0.13 115.58 117.30 2i6a h ASN 296 Ca 0.37 0.01 0.02 0.00 -0.56 0.00 0.00 56.30 56.15 2i6a h ASN 296 Cb 0.57 0.08 -0.02 0.00 -1.06 0.00 0.00 38.32 37.89 2i6a h ASN 296 CO -0.41 -0.20 0.27 1.23 -1.06 0.00 0.00 177.43 177.25 2i6a h GLY 297 N -0.33 0.53 0.91 2.83 0.00 -1.80 -0.97 103.07 104.24 2i6a h GLY 297 Ca -0.03 -0.19 -0.06 0.00 0.00 0.00 0.00 47.33 47.05 2i6a h GLY 297 CO 0.05 0.17 -0.04 0.00 0.00 0.00 0.00 176.54 176.72 2i6a h ALA 298 N 1.76 0.46 -0.69 3.60 0.00 0.40 -1.97 119.26 122.81 2i6a h ALA 298 Ca 0.16 -0.27 0.06 0.00 0.00 0.00 0.00 54.91 54.86 2i6a h ALA 298 Cb 0.05 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.66 2i6a h ALA 298 CO -0.04 0.26 0.39 0.78 0.00 0.00 0.00 179.25 180.64 2i6a h GLY 299 N 0.41 1.02 1.03 0.00 0.00 0.54 -0.40 103.07 105.67 2i6a h GLY 299 Ca 0.09 -0.28 -0.08 0.00 0.00 0.00 0.00 47.33 47.06 2i6a h GLY 299 CO 0.03 0.18 0.01 -0.55 0.00 0.00 0.00 176.54 176.20 2i6a h ASP 300 N 0.73 0.91 -0.50 0.19 3.32 -1.01 -2.53 116.42 117.53 2i6a h ASP 300 Ca 0.31 -0.30 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 2i6a h ASP 300 Cb 0.18 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 2i6a h ASP 300 CO -0.18 0.99 -0.12 0.00 -1.72 0.00 0.00 179.24 178.21 2i6a h ALA 301 N 0.95 0.80 -0.04 3.45 0.00 -1.00 -1.34 119.26 122.08 2i6a h ALA 301 Ca 0.15 -0.35 0.03 0.00 0.00 0.00 0.00 54.91 54.73 2i6a h ALA 301 Cb 0.52 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 2i6a h ALA 301 CO 0.03 0.66 -0.51 0.35 0.00 0.00 0.00 179.25 179.78 2i6a h PHE 302 N 0.87 -1.50 -0.98 0.00 3.57 -0.97 0.64 116.94 118.58 2i6a h PHE 302 Ca 0.13 0.05 0.06 0.00 3.53 0.00 0.00 57.97 61.74 2i6a h PHE 302 Cb 0.68 0.66 -0.06 0.00 2.79 0.00 0.00 35.95 40.01 2i6a h PHE 302 CO 0.04 -0.55 0.64 0.28 -2.23 0.00 0.00 178.31 176.49 2i6a h VAL 303 N -0.62 1.11 -0.27 1.41 2.07 -1.22 -0.59 116.25 118.14 2i6a h VAL 303 Ca 0.03 -0.40 0.03 0.00 0.82 0.00 0.00 66.70 67.18 2i6a h VAL 303 Cb 0.70 -0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 2i6a h VAL 303 CO -0.38 0.22 0.08 1.23 0.02 0.00 0.00 177.57 178.74 2i6a h GLY 304 N 1.18 0.33 0.70 2.17 0.00 -0.89 0.15 103.07 106.70 2i6a h GLY 304 Ca 0.41 -0.04 0.02 0.00 0.00 0.00 0.00 47.33 47.72 2i6a h GLY 304 CO -0.16 0.02 -0.12 -1.33 0.00 0.00 0.00 176.54 174.94 2i6a h GLY 305 N 0.19 -0.16 0.73 4.60 0.00 -0.25 0.79 103.07 108.96 2i6a h GLY 305 Ca 0.12 0.15 0.06 0.00 0.00 0.00 0.00 47.33 47.65 2i6a h GLY 305 CO -0.14 -0.13 0.46 -2.75 0.00 0.00 0.00 176.54 173.98 2i6a h PHE 306 N -0.22 0.85 -0.59 5.60 3.04 -0.86 -2.25 116.94 122.52 2i6a h PHE 306 Ca 0.04 0.03 -0.10 0.00 3.98 0.00 0.00 57.97 61.92 2i6a h PHE 306 Cb 0.27 -0.27 -0.02 0.00 2.56 0.00 0.00 35.95 38.48 2i6a h PHE 306 CO -0.18 0.43 -0.02 -0.07 -2.02 0.00 0.00 178.31 176.45 2i6a h LEU 307 N 0.85 1.03 -0.73 0.59 3.38 -0.14 -1.96 115.31 118.33 2i6a h LEU 307 Ca 0.33 -0.30 0.16 0.00 0.09 0.00 0.00 57.88 58.17 2i6a h LEU 307 Cb 0.16 -0.28 -0.11 0.00 0.09 0.00 0.00 40.66 40.51 2i6a h LEU 307 CO -0.17 1.09 0.14 0.77 0.09 0.00 0.00 178.44 180.36 2i6a h SER 308 N 0.96 -0.07 0.05 -0.43 4.64 -0.24 -2.18 113.55 116.28 2i6a h SER 308 Ca 0.17 0.16 -0.08 0.00 -0.47 0.00 0.00 61.79 61.57 2i6a h SER 308 Cb 0.58 0.23 0.01 0.00 -0.31 0.00 0.00 62.40 62.90 2i6a h SER 308 CO 0.03 -0.07 -0.34 1.56 -0.87 0.00 0.00 176.83 177.14 2i6a h GLN 309 N 0.23 0.13 -0.94 4.77 1.08 -1.40 -3.35 115.11 115.63 2i6a h GLN 309 Ca 0.41 -0.21 0.28 0.00 -1.45 0.00 0.00 58.65 57.67 2i6a h GLN 309 Cb 0.71 0.08 -0.14 0.00 -0.05 0.00 0.00 27.48 28.08 2i6a h GLN 309 CO -0.54 1.09 0.41 1.25 -0.95 0.00 0.00 178.83 180.08 2i6a h LEU 310 N -0.71 0.27 -1.63 1.46 7.12 -1.27 0.18 115.31 120.73 2i6a h LEU 310 Ca -0.06 0.19 0.08 0.00 0.13 0.00 0.00 57.88 58.23 2i6a h LEU 310 Cb 1.25 0.20 -0.03 0.00 -0.53 0.00 0.00 40.66 41.54 2i6a h LEU 310 CO 0.06 -0.13 0.38 1.62 -0.13 0.00 0.00 178.44 180.24 2i6a h VAL 311 N 0.28 0.93 -0.85 1.05 3.04 -1.52 -1.34 116.25 117.83 2i6a h VAL 311 Ca 0.64 -0.15 -0.46 0.00 -1.01 0.00 0.00 66.70 65.72 2i6a h VAL 311 Cb 1.38 0.46 -0.27 0.00 -2.01 0.00 0.00 31.29 30.86 2i6a h VAL 311 CO -0.63 0.08 0.49 -1.54 -1.01 0.00 0.00 177.57 174.96 2i6a n SER 312 N -4.47 3.86 -1.75 3.17 3.41 0.64 -4.94 113.62 113.53 2i6a n SER 312 Ca 0.09 -3.67 -0.18 0.00 -0.26 0.00 0.00 58.87 54.84 2i6a n SER 312 Cb 0.32 -0.80 -0.06 0.00 -0.26 0.00 0.00 64.21 63.41 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 -1.12 -4.97 -4.69 4.04 8.00 -0.51 -4.96 116.55 112.35 2i6a n ASP 313 Ca 0.54 0.35 -0.31 0.00 0.71 0.00 0.00 54.79 56.08 2i6a n ASP 313 Cb 1.43 -4.37 0.15 0.00 -0.02 0.00 0.00 41.12 38.32 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 -3.93 1.22 0.75 -1.24 -0.14 -1.18 -4.95 119.74 110.27 2i6a s LYS 314 Ca 0.00 1.47 -0.13 0.00 -1.36 0.00 0.00 55.97 55.95 2i6a s LYS 314 Cb 0.00 -1.76 0.05 0.00 -1.68 0.00 0.00 37.83 34.44 2i6a s LYS 314 CO 0.00 -2.46 1.13 -2.14 -0.76 0.00 0.00 175.35 171.12 2i6a s PRO 315 N -4.70 2.21 0.21 -1.68 0.02 -1.26 -4.77 135.00 125.03 2i6a s PRO 315 Ca 0.66 1.44 -0.10 0.00 0.02 0.00 0.00 61.00 63.02 2i6a s PRO 315 Cb -0.22 -1.87 0.24 0.00 0.02 0.00 0.00 34.50 32.67 2i6a s PRO 315 CO 0.58 -1.72 1.79 -0.07 -0.33 0.00 0.00 177.00 177.25 2i6a h LEU 316 N -0.68 0.47 -2.08 -5.54 3.38 -1.99 -0.31 115.31 108.56 2i6a h LEU 316 Ca -0.45 0.04 0.06 0.00 0.09 0.00 0.00 57.88 57.62 2i6a h LEU 316 Cb 1.26 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2i6a h LEU 316 CO 0.50 0.30 0.17 0.74 0.09 0.00 0.00 178.44 180.24 2i6a h THR 317 N 0.61 0.77 0.07 0.22 2.02 -1.99 0.14 112.91 114.75 2i6a h THR 317 Ca 0.29 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 67.31 2i6a h THR 317 Cb 0.22 0.88 0.02 0.00 -1.74 0.00 0.00 68.15 67.53 2i6a h THR 317 CO -0.20 0.00 -0.69 -0.08 0.37 0.00 0.00 175.52 174.91 2i6a h GLU 318 N 0.00 0.35 -0.28 6.66 4.57 -1.45 -2.20 114.58 122.22 2i6a h GLU 318 Ca 0.10 -0.47 0.06 0.00 -1.18 0.00 0.00 59.36 57.88 2i6a h GLU 318 Cb 0.44 0.15 -0.06 0.00 -0.16 0.00 0.00 28.75 29.12 2i6a h GLU 318 CO -0.00 1.17 -0.14 0.00 -1.18 0.00 0.00 179.01 178.86 2i6a h ILE 320 N -0.10 1.17 -0.52 0.00 2.04 -0.81 -0.08 117.51 119.21 2i6a h ILE 320 Ca 0.15 -0.37 -0.05 0.00 1.00 0.00 0.00 64.86 65.60 2i6a h ILE 320 Cb 0.32 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.66 2i6a h ILE 320 CO -0.35 0.18 0.15 -0.09 0.00 0.00 0.00 178.15 178.04 2i6a h ARG 321 N 0.86 0.82 -0.35 2.37 2.43 -0.63 -0.53 114.38 119.36 2i6a h ARG 321 Ca 0.23 -0.19 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 2i6a h ARG 321 Cb -0.05 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.37 2i6a h ARG 321 CO -0.04 0.77 0.01 0.00 -1.51 0.00 0.00 179.97 179.20 2i6a h ALA 322 N 1.02 0.47 -0.14 2.80 0.00 -0.73 -2.14 119.26 120.54 2i6a h ALA 322 Ca 0.17 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 54.89 2i6a h ALA 322 Cb 0.30 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 2i6a h ALA 322 CO -0.00 0.22 -0.28 0.78 0.00 0.00 0.00 179.25 179.97 2i6a h GLY 323 N 0.42 -0.33 1.82 0.00 0.00 -0.63 -0.40 103.07 103.96 2i6a h GLY 323 Ca 0.10 0.34 0.01 0.00 0.00 0.00 0.00 47.33 47.78 2i6a h GLY 323 CO 0.02 -0.21 0.10 0.45 0.00 0.00 0.00 176.54 176.90 2i6a h HIS 324 N -0.34 0.16 0.47 5.60 -0.00 -1.04 -1.69 115.15 118.31 2i6a h HIS 324 Ca 0.10 0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.45 2i6a h HIS 324 Cb 0.50 -0.05 0.00 0.00 -0.00 0.00 0.00 27.41 27.86 2i6a h HIS 324 CO -0.37 0.10 -0.23 -0.92 -0.00 0.00 0.00 177.93 176.51 2i6a h TYR 325 N 0.17 -0.59 -0.82 2.45 3.20 -0.61 -2.99 116.97 117.78 2i6a h TYR 325 Ca 0.06 -0.01 0.20 0.00 3.14 0.00 0.00 58.73 62.12 2i6a h TYR 325 Cb 0.03 0.19 -0.14 0.00 1.54 0.00 0.00 36.73 38.35 2i6a h TYR 325 CO -0.00 -0.37 0.05 0.00 -1.64 0.00 0.00 178.16 176.20 2i6a h ALA 326 N -1.24 0.94 -0.03 1.82 0.00 -0.96 0.18 119.26 119.96 2i6a h ALA 326 Ca -0.06 0.25 0.01 0.00 0.00 0.00 0.00 54.91 55.11 2i6a h ALA 326 Cb 0.49 0.43 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 2i6a h ALA 326 CO 0.11 -0.45 0.07 0.00 0.00 0.00 0.00 179.25 178.97 2i6a h ALA 327 N 1.77 1.34 0.02 0.00 0.00 -1.37 -1.54 119.26 119.47 2i6a h ALA 327 Ca 0.47 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 55.08 2i6a h ALA 327 Cb 0.88 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 2i6a h ALA 327 CO -0.71 -0.08 -1.71 0.66 0.00 0.00 0.00 179.25 177.41 2i6a h SER 328 N 0.00 0.05 0.00 0.00 4.64 -0.50 -3.43 113.55 114.30 2i6a h SER 328 Ca 0.02 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 2i6a h SER 328 Cb 0.15 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 2i6a h SER 328 CO -0.00 1.10 -0.05 0.40 -0.87 0.00 0.00 176.83 177.40 2i6a h ILE 329 N 0.01 0.00 -0.11 0.95 1.08 -1.03 -3.43 117.51 114.98 2i6a h ILE 329 Ca -0.29 -0.13 -0.01 0.00 -0.39 0.00 0.00 64.86 64.04 2i6a h ILE 329 Cb 2.01 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 35.76 2i6a h ILE 329 CO 0.08 0.00 0.04 -0.63 -0.69 0.00 0.00 178.15 176.95 2i6a s ILE 330 N -1.14 3.02 -0.28 -0.67 -1.09 -0.63 -4.87 121.20 115.53 2i6a s ILE 330 Ca -0.02 -0.03 -0.02 0.00 -2.23 0.00 0.00 60.65 58.36 2i6a s ILE 330 Cb 0.00 -3.95 0.04 0.00 -1.58 0.00 0.00 42.46 36.98 2i6a s ILE 330 CO 0.02 -0.03 -0.02 -0.63 -1.23 0.00 0.00 174.94 173.05 2i6a s ILE 331 N 17.16 2.96 0.63 2.92 1.01 -1.26 -4.82 121.20 139.80 2i6a s ILE 331 Ca 0.82 -1.28 -0.15 0.00 0.00 0.00 0.00 60.65 60.04 2i6a s ILE 331 Cb -0.05 -2.64 -0.01 0.00 0.01 0.00 0.00 42.46 39.76 2i6a s ILE 331 CO 0.18 -0.02 1.09 -0.13 0.00 0.00 0.00 174.94 176.06 2i6a s ARG 332 N 1.27 2.99 -0.04 2.79 0.52 -1.26 -5.06 118.95 120.17 2i6a s ARG 332 Ca -0.04 1.32 -0.14 0.00 -0.52 0.00 0.00 55.73 56.35 2i6a s ARG 332 Cb -0.19 -1.98 0.03 0.00 0.52 0.00 0.00 34.95 33.33 2i6a s ARG 332 CO -0.02 -1.09 0.32 1.03 0.02 0.00 0.00 175.30 175.56 2i6a s ARG 333 N -4.09 0.62 0.35 3.54 1.81 -1.26 -4.75 118.95 115.17 2i6a s ARG 333 Ca 0.66 -0.04 -0.20 0.00 -1.72 0.00 0.00 55.73 54.43 2i6a s ARG 333 Cb -0.19 0.28 -0.10 0.00 -0.45 0.00 0.00 34.95 34.49 2i6a s ARG 333 CO 0.40 -0.16 0.85 0.99 -0.68 0.00 0.00 175.30 176.70 2i6a s THR 334 N -1.00 4.48 0.00 0.02 2.01 -1.26 -4.03 115.64 115.86 2i6a s THR 334 Ca -0.11 1.33 0.00 0.00 0.31 0.00 0.00 61.69 63.22 2i6a s THR 334 Cb -0.05 -3.69 0.00 0.00 0.01 0.00 0.00 72.50 68.77 2i6a s THR 334 CO 0.04 -0.15 0.00 0.61 -0.69 0.00 0.00 174.62 174.43 2i6a n GLY 335 N -0.22 0.56 0.04 4.40 0.00 -1.26 -4.98 105.19 103.73 2i6a n GLY 335 Ca 0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.48 3.33 -0.03 0.00 -4.23 -1.26 -5.07 115.64 106.89 2i6a s THR 337 Ca -0.01 0.43 -0.03 0.00 -1.18 0.00 0.00 61.69 60.91 2i6a s THR 337 Cb 0.00 -3.06 -0.04 0.00 1.34 0.00 0.00 72.50 70.74 2i6a s THR 337 CO 0.02 -0.56 0.14 -0.36 -0.54 0.00 0.00 174.62 173.32 2i6a s PHE 338 N -3.02 3.48 0.51 3.99 2.99 -1.26 -5.07 117.98 119.59 2i6a s PHE 338 Ca 0.61 0.35 -0.22 0.00 0.00 0.00 0.00 56.93 57.66 2i6a s PHE 338 Cb -0.16 -1.83 -0.06 0.00 0.00 0.00 0.00 43.02 40.98 2i6a s PHE 338 CO 0.55 0.63 1.27 -2.14 -0.00 0.00 0.00 175.22 175.54 2i6a s PRO 339 N -1.65 3.41 0.32 0.24 0.02 -1.26 -4.90 135.00 131.18 2i6a s PRO 339 Ca 0.23 2.04 0.00 0.00 0.02 0.00 0.00 61.00 63.29 2i6a s PRO 339 Cb -0.12 -2.32 0.54 0.00 0.02 0.00 0.00 34.50 32.62 2i6a s PRO 339 CO 0.14 -0.91 1.99 0.93 -0.33 0.00 0.00 177.00 178.81 2i6a h GLU 340 N 1.72 0.96 -4.82 5.54 5.08 -1.99 -3.42 114.58 117.64 2i6a h GLU 340 Ca -0.50 -0.06 -0.46 0.00 -1.00 0.00 0.00 59.36 57.34 2i6a h GLU 340 Cb 1.28 -0.22 -0.31 0.00 0.50 0.00 0.00 28.75 30.00 2i6a h GLU 340 CO 0.59 0.63 -0.80 0.15 -1.00 0.00 0.00 179.01 178.58 2i6a s LYS 341 N -5.83 1.18 0.44 2.33 -0.14 -1.26 -5.15 119.74 111.31 2i6a s LYS 341 Ca -0.11 -0.40 -0.05 0.00 -1.36 0.00 0.00 55.97 54.06 2i6a s LYS 341 Cb 0.18 -1.07 0.08 0.00 -1.68 0.00 0.00 37.83 35.33 2i6a s LYS 341 CO 0.78 0.16 0.18 -0.35 -0.76 0.00 0.00 175.35 175.36 2i6a n PRO 342 N 3.21 -0.24 -0.70 -1.68 -0.04 -1.26 -4.96 135.00 129.33 2i6a n PRO 342 Ca -0.18 -0.30 -0.01 0.00 -0.04 0.00 0.00 63.50 62.97 2i6a n PRO 342 Cb 0.54 -0.67 -0.02 0.00 -0.04 0.00 0.00 33.50 33.31 2i6a n PRO 342 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2i6a n ASP 343 N -0.95 -0.17 -0.22 3.54 2.03 -1.26 -4.97 116.55 114.56 2i6a n ASP 343 Ca 0.03 -1.48 -0.07 0.00 0.52 0.00 0.00 54.79 53.78 2i6a n ASP 343 Cb 0.12 0.02 0.06 0.00 -0.72 0.00 0.00 41.12 40.60 2i6a n ASP 343 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 2i6a h PHE 344 N 0.08 1.13 0.00 -0.67 3.57 -2.07 -3.57 116.94 115.41 2i6a h PHE 344 Ca -0.16 -0.16 0.00 0.00 3.53 0.00 0.00 57.97 61.18 2i6a h PHE 344 Cb 1.23 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 39.66 2i6a h PHE 344 CO -0.17 0.96 0.00 0.72 -2.23 0.00 0.00 178.31 177.59