#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i6z h GLU 5 N 0.00 0.06 -0.22 -1.46 4.81 -2.03 -2.33 114.58 113.41 3i6z h GLU 5 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3i6z h GLU 5 Cb 0.00 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.37 3i6z h GLU 5 CO 0.00 0.13 0.00 1.28 -0.73 0.00 0.00 179.01 179.69 3i6z n LEU 6 N -4.42 1.50 -4.32 1.64 4.77 -1.26 -4.79 117.00 110.12 3i6z n LEU 6 Ca -0.02 -0.69 -0.34 0.00 -0.03 0.00 0.00 56.01 54.93 3i6z n LEU 6 Cb 0.17 -0.14 -0.14 0.00 -2.33 0.00 0.00 43.42 40.97 3i6z n LEU 6 CO 0.35 0.35 -0.44 -0.22 -1.33 0.00 0.00 177.39 176.10 3i6z s LEU 7 N -1.29 2.70 -0.04 2.23 2.96 -0.88 -0.14 118.68 124.22 3i6z s LEU 7 Ca 0.26 -0.39 0.02 0.00 -0.22 0.00 0.00 54.13 53.80 3i6z s LEU 7 Cb 0.14 -1.64 0.02 0.00 0.50 0.00 0.00 46.19 45.21 3i6z s LEU 7 CO 0.20 0.08 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.56 3i6z s VAL 8 N 0.83 0.66 -0.23 1.68 1.01 -0.58 -4.80 120.40 118.97 3i6z s VAL 8 Ca -0.04 -0.22 -0.14 0.00 0.00 0.00 0.00 61.98 61.58 3i6z s VAL 8 Cb -0.15 -0.64 -0.04 0.00 0.00 0.00 0.00 36.38 35.55 3i6z s VAL 8 CO 0.00 0.24 0.32 0.21 0.00 0.00 0.00 175.10 175.87 3i6z s ASN 9 N 0.67 6.28 0.45 3.32 2.47 -1.26 -1.08 114.94 125.79 3i6z s ASN 9 Ca -0.10 0.32 0.06 0.00 0.42 0.00 0.00 52.86 53.56 3i6z s ASN 9 Cb -0.13 -2.19 -0.03 0.00 -1.45 0.00 0.00 41.25 37.45 3i6z s ASN 9 CO 0.01 -0.06 0.17 0.42 -3.72 0.00 0.00 177.10 173.92 3i6z s THR 10 N 1.46 1.96 -0.01 -5.21 -4.23 -0.56 -4.89 115.64 104.16 3i6z s THR 10 Ca 0.14 -1.74 0.30 0.00 -1.18 0.00 0.00 61.69 59.20 3i6z s THR 10 Cb -0.15 -2.70 0.31 0.00 1.34 0.00 0.00 72.50 71.30 3i6z s THR 10 CO 0.08 0.00 1.90 0.11 -0.54 0.00 0.00 174.62 176.17 3i6z h LYS 11 N 1.33 0.00 -0.01 3.99 1.57 -1.93 -1.58 116.57 119.95 3i6z h LYS 11 Ca -0.42 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.36 3i6z h LYS 11 Cb 1.27 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.58 3i6z h LYS 11 CO 0.70 0.00 -0.68 0.43 -0.57 0.00 0.00 179.45 179.32 3i6z n SER 12 N -2.59 1.28 0.00 0.86 7.64 -1.26 -4.93 113.62 114.62 3i6z n SER 12 Ca -0.01 -1.06 0.00 0.00 1.01 0.00 0.00 58.87 58.81 3i6z n SER 12 Cb 0.13 0.64 0.00 0.00 -1.01 0.00 0.00 64.21 63.97 3i6z n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3i6z n GLY 13 N 1.46 1.96 3.80 0.23 0.00 -0.59 -1.42 105.19 110.62 3i6z n GLY 13 Ca 0.07 -1.98 -0.35 0.00 0.00 0.00 0.00 46.02 43.76 3i6z n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i6z s LYS 14 N -1.49 4.13 -0.01 1.61 1.02 -1.25 -1.50 119.74 122.26 3i6z s LYS 14 Ca 0.00 1.33 0.02 0.00 0.02 0.00 0.00 55.97 57.35 3i6z s LYS 14 Cb 0.00 -2.34 -0.00 0.00 -0.52 0.00 0.00 37.83 34.97 3i6z s LYS 14 CO 0.00 -0.14 -0.07 0.08 -0.92 0.00 0.00 175.35 174.30 3i6z s VAL 15 N -1.90 0.56 -0.18 3.17 1.01 -0.24 -1.00 120.40 121.82 3i6z s VAL 15 Ca 0.61 -0.30 0.00 0.00 0.00 0.00 0.00 61.98 62.29 3i6z s VAL 15 Cb -0.16 -0.48 0.01 0.00 0.00 0.00 0.00 36.38 35.75 3i6z s VAL 15 CO 0.21 0.16 -0.18 -0.32 0.00 0.00 0.00 175.10 174.97 3i6z s MET 16 N -0.14 3.05 0.00 2.72 1.75 0.57 -1.52 119.30 125.73 3i6z s MET 16 Ca 0.02 -0.80 0.00 0.00 -1.25 0.00 0.00 55.69 53.66 3i6z s MET 16 Cb -0.03 -2.62 0.00 0.00 2.84 0.00 0.00 34.83 35.02 3i6z s MET 16 CO -0.00 -0.18 0.00 0.41 -0.65 0.00 0.00 175.02 174.60 3i6z n GLY 17 N 4.57 1.16 3.03 2.11 0.00 0.80 0.01 105.19 116.87 3i6z n GLY 17 Ca -0.20 -1.93 -0.09 0.00 0.00 0.00 0.00 46.02 43.79 3i6z n GLY 17 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3i6z s THR 18 N 1.39 0.11 -0.07 2.61 -1.32 0.09 -4.67 115.64 113.78 3i6z s THR 18 Ca 0.00 -0.94 -0.22 0.00 -1.21 0.00 0.00 61.69 59.32 3i6z s THR 18 Cb 0.00 -0.44 -0.04 0.00 -1.51 0.00 0.00 72.50 70.51 3i6z s THR 18 CO 0.00 -0.52 0.64 -0.60 -2.21 0.00 0.00 174.62 171.93 3i6z s ARG 19 N -1.72 4.40 -0.04 7.08 3.52 -1.26 -0.37 118.95 130.57 3i6z s ARG 19 Ca -0.13 0.77 0.06 0.00 -0.13 0.00 0.00 55.73 56.29 3i6z s ARG 19 Cb -0.07 -3.43 -0.01 0.00 -1.56 0.00 0.00 34.95 29.88 3i6z s ARG 19 CO -0.01 0.13 -0.22 0.08 -0.81 0.00 0.00 175.30 174.47 3i6z s VAL 20 N 0.61 1.76 0.37 7.11 1.01 0.69 -4.95 120.40 127.01 3i6z s VAL 20 Ca 0.34 -0.92 -0.25 0.00 0.00 0.00 0.00 61.98 61.15 3i6z s VAL 20 Cb -0.17 -1.49 -0.09 0.00 0.00 0.00 0.00 36.38 34.63 3i6z s VAL 20 CO 0.16 0.50 1.03 -2.16 0.00 0.00 0.00 175.10 174.63 3i6z s PRO 21 N -0.21 4.31 -0.21 2.72 0.04 -1.26 -1.23 135.00 139.15 3i6z s PRO 21 Ca 0.00 1.51 -0.04 0.00 0.04 0.00 0.00 61.00 62.51 3i6z s PRO 21 Cb -0.11 -2.67 0.11 0.00 0.04 0.00 0.00 34.50 31.87 3i6z s PRO 21 CO 0.02 -0.01 0.36 0.08 0.04 0.00 0.00 177.00 177.48 3i6z s VAL 22 N -1.59 -0.56 -1.31 -0.36 1.01 -0.02 -4.90 120.40 112.67 3i6z s VAL 22 Ca 0.55 0.03 -0.21 0.00 0.00 0.00 0.00 61.98 62.35 3i6z s VAL 22 Cb -0.22 -0.71 0.02 0.00 0.00 0.00 0.00 36.38 35.47 3i6z s VAL 22 CO 0.28 -0.05 0.51 0.18 0.00 0.00 0.00 175.10 176.02 3i6z n LEU 23 N 5.36 -0.98 0.00 3.92 4.77 -1.26 -0.55 117.00 128.26 3i6z n LEU 23 Ca -0.05 -1.23 0.00 0.00 -0.03 0.00 0.00 56.01 54.70 3i6z n LEU 23 Cb 0.50 -1.78 0.00 0.00 -2.33 0.00 0.00 43.42 39.80 3i6z n LEU 23 CO 0.04 0.65 0.00 -1.20 -1.33 0.00 0.00 177.39 175.55 3i6z n SER 24 N -2.49 -1.80 0.00 -1.43 7.64 -1.26 -4.95 113.62 109.33 3i6z n SER 24 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.70 3i6z n SER 24 Cb 0.61 -1.07 0.00 0.00 -1.01 0.00 0.00 64.21 62.75 3i6z n SER 24 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3i6z n SER 25 N -0.14 0.49 -3.63 6.43 2.88 0.28 -5.18 113.62 114.75 3i6z n SER 25 Ca 0.00 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.43 3i6z n SER 25 Cb 0.07 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.48 3i6z n SER 25 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 3i6z s HIS 26 N 0.43 -0.24 0.26 0.66 3.76 -1.26 -0.84 115.29 118.05 3i6z s HIS 26 Ca 0.00 0.02 -0.11 0.00 -0.15 0.00 0.00 55.06 54.82 3i6z s HIS 26 Cb 0.00 0.26 -0.00 0.00 1.11 0.00 0.00 32.58 33.95 3i6z s HIS 26 CO 0.00 -0.67 0.46 0.96 -0.85 0.00 0.00 174.74 174.64 3i6z s ILE 27 N -3.38 0.00 0.03 0.60 -4.36 -0.36 -4.46 121.20 109.27 3i6z s ILE 27 Ca 0.00 -1.46 -0.05 0.00 -0.26 0.00 0.00 60.65 58.88 3i6z s ILE 27 Cb 0.01 -2.30 -0.05 0.00 1.25 0.00 0.00 42.46 41.37 3i6z s ILE 27 CO -0.09 0.00 0.26 -0.44 0.24 0.00 0.00 174.94 174.91 3i6z s SER 28 N -3.06 6.46 -0.04 4.36 0.01 -0.74 -0.22 113.70 120.47 3i6z s SER 28 Ca 0.24 0.50 0.02 0.00 1.31 0.00 0.00 55.95 58.02 3i6z s SER 28 Cb -0.00 -2.06 0.01 0.00 0.21 0.00 0.00 66.02 64.18 3i6z s SER 28 CO 0.11 0.22 -0.07 0.00 0.41 0.00 0.00 173.24 173.91 3i6z s ALA 29 N -1.36 0.80 -0.39 1.44 0.00 0.51 -0.69 121.76 122.06 3i6z s ALA 29 Ca 0.30 -0.20 0.03 0.00 0.00 0.00 0.00 51.96 52.09 3i6z s ALA 29 Cb -0.13 -0.39 0.11 0.00 0.00 0.00 0.00 23.12 22.71 3i6z s ALA 29 CO 0.19 0.06 0.12 -0.06 0.00 0.00 0.00 175.76 176.07 3i6z s PHE 30 N 0.59 3.63 -0.05 0.00 0.40 0.83 -0.73 117.98 122.66 3i6z s PHE 30 Ca -0.09 -2.96 -0.06 0.00 -0.60 0.00 0.00 56.93 53.22 3i6z s PHE 30 Cb -0.12 -2.95 -0.04 0.00 0.51 0.00 0.00 43.02 40.41 3i6z s PHE 30 CO 0.01 -0.91 0.19 -0.51 0.70 0.00 0.00 175.22 174.70 3i6z s LEU 31 N 0.69 4.38 -0.81 -0.37 1.43 0.22 -0.61 118.68 123.61 3i6z s LEU 31 Ca 0.12 0.47 -0.04 0.00 -1.03 0.00 0.00 54.13 53.64 3i6z s LEU 31 Cb -0.21 -2.42 0.00 0.00 0.03 0.00 0.00 46.19 43.60 3i6z s LEU 31 CO -0.06 0.32 0.70 0.61 0.23 0.00 0.00 176.35 178.15 3i6z n GLY 32 N 1.41 0.01 3.69 -3.19 0.00 -1.14 -4.00 105.19 101.96 3i6z n GLY 32 Ca -0.15 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.36 3i6z n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3i6z s ILE 33 N -3.20 4.95 0.22 -0.61 1.01 -0.05 -4.80 121.20 118.72 3i6z s ILE 33 Ca 0.27 1.55 -0.30 0.00 0.00 0.00 0.00 60.65 62.17 3i6z s ILE 33 Cb -0.12 -4.09 -0.08 0.00 0.01 0.00 0.00 42.46 38.17 3i6z s ILE 33 CO 0.45 0.12 1.15 -2.16 0.00 0.00 0.00 174.94 174.50 3i6z s PRO 34 N 1.58 4.56 0.00 2.79 0.04 -1.26 -0.38 135.00 142.32 3i6z s PRO 34 Ca 0.38 1.83 0.00 0.00 0.04 0.00 0.00 61.00 63.25 3i6z s PRO 34 Cb -0.17 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 31.14 3i6z s PRO 34 CO 0.15 0.04 0.25 1.97 0.04 0.00 0.00 177.00 179.45 3i6z n PHE 35 N 2.00 0.00 -3.81 0.56 1.16 -1.12 -4.89 117.46 111.36 3i6z n PHE 35 Ca 0.02 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.51 3i6z n PHE 35 Cb 0.45 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.25 3i6z n PHE 35 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3i6z s ALA 36 N -0.33 -0.40 0.42 1.98 0.00 -1.26 -3.16 121.76 119.01 3i6z s ALA 36 Ca 0.00 -0.49 -0.24 0.00 0.00 0.00 0.00 51.96 51.23 3i6z s ALA 36 Cb 0.00 0.59 -0.08 0.00 0.00 0.00 0.00 23.12 23.62 3i6z s ALA 36 CO 0.00 -0.56 1.16 -1.21 0.00 0.00 0.00 175.76 175.14 3i6z s GLU 37 N -3.86 3.98 0.10 0.00 0.41 0.26 -4.45 118.70 115.14 3i6z s GLU 37 Ca 0.06 1.79 -0.34 0.00 -0.41 0.00 0.00 54.97 56.07 3i6z s GLU 37 Cb 0.04 -2.58 -0.13 0.00 -1.78 0.00 0.00 34.13 29.67 3i6z s GLU 37 CO -0.10 -0.37 1.66 -2.30 -0.49 0.00 0.00 175.26 173.66 3i6z n PRO 38 N -0.10 2.18 -1.57 0.39 -0.02 -1.26 -4.64 135.00 129.97 3i6z n PRO 38 Ca 0.05 0.79 -0.39 0.00 -2.02 0.00 0.00 63.50 61.93 3i6z n PRO 38 Cb 0.47 -2.58 -0.02 0.00 -0.02 0.00 0.00 33.50 31.35 3i6z n PRO 38 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 3i6z n PRO 39 N 4.32 3.99 -4.09 0.52 -0.04 -1.26 -4.92 135.00 133.52 3i6z n PRO 39 Ca 0.18 -2.67 -0.23 0.00 -0.04 0.00 0.00 63.50 60.75 3i6z n PRO 39 Cb 0.29 -2.76 -0.06 0.00 -0.04 0.00 0.00 33.50 30.94 3i6z n PRO 39 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3i6z s VAL 40 N 1.02 3.17 0.00 0.52 -7.23 -1.26 -3.47 120.40 113.14 3i6z s VAL 40 Ca 0.63 -1.67 0.00 0.00 -1.81 0.00 0.00 61.98 59.13 3i6z s VAL 40 Cb 0.18 -3.00 0.00 0.00 0.56 0.00 0.00 36.38 34.12 3i6z s VAL 40 CO -0.07 -0.20 0.00 0.61 -0.31 0.00 0.00 175.10 175.12 3i6z n GLY 41 N -1.15 3.92 0.00 2.32 0.00 -1.26 -1.36 105.19 107.66 3i6z n GLY 41 Ca -0.03 0.02 0.07 0.00 0.00 0.00 0.00 46.02 46.07 3i6z n GLY 41 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3i6z n ASN 42 N 7.68 0.00 -0.37 1.61 4.13 -1.26 -2.16 115.26 124.89 3i6z n ASN 42 Ca 0.00 0.34 0.13 0.00 1.68 0.00 0.00 54.58 56.73 3i6z n ASN 42 Cb 0.00 -0.42 0.35 0.00 -1.54 0.00 0.00 39.78 38.17 3i6z n ASN 42 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 3i6z n MET 43 N -1.42 1.16 -1.84 3.52 2.81 -0.47 -4.83 117.12 116.06 3i6z n MET 43 Ca 0.05 -0.75 -0.41 0.00 -1.81 0.00 0.00 57.70 54.78 3i6z n MET 43 Cb 0.15 -1.48 -0.02 0.00 -0.71 0.00 0.00 33.22 31.16 3i6z n MET 43 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 3i6z s ARG 44 N -2.35 4.16 0.00 0.03 3.52 -0.92 -1.24 118.95 122.15 3i6z s ARG 44 Ca 0.27 2.51 0.00 0.00 -0.13 0.00 0.00 55.73 58.38 3i6z s ARG 44 Cb 0.20 -3.03 0.00 0.00 -1.56 0.00 0.00 34.95 30.55 3i6z s ARG 44 CO 0.47 -0.56 0.00 1.19 -0.81 0.00 0.00 175.30 175.59 3i6z n PHE 45 N 1.92 0.00 -2.29 5.12 3.72 -1.26 -4.93 117.46 119.74 3i6z n PHE 45 Ca 0.07 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.17 3i6z n PHE 45 Cb 0.38 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 38.92 3i6z n PHE 45 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3i6z s ARG 46 N -0.00 3.62 0.60 -1.08 0.52 -0.37 -4.28 118.95 117.95 3i6z s ARG 46 Ca 0.00 0.53 -0.19 0.00 -0.52 0.00 0.00 55.73 55.55 3i6z s ARG 46 Cb 0.00 -2.22 -0.04 0.00 0.52 0.00 0.00 34.95 33.21 3i6z s ARG 46 CO 0.00 -0.36 1.17 0.54 0.02 0.00 0.00 175.30 176.67 3i6z n ARG 47 N -2.34 1.17 -2.05 3.54 1.74 -1.26 -4.91 116.66 112.55 3i6z n ARG 47 Ca 0.04 0.45 -0.34 0.00 -0.77 0.00 0.00 57.85 57.23 3i6z n ARG 47 Cb 0.54 -2.38 0.02 0.00 -1.02 0.00 0.00 32.46 29.62 3i6z n ARG 47 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3i6z s PRO 48 N -2.98 3.19 -0.02 5.56 0.04 -1.26 -5.05 135.00 134.48 3i6z s PRO 48 Ca 0.77 1.40 0.04 0.00 0.04 0.00 0.00 61.00 63.25 3i6z s PRO 48 Cb -0.41 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.10 3i6z s PRO 48 CO 0.45 -0.94 -0.13 -1.21 0.04 0.00 0.00 177.00 175.21 3i6z s GLU 49 N -3.79 2.44 0.58 4.56 0.41 -1.26 -5.02 118.70 116.62 3i6z s GLU 49 Ca 0.68 -0.75 -0.20 0.00 -0.41 0.00 0.00 54.97 54.28 3i6z s GLU 49 Cb -0.20 -2.38 -0.04 0.00 -1.78 0.00 0.00 34.13 29.74 3i6z s GLU 49 CO 0.34 0.60 1.32 -1.25 -0.49 0.00 0.00 175.26 175.79 3i6z s PRO 50 N -1.03 2.95 0.13 0.39 0.04 -1.26 -0.57 135.00 135.64 3i6z s PRO 50 Ca 0.13 2.14 -0.31 0.00 0.04 0.00 0.00 61.00 63.00 3i6z s PRO 50 Cb -0.11 -2.10 -0.08 0.00 0.04 0.00 0.00 34.50 32.25 3i6z s PRO 50 CO 0.03 -1.31 1.41 0.21 0.04 0.00 0.00 177.00 177.38 3i6z s LYS 51 N -3.08 4.31 0.29 4.56 2.47 -1.19 -4.02 119.74 123.07 3i6z s LYS 51 Ca 0.75 2.12 -0.29 0.00 -1.56 0.00 0.00 55.97 56.99 3i6z s LYS 51 Cb -0.39 -3.23 -0.10 0.00 -1.46 0.00 0.00 37.83 32.66 3i6z s LYS 51 CO 0.44 -0.45 1.30 0.15 0.16 0.00 0.00 175.35 176.95 3i6z s LYS 52 N 1.01 4.38 0.64 4.03 1.02 -1.26 -4.93 119.74 124.64 3i6z s LYS 52 Ca 0.65 2.15 -0.18 0.00 0.02 0.00 0.00 55.97 58.61 3i6z s LYS 52 Cb -0.38 -3.11 -0.02 0.00 -0.52 0.00 0.00 37.83 33.79 3i6z s LYS 52 CO 0.31 -0.19 1.11 -2.30 -0.92 0.00 0.00 175.35 173.37 3i6z n PRO 53 N 1.43 0.94 -4.41 -1.68 -0.02 -1.26 -5.01 135.00 124.98 3i6z n PRO 53 Ca 0.02 0.37 -0.27 0.00 -2.02 0.00 0.00 63.50 61.60 3i6z n PRO 53 Cb 0.42 -2.34 -0.12 0.00 -0.02 0.00 0.00 33.50 31.44 3i6z n PRO 53 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 3i6z s TRP 54 N -1.49 2.33 0.51 6.00 -2.14 -0.51 -5.03 118.94 118.61 3i6z s TRP 54 Ca 0.79 -0.35 -0.01 0.00 2.66 0.00 0.00 56.10 59.19 3i6z s TRP 54 Cb -0.39 -1.18 0.01 0.00 -3.10 0.00 0.00 33.47 28.81 3i6z s TRP 54 CO 0.44 0.46 0.75 -1.12 -2.66 0.00 0.00 176.95 174.83 3i6z s SER 55 N -2.54 5.62 0.34 -2.66 0.01 -1.26 -4.49 113.70 108.72 3i6z s SER 55 Ca 0.19 0.31 0.00 0.00 1.31 0.00 0.00 55.95 57.76 3i6z s SER 55 Cb -0.08 -1.40 0.00 0.00 0.21 0.00 0.00 66.02 64.75 3i6z s SER 55 CO 0.09 -0.91 0.00 0.61 0.41 0.00 0.00 173.24 173.45 3i6z n GLY 56 N -2.27 -1.64 3.36 3.44 0.00 -1.26 -4.82 105.19 101.99 3i6z n GLY 56 Ca 0.04 -1.27 -0.33 0.00 0.00 0.00 0.00 46.02 44.45 3i6z n GLY 56 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i6z s VAL 57 N 0.00 3.05 0.02 1.61 0.11 -1.26 -3.76 120.40 120.16 3i6z s VAL 57 Ca 0.00 -0.65 -0.30 0.00 -2.93 0.00 0.00 61.98 58.09 3i6z s VAL 57 Cb 0.00 -2.29 -0.04 0.00 -1.53 0.00 0.00 36.38 32.52 3i6z s VAL 57 CO 0.00 0.51 1.03 0.86 -3.33 0.00 0.00 175.10 174.17 3i6z s TRP 58 N 0.50 3.61 -0.47 1.54 -0.11 -0.17 -4.87 118.94 118.97 3i6z s TRP 58 Ca -0.09 1.61 -0.28 0.00 1.22 0.00 0.00 56.10 58.57 3i6z s TRP 58 Cb -0.16 -3.19 0.03 0.00 -1.50 0.00 0.00 33.47 28.66 3i6z s TRP 58 CO 0.04 -0.29 1.08 1.21 -4.62 0.00 0.00 176.95 174.37 3i6z s ASN 59 N 0.99 6.61 -0.51 5.86 3.84 -1.26 -0.31 114.94 130.16 3i6z s ASN 59 Ca 0.53 0.40 0.04 0.00 0.21 0.00 0.00 52.86 54.04 3i6z s ASN 59 Cb -0.23 -2.52 0.41 0.00 -0.55 0.00 0.00 41.25 38.36 3i6z s ASN 59 CO 0.28 -1.18 1.33 0.00 -2.79 0.00 0.00 177.10 174.74 3i6z n ALA 60 N 7.63 5.39 0.97 1.71 0.00 0.10 -4.70 120.51 131.61 3i6z n ALA 60 Ca 0.10 -4.18 0.10 0.00 0.00 0.00 0.00 53.44 49.46 3i6z n ALA 60 Cb 0.49 -0.83 -0.11 0.00 0.00 0.00 0.00 19.45 18.99 3i6z n ALA 60 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3i6z n SER 61 N -0.54 1.03 -4.05 0.00 3.41 -1.24 -0.61 113.62 111.62 3i6z n SER 61 Ca 0.43 -1.01 -0.12 0.00 -0.26 0.00 0.00 58.87 57.91 3i6z n SER 61 Cb 0.62 0.97 -0.11 0.00 -0.26 0.00 0.00 64.21 65.43 3i6z n SER 61 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3i6z s THR 62 N -2.91 0.46 0.67 6.66 -4.23 -1.26 -4.86 115.64 110.17 3i6z s THR 62 Ca 0.08 -1.07 -0.17 0.00 -1.18 0.00 0.00 61.69 59.36 3i6z s THR 62 Cb 0.16 -0.57 -0.02 0.00 1.34 0.00 0.00 72.50 73.41 3i6z s THR 62 CO 0.83 -0.41 1.00 -1.22 -0.54 0.00 0.00 174.62 174.27 3i6z n TYR 63 N 1.46 0.87 -2.42 3.99 4.01 -1.26 -3.82 117.16 119.99 3i6z n TYR 63 Ca -0.23 0.41 -0.25 0.00 -0.16 0.00 0.00 57.90 57.67 3i6z n TYR 63 Cb 0.55 -2.13 0.14 0.00 -0.31 0.00 0.00 39.34 37.59 3i6z n TYR 63 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 3i6z s PRO 64 N -3.10 1.26 0.82 -0.72 0.04 -1.26 -4.86 135.00 127.17 3i6z s PRO 64 Ca 0.76 -0.99 -0.11 0.00 0.04 0.00 0.00 61.00 60.70 3i6z s PRO 64 Cb -0.38 -2.19 0.09 0.00 0.04 0.00 0.00 34.50 32.06 3i6z s PRO 64 CO 0.47 -1.81 1.09 -0.80 0.04 0.00 0.00 177.00 176.00 3i6z s ASN 65 N -4.82 4.07 0.17 6.66 0.01 -1.26 -4.83 114.94 114.94 3i6z s ASN 65 Ca 0.70 1.73 0.03 0.00 -0.71 0.00 0.00 52.86 54.61 3i6z s ASN 65 Cb -0.04 -2.41 -0.03 0.00 0.41 0.00 0.00 41.25 39.18 3i6z s ASN 65 CO 0.47 -2.30 0.31 0.20 -1.51 0.00 0.00 177.10 174.27 3i6z s ASN 66 N -3.36 6.34 0.67 -1.22 0.02 -0.55 -4.80 114.94 112.04 3i6z s ASN 66 Ca 0.62 0.16 -0.14 0.00 -1.02 0.00 0.00 52.86 52.48 3i6z s ASN 66 Cb -0.18 -1.90 0.01 0.00 0.02 0.00 0.00 41.25 39.19 3i6z s ASN 66 CO 0.56 0.02 1.11 0.00 0.02 0.00 0.00 177.10 178.81 3i6z s GLN 68 N -4.19 4.16 0.12 0.00 -1.52 -1.23 -4.61 119.66 112.39 3i6z s GLN 68 Ca 0.66 2.52 -0.25 0.00 -1.95 0.00 0.00 55.36 56.34 3i6z s GLN 68 Cb -0.20 -3.07 0.07 0.00 -0.22 0.00 0.00 33.01 29.59 3i6z s GLN 68 CO 0.43 -0.64 0.74 1.14 -0.25 0.00 0.00 175.29 176.70 3i6z s GLN 69 N 0.36 1.18 0.33 2.91 -2.07 -1.26 -4.67 119.66 116.44 3i6z s GLN 69 Ca 0.68 -0.49 -0.29 0.00 -1.82 0.00 0.00 55.36 53.44 3i6z s GLN 69 Cb -0.47 0.51 -0.10 0.00 -1.09 0.00 0.00 33.01 31.86 3i6z s GLN 69 CO 0.39 -0.52 1.35 -0.47 -1.32 0.00 0.00 175.29 174.72 3i6z s TYR 70 N -3.53 2.97 -0.14 9.60 5.04 -1.26 -5.01 117.35 125.03 3i6z s TYR 70 Ca 0.04 1.34 0.00 0.00 -2.44 0.00 0.00 57.07 56.01 3i6z s TYR 70 Cb -0.02 -3.75 -0.01 0.00 0.35 0.00 0.00 41.96 38.54 3i6z s TYR 70 CO -0.08 -2.13 -0.15 0.08 -1.34 0.00 0.00 175.55 171.93 3i6z s VAL 71 N -1.02 2.77 -0.11 3.14 1.01 -1.26 -4.88 120.40 120.04 3i6z s VAL 71 Ca 0.51 -0.75 -0.29 0.00 0.00 0.00 0.00 61.98 61.45 3i6z s VAL 71 Cb -0.41 -2.16 -0.05 0.00 0.00 0.00 0.00 36.38 33.76 3i6z s VAL 71 CO 0.54 0.52 1.71 -0.62 0.00 0.00 0.00 175.10 177.24 3i6z s ASP 72 N 0.61 6.47 -0.12 3.32 -1.08 -1.26 -4.88 116.67 119.74 3i6z s ASP 72 Ca -0.09 2.04 0.15 0.00 -0.52 0.00 0.00 52.55 54.14 3i6z s ASP 72 Cb -0.16 -2.53 0.27 0.00 -1.46 0.00 0.00 42.92 39.04 3i6z s ASP 72 CO 0.03 -1.12 1.14 -0.62 0.52 0.00 0.00 175.17 175.12 3i6z n GLU 73 N 7.45 1.06 -0.14 4.34 1.02 -1.26 -4.79 120.64 128.32 3i6z n GLU 73 Ca 0.19 -2.41 -0.02 0.00 -0.02 0.00 0.00 57.16 54.89 3i6z n GLU 73 Cb 0.44 -1.29 0.20 0.00 -0.02 0.00 0.00 31.44 30.76 3i6z n GLU 73 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 3i6z h GLN 74 N 0.20 0.85 -2.33 3.49 1.08 -2.01 -3.35 115.11 113.05 3i6z h GLN 74 Ca -0.01 -0.15 -0.59 0.00 -1.45 0.00 0.00 58.65 56.45 3i6z h GLN 74 Cb 1.10 -0.14 -0.40 0.00 -0.05 0.00 0.00 27.48 28.00 3i6z h GLN 74 CO 0.00 0.73 -0.89 1.19 -0.95 0.00 0.00 178.83 178.92 3i6z n PHE 75 N -4.30 0.67 -1.63 2.96 3.72 -1.26 -5.11 117.46 112.52 3i6z n PHE 75 Ca 0.04 -3.69 -0.52 0.00 -0.05 0.00 0.00 57.45 53.23 3i6z n PHE 75 Cb 0.20 -0.22 -0.06 0.00 -0.94 0.00 0.00 39.48 38.46 3i6z n PHE 75 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 3i6z n PRO 76 N 1.90 1.31 0.00 -1.08 -0.02 -1.26 -0.79 135.00 135.06 3i6z n PRO 76 Ca 0.25 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 3i6z n PRO 76 Cb 0.46 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 3i6z n PRO 76 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3i6z n GLY 77 N 3.06 2.83 3.70 -1.23 0.00 -1.26 -4.99 105.19 107.30 3i6z n GLY 77 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3i6z n GLY 77 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3i6z s PHE 78 N -2.47 3.44 0.32 1.61 5.36 0.03 -4.93 117.98 121.33 3i6z s PHE 78 Ca 0.00 1.41 0.12 0.00 -0.96 0.00 0.00 56.93 57.50 3i6z s PHE 78 Cb 0.00 -3.32 0.53 0.00 -0.34 0.00 0.00 43.02 39.90 3i6z s PHE 78 CO 0.00 -0.84 1.72 0.66 -1.46 0.00 0.00 175.22 175.29 3i6z h SER 79 N 7.01 0.00 -0.86 6.13 4.64 -1.94 -1.90 113.55 126.63 3i6z h SER 79 Ca -0.38 0.00 0.09 0.00 -0.47 0.00 0.00 61.79 61.03 3i6z h SER 79 Cb 1.19 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.21 3i6z h SER 79 CO 0.82 0.50 0.51 1.23 -0.87 0.00 0.00 176.83 179.01 3i6z h GLY 80 N 1.52 1.34 0.57 -0.77 0.00 -1.93 -1.76 103.07 102.03 3i6z h GLY 80 Ca -0.00 -0.34 -0.35 0.00 0.00 0.00 0.00 47.33 46.63 3i6z h GLY 80 CO 0.06 0.16 -2.02 -1.14 0.00 0.00 0.00 176.54 173.60 3i6z n SER 81 N -4.70 1.66 0.19 0.19 3.41 -1.20 -4.31 113.62 108.86 3i6z n SER 81 Ca 0.14 0.20 0.14 0.00 -0.26 0.00 0.00 58.87 59.09 3i6z n SER 81 Cb 0.27 -0.48 0.51 0.00 -0.26 0.00 0.00 64.21 64.25 3i6z n SER 81 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3i6z h GLU 82 N 0.04 0.00 0.00 4.33 5.08 -1.28 -2.60 114.58 120.15 3i6z h GLU 82 Ca -0.42 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 3i6z h GLU 82 Cb 2.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.28 3i6z h GLU 82 CO 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.07 3i6z n MET 83 N -2.67 0.03 -0.01 2.33 0.00 -0.67 -2.06 117.12 114.07 3i6z n MET 83 Ca 0.02 0.37 0.10 0.00 0.00 0.00 0.00 57.70 58.20 3i6z n MET 83 Cb 0.33 -1.57 -0.16 0.00 0.00 0.00 0.00 33.22 31.82 3i6z n MET 83 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 175.97 176.88 3i6z n TRP 84 N -1.62 0.00 -2.03 3.17 7.02 -0.98 -4.73 117.44 118.27 3i6z n TRP 84 Ca 0.02 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.16 3i6z n TRP 84 Cb 0.11 -0.46 0.02 0.00 -2.42 0.00 0.00 31.31 28.56 3i6z n TRP 84 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 3i6z s ASN 85 N -4.35 5.56 0.32 -0.99 0.01 -0.87 -4.72 114.94 109.90 3i6z s ASN 85 Ca -0.07 1.98 -0.29 0.00 -0.71 0.00 0.00 52.86 53.77 3i6z s ASN 85 Cb 0.13 -2.55 -0.12 0.00 0.41 0.00 0.00 41.25 39.12 3i6z s ASN 85 CO 0.86 -1.32 1.47 -0.81 -1.51 0.00 0.00 177.10 175.78 3i6z n PRO 86 N -1.91 2.46 -0.28 -0.60 -0.04 -1.26 -4.87 135.00 128.50 3i6z n PRO 86 Ca 0.10 0.87 0.07 0.00 -0.04 0.00 0.00 63.50 64.50 3i6z n PRO 86 Cb 0.52 -2.57 0.19 0.00 -0.04 0.00 0.00 33.50 31.60 3i6z n PRO 86 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 3i6z n ASN 87 N 1.37 3.29 -4.25 3.54 6.94 -1.26 -4.96 115.26 119.93 3i6z n ASN 87 Ca 0.06 -2.44 -0.14 0.00 -0.02 0.00 0.00 54.58 52.04 3i6z n ASN 87 Cb 0.36 -0.36 -0.10 0.00 -2.36 0.00 0.00 39.78 37.32 3i6z n ASN 87 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 3i6z s ARG 88 N -1.79 1.17 0.48 -3.83 1.81 -1.26 -5.11 118.95 110.42 3i6z s ARG 88 Ca 0.31 -1.58 -0.24 0.00 -1.72 0.00 0.00 55.73 52.49 3i6z s ARG 88 Cb 0.21 -0.21 -0.07 0.00 -0.45 0.00 0.00 34.95 34.43 3i6z s ARG 88 CO 0.12 -0.19 1.38 -2.00 -0.68 0.00 0.00 175.30 173.94 3i6z s GLU 89 N -3.96 3.51 0.20 3.54 2.12 -1.26 -4.50 118.70 118.34 3i6z s GLU 89 Ca 0.28 2.31 -0.14 0.00 0.36 0.00 0.00 54.97 57.77 3i6z s GLU 89 Cb 0.07 -2.51 -0.07 0.00 0.26 0.00 0.00 34.13 31.87 3i6z s GLU 89 CO 0.06 -0.92 0.60 -1.64 -0.54 0.00 0.00 175.26 172.82 3i6z s MET 90 N -2.61 3.99 -0.08 4.30 -1.94 -1.26 -1.48 119.30 120.22 3i6z s MET 90 Ca 0.65 0.53 -0.31 0.00 -1.71 0.00 0.00 55.69 54.85 3i6z s MET 90 Cb -0.42 -2.81 0.08 0.00 2.01 0.00 0.00 34.83 33.70 3i6z s MET 90 CO 0.52 0.39 0.75 0.45 -0.01 0.00 0.00 175.02 177.12 3i6z s SER 91 N -1.90 -0.60 0.42 3.03 0.15 -0.19 -4.89 113.70 109.72 3i6z s SER 91 Ca 0.42 0.66 0.29 0.00 0.70 0.00 0.00 55.95 58.02 3i6z s SER 91 Cb -0.14 0.49 1.11 0.00 -1.71 0.00 0.00 66.02 65.78 3i6z s SER 91 CO 0.20 -0.55 1.85 -0.33 1.20 0.00 0.00 173.24 175.61 3i6z h GLU 92 N 2.92 0.00 -5.07 5.44 5.08 -1.95 -3.25 114.58 117.75 3i6z h GLU 92 Ca -0.25 0.00 -0.69 0.00 -1.00 0.00 0.00 59.36 57.41 3i6z h GLU 92 Cb 1.15 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 30.23 3i6z h GLU 92 CO 0.37 0.00 1.06 0.34 -1.00 0.00 0.00 179.01 179.78 3i6z s ASP 93 N -5.17 6.73 0.00 1.42 -1.08 -1.26 -4.25 116.67 113.06 3i6z s ASP 93 Ca 0.03 -2.24 0.00 0.00 -0.52 0.00 0.00 52.55 49.82 3i6z s ASP 93 Cb 0.09 -2.42 0.00 0.00 -1.46 0.00 0.00 42.92 39.13 3i6z s ASP 93 CO 0.51 -1.02 0.63 0.00 0.52 0.00 0.00 175.17 175.81 3i6z s LEU 95 N 0.00 4.85 0.10 0.00 1.43 -1.26 -4.71 118.68 119.08 3i6z s LEU 95 Ca 0.00 -2.18 0.02 0.00 -1.03 0.00 0.00 54.13 50.93 3i6z s LEU 95 Cb 0.00 -2.42 -0.04 0.00 0.03 0.00 0.00 46.19 43.75 3i6z s LEU 95 CO 0.00 -1.05 -0.06 -0.31 0.23 0.00 0.00 176.35 175.16 3i6z s TYR 96 N 2.76 0.90 0.15 0.29 1.51 -1.26 -2.79 117.35 118.91 3i6z s TYR 96 Ca 0.37 -0.93 0.05 0.00 -1.01 0.00 0.00 57.07 55.55 3i6z s TYR 96 Cb -0.04 -0.52 -0.04 0.00 -0.11 0.00 0.00 41.96 41.25 3i6z s TYR 96 CO -0.07 -0.16 -0.11 -0.48 -1.11 0.00 0.00 175.55 173.62 3i6z s LEU 97 N -3.05 2.52 0.01 -1.29 0.05 0.49 -3.12 118.68 114.29 3i6z s LEU 97 Ca 0.12 -0.99 0.07 0.00 0.05 0.00 0.00 54.13 53.38 3i6z s LEU 97 Cb 0.05 -0.41 -0.02 0.00 -2.05 0.00 0.00 46.19 43.76 3i6z s LEU 97 CO -0.04 -0.29 -0.21 0.20 -0.55 0.00 0.00 176.35 175.46 3i6z s ASN 98 N -3.10 2.43 -0.05 1.48 0.01 -0.23 -0.87 114.94 114.61 3i6z s ASN 98 Ca 0.16 -0.44 0.01 0.00 -0.71 0.00 0.00 52.86 51.89 3i6z s ASN 98 Cb 0.01 -0.24 0.02 0.00 0.41 0.00 0.00 41.25 41.45 3i6z s ASN 98 CO 0.02 0.21 -0.07 -0.63 -1.51 0.00 0.00 177.10 175.11 3i6z s ILE 99 N -0.63 0.76 -0.18 0.60 1.01 0.22 -0.92 121.20 122.07 3i6z s ILE 99 Ca 0.08 -0.25 -0.04 0.00 0.00 0.00 0.00 60.65 60.43 3i6z s ILE 99 Cb -0.08 -0.74 -0.02 0.00 0.01 0.00 0.00 42.46 41.63 3i6z s ILE 99 CO 0.00 0.27 -0.03 0.26 0.00 0.00 0.00 174.94 175.45 3i6z s TRP 100 N 0.82 3.01 -0.11 3.97 0.51 0.12 -0.12 118.94 127.14 3i6z s TRP 100 Ca -0.12 -0.44 0.03 0.00 -2.12 0.00 0.00 56.10 53.44 3i6z s TRP 100 Cb -0.15 -2.01 0.01 0.00 -0.81 0.00 0.00 33.47 30.51 3i6z s TRP 100 CO 0.01 -0.17 -0.20 0.08 -0.51 0.00 0.00 176.95 176.17 3i6z s VAL 101 N 0.71 1.81 0.94 4.03 1.01 0.13 -1.60 120.40 127.43 3i6z s VAL 101 Ca -0.01 -0.85 -0.11 0.00 0.00 0.00 0.00 61.98 61.01 3i6z s VAL 101 Cb -0.14 -1.60 0.13 0.00 0.00 0.00 0.00 36.38 34.76 3i6z s VAL 101 CO 0.02 0.50 0.94 -0.81 0.00 0.00 0.00 175.10 175.76 3i6z n PRO 102 N 3.92 -0.54 -4.43 2.72 -0.04 -1.26 -1.80 135.00 133.56 3i6z n PRO 102 Ca -0.20 -0.10 -0.28 0.00 -0.04 0.00 0.00 63.50 62.89 3i6z n PRO 102 Cb 0.52 -2.23 -0.17 0.00 -0.04 0.00 0.00 33.50 31.58 3i6z n PRO 102 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3i6z s SER 103 N -2.46 2.32 0.74 3.54 0.15 -1.26 -3.18 113.70 113.54 3i6z s SER 103 Ca 0.64 -0.40 -0.14 0.00 0.70 0.00 0.00 55.95 56.75 3i6z s SER 103 Cb -0.22 -1.03 0.05 0.00 -1.71 0.00 0.00 66.02 63.10 3i6z s SER 103 CO 0.61 0.01 1.19 -2.84 1.20 0.00 0.00 173.24 173.40 3i6z s PRO 104 N 0.99 2.11 0.10 5.44 0.02 -1.26 -4.98 135.00 137.42 3i6z s PRO 104 Ca -0.07 1.68 -0.34 0.00 0.02 0.00 0.00 61.00 62.29 3i6z s PRO 104 Cb -0.15 -1.84 -0.13 0.00 0.02 0.00 0.00 34.50 32.40 3i6z s PRO 104 CO -0.01 -1.84 1.65 -2.13 -0.33 0.00 0.00 177.00 174.34 3i6z n ARG 105 N -2.85 2.15 -1.30 5.54 0.63 -1.19 -4.95 116.66 114.68 3i6z n ARG 105 Ca 0.13 0.78 -0.29 0.00 -0.92 0.00 0.00 57.85 57.54 3i6z n ARG 105 Cb 0.51 -2.57 0.19 0.00 0.45 0.00 0.00 32.46 31.05 3i6z n ARG 105 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 3i6z s PRO 106 N 1.72 -0.06 -0.24 -0.14 0.04 -1.26 -5.00 135.00 130.06 3i6z s PRO 106 Ca 0.82 0.13 -0.10 0.00 0.04 0.00 0.00 61.00 61.89 3i6z s PRO 106 Cb -0.68 -1.71 -0.17 0.00 0.04 0.00 0.00 34.50 31.97 3i6z s PRO 106 CO 0.41 -2.98 -0.11 1.63 0.04 0.00 0.00 177.00 175.99 3i6z n LYS 107 N -4.28 0.63 -2.80 4.56 4.76 -1.26 -4.01 118.16 115.76 3i6z n LYS 107 Ca 0.10 0.29 -0.05 0.00 -2.87 0.00 0.00 58.31 55.77 3i6z n LYS 107 Cb 0.59 -1.58 0.00 0.00 -1.84 0.00 0.00 35.03 32.20 3i6z n LYS 107 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3i6z s SER 108 N -7.04 -1.28 0.42 4.39 0.15 -0.97 -4.46 113.70 104.90 3i6z s SER 108 Ca -0.34 -1.81 0.07 0.00 0.70 0.00 0.00 55.95 54.57 3i6z s SER 108 Cb 0.10 1.76 -0.05 0.00 -1.71 0.00 0.00 66.02 66.13 3i6z s SER 108 CO 0.58 -0.06 0.19 0.28 1.20 0.00 0.00 173.24 175.43 3i6z s THR 109 N 0.83 2.30 0.20 6.45 -1.32 0.70 -4.57 115.64 120.23 3i6z s THR 109 Ca 0.30 -1.68 -0.32 0.00 -1.21 0.00 0.00 61.69 58.78 3i6z s THR 109 Cb 0.00 -2.98 -0.15 0.00 -1.51 0.00 0.00 72.50 67.86 3i6z s THR 109 CO -0.06 0.00 1.22 0.41 -2.21 0.00 0.00 174.62 173.98 3i6z n THR 110 N -1.26 1.02 -5.08 5.08 -1.04 -1.26 -0.59 114.28 111.15 3i6z n THR 110 Ca -0.01 -0.26 -0.32 0.00 -2.04 0.00 0.00 64.05 61.42 3i6z n THR 110 Cb 0.64 -1.05 -0.15 0.00 -1.82 0.00 0.00 70.33 67.95 3i6z n THR 110 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3i6z s VAL 111 N -0.24 2.53 -0.08 12.58 1.01 -0.77 -1.64 120.40 133.78 3i6z s VAL 111 Ca 0.70 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.81 3i6z s VAL 111 Cb -0.78 -1.96 0.01 0.00 0.00 0.00 0.00 36.38 33.65 3i6z s VAL 111 CO 0.52 0.57 -0.15 -0.04 0.00 0.00 0.00 175.10 176.00 3i6z s MET 112 N -0.29 2.08 -0.21 2.72 -1.94 -0.80 -0.12 119.30 120.76 3i6z s MET 112 Ca 0.01 -0.54 -0.01 0.00 -1.71 0.00 0.00 55.69 53.44 3i6z s MET 112 Cb -0.13 -1.70 0.01 0.00 2.01 0.00 0.00 34.83 35.02 3i6z s MET 112 CO 0.03 0.03 -0.11 0.08 -0.01 0.00 0.00 175.02 175.03 3i6z s VAL 113 N 0.71 2.72 -0.06 -6.03 1.01 0.21 0.09 120.40 119.06 3i6z s VAL 113 Ca -0.13 -0.79 -0.17 0.00 0.00 0.00 0.00 61.98 60.90 3i6z s VAL 113 Cb -0.16 -2.24 -0.05 0.00 0.00 0.00 0.00 36.38 33.94 3i6z s VAL 113 CO 0.03 0.43 0.46 0.86 0.00 0.00 0.00 175.10 176.88 3i6z s TRP 114 N 1.37 3.62 -0.27 5.22 -0.11 0.24 -0.99 118.94 128.02 3i6z s TRP 114 Ca 0.04 0.96 0.03 0.00 1.22 0.00 0.00 56.10 58.35 3i6z s TRP 114 Cb -0.14 -2.45 0.06 0.00 -1.50 0.00 0.00 33.47 29.44 3i6z s TRP 114 CO -0.08 0.38 -0.09 0.42 -4.62 0.00 0.00 176.95 172.97 3i6z s ILE 115 N -0.17 2.24 0.69 5.86 1.01 0.16 -2.18 121.20 128.80 3i6z s ILE 115 Ca 0.25 -1.68 -0.15 0.00 0.00 0.00 0.00 60.65 59.06 3i6z s ILE 115 Cb -0.16 -2.35 0.02 0.00 0.01 0.00 0.00 42.46 39.98 3i6z s ILE 115 CO 0.12 -0.09 1.17 -0.72 0.00 0.00 0.00 174.94 175.42 3i6z s TYR 116 N 1.09 2.30 0.00 3.97 -0.85 -1.26 -3.65 117.35 118.95 3i6z s TYR 116 Ca -0.07 1.58 0.00 0.00 -0.52 0.00 0.00 57.07 58.06 3i6z s TYR 116 Cb -0.20 -3.36 0.00 0.00 0.38 0.00 0.00 41.96 38.78 3i6z s TYR 116 CO -0.05 -2.21 0.00 0.41 -1.52 0.00 0.00 175.55 172.18 3i6z n GLY 117 N 0.07 1.66 0.00 5.49 0.00 -1.23 -3.56 105.19 107.62 3i6z n GLY 117 Ca 0.12 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 44.10 3i6z n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i6z n GLY 118 N 5.00 0.38 2.49 -0.02 0.00 -1.26 -4.18 105.19 107.60 3i6z n GLY 118 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 3i6z n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i6z n GLY 119 N 0.00 1.68 3.47 -0.02 0.00 -1.26 -1.78 105.19 107.28 3i6z n GLY 119 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3i6z n GLY 119 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3i6z n PHE 120 N -2.41 0.00 0.26 1.61 3.72 -1.26 -4.77 117.46 114.61 3i6z n PHE 120 Ca -0.20 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.23 3i6z n PHE 120 Cb 0.64 -0.99 0.00 0.00 -0.94 0.00 0.00 39.48 38.20 3i6z n PHE 120 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 3i6z n TYR 121 N -2.06 0.00 -3.89 1.38 0.18 -0.76 0.03 117.16 112.06 3i6z n TYR 121 Ca 0.00 0.00 -0.11 0.00 1.88 0.00 0.00 57.90 59.67 3i6z n TYR 121 Cb 0.05 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.01 3i6z n TYR 121 CO 0.00 0.00 0.00 -1.13 -2.08 0.00 0.00 176.86 173.65 3i6z n SER 122 N -0.22 -1.85 0.00 9.48 3.41 -0.73 -4.02 113.62 119.69 3i6z n SER 122 Ca 0.03 -2.68 0.00 0.00 -0.26 0.00 0.00 58.87 55.96 3i6z n SER 122 Cb 0.13 3.20 0.00 0.00 -0.26 0.00 0.00 64.21 67.28 3i6z n SER 122 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i6z n GLY 123 N -0.54 3.81 3.16 5.00 0.00 -1.26 -4.07 105.19 111.29 3i6z n GLY 123 Ca -0.05 -1.59 -0.12 0.00 0.00 0.00 0.00 46.02 44.26 3i6z n GLY 123 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3i6z s SER 124 N 0.00 -0.14 0.00 1.61 0.01 -1.26 -4.60 113.70 109.31 3i6z s SER 124 Ca 0.00 0.13 0.28 0.00 1.31 0.00 0.00 55.95 57.66 3i6z s SER 124 Cb 0.00 0.35 1.00 0.00 0.21 0.00 0.00 66.02 67.58 3i6z s SER 124 CO 0.00 -0.31 1.73 -1.54 0.41 0.00 0.00 173.24 173.53 3i6z n SER 125 N 1.87 0.47 -1.18 2.44 3.41 -1.26 -4.09 113.62 115.27 3i6z n SER 125 Ca -0.19 -0.36 0.12 0.00 -0.26 0.00 0.00 58.87 58.18 3i6z n SER 125 Cb 0.57 -0.04 0.23 0.00 -0.26 0.00 0.00 64.21 64.70 3i6z n SER 125 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3i6z n THR 126 N -1.13 0.60 -1.88 6.66 -2.24 -1.26 -4.86 114.28 110.17 3i6z n THR 126 Ca 0.11 -0.80 -0.38 0.00 -2.27 0.00 0.00 64.05 60.71 3i6z n THR 126 Cb 0.31 0.89 0.03 0.00 -2.10 0.00 0.00 70.33 69.47 3i6z n THR 126 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3i6z s LEU 127 N -1.38 3.86 0.40 3.22 1.43 -1.26 -4.91 118.68 120.04 3i6z s LEU 127 Ca 0.40 2.65 0.11 0.00 -1.03 0.00 0.00 54.13 56.26 3i6z s LEU 127 Cb 0.23 -4.30 0.91 0.00 0.03 0.00 0.00 46.19 43.06 3i6z s LEU 127 CO 0.32 -1.47 1.96 0.44 0.23 0.00 0.00 176.35 177.82 3i6z h ASP 128 N 1.49 0.50 0.72 2.29 3.32 -1.95 -0.27 116.42 122.52 3i6z h ASP 128 Ca -0.51 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.55 3i6z h ASP 128 Cb 1.29 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.75 3i6z h ASP 128 CO 0.57 0.30 0.00 1.33 -1.72 0.00 0.00 179.24 179.73 3i6z n VAL 129 N -4.48 0.84 -0.48 -1.35 0.24 -1.26 -2.31 118.33 109.53 3i6z n VAL 129 Ca 0.11 0.20 0.09 0.00 -2.04 0.00 0.00 64.34 62.70 3i6z n VAL 129 Cb 0.33 -1.06 0.30 0.00 -1.47 0.00 0.00 33.84 31.94 3i6z n VAL 129 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 3i6z n TYR 130 N -2.00 1.07 -1.64 6.34 4.01 -0.12 -4.66 117.16 120.17 3i6z n TYR 130 Ca 0.03 -0.57 -0.43 0.00 -0.16 0.00 0.00 57.90 56.77 3i6z n TYR 130 Cb 0.23 -0.13 -0.03 0.00 -0.31 0.00 0.00 39.34 39.10 3i6z n TYR 130 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 3i6z s ASN 131 N -1.04 5.67 0.00 7.72 3.84 -0.98 -4.85 114.94 125.31 3i6z s ASN 131 Ca 0.44 2.02 0.30 0.00 0.21 0.00 0.00 52.86 55.83 3i6z s ASN 131 Cb 0.26 -2.52 1.68 0.00 -0.55 0.00 0.00 41.25 40.13 3i6z s ASN 131 CO 0.24 -1.77 2.10 0.61 -2.79 0.00 0.00 177.10 175.49 3i6z n GLY 132 N 5.50 -1.10 0.35 1.21 0.00 -1.26 -4.13 105.19 105.77 3i6z n GLY 132 Ca 0.28 -0.17 -0.03 0.00 0.00 0.00 0.00 46.02 46.09 3i6z n GLY 132 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3i6z h LYS 133 N 0.00 1.20 -0.25 1.61 2.10 -1.92 -1.56 116.57 117.76 3i6z h LYS 133 Ca 0.00 -0.10 -0.01 0.00 -2.00 0.00 0.00 60.65 58.54 3i6z h LYS 133 Cb 0.12 -0.26 -0.01 0.00 -0.90 0.00 0.00 32.23 31.19 3i6z h LYS 133 CO 0.00 0.83 0.12 1.88 -2.00 0.00 0.00 179.45 180.28 3i6z h TYR 134 N 1.23 0.36 -0.34 0.07 0.05 -1.81 0.13 116.97 116.66 3i6z h TYR 134 Ca 0.32 -0.02 -0.11 0.00 0.05 0.00 0.00 58.73 58.98 3i6z h TYR 134 Cb -0.08 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 37.54 3i6z h TYR 134 CO -0.00 0.34 -0.20 1.25 -1.05 0.00 0.00 178.16 178.50 3i6z h LEU 135 N 0.27 0.77 -0.47 3.88 5.85 -1.71 0.20 115.31 124.10 3i6z h LEU 135 Ca 0.09 -0.42 -0.03 0.00 0.84 0.00 0.00 57.88 58.35 3i6z h LEU 135 Cb 0.11 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 3i6z h LEU 135 CO -0.01 1.02 0.16 0.00 -0.34 0.00 0.00 178.44 179.27 3i6z h ALA 136 N 0.77 0.61 0.33 1.25 0.00 -1.15 -0.82 119.26 120.26 3i6z h ALA 136 Ca 0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 3i6z h ALA 136 Cb 0.74 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3i6z h ALA 136 CO 0.06 0.25 -0.16 -0.92 0.00 0.00 0.00 179.25 178.48 3i6z h TYR 137 N 0.62 -0.41 -0.54 0.00 3.20 -0.66 0.13 116.97 119.30 3i6z h TYR 137 Ca 0.15 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 3i6z h TYR 137 Cb 0.25 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.63 3i6z h TYR 137 CO 0.01 -0.08 0.27 1.15 -1.64 0.00 0.00 178.16 177.88 3i6z h THR 138 N -0.84 1.19 -0.04 1.81 2.02 -0.62 -3.11 112.91 113.32 3i6z h THR 138 Ca -0.05 -0.53 0.00 0.00 0.77 0.00 0.00 66.41 66.60 3i6z h THR 138 Cb 0.52 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.49 3i6z h THR 138 CO 0.08 0.22 0.00 -0.62 0.37 0.00 0.00 175.52 175.56 3i6z n GLU 139 N -4.59 2.23 -3.51 6.66 -0.58 -0.32 -4.98 120.64 115.56 3i6z n GLU 139 Ca 0.03 -1.79 -0.20 0.00 -0.42 0.00 0.00 57.16 54.79 3i6z n GLU 139 Cb 0.11 -1.46 0.08 0.00 -0.57 0.00 0.00 31.44 29.60 3i6z n GLU 139 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 3i6z n GLU 140 N 1.16 -6.92 -4.41 3.49 2.13 0.00 -5.01 120.64 111.09 3i6z n GLU 140 Ca 0.15 0.83 -0.24 0.00 0.66 0.00 0.00 57.16 58.55 3i6z n GLU 140 Cb 0.56 -5.83 -0.10 0.00 0.27 0.00 0.00 31.44 26.35 3i6z n GLU 140 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 3i6z s VAL 141 N -3.36 2.72 -0.32 6.31 -7.23 -1.02 -4.70 120.40 112.80 3i6z s VAL 141 Ca 0.19 -2.19 -0.21 0.00 -1.81 0.00 0.00 61.98 57.96 3i6z s VAL 141 Cb -0.09 -2.41 -0.00 0.00 0.56 0.00 0.00 36.38 34.44 3i6z s VAL 141 CO 0.74 -0.33 0.67 -0.69 -0.31 0.00 0.00 175.10 175.18 3i6z s VAL 142 N -2.28 4.89 -0.24 1.32 1.01 -0.65 -4.42 120.40 120.02 3i6z s VAL 142 Ca 0.29 0.88 -0.08 0.00 0.00 0.00 0.00 61.98 63.07 3i6z s VAL 142 Cb -0.06 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 3i6z s VAL 142 CO 0.15 -0.21 0.10 -0.22 0.00 0.00 0.00 175.10 174.92 3i6z s LEU 143 N 2.73 3.66 -0.06 3.92 1.98 -0.63 -1.89 118.68 128.39 3i6z s LEU 143 Ca 0.27 -0.09 0.03 0.00 -2.89 0.00 0.00 54.13 51.45 3i6z s LEU 143 Cb -0.15 -1.98 -0.02 0.00 0.66 0.00 0.00 46.19 44.70 3i6z s LEU 143 CO 0.13 0.01 -0.14 -0.69 -1.89 0.00 0.00 176.35 173.76 3i6z s VAL 144 N 1.36 3.05 -0.13 1.68 1.01 0.11 -0.70 120.40 126.78 3i6z s VAL 144 Ca 0.06 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.33 3i6z s VAL 144 Cb -0.15 -2.20 0.01 0.00 0.00 0.00 0.00 36.38 34.05 3i6z s VAL 144 CO 0.05 0.58 -0.18 -0.94 0.00 0.00 0.00 175.10 174.62 3i6z s SER 145 N -0.62 2.73 0.45 3.32 1.04 -0.09 0.82 113.70 121.36 3i6z s SER 145 Ca 0.09 -0.51 0.03 0.00 0.48 0.00 0.00 55.95 56.05 3i6z s SER 145 Cb -0.11 -1.24 0.07 0.00 0.10 0.00 0.00 66.02 64.84 3i6z s SER 145 CO 0.01 0.03 0.53 0.00 0.98 0.00 0.00 173.24 174.78 3i6z n LEU 146 N 4.26 0.00 -4.07 2.42 -0.00 -0.93 -1.07 117.00 117.62 3i6z n LEU 146 Ca -0.19 -1.38 -0.10 0.00 -0.00 0.00 0.00 56.01 54.34 3i6z n LEU 146 Cb 0.51 -0.31 -0.09 0.00 -0.00 0.00 0.00 43.42 43.54 3i6z n LEU 146 CO 0.25 -0.70 -0.18 -0.94 -0.00 0.00 0.00 177.39 175.82 3i6z s SER 147 N -3.25 0.20 -0.03 1.45 1.04 -1.18 -4.57 113.70 107.35 3i6z s SER 147 Ca 0.37 -1.06 -0.29 0.00 0.48 0.00 0.00 55.95 55.46 3i6z s SER 147 Cb -0.03 0.35 0.09 0.00 0.10 0.00 0.00 66.02 66.54 3i6z s SER 147 CO 0.24 -0.79 0.79 -0.72 0.98 0.00 0.00 173.24 173.74 3i6z s TYR 148 N -4.01 -0.50 0.29 5.02 1.13 -1.26 -4.45 117.35 113.56 3i6z s TYR 148 Ca 0.21 0.69 -0.29 0.00 -1.41 0.00 0.00 57.07 56.26 3i6z s TYR 148 Cb 0.06 0.47 -0.10 0.00 -1.10 0.00 0.00 41.96 41.29 3i6z s TYR 148 CO 0.01 -0.57 1.32 1.03 -2.51 0.00 0.00 175.55 174.82 3i6z s ARG 149 N -1.99 4.36 0.47 -3.49 0.52 -1.26 -4.89 118.95 112.66 3i6z s ARG 149 Ca -0.03 2.17 0.04 0.00 -0.52 0.00 0.00 55.73 57.39 3i6z s ARG 149 Cb -0.00 -3.11 -0.04 0.00 0.52 0.00 0.00 34.95 32.31 3i6z s ARG 149 CO 0.00 -0.22 0.01 0.14 0.02 0.00 0.00 175.30 175.25 3i6z s VAL 150 N -0.68 1.48 0.00 3.52 -7.23 -1.26 -4.15 120.40 112.08 3i6z s VAL 150 Ca 0.52 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.69 3i6z s VAL 150 Cb -0.39 -2.51 0.00 0.00 0.56 0.00 0.00 36.38 34.04 3i6z s VAL 150 CO 0.47 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.87 3i6z n GLY 151 N -1.13 0.85 0.36 2.32 0.00 0.10 -2.67 105.19 105.03 3i6z n GLY 151 Ca -0.13 -0.77 0.09 0.00 0.00 0.00 0.00 46.02 45.21 3i6z n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i6z h ALA 152 N -0.93 1.77 -0.27 4.61 0.00 -1.90 -0.71 119.26 121.83 3i6z h ALA 152 Ca 0.00 -0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.98 3i6z h ALA 152 Cb 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3i6z h ALA 152 CO 0.00 0.05 0.20 0.74 0.00 0.00 0.00 179.25 180.24 3i6z h PHE 153 N 0.74 0.03 0.00 0.00 0.04 -1.91 -1.33 116.94 114.50 3i6z h PHE 153 Ca 0.39 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.16 3i6z h PHE 153 Cb 0.50 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.64 3i6z h PHE 153 CO -0.00 0.02 -0.81 0.41 -0.60 0.00 0.00 178.31 177.33 3i6z n GLY 154 N -1.58 -0.13 0.00 -1.45 0.00 -0.62 -4.17 105.19 97.24 3i6z n GLY 154 Ca 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.78 3i6z n GLY 154 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3i6z n PHE 155 N -1.44 0.00 -1.70 1.61 3.72 -0.37 -0.90 117.46 118.38 3i6z n PHE 155 Ca 0.01 -0.05 -0.43 0.00 -0.05 0.00 0.00 57.45 56.92 3i6z n PHE 155 Cb 0.20 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.70 3i6z n PHE 155 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 3i6z n LEU 156 N -0.05 3.70 -3.84 4.37 7.94 -0.52 -4.41 117.00 124.19 3i6z n LEU 156 Ca 0.00 1.06 -0.27 0.00 -1.11 0.00 0.00 56.01 55.69 3i6z n LEU 156 Cb 0.36 -1.52 -0.17 0.00 0.53 0.00 0.00 43.42 42.62 3i6z n LEU 156 CO 0.00 0.03 -0.40 0.00 -1.11 0.00 0.00 177.39 175.90 3i6z s ALA 157 N 1.19 1.25 -0.73 1.96 0.00 -1.26 -3.38 121.76 120.79 3i6z s ALA 157 Ca 0.77 -0.69 0.04 0.00 0.00 0.00 0.00 51.96 52.08 3i6z s ALA 157 Cb -0.56 -1.07 0.18 0.00 0.00 0.00 0.00 23.12 21.66 3i6z s ALA 157 CO 0.34 -0.81 0.54 -0.51 0.00 0.00 0.00 175.76 175.32 3i6z s LEU 158 N 1.74 4.94 0.18 0.00 1.43 0.28 -3.02 118.68 124.23 3i6z s LEU 158 Ca 0.01 -3.86 -0.33 0.00 -1.03 0.00 0.00 54.13 48.92 3i6z s LEU 158 Cb -0.15 -1.67 -0.14 0.00 0.03 0.00 0.00 46.19 44.25 3i6z s LEU 158 CO -0.07 -0.09 1.47 1.57 0.23 0.00 0.00 176.35 179.46 3i6z n HIS 159 N 2.00 2.11 0.00 0.29 -0.00 -1.26 -1.52 115.22 116.84 3i6z n HIS 159 Ca 0.20 0.38 0.00 0.00 -0.00 0.00 0.00 57.72 58.30 3i6z n HIS 159 Cb 0.35 -2.48 0.00 0.00 -0.00 0.00 0.00 29.99 27.86 3i6z n HIS 159 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3i6z n GLY 160 N 2.82 2.02 3.86 1.57 0.00 -1.26 -5.07 105.19 109.13 3i6z n GLY 160 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 3i6z n GLY 160 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3i6z s SER 161 N -1.64 6.09 -0.00 1.61 0.15 -0.57 -4.99 113.70 114.34 3i6z s SER 161 Ca 0.00 0.24 0.21 0.00 0.70 0.00 0.00 55.95 57.11 3i6z s SER 161 Cb 0.00 -1.84 -0.18 0.00 -1.71 0.00 0.00 66.02 62.29 3i6z s SER 161 CO 0.00 0.24 0.88 0.00 1.20 0.00 0.00 173.24 175.56 3i6z n GLN 162 N 0.83 0.10 0.07 5.44 1.13 -1.26 -3.22 117.38 120.46 3i6z n GLN 162 Ca -0.10 -0.03 -0.08 0.00 -1.94 0.00 0.00 57.00 54.86 3i6z n GLN 162 Cb 0.52 -1.51 -0.12 0.00 0.11 0.00 0.00 30.24 29.25 3i6z n GLN 162 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 3i6z h GLU 163 N 0.00 0.03 -1.09 -1.09 4.39 -1.93 -3.40 114.58 111.48 3i6z h GLU 163 Ca 0.00 -0.05 -0.39 0.00 0.34 0.00 0.00 59.36 59.26 3i6z h GLU 163 Cb 0.58 0.02 -0.27 0.00 -0.10 0.00 0.00 28.75 28.97 3i6z h GLU 163 CO 0.00 1.02 -0.81 0.00 -1.16 0.00 0.00 179.01 178.06 3i6z n ALA 164 N -2.37 0.57 0.25 3.43 0.00 -1.26 -3.42 120.51 117.71 3i6z n ALA 164 Ca -0.01 -2.41 0.13 0.00 0.00 0.00 0.00 53.44 51.16 3i6z n ALA 164 Cb 0.94 -1.07 0.56 0.00 0.00 0.00 0.00 19.45 19.88 3i6z n ALA 164 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3i6z h PRO 165 N 4.11 0.00 0.00 0.00 0.13 -1.74 0.82 132.00 135.32 3i6z h PRO 165 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 3i6z h PRO 165 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 3i6z h PRO 165 CO 0.38 0.13 0.00 0.41 -0.23 0.00 0.00 178.00 178.69 3i6z n GLY 166 N 0.09 0.82 2.94 1.56 0.00 -1.22 -4.44 105.19 104.94 3i6z n GLY 166 Ca 0.00 -1.91 -0.02 0.00 0.00 0.00 0.00 46.02 44.09 3i6z n GLY 166 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3i6z n ASN 167 N -0.41 -5.84 0.26 1.61 3.02 -1.26 -4.84 115.26 107.81 3i6z n ASN 167 Ca 0.00 0.05 0.13 0.00 -0.03 0.00 0.00 54.58 54.72 3i6z n ASN 167 Cb 0.00 -3.56 0.73 0.00 -0.61 0.00 0.00 39.78 36.34 3i6z n ASN 167 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 3i6z h VAL 168 N 0.00 0.59 -0.31 2.41 -1.51 -1.80 -0.66 116.25 114.97 3i6z h VAL 168 Ca -0.04 -0.49 -0.11 0.00 -1.23 0.00 0.00 66.70 64.83 3i6z h VAL 168 Cb 1.01 1.32 -0.01 0.00 -2.13 0.00 0.00 31.29 31.47 3i6z h VAL 168 CO 0.05 0.11 -0.27 1.23 -1.23 0.00 0.00 177.57 177.47 3i6z h GLY 169 N 0.77 0.67 1.31 5.19 0.00 -1.23 0.14 103.07 109.92 3i6z h GLY 169 Ca -0.00 -0.57 -0.14 0.00 0.00 0.00 0.00 47.33 46.62 3i6z h GLY 169 CO 0.01 0.52 -0.35 1.41 0.00 0.00 0.00 176.54 178.14 3i6z h LEU 170 N 0.53 0.80 -1.20 3.11 3.38 -1.40 -2.28 115.31 118.25 3i6z h LEU 170 Ca 0.07 -0.35 -0.08 0.00 0.09 0.00 0.00 57.88 57.61 3i6z h LEU 170 Cb 0.74 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 3i6z h LEU 170 CO 0.06 1.08 -0.39 -0.07 0.09 0.00 0.00 178.44 179.20 3i6z h LEU 171 N 0.64 0.02 -0.45 1.67 3.38 -0.80 -0.20 115.31 119.57 3i6z h LEU 171 Ca 0.06 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 3i6z h LEU 171 Cb 0.89 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 3i6z h LEU 171 CO 0.08 0.41 0.22 0.44 0.09 0.00 0.00 178.44 179.68 3i6z h ASP 172 N 0.01 0.59 -0.59 -0.43 3.32 -0.40 0.95 116.42 119.88 3i6z h ASP 172 Ca -0.00 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 56.88 3i6z h ASP 172 Cb 0.70 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.07 3i6z h ASP 172 CO 0.05 0.55 0.21 1.56 -1.72 0.00 0.00 179.24 179.89 3i6z h GLN 173 N 0.59 0.90 -0.77 3.56 4.20 -0.79 -1.88 115.11 120.91 3i6z h GLN 173 Ca 0.15 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 3i6z h GLN 173 Cb 0.11 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 27.72 3i6z h GLN 173 CO -0.02 0.79 0.43 -0.09 -0.67 0.00 0.00 178.83 179.27 3i6z h ARG 174 N 0.83 1.08 -0.76 1.46 2.43 -0.71 -1.01 114.38 117.70 3i6z h ARG 174 Ca 0.19 -0.12 -0.04 0.00 -0.81 0.00 0.00 59.98 59.20 3i6z h ARG 174 Cb 0.24 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 3i6z h ARG 174 CO -0.01 0.79 0.32 1.98 -1.51 0.00 0.00 179.97 181.54 3i6z h MET 175 N 1.07 1.13 -0.63 0.20 4.05 -0.43 0.40 114.93 120.71 3i6z h MET 175 Ca 0.27 -0.19 -0.09 0.00 -0.28 0.00 0.00 59.70 59.41 3i6z h MET 175 Cb 0.03 -0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 30.61 3i6z h MET 175 CO -0.04 0.90 0.05 0.00 0.23 0.00 0.00 176.91 178.05 3i6z h ALA 176 N 1.24 0.90 -0.20 0.39 0.00 -0.83 -1.06 119.26 119.70 3i6z h ALA 176 Ca 0.26 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3i6z h ALA 176 Cb 0.19 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3i6z h ALA 176 CO -0.02 0.66 -0.18 -0.07 0.00 0.00 0.00 179.25 179.64 3i6z h LEU 177 N 0.99 0.34 -0.46 0.00 3.38 -0.56 -0.62 115.31 118.38 3i6z h LEU 177 Ca 0.19 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 3i6z h LEU 177 Cb 0.50 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3i6z h LEU 177 CO 0.02 0.54 -0.14 -0.61 0.09 0.00 0.00 178.44 178.34 3i6z h GLN 178 N 0.32 0.90 -0.47 1.13 5.75 -0.38 0.02 115.11 122.38 3i6z h GLN 178 Ca 0.06 -0.36 -0.04 0.00 -0.15 0.00 0.00 58.65 58.16 3i6z h GLN 178 Cb 0.51 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.99 3i6z h GLN 178 CO 0.03 1.01 0.15 2.35 -2.65 0.00 0.00 178.83 179.72 3i6z h TRP 179 N 0.74 0.75 -0.14 3.99 7.01 -0.78 0.38 115.95 127.90 3i6z h TRP 179 Ca 0.11 -0.07 -0.00 0.00 2.11 0.00 0.00 58.89 61.04 3i6z h TRP 179 Cb 0.69 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.53 3i6z h TRP 179 CO 0.05 0.66 0.08 0.28 -2.79 0.00 0.00 178.44 176.73 3i6z h VAL 180 N 0.62 1.06 -0.49 2.65 2.07 -0.99 0.22 116.25 121.39 3i6z h VAL 180 Ca 0.15 -0.14 0.03 0.00 0.82 0.00 0.00 66.70 67.57 3i6z h VAL 180 Cb 0.26 0.91 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 3i6z h VAL 180 CO -0.01 0.05 0.27 -0.74 0.02 0.00 0.00 177.57 177.17 3i6z h HIS 181 N 0.16 0.51 -0.03 1.57 -0.00 -0.70 0.65 115.15 117.31 3i6z h HIS 181 Ca 0.05 0.02 -0.15 0.00 -0.00 0.00 0.00 60.37 60.29 3i6z h HIS 181 Cb 0.01 -0.16 -0.01 0.00 -0.00 0.00 0.00 27.41 27.25 3i6z h HIS 181 CO -0.06 0.27 -0.64 -0.44 -0.00 0.00 0.00 177.93 177.06 3i6z h ASP 182 N 0.54 0.16 0.00 3.26 3.32 -0.63 -3.40 116.42 119.66 3i6z h ASP 182 Ca 0.21 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 57.16 3i6z h ASP 182 Cb 0.07 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.58 3i6z h ASP 182 CO -0.12 0.76 -0.24 0.59 -1.72 0.00 0.00 179.24 178.51 3i6z n ASN 183 N -3.82 1.19 0.31 6.45 3.02 0.76 -4.77 115.26 118.39 3i6z n ASN 183 Ca -0.02 -0.38 0.18 0.00 -0.03 0.00 0.00 54.58 54.33 3i6z n ASN 183 Cb 0.64 0.99 1.01 0.00 -0.61 0.00 0.00 39.78 41.81 3i6z n ASN 183 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 3i6z h ILE 184 N 0.00 0.35 -0.15 2.41 6.09 -1.01 -1.58 117.51 123.62 3i6z h ILE 184 Ca 0.00 0.00 0.04 0.00 -1.37 0.00 0.00 64.86 63.53 3i6z h ILE 184 Cb 0.00 0.99 -0.01 0.00 0.47 0.00 0.00 36.82 38.27 3i6z h ILE 184 CO 0.00 0.00 0.11 0.06 -3.07 0.00 0.00 178.15 175.25 3i6z h GLN 185 N 0.00 0.00 0.00 2.19 3.07 -1.80 -0.24 115.11 118.34 3i6z h GLN 185 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3i6z h GLN 185 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.59 3i6z h GLN 185 CO -0.00 0.00 0.00 0.74 0.09 0.00 0.00 178.83 179.66 3i6z h PHE 186 N 0.00 0.00 -0.45 0.06 0.04 -1.56 -2.35 116.94 112.67 3i6z h PHE 186 Ca 0.07 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.84 3i6z h PHE 186 Cb 0.28 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.43 3i6z h PHE 186 CO 0.00 0.00 0.00 1.19 -0.60 0.00 0.00 178.31 178.90 3i6z n PHE 187 N -2.65 0.59 -0.24 -0.55 3.01 -0.22 -4.86 117.46 112.55 3i6z n PHE 187 Ca 0.03 -0.29 0.00 0.00 1.01 0.00 0.00 57.45 58.19 3i6z n PHE 187 Cb 0.34 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.81 3i6z n PHE 187 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3i6z n GLY 188 N 1.55 0.65 3.87 1.37 0.00 -0.88 -4.54 105.19 107.20 3i6z n GLY 188 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 3i6z n GLY 188 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3i6z s GLY 189 N -1.33 2.08 -0.46 -0.02 0.00 -0.52 -0.22 107.32 106.85 3i6z s GLY 189 Ca 0.00 -0.15 -0.16 0.00 0.00 0.00 0.00 44.72 44.41 3i6z s GLY 189 CO 0.00 0.04 0.42 -0.35 0.00 0.00 0.00 173.10 173.21 3i6z s ASP 190 N -2.84 6.16 0.43 1.64 2.15 0.24 -3.24 116.67 121.21 3i6z s ASP 190 Ca 0.52 -1.09 0.29 0.00 0.43 0.00 0.00 52.55 52.69 3i6z s ASP 190 Cb -0.10 -2.20 1.56 0.00 -0.30 0.00 0.00 42.92 41.88 3i6z s ASP 190 CO 0.26 -0.64 1.88 -0.65 -0.17 0.00 0.00 175.17 175.85 3i6z h PRO 191 N 8.77 0.00 0.00 4.34 0.11 -1.88 0.10 132.00 143.43 3i6z h PRO 191 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3i6z h PRO 191 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3i6z h PRO 191 CO 0.85 0.00 -0.14 1.63 -0.21 0.00 0.00 178.00 180.13 3i6z n LYS 192 N -2.51 0.23 -3.10 1.05 5.02 -1.26 -4.27 118.16 113.31 3i6z n LYS 192 Ca -0.02 0.15 -0.23 0.00 -2.02 0.00 0.00 58.31 56.19 3i6z n LYS 192 Cb 0.05 -1.73 -0.04 0.00 -0.02 0.00 0.00 35.03 33.29 3i6z n LYS 192 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3i6z n THR 193 N -2.11 1.46 -3.69 -0.18 -1.04 0.02 -4.71 114.28 104.03 3i6z n THR 193 Ca 0.05 -5.04 -0.37 0.00 -2.04 0.00 0.00 64.05 56.65 3i6z n THR 193 Cb 0.42 -1.09 -0.11 0.00 -1.82 0.00 0.00 70.33 67.73 3i6z n THR 193 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3i6z s VAL 194 N -3.22 5.09 -0.22 12.58 1.01 -1.26 -1.84 120.40 132.54 3i6z s VAL 194 Ca 0.43 0.09 -0.06 0.00 0.00 0.00 0.00 61.98 62.44 3i6z s VAL 194 Cb 0.28 -3.38 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 3i6z s VAL 194 CO -0.10 0.32 0.03 -0.89 0.00 0.00 0.00 175.10 174.46 3i6z s THR 195 N 1.34 4.15 -0.03 3.92 2.01 0.83 -0.48 115.64 127.39 3i6z s THR 195 Ca 0.07 -0.24 -0.13 0.00 0.31 0.00 0.00 61.69 61.70 3i6z s THR 195 Cb -0.15 -2.90 -0.05 0.00 0.01 0.00 0.00 72.50 69.41 3i6z s THR 195 CO 0.06 0.40 0.35 0.27 -0.69 0.00 0.00 174.62 175.01 3i6z s ILE 196 N 1.20 5.13 -0.01 1.82 -4.36 -0.80 -0.62 121.20 123.56 3i6z s ILE 196 Ca 0.04 0.71 -0.07 0.00 -0.26 0.00 0.00 60.65 61.07 3i6z s ILE 196 Cb -0.14 -3.65 0.00 0.00 1.25 0.00 0.00 42.46 39.92 3i6z s ILE 196 CO 0.02 0.58 0.14 0.72 0.24 0.00 0.00 174.94 176.64 3i6z s PHE 197 N -1.00 -0.01 0.14 1.37 -0.71 -0.16 -1.01 117.98 116.59 3i6z s PHE 197 Ca 0.22 0.00 -0.25 0.00 -1.04 0.00 0.00 56.93 55.86 3i6z s PHE 197 Cb -0.16 -0.02 0.07 0.00 -1.21 0.00 0.00 43.02 41.70 3i6z s PHE 197 CO 0.11 -0.24 0.81 0.20 -1.34 0.00 0.00 175.22 174.77 3i6z s GLY 198 N -1.02 -0.35 0.00 1.99 0.00 -1.12 -0.67 107.32 106.15 3i6z s GLY 198 Ca -0.11 0.36 0.08 0.00 0.00 0.00 0.00 44.72 45.06 3i6z s GLY 198 CO 0.01 0.11 -0.25 1.85 0.00 0.00 0.00 173.10 174.82 3i6z s GLU 199 N -3.47 1.93 6.92 2.90 -6.30 -1.24 -1.32 118.70 118.12 3i6z s GLU 199 Ca 0.08 -0.97 0.00 0.00 -2.50 0.00 0.00 54.97 51.58 3i6z s GLU 199 Cb -0.02 -1.95 0.00 0.00 0.00 0.00 0.00 34.13 32.16 3i6z s GLU 199 CO -0.03 0.52 0.00 0.45 0.02 0.00 0.00 175.26 176.22 3i6z n SER 200 N 2.21 0.00 0.07 -1.70 2.88 0.10 -0.81 113.62 116.37 3i6z n SER 200 Ca -0.16 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.50 3i6z n SER 200 Cb 0.52 0.00 0.60 0.00 -0.75 0.00 0.00 64.21 64.58 3i6z n SER 200 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3i6z h ALA 201 N -0.89 2.13 -0.20 -1.46 0.00 -1.88 0.42 119.26 117.38 3i6z h ALA 201 Ca 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 3i6z h ALA 201 Cb 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3i6z h ALA 201 CO 0.00 -0.22 -0.43 0.78 0.00 0.00 0.00 179.25 179.38 3i6z h GLY 202 N 0.16 0.52 1.28 0.00 0.00 -1.02 0.93 103.07 104.94 3i6z h GLY 202 Ca 0.16 -0.53 -0.18 0.00 0.00 0.00 0.00 47.33 46.78 3i6z h GLY 202 CO -0.02 0.48 -0.56 -1.33 0.00 0.00 0.00 176.54 175.11 3i6z h GLY 203 N 1.11 0.82 0.98 4.60 0.00 -0.48 -0.93 103.07 109.18 3i6z h GLY 203 Ca 0.03 -0.97 -0.02 0.00 0.00 0.00 0.00 47.33 46.37 3i6z h GLY 203 CO 0.08 0.87 0.26 0.00 0.00 0.00 0.00 176.54 177.74 3i6z h ALA 204 N 0.79 0.72 -0.13 3.60 0.00 -0.17 -2.23 119.26 121.85 3i6z h ALA 204 Ca 0.01 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.81 3i6z h ALA 204 Cb 1.15 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 3i6z h ALA 204 CO 0.12 0.30 -0.05 0.77 0.00 0.00 0.00 179.25 180.39 3i6z h SER 205 N 0.76 -0.16 -0.56 0.00 0.02 -0.57 -0.03 113.55 113.02 3i6z h SER 205 Ca 0.19 0.04 0.10 0.00 -0.84 0.00 0.00 61.79 61.29 3i6z h SER 205 Cb 0.14 0.10 -0.08 0.00 0.14 0.00 0.00 62.40 62.70 3i6z h SER 205 CO -0.02 -0.06 0.11 0.58 -1.14 0.00 0.00 176.83 176.29 3i6z h VAL 206 N -0.02 0.66 -0.03 2.27 2.07 -0.98 0.12 116.25 120.33 3i6z h VAL 206 Ca 0.07 -0.08 -0.04 0.00 0.82 0.00 0.00 66.70 67.46 3i6z h VAL 206 Cb 0.12 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 3i6z h VAL 206 CO -0.14 0.04 -0.19 1.23 0.02 0.00 0.00 177.57 178.53 3i6z h GLY 207 N 0.24 0.05 1.83 2.17 0.00 -0.77 -2.01 103.07 104.57 3i6z h GLY 207 Ca 0.29 -0.03 -0.13 0.00 0.00 0.00 0.00 47.33 47.46 3i6z h GLY 207 CO -0.38 0.03 -0.54 -0.33 0.00 0.00 0.00 176.54 175.32 3i6z h MET 208 N 0.05 0.18 0.00 4.80 2.86 0.85 -1.94 114.93 121.73 3i6z h MET 208 Ca 0.01 -0.11 -0.11 0.00 -2.06 0.00 0.00 59.70 57.43 3i6z h MET 208 Cb 0.37 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 3i6z h MET 208 CO 0.03 0.68 -0.51 0.45 1.06 0.00 0.00 176.91 178.61 3i6z h HIS 209 N 0.14 0.00 -0.31 -0.22 3.86 -0.54 0.56 115.15 118.64 3i6z h HIS 209 Ca 0.00 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.07 3i6z h HIS 209 Cb 1.00 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.46 3i6z h HIS 209 CO 0.01 0.51 -0.36 0.82 0.86 0.00 0.00 177.93 179.78 3i6z h ILE 210 N 0.00 1.29 0.00 2.45 2.04 -1.06 -3.18 117.51 119.05 3i6z h ILE 210 Ca -0.01 -1.52 -0.01 0.00 1.00 0.00 0.00 64.86 64.33 3i6z h ILE 210 Cb 1.17 1.43 0.00 0.00 -0.74 0.00 0.00 36.82 38.69 3i6z h ILE 210 CO 0.07 0.49 -0.02 -0.07 0.00 0.00 0.00 178.15 178.61 3i6z h LEU 211 N 0.59 0.02 -9.19 1.44 3.38 -1.07 0.09 115.31 110.56 3i6z h LEU 211 Ca 0.06 -0.87 -0.55 0.00 0.09 0.00 0.00 57.88 56.60 3i6z h LEU 211 Cb 0.89 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.63 3i6z h LEU 211 CO 0.08 0.89 1.20 -0.55 0.09 0.00 0.00 178.44 180.15 3i6z s SER 212 N -6.11 6.35 0.35 -0.43 0.15 0.16 -4.64 113.70 109.53 3i6z s SER 212 Ca -0.18 2.17 0.12 0.00 0.70 0.00 0.00 55.95 58.76 3i6z s SER 212 Cb -0.02 -2.53 0.95 0.00 -1.71 0.00 0.00 66.02 62.71 3i6z s SER 212 CO 0.69 -1.20 1.75 -0.65 1.20 0.00 0.00 173.24 175.04 3i6z h PRO 213 N 10.97 0.52 0.00 5.44 0.11 -1.87 0.18 132.00 147.36 3i6z h PRO 213 Ca -0.41 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3i6z h PRO 213 Cb 1.20 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3i6z h PRO 213 CO 0.96 0.34 0.00 0.41 -0.21 0.00 0.00 178.00 179.51 3i6z n GLY 214 N -1.38 -0.89 0.01 -0.55 0.00 -1.26 -3.61 105.19 97.51 3i6z n GLY 214 Ca 0.26 -0.12 -0.01 0.00 0.00 0.00 0.00 46.02 46.15 3i6z n GLY 214 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3i6z n SER 215 N -1.16 4.04 -0.30 1.61 7.64 0.01 -4.81 113.62 120.64 3i6z n SER 215 Ca 0.13 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.16 3i6z n SER 215 Cb 0.13 0.76 0.31 0.00 -1.01 0.00 0.00 64.21 64.40 3i6z n SER 215 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 3i6z h ARG 216 N 0.00 0.17 0.00 1.43 3.08 -1.43 -1.06 114.38 116.58 3i6z h ARG 216 Ca -0.08 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.96 3i6z h ARG 216 Cb 0.96 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.97 3i6z h ARG 216 CO 0.00 0.12 0.00 -0.25 -1.07 0.00 0.00 179.97 178.77 3i6z n ASP 217 N -5.25 0.01 -0.10 7.04 8.00 -1.26 -3.66 116.55 121.33 3i6z n ASP 217 Ca 0.23 0.50 0.15 0.00 0.71 0.00 0.00 54.79 56.38 3i6z n ASP 217 Cb 0.73 -0.50 0.80 0.00 -0.02 0.00 0.00 41.12 42.13 3i6z n ASP 217 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3i6z n LEU 218 N -1.51 0.33 -3.88 0.64 4.77 -0.40 -4.91 117.00 112.04 3i6z n LEU 218 Ca 0.05 -0.05 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 3i6z n LEU 218 Cb 0.24 -0.06 -0.05 0.00 -2.33 0.00 0.00 43.42 41.22 3i6z n LEU 218 CO 0.19 0.06 0.22 0.72 -1.33 0.00 0.00 177.39 177.24 3i6z s PHE 219 N -2.14 0.12 -0.25 -1.77 -0.71 -1.24 -4.77 117.98 107.22 3i6z s PHE 219 Ca 0.41 -0.48 -0.14 0.00 -1.04 0.00 0.00 56.93 55.67 3i6z s PHE 219 Cb 0.21 0.29 -0.15 0.00 -1.21 0.00 0.00 43.02 42.16 3i6z s PHE 219 CO 0.39 -0.95 -0.14 -2.13 -1.34 0.00 0.00 175.22 171.05 3i6z n ARG 220 N -0.35 0.60 -4.22 1.99 3.00 0.37 -4.95 116.66 113.10 3i6z n ARG 220 Ca -0.06 0.34 -0.14 0.00 -0.00 0.00 0.00 57.85 57.99 3i6z n ARG 220 Cb 0.62 -1.58 -0.09 0.00 0.00 0.00 0.00 32.46 31.41 3i6z n ARG 220 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 3i6z s ARG 221 N -2.47 1.38 -0.01 -0.14 0.52 -1.07 -4.67 118.95 112.48 3i6z s ARG 221 Ca -0.35 -1.74 -0.06 0.00 -0.52 0.00 0.00 55.73 53.06 3i6z s ARG 221 Cb 0.11 0.29 0.00 0.00 0.52 0.00 0.00 34.95 35.88 3i6z s ARG 221 CO 0.55 -0.48 0.13 0.00 0.02 0.00 0.00 175.30 175.52 3i6z s ALA 222 N -3.93 -0.32 -0.09 2.13 0.00 -1.14 -1.90 121.76 116.51 3i6z s ALA 222 Ca 0.39 0.01 0.02 0.00 0.00 0.00 0.00 51.96 52.38 3i6z s ALA 222 Cb 0.05 0.00 0.01 0.00 0.00 0.00 0.00 23.12 23.19 3i6z s ALA 222 CO 0.17 -0.16 -0.13 0.42 0.00 0.00 0.00 175.76 176.05 3i6z s ILE 223 N -0.95 1.26 -0.18 0.00 1.01 -0.18 -1.61 121.20 120.56 3i6z s ILE 223 Ca -0.10 -0.52 0.01 0.00 0.00 0.00 0.00 60.65 60.03 3i6z s ILE 223 Cb -0.06 -1.17 0.02 0.00 0.01 0.00 0.00 42.46 41.27 3i6z s ILE 223 CO 0.01 0.39 -0.20 -0.76 0.00 0.00 0.00 174.94 174.39 3i6z s LEU 224 N 0.89 2.11 -0.27 2.97 1.02 -0.43 -2.79 118.68 122.18 3i6z s LEU 224 Ca -0.10 -0.64 -0.05 0.00 0.02 0.00 0.00 54.13 53.36 3i6z s LEU 224 Cb -0.15 -1.46 0.01 0.00 0.02 0.00 0.00 46.19 44.61 3i6z s LEU 224 CO 0.01 -0.01 0.02 -1.10 0.02 0.00 0.00 176.35 175.30 3i6z s GLN 225 N 1.30 3.13 -1.55 1.70 -0.21 -0.43 -2.11 119.66 121.49 3i6z s GLN 225 Ca 0.05 -0.81 -0.13 0.00 0.02 0.00 0.00 55.36 54.49 3i6z s GLN 225 Cb -0.13 -3.21 0.09 0.00 1.00 0.00 0.00 33.01 30.76 3i6z s GLN 225 CO -0.13 -0.37 0.87 0.43 -2.12 0.00 0.00 175.29 173.97 3i6z n SER 226 N 4.81 -3.77 -3.58 5.90 7.64 0.37 0.03 113.62 125.03 3i6z n SER 226 Ca -0.16 -0.86 -0.12 0.00 1.01 0.00 0.00 58.87 58.74 3i6z n SER 226 Cb 0.49 -3.55 -0.06 0.00 -1.01 0.00 0.00 64.21 60.08 3i6z n SER 226 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3i6z s GLY 227 N -3.48 -0.33 -0.07 0.23 0.00 -1.26 -3.22 107.32 99.19 3i6z s GLY 227 Ca 0.58 2.02 -0.13 0.00 0.00 0.00 0.00 44.72 47.19 3i6z s GLY 227 CO 0.86 1.24 0.31 -0.45 0.00 0.00 0.00 173.10 175.06 3i6z s SER 228 N -0.74 -0.26 0.53 1.64 0.15 -1.26 -4.23 113.70 109.53 3i6z s SER 228 Ca -0.02 0.38 0.19 0.00 0.70 0.00 0.00 55.95 57.19 3i6z s SER 228 Cb -0.02 0.50 1.35 0.00 -1.71 0.00 0.00 66.02 66.14 3i6z s SER 228 CO 0.02 -0.26 2.13 1.55 1.20 0.00 0.00 173.24 177.88 3i6z h PRO 229 N 4.84 0.00 -0.21 5.44 0.13 -1.81 -2.07 132.00 138.33 3i6z h PRO 229 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3i6z h PRO 229 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3i6z h PRO 229 CO 0.35 0.00 0.00 0.27 -0.23 0.00 0.00 178.00 178.39 3i6z n ASN 230 N -4.44 1.31 -4.70 1.44 6.94 -1.26 -4.75 115.26 109.80 3i6z n ASN 230 Ca -0.01 -1.86 -0.42 0.00 -0.02 0.00 0.00 54.58 52.27 3i6z n ASN 230 Cb 0.17 -0.14 0.00 0.00 -2.36 0.00 0.00 39.78 37.46 3i6z n ASN 230 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3i6z h PRO 232 N 2.36 0.00 -0.00 0.00 0.13 -1.84 -1.42 132.00 131.23 3i6z h PRO 232 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3i6z h PRO 232 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 3i6z h PRO 232 CO 0.61 0.00 -0.92 -2.67 -0.23 0.00 0.00 178.00 174.79 3i6z n TRP 233 N -3.39 0.00 0.84 1.56 4.27 -1.26 -4.55 117.44 114.91 3i6z n TRP 233 Ca -0.01 0.00 0.13 0.00 -3.89 0.00 0.00 57.50 53.73 3i6z n TRP 233 Cb 0.23 -0.02 0.50 0.00 -1.36 0.00 0.00 31.31 30.66 3i6z n TRP 233 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 3i6z n ALA 234 N -1.41 2.40 -3.22 -1.67 0.00 -0.54 -4.66 120.51 111.41 3i6z n ALA 234 Ca 0.04 -0.09 -0.11 0.00 0.00 0.00 0.00 53.44 53.29 3i6z n ALA 234 Cb 0.34 -1.44 -0.04 0.00 0.00 0.00 0.00 19.45 18.31 3i6z n ALA 234 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3i6z s SER 235 N -3.62 -0.34 0.21 0.00 1.04 -1.26 -3.62 113.70 106.10 3i6z s SER 235 Ca 0.12 -0.27 0.01 0.00 0.48 0.00 0.00 55.95 56.29 3i6z s SER 235 Cb 0.16 0.54 -0.05 0.00 0.10 0.00 0.00 66.02 66.78 3i6z s SER 235 CO 0.57 -0.95 0.06 0.68 0.98 0.00 0.00 173.24 174.58 3i6z s VAL 236 N -3.81 0.53 0.77 5.02 -7.23 -0.44 -4.98 120.40 110.27 3i6z s VAL 236 Ca 0.04 -1.98 -0.12 0.00 -1.81 0.00 0.00 61.98 58.11 3i6z s VAL 236 Cb 0.00 -2.36 0.06 0.00 0.56 0.00 0.00 36.38 34.64 3i6z s VAL 236 CO -0.09 -0.24 1.14 -0.94 -0.31 0.00 0.00 175.10 174.66 3i6z s SER 237 N -3.22 4.84 0.37 4.85 1.04 -1.26 -1.91 113.70 118.40 3i6z s SER 237 Ca 0.31 0.95 0.14 0.00 0.48 0.00 0.00 55.95 57.83 3i6z s SER 237 Cb 0.07 -1.58 0.71 0.00 0.10 0.00 0.00 66.02 65.31 3i6z s SER 237 CO 0.08 -1.71 1.80 -0.37 0.98 0.00 0.00 173.24 174.02 3i6z h VAL 238 N -0.92 1.21 -0.29 5.02 -1.51 -1.95 0.05 116.25 117.87 3i6z h VAL 238 Ca -0.46 -1.39 -0.09 0.00 -1.23 0.00 0.00 66.70 63.54 3i6z h VAL 238 Cb 1.30 1.76 -0.01 0.00 -2.13 0.00 0.00 31.29 32.21 3i6z h VAL 238 CO 0.65 0.39 -0.17 0.00 -1.23 0.00 0.00 177.57 177.20 3i6z h ALA 239 N 1.61 0.41 -0.32 5.19 0.00 -1.95 -0.72 119.26 123.48 3i6z h ALA 239 Ca -0.00 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.42 3i6z h ALA 239 Cb 0.73 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3i6z h ALA 239 CO 0.05 0.32 -0.39 1.49 0.00 0.00 0.00 179.25 180.73 3i6z h GLU 240 N 0.36 0.75 -0.81 0.00 4.57 -1.88 -0.98 114.58 116.60 3i6z h GLU 240 Ca 0.06 -0.38 -0.01 0.00 -1.18 0.00 0.00 59.36 57.85 3i6z h GLU 240 Cb 0.70 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.26 3i6z h GLU 240 CO 0.05 1.00 0.47 0.78 -1.18 0.00 0.00 179.01 180.13 3i6z h GLY 241 N 0.93 1.18 0.83 1.92 0.00 -0.91 -1.25 103.07 105.76 3i6z h GLY 241 Ca 0.05 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 46.86 3i6z h GLY 241 CO 0.09 0.49 0.03 -0.09 0.00 0.00 0.00 176.54 177.06 3i6z h ARG 242 N 1.11 0.25 -0.88 4.80 2.43 -0.88 -1.56 114.38 119.65 3i6z h ARG 242 Ca 0.29 -0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.48 3i6z h ARG 242 Cb -0.02 -0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 29.43 3i6z h ARG 242 CO -0.05 0.41 0.53 -0.09 -1.51 0.00 0.00 179.97 179.26 3i6z h ARG 243 N 0.05 0.89 -0.27 0.20 2.43 -0.89 0.26 114.38 117.06 3i6z h ARG 243 Ca 0.05 -0.05 -0.15 0.00 -0.81 0.00 0.00 59.98 59.02 3i6z h ARG 243 Cb 0.27 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 3i6z h ARG 243 CO 0.00 0.59 -0.43 0.00 -1.51 0.00 0.00 179.97 178.62 3i6z h ARG 244 N 0.92 0.67 -0.42 0.20 3.08 -1.07 -0.18 114.38 117.58 3i6z h ARG 244 Ca 0.40 -0.36 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 3i6z h ARG 244 Cb 0.29 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 3i6z h ARG 244 CO -0.21 0.97 0.07 0.00 -1.07 0.00 0.00 179.97 179.73 3i6z h ALA 245 N 0.97 0.56 -0.62 0.04 0.00 -0.51 0.47 119.26 120.17 3i6z h ALA 245 Ca 0.04 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 3i6z h ALA 245 Cb 0.97 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 3i6z h ALA 245 CO 0.09 0.27 0.20 0.28 0.00 0.00 0.00 179.25 180.09 3i6z h VAL 246 N 0.55 1.24 -0.33 0.00 2.07 -0.86 -1.65 116.25 117.27 3i6z h VAL 246 Ca 0.13 -0.83 -0.05 0.00 0.82 0.00 0.00 66.70 66.76 3i6z h VAL 246 Cb 0.37 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 3i6z h VAL 246 CO 0.01 0.32 -0.02 -0.08 0.02 0.00 0.00 177.57 177.82 3i6z h GLU 247 N 0.89 0.52 -0.26 1.57 4.57 -0.78 0.17 114.58 121.25 3i6z h GLU 247 Ca 0.20 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 58.24 3i6z h GLU 247 Cb 0.29 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.79 3i6z h GLU 247 CO -0.01 0.56 0.08 1.25 -1.18 0.00 0.00 179.01 179.71 3i6z h LEU 248 N 0.49 0.39 -0.77 1.64 5.85 -0.45 -1.31 115.31 121.16 3i6z h LEU 248 Ca 0.10 -0.21 0.05 0.00 0.84 0.00 0.00 57.88 58.66 3i6z h LEU 248 Cb 0.35 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.23 3i6z h LEU 248 CO 0.01 0.49 0.47 1.23 -0.34 0.00 0.00 178.44 180.31 3i6z h GLY 249 N 0.26 1.14 1.93 3.75 0.00 -0.50 -0.97 103.07 108.67 3i6z h GLY 249 Ca 0.08 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 47.05 3i6z h GLY 249 CO -0.00 0.26 -0.06 -0.09 0.00 0.00 0.00 176.54 176.65 3i6z h ARG 250 N 0.89 0.09 0.00 4.80 2.43 -0.29 -0.78 114.38 121.52 3i6z h ARG 250 Ca 0.33 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.44 3i6z h ARG 250 Cb 0.11 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 3i6z h ARG 250 CO -0.15 0.16 -0.20 -0.91 -1.51 0.00 0.00 179.97 177.36 3i6z h ASN 251 N 0.09 0.00 -0.44 -3.80 2.35 -0.02 -3.11 115.58 110.64 3i6z h ASN 251 Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 3i6z h ASN 251 Cb 0.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.54 3i6z h ASN 251 CO 0.01 0.20 0.00 0.18 -1.65 0.00 0.00 177.43 176.17 3i6z n LEU 252 N -3.27 4.21 -3.69 1.61 4.77 -0.56 -4.96 117.00 115.11 3i6z n LEU 252 Ca 0.01 -2.61 -0.24 0.00 -0.03 0.00 0.00 56.01 53.14 3i6z n LEU 252 Cb 0.47 -0.51 0.05 0.00 -2.33 0.00 0.00 43.42 41.10 3i6z n LEU 252 CO 0.33 0.73 0.10 0.59 -1.33 0.00 0.00 177.39 177.81 3i6z n ASN 253 N 0.38 -3.73 -4.91 -1.43 4.13 -0.93 -4.97 115.26 103.79 3i6z n ASN 253 Ca 0.22 -0.70 -0.27 0.00 1.68 0.00 0.00 54.58 55.50 3i6z n ASN 253 Cb 0.84 -4.44 0.02 0.00 -1.54 0.00 0.00 39.78 34.65 3i6z n ASN 253 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3i6z s ASN 255 N -4.23 7.26 -0.08 0.00 3.84 -1.26 -4.79 114.94 115.67 3i6z s ASN 255 Ca 0.52 1.54 0.16 0.00 0.21 0.00 0.00 52.86 55.29 3i6z s ASN 255 Cb -0.10 -2.56 0.56 0.00 -0.55 0.00 0.00 41.25 38.60 3i6z s ASN 255 CO 0.46 -0.43 1.48 0.18 -2.79 0.00 0.00 177.10 176.00 3i6z n LEU 256 N 4.90 4.01 0.10 3.21 4.77 -1.26 -3.13 117.00 129.59 3i6z n LEU 256 Ca 0.08 -2.39 0.05 0.00 -0.03 0.00 0.00 56.01 53.72 3i6z n LEU 256 Cb 0.49 -0.47 0.49 0.00 -2.33 0.00 0.00 43.42 41.60 3i6z n LEU 256 CO 0.52 0.78 1.10 0.78 -1.33 0.00 0.00 177.39 179.24 3i6z h ASN 257 N 3.07 0.29 -5.14 -1.43 2.35 -1.95 -3.46 115.58 109.32 3i6z h ASN 257 Ca 0.00 -0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.69 3i6z h ASN 257 Cb 1.21 -0.07 -0.11 0.00 0.05 0.00 0.00 38.32 39.40 3i6z h ASN 257 CO 0.15 0.24 -0.07 -0.94 -1.65 0.00 0.00 177.43 175.16 3i6z s SER 258 N -6.83 -0.17 0.20 5.81 1.04 -1.26 -5.01 113.70 107.48 3i6z s SER 258 Ca -0.07 -0.60 -0.10 0.00 0.48 0.00 0.00 55.95 55.65 3i6z s SER 258 Cb 0.17 0.54 0.19 0.00 0.10 0.00 0.00 66.02 67.03 3i6z s SER 258 CO 0.71 -1.02 1.82 0.44 0.98 0.00 0.00 173.24 176.18 3i6z h ASP 259 N 2.29 0.61 -0.42 7.02 3.32 -1.95 0.68 116.42 127.97 3i6z h ASP 259 Ca -0.29 0.01 0.04 0.00 0.02 0.00 0.00 57.03 56.81 3i6z h ASP 259 Cb 1.25 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 40.65 3i6z h ASP 259 CO 0.40 0.41 0.19 -0.33 -1.72 0.00 0.00 179.24 178.19 3i6z h GLU 260 N 0.74 0.38 -0.46 3.56 3.07 -1.97 0.26 114.58 120.16 3i6z h GLU 260 Ca 0.28 -0.02 -0.04 0.00 -0.50 0.00 0.00 59.36 59.07 3i6z h GLU 260 Cb 0.09 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 27.90 3i6z h GLU 260 CO -0.14 0.25 0.12 0.93 -1.40 0.00 0.00 179.01 178.78 3i6z h GLU 261 N 0.39 0.73 0.14 2.33 4.39 -1.69 -2.05 114.58 118.82 3i6z h GLU 261 Ca 0.18 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.71 3i6z h GLU 261 Cb 0.11 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.67 3i6z h GLU 261 CO -0.15 0.71 -0.07 1.25 -1.16 0.00 0.00 179.01 179.60 3i6z h LEU 262 N 0.61 -0.16 -0.65 1.33 5.85 -0.15 -2.45 115.31 119.70 3i6z h LEU 262 Ca 0.15 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 3i6z h LEU 262 Cb 0.30 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 3i6z h LEU 262 CO -0.00 0.02 0.36 0.40 -0.34 0.00 0.00 178.44 178.88 3i6z h ILE 263 N -0.33 1.20 -0.56 4.05 2.04 -0.53 -0.33 117.51 123.06 3i6z h ILE 263 Ca -0.02 -0.49 0.01 0.00 1.00 0.00 0.00 64.86 65.36 3i6z h ILE 263 Cb 0.26 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 36.66 3i6z h ILE 263 CO 0.03 0.22 0.36 -0.74 0.00 0.00 0.00 178.15 178.02 3i6z h HIS 264 N 0.88 0.68 -0.18 1.37 2.76 -1.36 0.53 115.15 119.83 3i6z h HIS 264 Ca 0.23 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.41 3i6z h HIS 264 Cb 0.02 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 28.75 3i6z h HIS 264 CO -0.01 0.42 0.09 0.00 -1.30 0.00 0.00 177.93 177.13 3i6z h LEU 266 N 0.18 0.00 -0.59 0.00 3.38 -0.65 -2.11 115.31 115.51 3i6z h LEU 266 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3i6z h LEU 266 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 3i6z h LEU 266 CO -0.01 0.06 0.00 0.03 0.09 0.00 0.00 178.44 178.61 3i6z h ARG 267 N 0.00 0.00 0.00 1.13 3.08 -0.40 -3.07 114.38 115.11 3i6z h ARG 267 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3i6z h ARG 267 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 3i6z h ARG 267 CO 0.01 0.00 -0.35 0.93 -1.07 0.00 0.00 179.97 179.49 3i6z h GLU 268 N 0.00 0.00 -6.94 0.04 4.39 -1.05 -3.47 114.58 107.56 3i6z h GLU 268 Ca 0.00 0.00 -0.49 0.00 0.34 0.00 0.00 59.36 59.21 3i6z h GLU 268 Cb 0.79 0.00 0.03 0.00 -0.10 0.00 0.00 28.75 29.46 3i6z h GLU 268 CO 0.00 0.00 0.45 0.15 -1.16 0.00 0.00 179.01 178.45 3i6z s LYS 269 N -3.21 4.17 0.61 2.33 -0.14 -1.16 -5.02 119.74 117.31 3i6z s LYS 269 Ca 0.06 1.64 -0.16 0.00 -1.36 0.00 0.00 55.97 56.15 3i6z s LYS 269 Cb 0.10 -2.65 -0.03 0.00 -1.68 0.00 0.00 37.83 33.57 3i6z s LYS 269 CO 0.69 -0.17 1.10 0.15 -0.76 0.00 0.00 175.35 176.36 3i6z s LYS 270 N -2.33 3.08 0.18 1.68 1.02 -1.26 -4.94 119.74 117.17 3i6z s LYS 270 Ca 0.56 1.41 -0.19 0.00 0.02 0.00 0.00 55.97 57.78 3i6z s LYS 270 Cb -0.26 -1.99 0.13 0.00 -0.52 0.00 0.00 37.83 35.20 3i6z s LYS 270 CO 0.32 -1.03 1.61 -1.35 -0.92 0.00 0.00 175.35 173.98 3i6z h PRO 271 N 0.47 -0.13 -0.00 -1.68 0.11 -1.96 -1.21 132.00 127.59 3i6z h PRO 271 Ca -0.48 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3i6z h PRO 271 Cb 1.24 0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 3i6z h PRO 271 CO 0.56 -0.09 0.01 0.37 -0.21 0.00 0.00 178.00 178.64 3i6z h GLN 272 N -0.13 0.00 -0.18 1.05 5.75 -1.99 -1.52 115.11 118.09 3i6z h GLN 272 Ca 0.23 0.00 -0.14 0.00 -0.15 0.00 0.00 58.65 58.59 3i6z h GLN 272 Cb 0.50 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.04 3i6z h GLN 272 CO -0.59 0.00 -0.49 0.93 -2.65 0.00 0.00 178.83 176.03 3i6z h GLU 273 N 0.00 0.47 -0.09 1.69 5.08 -1.58 -0.25 114.58 119.90 3i6z h GLU 273 Ca 0.00 -0.27 -0.13 0.00 -1.00 0.00 0.00 59.36 57.96 3i6z h GLU 273 Cb 0.02 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.29 3i6z h GLU 273 CO -0.00 0.86 -0.45 -0.07 -1.00 0.00 0.00 179.01 178.35 3i6z h LEU 274 N 0.38 0.56 -0.90 1.33 4.07 -1.31 -3.26 115.31 116.17 3i6z h LEU 274 Ca 0.02 -0.64 -0.00 0.00 0.08 0.00 0.00 57.88 57.33 3i6z h LEU 274 Cb 1.00 -0.16 -0.04 0.00 1.08 0.00 0.00 40.66 42.53 3i6z h LEU 274 CO 0.09 1.11 0.55 0.40 -1.08 0.00 0.00 178.44 179.51 3i6z h ILE 275 N 0.04 1.25 -0.16 1.22 2.04 -1.40 -1.16 117.51 119.33 3i6z h ILE 275 Ca -0.03 -0.53 0.05 0.00 1.00 0.00 0.00 64.86 65.35 3i6z h ILE 275 Cb 1.09 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 3i6z h ILE 275 CO 0.09 0.26 0.14 0.44 0.00 0.00 0.00 178.15 179.08 3i6z h ASP 276 N 1.23 0.00 -0.02 1.72 3.32 -1.08 -2.85 116.42 118.75 3i6z h ASP 276 Ca 0.32 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.37 3i6z h ASP 276 Cb -0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.49 3i6z h ASP 276 CO -0.06 0.00 0.00 1.33 -1.72 0.00 0.00 179.24 178.79 3i6z n VAL 277 N -4.10 0.07 -0.28 -1.35 0.24 -1.03 -4.78 118.33 107.10 3i6z n VAL 277 Ca 0.01 -0.54 0.09 0.00 -2.04 0.00 0.00 64.34 61.87 3i6z n VAL 277 Cb 0.27 1.05 0.23 0.00 -1.47 0.00 0.00 33.84 33.92 3i6z n VAL 277 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3i6z h GLU 278 N 0.88 0.19 0.00 7.34 4.81 -0.97 -0.47 114.58 126.36 3i6z h GLU 278 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3i6z h GLU 278 Cb 0.22 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.55 3i6z h GLU 278 CO 0.00 0.13 0.00 0.91 -0.73 0.00 0.00 179.01 179.32 3i6z n TRP 279 N -5.24 0.00 1.12 0.92 7.02 -1.26 -3.28 117.44 116.72 3i6z n TRP 279 Ca 0.18 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.79 3i6z n TRP 279 Cb 0.58 -0.49 0.63 0.00 -2.42 0.00 0.00 31.31 29.60 3i6z n TRP 279 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 3i6z n ASN 280 N -1.49 0.00 -0.29 -0.99 3.02 -0.18 -3.63 115.26 111.69 3i6z n ASN 280 Ca 0.05 0.14 0.12 0.00 -0.03 0.00 0.00 54.58 54.86 3i6z n ASN 280 Cb 0.23 -0.37 0.27 0.00 -0.61 0.00 0.00 39.78 39.30 3i6z n ASN 280 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 3i6z n VAL 281 N -1.37 0.00 -1.76 2.41 0.24 -1.21 -4.94 118.33 111.71 3i6z n VAL 281 Ca 0.10 -0.15 -0.40 0.00 -2.04 0.00 0.00 64.34 61.85 3i6z n VAL 281 Cb 0.25 0.60 0.01 0.00 -1.47 0.00 0.00 33.84 33.23 3i6z n VAL 281 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3i6z n LEU 282 N -0.56 4.86 0.22 1.34 4.77 -1.24 -4.80 117.00 121.59 3i6z n LEU 282 Ca 0.11 1.15 0.11 0.00 -0.03 0.00 0.00 56.01 57.35 3i6z n LEU 282 Cb 0.37 -1.59 0.22 0.00 -2.33 0.00 0.00 43.42 40.10 3i6z n LEU 282 CO 0.27 -0.14 0.79 1.55 -1.33 0.00 0.00 177.39 178.53 3i6z h PRO 283 N 2.44 0.00 -4.96 3.23 0.13 -1.95 -3.47 132.00 127.43 3i6z h PRO 283 Ca -0.50 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.31 3i6z h PRO 283 Cb 1.27 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.25 3i6z h PRO 283 CO 0.62 0.07 -0.69 -0.06 -0.23 0.00 0.00 178.00 177.70 3i6z s PHE 284 N -3.25 1.26 -0.17 1.56 0.08 -1.26 -5.09 117.98 111.11 3i6z s PHE 284 Ca 0.06 -0.87 -0.29 0.00 0.12 0.00 0.00 56.93 55.95 3i6z s PHE 284 Cb 0.06 -0.69 -0.01 0.00 -0.57 0.00 0.00 43.02 41.81 3i6z s PHE 284 CO 0.66 -0.03 1.22 0.34 -0.10 0.00 0.00 175.22 177.31 3i6z s ASP 285 N -3.18 6.98 0.32 1.36 2.15 -1.26 -4.95 116.67 118.09 3i6z s ASP 285 Ca 0.20 1.64 -0.19 0.00 0.43 0.00 0.00 52.55 54.64 3i6z s ASP 285 Cb 0.04 -2.54 0.05 0.00 -0.30 0.00 0.00 42.92 40.17 3i6z s ASP 285 CO 0.02 -0.73 0.81 -0.94 -0.17 0.00 0.00 175.17 174.16 3i6z s SER 286 N 1.81 -0.08 0.12 -0.34 1.04 -1.26 -4.65 113.70 110.34 3i6z s SER 286 Ca 0.53 -0.89 0.05 0.00 0.48 0.00 0.00 55.95 56.12 3i6z s SER 286 Cb -0.21 0.75 -0.04 0.00 0.10 0.00 0.00 66.02 66.63 3i6z s SER 286 CO 0.14 -1.46 -0.12 0.27 0.98 0.00 0.00 173.24 173.04 3i6z s ILE 287 N -2.80 1.21 -1.27 -1.02 -4.36 -0.93 -4.83 121.20 107.21 3i6z s ILE 287 Ca 0.15 -1.77 -0.08 0.00 -0.26 0.00 0.00 60.65 58.69 3i6z s ILE 287 Cb -0.05 -1.55 0.01 0.00 1.25 0.00 0.00 42.46 42.12 3i6z s ILE 287 CO 0.09 -0.51 1.04 0.33 0.24 0.00 0.00 174.94 176.12 3i6z n PHE 288 N 0.39 -2.57 -3.86 1.37 -0.00 -1.26 -4.75 117.46 106.77 3i6z n PHE 288 Ca -0.14 0.89 -0.15 0.00 -0.00 0.00 0.00 57.45 58.04 3i6z n PHE 288 Cb 0.58 -4.67 -0.16 0.00 -0.00 0.00 0.00 39.48 35.23 3i6z n PHE 288 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 3i6z s ARG 289 N -6.15 0.11 0.09 -4.13 1.81 -1.26 -4.65 118.95 104.76 3i6z s ARG 289 Ca 0.51 0.10 0.09 0.00 -1.72 0.00 0.00 55.73 54.71 3i6z s ARG 289 Cb -0.23 -0.30 -0.03 0.00 -0.45 0.00 0.00 34.95 33.94 3i6z s ARG 289 CO 0.64 -0.12 -0.23 -0.06 -0.68 0.00 0.00 175.30 174.85 3i6z s PHE 290 N 0.82 2.01 0.04 -0.53 0.08 -1.26 -5.07 117.98 114.07 3i6z s PHE 290 Ca -0.07 -0.40 -0.30 0.00 0.12 0.00 0.00 56.93 56.27 3i6z s PHE 290 Cb -0.11 -1.14 -0.17 0.00 -0.57 0.00 0.00 43.02 41.04 3i6z s PHE 290 CO -0.02 0.20 1.34 0.77 -0.10 0.00 0.00 175.22 177.41 3i6z h SER 291 N 4.32 -0.93 -3.64 1.36 0.02 -1.90 -3.42 113.55 109.36 3i6z h SER 291 Ca -0.47 0.03 -0.70 0.00 -0.84 0.00 0.00 61.79 59.82 3i6z h SER 291 Cb 1.17 0.24 -0.29 0.00 0.14 0.00 0.00 62.40 63.66 3i6z h SER 291 CO 0.41 -0.61 -0.58 -0.36 -1.14 0.00 0.00 176.83 174.54 3i6z s PHE 292 N -5.22 3.28 0.31 3.45 0.08 -1.26 -5.01 117.98 113.60 3i6z s PHE 292 Ca -0.16 -1.46 0.03 0.00 0.12 0.00 0.00 56.93 55.46 3i6z s PHE 292 Cb 0.02 -2.40 -0.04 0.00 -0.57 0.00 0.00 43.02 40.03 3i6z s PHE 292 CO 0.48 -0.75 0.17 0.14 -0.10 0.00 0.00 175.22 175.16 3i6z s VAL 293 N 1.40 0.32 0.50 -0.44 -7.23 -1.26 -4.44 120.40 109.25 3i6z s VAL 293 Ca -0.01 -2.00 -0.21 0.00 -1.81 0.00 0.00 61.98 57.95 3i6z s VAL 293 Cb -0.20 -2.50 -0.09 0.00 0.56 0.00 0.00 36.38 34.15 3i6z s VAL 293 CO 0.03 0.00 0.88 -2.65 -0.31 0.00 0.00 175.10 173.05 3i6z n PRO 294 N -0.60 1.02 -5.14 4.82 -0.02 -1.24 -4.71 135.00 129.13 3i6z n PRO 294 Ca 0.01 0.38 -0.32 0.00 -2.02 0.00 0.00 63.50 61.55 3i6z n PRO 294 Cb 0.65 -1.99 -0.15 0.00 -0.02 0.00 0.00 33.50 31.99 3i6z n PRO 294 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3i6z s VAL 295 N -1.44 2.46 -1.02 -1.45 -7.23 -1.26 -1.32 120.40 109.13 3i6z s VAL 295 Ca 0.68 -0.95 -0.23 0.00 -1.81 0.00 0.00 61.98 59.67 3i6z s VAL 295 Cb -0.50 -1.90 0.02 0.00 0.56 0.00 0.00 36.38 34.57 3i6z s VAL 295 CO 0.53 0.58 1.61 -0.63 -0.31 0.00 0.00 175.10 176.89 3i6z s ILE 296 N -0.66 3.81 -0.83 -0.62 -1.09 -0.80 -4.77 121.20 116.23 3i6z s ILE 296 Ca 0.11 -0.76 0.24 0.00 -2.23 0.00 0.00 60.65 58.00 3i6z s ILE 296 Cb -0.10 -4.80 -0.03 0.00 -1.58 0.00 0.00 42.46 35.95 3i6z s ILE 296 CO -0.00 -1.67 1.27 -0.90 -1.23 0.00 0.00 174.94 172.40 3i6z n ASP 297 N 10.28 0.60 0.00 3.58 5.75 -1.26 -4.28 116.55 131.22 3i6z n ASP 297 Ca 0.36 -0.22 0.00 0.00 -0.01 0.00 0.00 54.79 54.93 3i6z n ASP 297 Cb 0.49 0.41 0.00 0.00 -1.03 0.00 0.00 41.12 40.99 3i6z n ASP 297 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3i6z n GLY 298 N 1.44 0.69 1.03 6.12 0.00 -0.09 -4.86 105.19 109.51 3i6z n GLY 298 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3i6z n GLY 298 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3i6z n GLU 299 N -2.57 0.00 -0.33 1.61 1.02 -1.26 -4.52 120.64 114.59 3i6z n GLU 299 Ca 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.11 3i6z n GLU 299 Cb 0.00 0.00 0.09 0.00 -0.02 0.00 0.00 31.44 31.51 3i6z n GLU 299 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 3i6z h PHE 300 N 0.00 1.12 -3.73 -0.32 3.04 -1.91 -3.33 116.94 111.81 3i6z h PHE 300 Ca 0.00 0.02 -0.69 0.00 3.98 0.00 0.00 57.97 61.29 3i6z h PHE 300 Cb 0.00 -0.38 -0.32 0.00 2.56 0.00 0.00 35.95 37.81 3i6z h PHE 300 CO 0.00 0.71 -0.67 -0.06 -2.02 0.00 0.00 178.31 176.27 3i6z s PHE 301 N -6.11 3.29 0.17 0.41 0.08 -1.26 -4.35 117.98 110.21 3i6z s PHE 301 Ca -0.13 -1.83 -0.15 0.00 0.12 0.00 0.00 56.93 54.94 3i6z s PHE 301 Cb 0.17 -2.23 0.13 0.00 -0.57 0.00 0.00 43.02 40.51 3i6z s PHE 301 CO 0.80 -0.80 1.69 -1.35 -0.10 0.00 0.00 175.22 175.46 3i6z h PRO 302 N 8.04 0.09 0.00 0.24 0.11 -1.80 -0.21 132.00 138.48 3i6z h PRO 302 Ca -0.21 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.82 3i6z h PRO 302 Cb 1.06 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 3i6z h PRO 302 CO 0.56 0.06 -0.07 0.25 -0.21 0.00 0.00 178.00 178.58 3i6z n THR 303 N -5.23 0.00 -1.61 -1.15 -2.24 -1.26 -4.39 114.28 98.40 3i6z n THR 303 Ca 0.03 -0.37 -0.38 0.00 -2.27 0.00 0.00 64.05 61.06 3i6z n THR 303 Cb 0.23 0.18 0.05 0.00 -2.10 0.00 0.00 70.33 68.68 3i6z n THR 303 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3i6z n SER 304 N -2.76 0.75 -0.32 3.42 3.41 -1.26 -4.80 113.62 112.06 3i6z n SER 304 Ca 0.01 0.84 -0.03 0.00 -0.26 0.00 0.00 58.87 59.43 3i6z n SER 304 Cb 0.09 -1.37 0.09 0.00 -0.26 0.00 0.00 64.21 62.76 3i6z n SER 304 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3i6z h LEU 305 N 0.65 0.98 -0.71 1.04 3.38 -1.99 -1.96 115.31 116.70 3i6z h LEU 305 Ca -0.48 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.46 3i6z h LEU 305 Cb 1.36 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.84 3i6z h LEU 305 CO 0.52 0.70 0.40 -0.08 0.09 0.00 0.00 178.44 180.07 3i6z h GLU 306 N 1.15 0.98 -0.05 1.13 4.57 -1.99 0.41 114.58 120.78 3i6z h GLU 306 Ca 0.32 -0.11 -0.13 0.00 -1.18 0.00 0.00 59.36 58.27 3i6z h GLU 306 Cb -0.11 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.27 3i6z h GLU 306 CO -0.08 0.72 -0.54 0.66 -1.18 0.00 0.00 179.01 178.60 3i6z h SER 307 N 0.97 0.16 -0.32 1.04 4.64 -1.86 -0.10 113.55 118.09 3i6z h SER 307 Ca 0.25 -0.09 -0.06 0.00 -0.47 0.00 0.00 61.79 61.43 3i6z h SER 307 Cb 0.02 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.05 3i6z h SER 307 CO -0.04 0.67 -0.04 0.24 -0.87 0.00 0.00 176.83 176.79 3i6z h MET 308 N 0.12 0.59 -0.69 4.77 2.86 -0.82 -1.80 114.93 119.96 3i6z h MET 308 Ca -0.00 -0.21 -0.06 0.00 -2.06 0.00 0.00 59.70 57.37 3i6z h MET 308 Cb 0.99 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.57 3i6z h MET 308 CO 0.08 0.75 0.19 -0.07 1.06 0.00 0.00 176.91 178.91 3i6z h LEU 309 N 0.38 1.02 -0.73 1.22 3.38 -0.72 0.11 115.31 119.97 3i6z h LEU 309 Ca 0.09 -0.20 -0.13 0.00 0.09 0.00 0.00 57.88 57.72 3i6z h LEU 309 Cb 0.50 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 3i6z h LEU 309 CO 0.02 0.96 -0.50 0.78 0.09 0.00 0.00 178.44 179.79 3i6z h ASN 310 N 1.03 0.37 -0.00 -0.43 2.35 -0.89 -3.16 115.58 114.85 3i6z h ASN 310 Ca 0.22 -0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 3i6z h ASN 310 Cb 0.33 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.60 3i6z h ASN 310 CO -0.00 0.81 -0.03 -1.54 -1.65 0.00 0.00 177.43 175.02 3i6z n SER 311 N -3.96 1.88 -0.57 5.81 3.41 -0.69 -4.93 113.62 114.58 3i6z n SER 311 Ca -0.02 -1.60 -0.06 0.00 -0.26 0.00 0.00 58.87 56.94 3i6z n SER 311 Cb 0.55 0.02 -0.01 0.00 -0.26 0.00 0.00 64.21 64.51 3i6z n SER 311 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3i6z n GLY 312 N 1.24 0.37 3.22 5.00 0.00 -0.90 -4.92 105.19 109.19 3i6z n GLY 312 Ca 0.17 -0.70 -0.43 0.00 0.00 0.00 0.00 46.02 45.06 3i6z n GLY 312 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3i6z n ASN 313 N 0.98 4.92 -3.61 1.61 5.15 -0.02 -4.86 115.26 119.43 3i6z n ASN 313 Ca -0.06 -2.98 -0.06 0.00 -0.60 0.00 0.00 54.58 50.88 3i6z n ASN 313 Cb 0.43 -1.60 -0.02 0.00 -0.53 0.00 0.00 39.78 38.06 3i6z n ASN 313 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 3i6z s PHE 314 N 2.09 -0.23 0.18 1.20 -0.12 -1.26 -4.71 117.98 115.13 3i6z s PHE 314 Ca 0.45 0.04 -0.32 0.00 -0.05 0.00 0.00 56.93 57.06 3i6z s PHE 314 Cb 0.05 0.57 -0.11 0.00 -0.63 0.00 0.00 43.02 42.90 3i6z s PHE 314 CO 0.01 -0.60 1.60 0.21 -0.05 0.00 0.00 175.22 176.39 3i6z s LYS 315 N -3.08 4.19 -0.31 1.99 2.20 0.02 -4.97 119.74 119.78 3i6z s LYS 315 Ca 0.09 2.43 -0.13 0.00 -0.36 0.00 0.00 55.97 58.00 3i6z s LYS 315 Cb -0.01 -3.13 -0.03 0.00 -1.51 0.00 0.00 37.83 33.16 3i6z s LYS 315 CO -0.04 -0.63 0.26 0.15 -0.36 0.00 0.00 175.35 174.72 3i6z s LYS 316 N 1.01 3.71 0.00 4.03 3.01 -1.26 -4.96 119.74 125.27 3i6z s LYS 316 Ca 0.70 -0.43 0.00 0.00 -1.01 0.00 0.00 55.97 55.24 3i6z s LYS 316 Cb -0.45 -3.74 0.00 0.00 -1.01 0.00 0.00 37.83 32.62 3i6z s LYS 316 CO 0.33 -0.36 0.00 -2.37 0.51 0.00 0.00 175.35 173.46 3i6z n THR 317 N 5.12 0.00 -3.84 2.17 5.66 -1.26 -4.80 114.28 117.33 3i6z n THR 317 Ca -0.12 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.56 3i6z n THR 317 Cb 0.50 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.24 3i6z n THR 317 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 3i6z s GLN 318 N 0.79 3.50 0.03 1.09 1.11 -1.26 -1.29 119.66 123.64 3i6z s GLN 318 Ca 0.00 -0.27 0.01 0.00 0.01 0.00 0.00 55.36 55.11 3i6z s GLN 318 Cb 0.00 -3.03 -0.02 0.00 -1.01 0.00 0.00 33.01 28.95 3i6z s GLN 318 CO 0.00 0.61 -0.06 0.96 0.01 0.00 0.00 175.29 176.81 3i6z s ILE 319 N -1.45 0.37 -0.06 1.08 -4.36 0.36 -2.90 121.20 114.24 3i6z s ILE 319 Ca 0.33 -0.96 0.02 0.00 -0.26 0.00 0.00 60.65 59.77 3i6z s ILE 319 Cb -0.13 -0.46 0.02 0.00 1.25 0.00 0.00 42.46 43.13 3i6z s ILE 319 CO 0.23 -0.39 -0.10 -0.22 0.24 0.00 0.00 174.94 174.69 3i6z s LEU 320 N -1.45 1.51 0.27 0.37 0.20 -0.63 -1.53 118.68 117.42 3i6z s LEU 320 Ca -0.11 -0.25 -0.17 0.00 0.69 0.00 0.00 54.13 54.29 3i6z s LEU 320 Cb -0.09 -0.73 0.01 0.00 -0.43 0.00 0.00 46.19 44.95 3i6z s LEU 320 CO -0.00 -0.01 0.62 -1.48 -0.29 0.00 0.00 176.35 175.19 3i6z s LEU 321 N 0.84 0.03 0.00 -0.68 2.34 -0.06 -1.32 118.68 119.83 3i6z s LEU 321 Ca -0.12 -0.79 0.00 0.00 0.06 0.00 0.00 54.13 53.28 3i6z s LEU 321 Cb -0.15 2.30 0.00 0.00 -0.56 0.00 0.00 46.19 47.78 3i6z s LEU 321 CO 0.02 -1.28 0.00 0.61 -1.06 0.00 0.00 176.35 174.64 3i6z n GLY 322 N -0.43 -1.31 3.24 -3.48 0.00 -0.90 -1.35 105.19 100.97 3i6z n GLY 322 Ca -0.03 -0.99 -0.14 0.00 0.00 0.00 0.00 46.02 44.87 3i6z n GLY 322 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3i6z s VAL 323 N -2.34 0.43 0.23 1.61 -7.23 -1.08 -0.48 120.40 111.55 3i6z s VAL 323 Ca 0.00 -1.98 0.05 0.00 -1.81 0.00 0.00 61.98 58.24 3i6z s VAL 323 Cb 0.00 -2.33 -0.03 0.00 0.56 0.00 0.00 36.38 34.58 3i6z s VAL 323 CO 0.00 -0.25 0.32 0.20 -0.31 0.00 0.00 175.10 175.06 3i6z s ASN 324 N -3.19 6.15 0.19 4.85 -0.87 -1.26 -0.88 114.94 119.94 3i6z s ASN 324 Ca 0.31 0.01 -0.11 0.00 -1.57 0.00 0.00 52.86 51.50 3i6z s ASN 324 Cb 0.07 -1.77 0.12 0.00 -0.02 0.00 0.00 41.25 39.65 3i6z s ASN 324 CO 0.08 -0.05 1.82 0.50 -2.57 0.00 0.00 177.10 176.87 3i6z h LYS 325 N 1.33 0.93 -2.22 -0.60 3.64 -1.38 -3.34 116.57 114.93 3i6z h LYS 325 Ca -0.51 -0.10 -0.59 0.00 -1.27 0.00 0.00 60.65 58.18 3i6z h LYS 325 Cb 1.23 -0.19 -0.42 0.00 -0.41 0.00 0.00 32.23 32.44 3i6z h LYS 325 CO 0.62 0.69 -0.65 -0.25 -2.27 0.00 0.00 179.45 177.58 3i6z n ASP 326 N -4.53 3.91 0.16 4.20 8.00 -0.44 -4.90 116.55 122.94 3i6z n ASP 326 Ca 0.05 -3.52 0.06 0.00 0.71 0.00 0.00 54.79 52.09 3i6z n ASP 326 Cb 0.08 -0.62 0.53 0.00 -0.02 0.00 0.00 41.12 41.09 3i6z n ASP 326 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 3i6z h GLU 327 N 3.58 0.20 0.00 -1.24 4.39 -1.72 -3.19 114.58 116.60 3i6z h GLU 327 Ca 0.16 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.84 3i6z h GLU 327 Cb 0.60 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 3i6z h GLU 327 CO 0.81 0.18 -0.06 0.78 -1.16 0.00 0.00 179.01 179.55 3i6z h GLY 328 N 0.32 0.00 0.64 -3.84 0.00 -1.84 -3.39 103.07 94.95 3i6z h GLY 328 Ca 0.05 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.46 3i6z h GLY 328 CO -0.00 0.00 0.49 1.48 0.00 0.00 0.00 176.54 178.50 3i6z h SER 329 N 0.00 0.74 -0.75 0.19 4.64 -1.80 -2.40 113.55 114.16 3i6z h SER 329 Ca 0.00 0.03 0.09 0.00 -0.47 0.00 0.00 61.79 61.44 3i6z h SER 329 Cb 0.84 -0.12 -0.07 0.00 -0.31 0.00 0.00 62.40 62.74 3i6z h SER 329 CO 0.00 0.45 0.41 0.15 -0.87 0.00 0.00 176.83 176.97 3i6z h PHE 330 N 0.86 0.73 0.00 4.77 3.04 -1.83 -1.35 116.94 123.17 3i6z h PHE 330 Ca 0.37 0.03 -0.15 0.00 3.98 0.00 0.00 57.97 62.21 3i6z h PHE 330 Cb 0.25 -0.22 -0.02 0.00 2.56 0.00 0.00 35.95 38.52 3i6z h PHE 330 CO -0.05 0.29 -0.70 0.74 -2.02 0.00 0.00 178.31 176.57 3i6z h PHE 331 N 0.69 0.00 -0.06 0.41 -1.00 -1.72 -2.72 116.94 112.54 3i6z h PHE 331 Ca 0.36 0.00 -0.25 0.00 2.81 0.00 0.00 57.97 60.90 3i6z h PHE 331 Cb 0.35 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.92 3i6z h PHE 331 CO -0.08 0.70 -0.92 -0.07 -1.61 0.00 0.00 178.31 176.33 3i6z h LEU 332 N 0.00 0.89 -0.55 1.54 3.38 -1.14 -2.72 115.31 116.71 3i6z h LEU 332 Ca -0.01 -0.66 0.03 0.00 0.09 0.00 0.00 57.88 57.34 3i6z h LEU 332 Cb 1.33 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 3i6z h LEU 332 CO 0.09 1.46 0.32 0.25 0.09 0.00 0.00 178.44 180.65 3i6z h LEU 333 N 0.44 0.51 -0.47 1.67 5.85 -1.20 -0.99 115.31 121.12 3i6z h LEU 333 Ca -0.09 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 3i6z h LEU 333 Cb 1.56 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.49 3i6z h LEU 333 CO 0.18 0.35 -0.07 1.88 -0.34 0.00 0.00 178.44 180.44 3i6z h TYR 334 N 0.63 0.00 0.00 1.25 -1.99 -1.47 -3.42 116.97 111.97 3i6z h TYR 334 Ca 0.23 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.96 3i6z h TYR 334 Cb 0.05 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.78 3i6z h TYR 334 CO -0.07 0.07 -0.02 0.41 -0.00 0.00 0.00 178.16 178.55 3i6z n GLY 335 N 0.76 0.37 3.76 3.88 0.00 -1.03 -5.09 105.19 107.84 3i6z n GLY 335 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 3i6z n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i6z s ALA 336 N -0.06 3.44 0.31 4.61 0.00 -0.39 -5.02 121.76 124.65 3i6z s ALA 336 Ca 0.00 0.19 -0.29 0.00 0.00 0.00 0.00 51.96 51.85 3i6z s ALA 336 Cb 0.00 -2.87 -0.11 0.00 0.00 0.00 0.00 23.12 20.14 3i6z s ALA 336 CO 0.00 0.16 1.55 -1.25 0.00 0.00 0.00 175.76 176.22 3i6z s PRO 337 N -0.36 4.13 0.00 0.00 0.04 -1.26 -2.80 135.00 134.75 3i6z s PRO 337 Ca 0.35 2.55 0.00 0.00 0.04 0.00 0.00 61.00 63.94 3i6z s PRO 337 Cb -0.20 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.33 3i6z s PRO 337 CO 0.21 -0.59 0.00 0.41 0.04 0.00 0.00 177.00 177.08 3i6z n GLY 338 N 1.69 3.15 3.84 0.56 0.00 -1.26 -4.85 105.19 108.32 3i6z n GLY 338 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 3i6z n GLY 338 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3i6z s PHE 339 N -2.82 3.70 0.03 1.61 0.40 -1.12 -4.67 117.98 115.12 3i6z s PHE 339 Ca 0.00 0.96 -0.11 0.00 -0.60 0.00 0.00 56.93 57.18 3i6z s PHE 339 Cb 0.00 -2.27 0.01 0.00 0.51 0.00 0.00 43.02 41.27 3i6z s PHE 339 CO 0.00 0.62 0.23 -1.12 0.70 0.00 0.00 175.22 175.66 3i6z s SER 340 N -1.19 -0.05 0.28 1.36 0.01 -1.26 -4.89 113.70 107.96 3i6z s SER 340 Ca 0.25 -0.22 0.07 0.00 1.31 0.00 0.00 55.95 57.36 3i6z s SER 340 Cb -0.16 0.30 0.41 0.00 0.21 0.00 0.00 66.02 66.77 3i6z s SER 340 CO 0.14 -0.53 1.66 0.50 0.41 0.00 0.00 173.24 175.42 3i6z h LYS 341 N 3.57 0.19 -0.72 12.44 3.64 -1.98 -3.25 116.57 130.46 3i6z h LYS 341 Ca -0.31 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 3i6z h LYS 341 Cb 1.19 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 3i6z h LYS 341 CO 0.45 0.64 0.00 -0.25 -2.27 0.00 0.00 179.45 178.02 3i6z n ASP 342 N -3.96 3.94 -4.59 4.20 8.00 -1.26 -4.47 116.55 118.41 3i6z n ASP 342 Ca -0.02 -2.00 -0.28 0.00 0.71 0.00 0.00 54.79 53.21 3i6z n ASP 342 Cb 0.53 -0.48 -0.10 0.00 -0.02 0.00 0.00 41.12 41.05 3i6z n ASP 342 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3i6z s SER 343 N -1.02 3.57 0.02 -2.24 1.04 -1.23 -5.01 113.70 108.84 3i6z s SER 343 Ca 0.49 -1.45 0.25 0.00 0.48 0.00 0.00 55.95 55.71 3i6z s SER 343 Cb 0.25 -0.08 1.04 0.00 0.10 0.00 0.00 66.02 67.34 3i6z s SER 343 CO 0.33 -0.60 1.79 1.21 0.98 0.00 0.00 173.24 176.96 3i6z n GLU 344 N -0.97 0.02 -3.73 4.02 2.13 -1.26 -4.76 120.64 116.09 3i6z n GLU 344 Ca -0.08 0.09 -0.22 0.00 0.66 0.00 0.00 57.16 57.61 3i6z n GLU 344 Cb 0.67 -1.52 0.03 0.00 0.27 0.00 0.00 31.44 30.88 3i6z n GLU 344 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 3i6z n SER 345 N -1.56 -1.45 -4.72 4.31 7.64 -1.26 -4.83 113.62 111.75 3i6z n SER 345 Ca 0.06 -0.86 -0.42 0.00 1.01 0.00 0.00 58.87 58.66 3i6z n SER 345 Cb 0.30 -3.88 -0.03 0.00 -1.01 0.00 0.00 64.21 59.58 3i6z n SER 345 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 3i6z s LYS 346 N -6.02 4.44 -0.20 1.43 1.02 -1.26 -4.72 119.74 114.42 3i6z s LYS 346 Ca 0.05 1.82 -0.08 0.00 0.02 0.00 0.00 55.97 57.78 3i6z s LYS 346 Cb -0.01 -3.31 -0.04 0.00 -0.52 0.00 0.00 37.83 33.94 3i6z s LYS 346 CO 0.83 -0.23 0.09 0.42 -0.92 0.00 0.00 175.35 175.53 3i6z s ILE 347 N 0.80 4.89 0.90 2.17 -1.09 -0.59 -4.96 121.20 123.32 3i6z s ILE 347 Ca 0.58 0.01 -0.12 0.00 -2.23 0.00 0.00 60.65 58.89 3i6z s ILE 347 Cb -0.31 -3.23 0.13 0.00 -1.58 0.00 0.00 42.46 37.47 3i6z s ILE 347 CO 0.31 0.42 1.09 -0.94 -1.23 0.00 0.00 174.94 174.59 3i6z s SER 348 N 0.65 3.48 0.37 3.58 1.04 -1.26 -4.27 113.70 117.28 3i6z s SER 348 Ca 0.05 1.43 0.04 0.00 0.48 0.00 0.00 55.95 57.94 3i6z s SER 348 Cb -0.13 -2.11 0.70 0.00 0.10 0.00 0.00 66.02 64.58 3i6z s SER 348 CO 0.01 -2.63 2.00 -0.09 0.98 0.00 0.00 173.24 173.52 3i6z h ARG 349 N -1.54 0.70 -0.08 4.02 9.65 -1.92 -0.78 114.38 124.43 3i6z h ARG 349 Ca -0.50 -0.06 -0.23 0.00 -1.10 0.00 0.00 59.98 58.09 3i6z h ARG 349 Cb 1.29 -0.15 0.01 0.00 -1.39 0.00 0.00 29.97 29.73 3i6z h ARG 349 CO 0.55 0.50 -0.87 0.93 2.80 0.00 0.00 179.97 183.88 3i6z h GLU 350 N 0.71 0.68 -0.08 0.20 3.07 -1.97 -2.38 114.58 114.80 3i6z h GLU 350 Ca 0.19 -0.62 -0.08 0.00 -0.50 0.00 0.00 59.36 58.34 3i6z h GLU 350 Cb -0.02 0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 28.03 3i6z h GLU 350 CO -0.03 1.23 -0.34 -0.44 -1.40 0.00 0.00 179.01 178.03 3i6z h ASP 351 N 0.43 0.16 -0.10 1.42 3.32 -1.82 -0.96 116.42 118.87 3i6z h ASP 351 Ca -0.08 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.92 3i6z h ASP 351 Cb 1.50 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 41.00 3i6z h ASP 351 CO 0.17 0.49 0.07 0.15 -1.72 0.00 0.00 179.24 178.40 3i6z h PHE 352 N 0.14 0.12 -0.50 4.55 3.57 -0.98 0.14 116.94 123.98 3i6z h PHE 352 Ca 0.02 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.55 3i6z h PHE 352 Cb 0.67 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.33 3i6z h PHE 352 CO 0.01 0.08 0.29 0.52 -2.23 0.00 0.00 178.31 176.98 3i6z h MET 353 N 0.13 0.55 -0.73 1.11 2.86 -0.95 -0.79 114.93 117.12 3i6z h MET 353 Ca 0.04 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3i6z h MET 353 Cb -0.01 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 31.49 3i6z h MET 353 CO -0.01 0.36 0.46 0.77 1.06 0.00 0.00 176.91 179.56 3i6z h SER 354 N 0.57 0.86 -0.64 1.22 0.02 -0.77 -2.40 113.55 112.41 3i6z h SER 354 Ca 0.21 -0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 61.11 3i6z h SER 354 Cb 0.05 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.34 3i6z h SER 354 CO -0.11 0.65 0.40 1.23 -1.14 0.00 0.00 176.83 177.86 3i6z h GLY 355 N 1.00 0.91 0.99 -3.77 0.00 -0.06 -2.03 103.07 100.12 3i6z h GLY 355 Ca 0.26 -0.37 0.01 0.00 0.00 0.00 0.00 47.33 47.24 3i6z h GLY 355 CO -0.05 0.36 0.58 -2.08 0.00 0.00 0.00 176.54 175.35 3i6z h VAL 356 N 0.86 1.22 -0.68 4.60 2.07 -0.80 -0.01 116.25 123.50 3i6z h VAL 356 Ca 0.23 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.30 3i6z h VAL 356 Cb -0.05 -0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 29.62 3i6z h VAL 356 CO -0.05 0.22 0.27 0.50 0.02 0.00 0.00 177.57 178.53 3i6z h LYS 357 N 1.18 1.01 -0.04 1.57 3.11 -1.01 -2.23 116.57 120.16 3i6z h LYS 357 Ca 0.33 -0.18 -0.11 0.00 -2.81 0.00 0.00 60.65 57.87 3i6z h LYS 357 Cb -0.12 -0.16 -0.01 0.00 -1.00 0.00 0.00 32.23 30.93 3i6z h LYS 357 CO -0.07 0.84 -0.50 -0.07 -2.81 0.00 0.00 179.45 176.84 3i6z h LEU 358 N 0.96 0.12 -0.49 5.20 3.38 -0.79 -3.16 115.31 120.53 3i6z h LEU 358 Ca 0.23 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 58.00 3i6z h LEU 358 Cb 0.21 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 3i6z h LEU 358 CO -0.02 0.60 -0.65 0.28 0.09 0.00 0.00 178.44 178.74 3i6z h SER 359 N 0.09 0.00 -2.11 -0.43 0.02 -0.59 -2.48 113.55 108.06 3i6z h SER 359 Ca 0.00 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.40 3i6z h SER 359 Cb 0.91 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 63.04 3i6z h SER 359 CO 0.07 0.65 -0.91 0.52 -1.14 0.00 0.00 176.83 176.03 3i6z n VAL 360 N -3.54 1.04 0.11 2.27 0.31 -0.88 -4.92 118.33 112.73 3i6z n VAL 360 Ca -0.00 -4.82 0.19 0.00 -0.01 0.00 0.00 64.34 59.70 3i6z n VAL 360 Cb 0.70 -1.38 0.76 0.00 -0.91 0.00 0.00 33.84 33.01 3i6z n VAL 360 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 3i6z h PRO 361 N 3.51 0.00 -0.00 5.55 0.13 -1.68 -1.36 132.00 138.15 3i6z h PRO 361 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3i6z h PRO 361 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 3i6z h PRO 361 CO 0.64 0.00 -0.11 -2.39 -0.23 0.00 0.00 178.00 175.91 3i6z n HIS 362 N -3.90 0.00 -2.99 1.56 1.44 -1.26 -4.93 115.22 105.14 3i6z n HIS 362 Ca 0.06 0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.40 3i6z n HIS 362 Cb 0.51 -0.16 -0.06 0.00 0.12 0.00 0.00 29.99 30.39 3i6z n HIS 362 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3i6z s ALA 363 N -2.44 3.35 0.95 1.59 0.00 -0.51 -5.08 121.76 119.62 3i6z s ALA 363 Ca 0.30 0.28 -0.13 0.00 0.00 0.00 0.00 51.96 52.41 3i6z s ALA 363 Cb 0.20 -2.94 0.21 0.00 0.00 0.00 0.00 23.12 20.59 3i6z s ALA 363 CO 0.47 0.28 1.24 0.27 0.00 0.00 0.00 175.76 178.02 3i6z n ASN 364 N 0.68 0.32 -0.17 0.00 0.23 -1.26 -4.76 115.26 110.30 3i6z n ASN 364 Ca -0.01 -1.58 -0.01 0.00 -0.53 0.00 0.00 54.58 52.45 3i6z n ASN 364 Cb 0.51 -0.93 0.22 0.00 -2.08 0.00 0.00 39.78 37.50 3i6z n ASN 364 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 3i6z h ASP 365 N -1.51 0.81 -0.60 0.53 5.19 -1.99 -0.52 116.42 118.34 3i6z h ASP 365 Ca -0.40 -0.08 -0.05 0.00 -0.62 0.00 0.00 57.03 55.89 3i6z h ASP 365 Cb 1.16 -0.21 -0.03 0.00 0.18 0.00 0.00 39.33 40.44 3i6z h ASP 365 CO 0.31 0.68 0.20 0.25 -3.12 0.00 0.00 179.24 177.55 3i6z h LEU 366 N 0.91 0.86 -0.32 1.55 6.46 -1.99 -0.77 115.31 122.01 3i6z h LEU 366 Ca 0.23 -0.20 -0.00 0.00 -0.12 0.00 0.00 57.88 57.78 3i6z h LEU 366 Cb 0.07 -0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 39.76 3i6z h LEU 366 CO -0.03 0.83 0.18 1.23 -0.62 0.00 0.00 178.44 180.03 3i6z h GLY 367 N 0.85 0.47 0.88 3.75 0.00 -1.71 -0.10 103.07 107.21 3i6z h GLY 367 Ca 0.19 -0.21 0.03 0.00 0.00 0.00 0.00 47.33 47.35 3i6z h GLY 367 CO -0.01 0.20 0.53 1.41 0.00 0.00 0.00 176.54 178.67 3i6z h LEU 368 N 0.40 0.89 -0.73 3.11 3.38 -0.83 -1.61 115.31 119.92 3i6z h LEU 368 Ca 0.11 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 3i6z h LEU 368 Cb 0.04 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 3i6z h LEU 368 CO -0.02 0.61 0.27 0.44 0.09 0.00 0.00 178.44 179.83 3i6z h ASP 369 N 1.04 1.03 -0.22 -0.43 3.32 -0.61 -1.32 116.42 119.23 3i6z h ASP 369 Ca 0.33 -0.19 0.02 0.00 0.02 0.00 0.00 57.03 57.21 3i6z h ASP 369 Cb 0.00 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 3i6z h ASP 369 CO -0.11 0.94 0.10 0.00 -1.72 0.00 0.00 179.24 178.45 3i6z h ALA 370 N 1.13 0.26 -0.08 3.45 0.00 -0.35 -0.75 119.26 122.92 3i6z h ALA 370 Ca 0.24 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 3i6z h ALA 370 Cb 0.25 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3i6z h ALA 370 CO -0.01 -0.31 0.05 0.28 0.00 0.00 0.00 179.25 179.25 3i6z h VAL 371 N 0.22 1.05 -0.49 0.00 2.07 -1.13 -1.58 116.25 116.39 3i6z h VAL 371 Ca 0.09 -0.14 0.04 0.00 0.82 0.00 0.00 66.70 67.51 3i6z h VAL 371 Cb 0.04 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 3i6z h VAL 371 CO -0.07 0.05 0.26 0.74 0.02 0.00 0.00 177.57 178.57 3i6z h THR 372 N 0.07 0.99 -0.42 2.57 2.02 -1.03 -2.08 112.91 115.02 3i6z h THR 372 Ca 0.03 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.04 3i6z h THR 372 Cb 0.04 0.42 -0.02 0.00 -1.74 0.00 0.00 68.15 66.85 3i6z h THR 372 CO -0.01 0.09 0.28 0.25 0.37 0.00 0.00 175.52 176.51 3i6z h LEU 373 N 0.52 0.49 -2.23 2.58 5.85 -1.00 -1.79 115.31 119.72 3i6z h LEU 373 Ca 0.21 -0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 3i6z h LEU 373 Cb 0.09 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.00 3i6z h LEU 373 CO -0.13 0.36 -0.01 -0.61 -0.34 0.00 0.00 178.44 177.70 3i6z h GLN 374 N 0.57 0.00 -0.19 1.25 5.75 -0.71 -3.02 115.11 118.77 3i6z h GLN 374 Ca 0.15 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.65 3i6z h GLN 374 Cb -0.06 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.49 3i6z h GLN 374 CO -0.03 0.01 0.00 0.66 -2.65 0.00 0.00 178.83 176.82 3i6z n TYR 375 N -4.12 0.26 -4.26 3.99 4.02 -0.84 -4.99 117.16 111.22 3i6z n TYR 375 Ca -0.03 -0.49 -0.34 0.00 -0.01 0.00 0.00 57.90 57.02 3i6z n TYR 375 Cb 0.10 -0.04 -0.11 0.00 -0.02 0.00 0.00 39.34 39.28 3i6z n TYR 375 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3i6z s THR 376 N -0.99 4.30 -0.69 -0.72 2.01 -0.71 -4.81 115.64 114.02 3i6z s THR 376 Ca 0.13 -0.22 -0.21 0.00 0.31 0.00 0.00 61.69 61.70 3i6z s THR 376 Cb 0.07 -2.88 0.09 0.00 0.01 0.00 0.00 72.50 69.79 3i6z s THR 376 CO 0.09 0.51 0.92 -0.62 -0.69 0.00 0.00 174.62 174.83 3i6z s ASP 377 N 0.05 6.27 0.00 3.53 -1.08 -1.26 -4.89 116.67 119.29 3i6z s ASP 377 Ca 0.02 -1.33 0.14 0.00 -0.52 0.00 0.00 52.55 50.87 3i6z s ASP 377 Cb -0.13 -2.38 0.81 0.00 -1.46 0.00 0.00 42.92 39.76 3i6z s ASP 377 CO 0.02 -1.27 1.30 0.79 0.52 0.00 0.00 175.17 176.52 3i6z n TRP 378 N 7.08 0.00 1.03 -5.34 7.02 -1.26 -1.02 117.44 124.94 3i6z n TRP 378 Ca 0.00 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.60 3i6z n TRP 378 Cb 0.45 -0.08 0.17 0.00 -2.42 0.00 0.00 31.31 29.43 3i6z n TRP 378 CO 0.00 0.00 0.00 -0.12 -2.02 0.00 0.00 177.69 175.55 3i6z n MET 379 N -1.08 0.13 -2.71 -0.99 1.56 -1.26 -4.46 117.12 108.31 3i6z n MET 379 Ca 0.10 -0.09 -0.08 0.00 -0.27 0.00 0.00 57.70 57.36 3i6z n MET 379 Cb 0.07 -1.50 0.11 0.00 2.15 0.00 0.00 33.22 34.04 3i6z n MET 379 CO 0.00 0.00 0.00 -3.47 -0.73 0.00 0.00 175.97 171.77 3i6z n ASP 380 N -1.36 -2.07 0.19 6.12 2.03 -0.19 -5.02 116.55 116.26 3i6z n ASP 380 Ca 0.06 -2.93 0.14 0.00 0.52 0.00 0.00 54.79 52.58 3i6z n ASP 380 Cb 0.34 1.38 0.61 0.00 -0.72 0.00 0.00 41.12 42.73 3i6z n ASP 380 CO 0.00 0.00 0.00 -2.24 -1.92 0.00 0.00 177.20 173.04 3i6z h ASP 381 N 2.38 0.00 -0.60 1.67 2.03 -1.51 -2.81 116.42 117.57 3i6z h ASP 381 Ca -0.21 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.09 3i6z h ASP 381 Cb 1.22 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.72 3i6z h ASP 381 CO 0.01 0.00 0.00 0.59 -1.03 0.00 0.00 179.24 178.81 3i6z n ASN 382 N -2.55 5.30 -4.64 4.15 3.02 -1.26 -4.69 115.26 114.59 3i6z n ASN 382 Ca 0.01 -2.72 -0.43 0.00 -0.03 0.00 0.00 54.58 51.41 3i6z n ASN 382 Cb 0.22 -0.64 -0.02 0.00 -0.61 0.00 0.00 39.78 38.72 3i6z n ASN 382 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3i6z s ASN 383 N -0.81 6.90 0.26 6.41 3.84 -1.06 -4.91 114.94 125.56 3i6z s ASN 383 Ca 0.53 1.06 -0.03 0.00 0.21 0.00 0.00 52.86 54.62 3i6z s ASN 383 Cb 0.38 -2.54 0.32 0.00 -0.55 0.00 0.00 41.25 38.85 3i6z s ASN 383 CO 0.19 -0.91 1.80 1.23 -2.79 0.00 0.00 177.10 176.62 3i6z h GLY 384 N 10.20 0.99 1.19 1.21 0.00 -1.90 -0.91 103.07 113.84 3i6z h GLY 384 Ca -0.21 -0.58 -0.16 0.00 0.00 0.00 0.00 47.33 46.38 3i6z h GLY 384 CO 1.04 0.54 -0.39 -2.22 0.00 0.00 0.00 176.54 175.51 3i6z h ILE 385 N 0.88 1.28 -0.31 2.60 2.04 -1.91 -1.03 117.51 121.06 3i6z h ILE 385 Ca 0.19 -1.56 -0.14 0.00 1.00 0.00 0.00 64.86 64.35 3i6z h ILE 385 Cb 0.32 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 3i6z h ILE 385 CO -0.00 0.52 -0.36 0.11 0.00 0.00 0.00 178.15 178.41 3i6z h LYS 386 N 0.73 0.71 -0.43 2.37 1.57 -1.89 0.47 116.57 120.09 3i6z h LYS 386 Ca 0.06 -0.35 -0.10 0.00 -1.87 0.00 0.00 60.65 58.39 3i6z h LYS 386 Cb 0.97 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.26 3i6z h LYS 386 CO 0.09 0.96 -0.12 -0.91 -0.57 0.00 0.00 179.45 178.90 3i6z h ASN 387 N 0.59 0.85 -0.04 0.86 2.35 -1.10 0.82 115.58 119.91 3i6z h ASN 387 Ca 0.06 -0.37 -0.00 0.00 -0.55 0.00 0.00 56.30 55.44 3i6z h ASN 387 Cb 0.89 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 39.03 3i6z h ASN 387 CO 0.08 1.02 0.01 -0.09 -1.65 0.00 0.00 177.43 176.80 3i6z h ARG 388 N 0.67 0.05 -0.18 0.81 1.12 -1.04 -2.10 114.38 113.71 3i6z h ARG 388 Ca 0.11 -0.01 -0.10 0.00 -1.11 0.00 0.00 59.98 58.86 3i6z h ARG 388 Cb 0.66 -0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 30.60 3i6z h ARG 388 CO 0.05 0.20 -0.35 -0.44 -3.11 0.00 0.00 179.97 176.32 3i6z h ASP 389 N -0.10 0.38 -0.58 -3.80 3.32 -0.88 -1.79 116.42 112.97 3i6z h ASP 389 Ca 0.01 -0.15 -0.02 0.00 0.02 0.00 0.00 57.03 56.90 3i6z h ASP 389 Cb 0.17 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 3i6z h ASP 389 CO -0.00 0.70 0.30 1.23 -1.72 0.00 0.00 179.24 179.75 3i6z h GLY 390 N 1.10 0.87 1.08 2.75 0.00 -0.70 -1.00 103.07 107.18 3i6z h GLY 390 Ca 0.04 -0.42 -0.09 0.00 0.00 0.00 0.00 47.33 46.86 3i6z h GLY 390 CO 0.06 0.40 0.05 1.41 0.00 0.00 0.00 176.54 178.46 3i6z h LEU 391 N 0.78 1.06 -0.36 3.11 3.38 -1.19 0.49 115.31 122.58 3i6z h LEU 391 Ca 0.20 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.92 3i6z h LEU 391 Cb 0.08 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 3i6z h LEU 391 CO -0.03 1.08 0.15 -0.78 0.09 0.00 0.00 178.44 178.95 3i6z h ASP 392 N 1.01 0.18 -0.54 -0.43 1.82 -0.99 -0.95 116.42 116.51 3i6z h ASP 392 Ca 0.19 0.03 -0.08 0.00 -0.39 0.00 0.00 57.03 56.78 3i6z h ASP 392 Cb 0.51 0.01 -0.02 0.00 0.68 0.00 0.00 39.33 40.50 3i6z h ASP 392 CO 0.02 0.14 0.03 0.44 -1.61 0.00 0.00 179.24 178.27 3i6z h ASP 393 N 0.31 0.94 0.05 2.28 3.32 -0.83 -1.62 116.42 120.87 3i6z h ASP 393 Ca 0.16 -0.24 0.01 0.00 0.02 0.00 0.00 57.03 56.98 3i6z h ASP 393 Cb 0.12 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 3i6z h ASP 393 CO -0.15 0.98 -0.09 0.40 -1.72 0.00 0.00 179.24 178.67 3i6z h ILE 394 N 0.90 0.79 -0.36 0.35 2.04 -0.21 0.23 117.51 121.25 3i6z h ILE 394 Ca 0.17 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.03 3i6z h ILE 394 Cb 0.49 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 3i6z h ILE 394 CO 0.02 0.00 0.21 0.58 0.00 0.00 0.00 178.15 178.96 3i6z h VAL 395 N -0.17 1.13 -0.31 1.67 2.07 -1.14 -1.50 116.25 118.00 3i6z h VAL 395 Ca 0.02 -0.32 -0.11 0.00 0.82 0.00 0.00 66.70 67.11 3i6z h VAL 395 Cb 0.19 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 3i6z h VAL 395 CO -0.05 0.13 -0.23 1.23 0.02 0.00 0.00 177.57 178.67 3i6z h GLY 396 N 0.46 0.76 0.80 2.17 0.00 -1.12 -2.17 103.07 103.96 3i6z h GLY 396 Ca 0.13 -0.73 -0.00 0.00 0.00 0.00 0.00 47.33 46.72 3i6z h GLY 396 CO -0.02 0.66 0.00 -0.55 0.00 0.00 0.00 176.54 176.64 3i6z h ASP 397 N 0.45 0.02 -0.31 0.19 3.32 -0.50 -0.27 116.42 119.32 3i6z h ASP 397 Ca 0.06 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 56.88 3i6z h ASP 397 Cb 0.78 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.31 3i6z h ASP 397 CO 0.06 0.22 0.09 -0.74 -1.72 0.00 0.00 179.24 177.15 3i6z h HIS 398 N -0.18 0.50 0.00 4.55 2.76 -1.33 0.14 115.15 121.59 3i6z h HIS 398 Ca 0.00 -0.05 -0.14 0.00 -2.20 0.00 0.00 60.37 57.98 3i6z h HIS 398 Cb 0.21 -0.14 -0.02 0.00 1.55 0.00 0.00 27.41 29.00 3i6z h HIS 398 CO -0.01 0.51 -1.21 -0.91 -1.30 0.00 0.00 177.93 175.02 3i6z h ASN 399 N 0.34 0.00 0.00 3.26 2.35 -1.45 -3.40 115.58 116.68 3i6z h ASN 399 Ca 0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 3i6z h ASN 399 Cb 0.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.62 3i6z h ASN 399 CO -0.00 0.52 0.00 0.52 -1.65 0.00 0.00 177.43 176.82 3i6z n VAL 400 N -2.94 0.54 0.20 2.81 0.31 -0.44 -4.60 118.33 114.22 3i6z n VAL 400 Ca -0.07 0.18 -0.15 0.00 -0.01 0.00 0.00 64.34 64.29 3i6z n VAL 400 Cb 0.80 -1.01 -0.08 0.00 -0.91 0.00 0.00 33.84 32.64 3i6z n VAL 400 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 3i6z h ILE 401 N 0.00 0.68 -0.25 2.52 2.04 -1.18 -1.76 117.51 119.56 3i6z h ILE 401 Ca 0.00 -0.11 -0.12 0.00 1.00 0.00 0.00 64.86 65.63 3i6z h ILE 401 Cb 0.00 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 3i6z h ILE 401 CO 0.00 0.02 -0.33 0.00 0.00 0.00 0.00 178.15 177.84 3i6z h PRO 403 N 0.46 1.12 -0.69 0.00 0.11 -1.71 -0.75 132.00 130.54 3i6z h PRO 403 Ca 0.05 -0.26 -0.05 0.00 0.11 0.00 0.00 66.00 65.86 3i6z h PRO 403 Cb 0.80 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 31.73 3i6z h PRO 403 CO 0.07 0.98 0.25 1.25 -0.21 0.00 0.00 178.00 180.34 3i6z h LEU 404 N 1.06 0.97 -1.09 2.35 6.46 -0.98 -0.53 115.31 123.56 3i6z h LEU 404 Ca 0.22 -0.19 -0.06 0.00 -0.12 0.00 0.00 57.88 57.74 3i6z h LEU 404 Cb 0.35 -0.25 -0.02 0.00 -0.73 0.00 0.00 40.66 40.01 3i6z h LEU 404 CO -0.00 0.90 0.02 0.24 -0.62 0.00 0.00 178.44 178.98 3i6z h MET 405 N 0.99 0.67 -0.35 1.25 2.86 -0.75 0.33 114.93 119.92 3i6z h MET 405 Ca 0.23 -0.15 -0.08 0.00 -2.06 0.00 0.00 59.70 57.63 3i6z h MET 405 Cb 0.25 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 3i6z h MET 405 CO -0.01 0.67 -0.09 1.25 1.06 0.00 0.00 176.91 179.79 3i6z h HIS 406 N 0.64 0.77 -0.29 -0.22 -0.00 -0.74 -1.72 115.15 113.59 3i6z h HIS 406 Ca 0.13 -0.17 -0.00 0.00 -0.00 0.00 0.00 60.37 60.34 3i6z h HIS 406 Cb 0.37 -0.19 -0.01 0.00 -0.00 0.00 0.00 27.41 27.58 3i6z h HIS 406 CO 0.02 0.84 0.18 0.35 -0.00 0.00 0.00 177.93 179.32 3i6z h PHE 407 N 0.47 0.37 -0.48 5.26 3.57 -0.57 -1.68 116.94 123.89 3i6z h PHE 407 Ca 0.09 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.63 3i6z h PHE 407 Cb 0.60 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 39.17 3i6z h PHE 407 CO 0.05 0.27 0.24 0.28 -2.23 0.00 0.00 178.31 176.92 3i6z h VAL 408 N 0.37 0.96 -0.25 1.41 2.07 -0.25 0.16 116.25 120.73 3i6z h VAL 408 Ca 0.10 -0.16 -0.20 0.00 0.82 0.00 0.00 66.70 67.26 3i6z h VAL 408 Cb -0.01 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 3i6z h VAL 408 CO -0.02 0.09 -0.62 0.78 0.02 0.00 0.00 177.57 177.82 3i6z h ASN 409 N 0.48 0.97 -0.58 0.57 2.35 -1.22 -2.07 115.58 116.08 3i6z h ASN 409 Ca 0.21 -0.56 -0.09 0.00 -0.55 0.00 0.00 56.30 55.31 3i6z h ASN 409 Cb 0.11 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.18 3i6z h ASN 409 CO -0.14 1.36 0.03 0.11 -1.65 0.00 0.00 177.43 177.14 3i6z h LYS 410 N 0.63 1.02 0.05 0.81 1.79 -1.10 -3.27 116.57 116.50 3i6z h LYS 410 Ca -0.01 -0.30 -0.00 0.00 -2.18 0.00 0.00 60.65 58.16 3i6z h LYS 410 Cb 1.24 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 31.78 3i6z h LYS 410 CO 0.13 0.98 -0.03 -0.92 -1.08 0.00 0.00 179.45 178.54 3i6z h TYR 411 N 0.95 -0.07 -0.66 -1.35 3.20 -0.63 -3.22 116.97 115.19 3i6z h TYR 411 Ca 0.18 -0.00 0.19 0.00 3.14 0.00 0.00 58.73 62.24 3i6z h TYR 411 Cb 0.50 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.77 3i6z h TYR 411 CO 0.03 0.26 0.51 1.15 -1.64 0.00 0.00 178.16 178.48 3i6z h THR 412 N -0.40 0.56 -0.24 1.81 2.02 -1.43 0.61 112.91 115.85 3i6z h THR 412 Ca -0.01 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 3i6z h THR 412 Cb 0.36 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.39 3i6z h THR 412 CO 0.01 0.00 0.09 0.50 0.37 0.00 0.00 175.52 176.49 3i6z h LYS 413 N 0.00 0.33 0.00 6.66 3.64 -1.61 -3.25 116.57 122.34 3i6z h LYS 413 Ca 0.31 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 3i6z h LYS 413 Cb 1.34 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 3i6z h LYS 413 CO -0.00 0.28 -1.35 1.19 -2.27 0.00 0.00 179.45 177.29 3i6z n PHE 414 N -4.43 0.00 -1.22 1.91 3.72 -0.39 -5.07 117.46 111.98 3i6z n PHE 414 Ca 0.00 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.10 3i6z n PHE 414 Cb 0.13 -0.18 0.24 0.00 -0.94 0.00 0.00 39.48 38.73 3i6z n PHE 414 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3i6z s GLY 415 N -2.92 1.62 -0.10 1.37 0.00 0.07 -4.85 107.32 102.52 3i6z s GLY 415 Ca -0.03 -1.08 0.14 0.00 0.00 0.00 0.00 44.72 43.74 3i6z s GLY 415 CO 0.34 -0.17 1.30 -2.01 0.00 0.00 0.00 173.10 172.56 3i6z n ASN 416 N -4.68 3.23 0.00 1.64 4.05 -0.41 -4.89 115.26 114.20 3i6z n ASN 416 Ca 0.15 -2.61 0.00 0.00 0.45 0.00 0.00 54.58 52.57 3i6z n ASN 416 Cb 0.60 -0.38 0.00 0.00 1.23 0.00 0.00 39.78 41.22 3i6z n ASN 416 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3i6z n GLY 417 N -0.29 2.95 3.12 8.20 0.00 -1.24 -4.68 105.19 113.25 3i6z n GLY 417 Ca 0.16 -0.01 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 3i6z n GLY 417 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3i6z s THR 418 N 0.00 1.48 -0.13 2.61 2.01 -1.26 -0.49 115.64 119.87 3i6z s THR 418 Ca 0.00 -0.72 0.01 0.00 0.31 0.00 0.00 61.69 61.29 3i6z s THR 418 Cb 0.00 -1.29 0.02 0.00 0.01 0.00 0.00 72.50 71.24 3i6z s THR 418 CO 0.00 0.43 -0.13 -0.31 -0.69 0.00 0.00 174.62 173.92 3i6z s TYR 419 N 0.25 1.93 -0.07 4.92 2.02 -0.58 0.48 117.35 126.30 3i6z s TYR 419 Ca -0.09 -1.01 0.03 0.00 -0.37 0.00 0.00 57.07 55.63 3i6z s TYR 419 Cb -0.14 -1.45 -0.02 0.00 -0.40 0.00 0.00 41.96 39.95 3i6z s TYR 419 CO 0.04 -0.57 -0.15 -1.17 -1.57 0.00 0.00 175.55 172.13 3i6z s LEU 420 N 1.40 2.70 0.17 -1.29 2.96 -1.26 -0.88 118.68 122.48 3i6z s LEU 420 Ca 0.02 -0.24 0.05 0.00 -0.22 0.00 0.00 54.13 53.74 3i6z s LEU 420 Cb -0.13 -1.56 -0.05 0.00 0.50 0.00 0.00 46.19 44.95 3i6z s LEU 420 CO -0.08 0.30 -0.11 -0.72 -1.32 0.00 0.00 176.35 174.43 3i6z s TYR 421 N -0.48 1.40 -0.27 5.38 -0.85 -0.45 -2.37 117.35 119.70 3i6z s TYR 421 Ca 0.06 -0.72 -0.00 0.00 -0.52 0.00 0.00 57.07 55.89 3i6z s TYR 421 Cb -0.12 -0.70 0.08 0.00 0.38 0.00 0.00 41.96 41.61 3i6z s TYR 421 CO 0.02 0.15 0.05 0.12 -1.52 0.00 0.00 175.55 174.36 3i6z s PHE 422 N -3.24 1.91 -0.32 -3.49 5.36 0.10 -2.65 117.98 115.65 3i6z s PHE 422 Ca 0.19 -1.67 -0.23 0.00 -0.96 0.00 0.00 56.93 54.26 3i6z s PHE 422 Cb 0.02 -1.65 0.00 0.00 -0.34 0.00 0.00 43.02 41.06 3i6z s PHE 422 CO 0.03 -0.80 0.80 0.12 -1.46 0.00 0.00 175.22 173.90 3i6z s PHE 423 N 1.55 3.17 -0.18 10.12 5.36 -0.05 -0.52 117.98 137.44 3i6z s PHE 423 Ca 0.04 0.75 0.20 0.00 -0.96 0.00 0.00 56.93 56.96 3i6z s PHE 423 Cb -0.18 -3.29 0.46 0.00 -0.34 0.00 0.00 43.02 39.68 3i6z s PHE 423 CO -0.16 -0.62 1.16 0.27 -1.46 0.00 0.00 175.22 174.41 3i6z n ASN 424 N 6.29 1.98 -4.61 6.13 6.94 -1.07 -1.46 115.26 129.45 3i6z n ASN 424 Ca 0.04 -2.56 -0.36 0.00 -0.02 0.00 0.00 54.58 51.67 3i6z n ASN 424 Cb 0.48 -0.41 -0.10 0.00 -2.36 0.00 0.00 39.78 37.39 3i6z n ASN 424 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 3i6z s HIS 425 N -2.51 3.25 -0.29 -2.53 2.46 -1.25 -4.98 115.29 109.44 3i6z s HIS 425 Ca 0.35 0.07 -0.20 0.00 0.47 0.00 0.00 55.06 55.75 3i6z s HIS 425 Cb 0.36 -2.25 -0.01 0.00 -0.13 0.00 0.00 32.58 30.55 3i6z s HIS 425 CO -0.07 -0.02 0.61 0.50 -2.47 0.00 0.00 174.74 173.28 3i6z s ARG 426 N 1.13 3.95 0.25 2.88 3.52 -1.26 -4.87 118.95 124.56 3i6z s ARG 426 Ca 0.06 0.33 -0.31 0.00 -0.13 0.00 0.00 55.73 55.68 3i6z s ARG 426 Cb -0.14 -3.71 -0.13 0.00 -1.56 0.00 0.00 34.95 29.42 3i6z s ARG 426 CO 0.05 -0.51 1.53 0.00 -0.81 0.00 0.00 175.30 175.55 3i6z n ALA 427 N 5.79 1.88 0.24 6.12 0.00 -1.26 -4.89 120.51 128.40 3i6z n ALA 427 Ca -0.02 0.40 0.10 0.00 0.00 0.00 0.00 53.44 53.92 3i6z n ALA 427 Cb 0.49 -2.38 0.67 0.00 0.00 0.00 0.00 19.45 18.23 3i6z n ALA 427 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3i6z h SER 428 N 4.80 0.00 -0.53 0.00 4.64 -1.95 -2.37 113.55 118.14 3i6z h SER 428 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3i6z h SER 428 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3i6z h SER 428 CO 0.80 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.30 3i6z n ASN 429 N -4.45 5.27 -4.74 4.97 0.23 -1.26 -5.00 115.26 110.28 3i6z n ASN 429 Ca -0.02 -2.86 -0.42 0.00 -0.53 0.00 0.00 54.58 50.75 3i6z n ASN 429 Cb 0.13 -0.64 -0.02 0.00 -2.08 0.00 0.00 39.78 37.17 3i6z n ASN 429 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 3i6z s LEU 430 N -2.62 4.37 0.04 -4.53 2.96 -0.90 -4.91 118.68 113.09 3i6z s LEU 430 Ca 0.52 2.79 0.24 0.00 -0.22 0.00 0.00 54.13 57.46 3i6z s LEU 430 Cb 0.39 -3.62 0.31 0.00 0.50 0.00 0.00 46.19 43.77 3i6z s LEU 430 CO 0.16 -0.83 1.27 1.33 -1.32 0.00 0.00 176.35 176.96 3i6z n VAL 431 N 2.65 0.12 -2.15 1.68 0.24 -1.26 -4.90 118.33 114.71 3i6z n VAL 431 Ca 0.09 -0.12 -0.32 0.00 -2.04 0.00 0.00 64.34 61.95 3i6z n VAL 431 Cb 0.38 0.21 -0.01 0.00 -1.47 0.00 0.00 33.84 32.96 3i6z n VAL 431 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 3i6z s TRP 432 N -3.08 3.25 0.88 6.34 0.52 -1.26 -4.98 118.94 120.62 3i6z s TRP 432 Ca 0.08 1.47 -0.10 0.00 0.02 0.00 0.00 56.10 57.57 3i6z s TRP 432 Cb 0.16 -2.88 0.13 0.00 -1.15 0.00 0.00 33.47 29.72 3i6z s TRP 432 CO 0.74 -0.76 1.13 -1.25 0.02 0.00 0.00 176.95 176.83 3i6z s PRO 433 N -4.23 1.28 0.34 4.98 0.04 -1.26 -4.93 135.00 131.22 3i6z s PRO 433 Ca 0.60 1.45 0.01 0.00 0.04 0.00 0.00 61.00 63.11 3i6z s PRO 433 Cb -0.13 -1.76 0.59 0.00 0.04 0.00 0.00 34.50 33.24 3i6z s PRO 433 CO 0.37 -2.42 1.99 0.93 0.04 0.00 0.00 177.00 177.92 3i6z h GLU 434 N -1.71 0.87 -0.12 4.56 4.39 -1.94 -2.83 114.58 117.80 3i6z h GLU 434 Ca -0.43 -0.06 0.04 0.00 0.34 0.00 0.00 59.36 59.24 3i6z h GLU 434 Cb 1.26 -0.19 -0.00 0.00 -0.10 0.00 0.00 28.75 29.71 3i6z h GLU 434 CO 0.44 0.59 0.13 0.11 -1.16 0.00 0.00 179.01 179.12 3i6z h TRP 435 N 0.89 0.00 0.00 4.33 5.08 -1.91 -1.82 115.95 122.53 3i6z h TRP 435 Ca 0.24 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.21 3i6z h TRP 435 Cb -0.08 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.08 3i6z h TRP 435 CO 0.00 0.00 0.00 0.52 -1.28 0.00 0.00 178.44 177.68 3i6z h MET 436 N 0.00 0.00 0.00 0.12 2.86 -1.87 -3.48 114.93 112.56 3i6z h MET 436 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 3i6z h MET 436 Cb 0.31 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.97 3i6z h MET 436 CO -0.00 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.38 3i6z n GLY 437 N 0.66 2.99 3.39 8.32 0.00 -0.69 -4.07 105.19 115.80 3i6z n GLY 437 Ca 0.03 -0.28 -0.45 0.00 0.00 0.00 0.00 46.02 45.33 3i6z n GLY 437 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i6z s VAL 438 N 0.00 5.05 0.53 1.61 1.01 -1.26 -4.89 120.40 122.45 3i6z s VAL 438 Ca 0.00 -1.77 -0.20 0.00 0.00 0.00 0.00 61.98 60.01 3i6z s VAL 438 Cb 0.00 -4.62 -0.06 0.00 0.00 0.00 0.00 36.38 31.70 3i6z s VAL 438 CO 0.00 -1.27 1.16 -0.63 0.00 0.00 0.00 175.10 174.36 3i6z s ILE 439 N 1.82 3.00 -0.01 2.22 1.01 -1.26 -1.33 121.20 126.65 3i6z s ILE 439 Ca 0.24 0.66 -0.34 0.00 0.00 0.00 0.00 60.65 61.20 3i6z s ILE 439 Cb -0.10 -3.28 -0.13 0.00 0.01 0.00 0.00 42.46 38.96 3i6z s ILE 439 CO -0.06 -0.10 1.77 1.57 0.00 0.00 0.00 174.94 178.11 3i6z n HIS 440 N -1.16 2.28 0.00 3.97 -0.00 -1.25 -1.35 115.22 117.72 3i6z n HIS 440 Ca 0.11 0.12 0.00 0.00 -0.00 0.00 0.00 57.72 57.94 3i6z n HIS 440 Cb 0.50 -2.61 0.00 0.00 -0.00 0.00 0.00 29.99 27.88 3i6z n HIS 440 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3i6z n GLY 441 N 4.04 1.00 0.56 1.57 0.00 -1.26 -4.96 105.19 106.14 3i6z n GLY 441 Ca 0.21 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.28 3i6z n GLY 441 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3i6z n TYR 442 N -2.00 0.41 0.41 1.61 4.02 -0.46 -2.75 117.16 118.40 3i6z n TYR 442 Ca 0.00 -0.20 0.11 0.00 -0.01 0.00 0.00 57.90 57.80 3i6z n TYR 442 Cb 0.00 -0.01 -0.05 0.00 -0.02 0.00 0.00 39.34 39.26 3i6z n TYR 442 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 3i6z n GLU 443 N 0.36 0.39 -0.13 -0.72 0.00 -1.26 -4.38 120.64 114.89 3i6z n GLU 443 Ca 0.10 -0.04 -0.05 0.00 0.00 0.00 0.00 57.16 57.17 3i6z n GLU 443 Cb 0.26 -1.59 0.04 0.00 0.00 0.00 0.00 31.44 30.15 3i6z n GLU 443 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 3i6z h ILE 444 N 0.00 0.87 -0.31 3.84 2.04 -1.92 -0.62 117.51 121.40 3i6z h ILE 444 Ca 0.00 -0.11 0.09 0.00 1.00 0.00 0.00 64.86 65.84 3i6z h ILE 444 Cb 0.81 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 3i6z h ILE 444 CO 0.00 0.06 0.25 1.05 0.00 0.00 0.00 178.15 179.51 3i6z h GLU 445 N 0.32 0.00 0.19 2.37 4.11 -1.79 0.13 114.58 119.91 3i6z h GLU 445 Ca 0.20 0.00 -0.31 0.00 0.07 0.00 0.00 59.36 59.32 3i6z h GLU 445 Cb 0.19 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.46 3i6z h GLU 445 CO -0.20 0.00 -1.35 0.74 0.07 0.00 0.00 179.01 178.27 3i6z h PHE 446 N 0.00 0.79 -0.43 2.06 -1.00 -1.42 -1.11 116.94 115.83 3i6z h PHE 446 Ca 0.15 -0.56 -0.07 0.00 2.81 0.00 0.00 57.97 60.30 3i6z h PHE 446 Cb 0.64 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 40.15 3i6z h PHE 446 CO 0.00 1.43 -0.03 0.28 -1.61 0.00 0.00 178.31 178.38 3i6z h VAL 447 N 0.14 1.24 -0.28 -0.55 2.07 -0.01 -2.83 116.25 116.03 3i6z h VAL 447 Ca -0.20 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.33 3i6z h VAL 447 Cb 2.05 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 32.76 3i6z h VAL 447 CO 0.24 0.34 0.00 0.49 0.02 0.00 0.00 177.57 178.66 3i6z n PHE 448 N -4.22 0.36 -1.14 1.57 3.01 0.30 -4.66 117.46 112.68 3i6z n PHE 448 Ca 0.02 -0.18 -0.05 0.00 1.01 0.00 0.00 57.45 58.25 3i6z n PHE 448 Cb 0.30 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.75 3i6z n PHE 448 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3i6z n GLY 449 N 1.14 0.73 0.38 1.37 0.00 -1.07 -4.21 105.19 103.53 3i6z n GLY 449 Ca 0.15 -0.49 0.14 0.00 0.00 0.00 0.00 46.02 45.82 3i6z n GLY 449 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3i6z h LEU 450 N 0.00 0.52 -1.06 0.99 -0.00 -1.48 -1.88 115.31 112.40 3i6z h LEU 450 Ca -0.10 0.03 0.00 0.00 -0.00 0.00 0.00 57.88 57.82 3i6z h LEU 450 Cb 0.42 -0.07 0.00 0.00 -0.00 0.00 0.00 40.66 41.01 3i6z h LEU 450 CO 0.14 0.26 0.00 -2.65 -0.00 0.00 0.00 178.44 176.19 3i6z n PRO 451 N -4.53 0.13 0.04 1.13 -0.02 -1.26 -1.18 135.00 129.31 3i6z n PRO 451 Ca 0.17 0.56 0.13 0.00 -2.02 0.00 0.00 63.50 62.34 3i6z n PRO 451 Cb 0.52 -1.87 0.52 0.00 -0.02 0.00 0.00 33.50 32.65 3i6z n PRO 451 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3i6z n LEU 452 N -2.14 0.31 -4.48 2.45 4.77 -0.71 -4.49 117.00 112.71 3i6z n LEU 452 Ca -0.00 0.53 -0.43 0.00 -0.03 0.00 0.00 56.01 56.08 3i6z n LEU 452 Cb 0.08 -0.44 -0.05 0.00 -2.33 0.00 0.00 43.42 40.67 3i6z n LEU 452 CO 0.11 -0.11 0.55 -0.69 -1.33 0.00 0.00 177.39 175.92 3i6z s VAL 453 N -3.05 4.61 0.23 4.08 1.01 -0.33 -4.96 120.40 122.00 3i6z s VAL 453 Ca 0.12 -0.18 -0.11 0.00 0.00 0.00 0.00 61.98 61.81 3i6z s VAL 453 Cb 0.15 -4.45 0.30 0.00 0.00 0.00 0.00 36.38 32.39 3i6z s VAL 453 CO 0.52 -1.01 1.61 0.50 0.00 0.00 0.00 175.10 176.72 3i6z h LYS 454 N 9.19 0.01 0.00 2.72 3.64 -1.86 -0.08 116.57 130.20 3i6z h LYS 454 Ca -0.27 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 3i6z h LYS 454 Cb 1.08 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 3i6z h LYS 454 CO 1.04 0.01 0.08 0.39 -2.27 0.00 0.00 179.45 178.70 3i6z n GLU 455 N -5.47 0.10 -0.02 1.90 4.71 -1.26 -1.44 120.64 119.16 3i6z n GLU 455 Ca 0.11 0.59 0.13 0.00 -0.01 0.00 0.00 57.16 57.97 3i6z n GLU 455 Cb 0.40 -1.91 0.59 0.00 -1.01 0.00 0.00 31.44 29.50 3i6z n GLU 455 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 3i6z n LEU 456 N -2.06 0.89 -2.68 -4.62 4.77 -0.04 -4.95 117.00 108.31 3i6z n LEU 456 Ca -0.01 -0.34 -0.18 0.00 -0.03 0.00 0.00 56.01 55.45 3i6z n LEU 456 Cb 0.10 -0.03 0.04 0.00 -2.33 0.00 0.00 43.42 41.21 3i6z n LEU 456 CO 0.07 0.17 0.09 0.59 -1.33 0.00 0.00 177.39 176.98 3i6z n ASN 457 N -0.25 -5.35 -4.94 -1.43 3.02 -0.52 -4.98 115.26 100.80 3i6z n ASN 457 Ca 0.18 -0.32 -0.24 0.00 -0.03 0.00 0.00 54.58 54.17 3i6z n ASN 457 Cb 0.23 -4.08 0.01 0.00 -0.61 0.00 0.00 39.78 35.33 3i6z n ASN 457 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3i6z s TYR 458 N -3.14 3.34 0.72 3.10 2.02 -1.26 -4.62 117.35 117.50 3i6z s TYR 458 Ca 0.35 0.36 -0.10 0.00 -0.37 0.00 0.00 57.07 57.31 3i6z s TYR 458 Cb -0.15 -2.23 0.04 0.00 -0.40 0.00 0.00 41.96 39.22 3i6z s TYR 458 CO 0.43 -0.26 1.08 0.95 -1.57 0.00 0.00 175.55 176.18 3i6z s THR 459 N -2.55 2.88 0.36 -0.71 -4.23 -1.26 -4.92 115.64 105.21 3i6z s THR 459 Ca 0.46 0.14 0.06 0.00 -1.18 0.00 0.00 61.69 61.17 3i6z s THR 459 Cb -0.10 -3.26 0.18 0.00 1.34 0.00 0.00 72.50 70.66 3i6z s THR 459 CO 0.39 -0.32 1.92 0.00 -0.54 0.00 0.00 174.62 176.07 3i6z h ALA 460 N -0.69 1.47 0.00 3.99 0.00 -1.98 -2.12 119.26 119.93 3i6z h ALA 460 Ca -0.45 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.15 3i6z h ALA 460 Cb 1.29 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 3i6z h ALA 460 CO 0.63 0.38 -0.67 1.05 0.00 0.00 0.00 179.25 180.64 3i6z h GLU 461 N 0.46 0.00 -0.09 0.00 9.09 -1.99 -2.26 114.58 119.80 3i6z h GLU 461 Ca 0.10 0.00 -0.13 0.00 0.05 0.00 0.00 59.36 59.39 3i6z h GLU 461 Cb 0.25 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.34 3i6z h GLU 461 CO 0.00 0.67 -0.51 0.93 0.05 0.00 0.00 179.01 180.16 3i6z h GLU 462 N 0.00 0.23 -0.37 1.06 5.08 -1.78 1.00 114.58 119.79 3i6z h GLU 462 Ca -0.01 -0.13 -0.14 0.00 -1.00 0.00 0.00 59.36 58.08 3i6z h GLU 462 Cb 1.22 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 3i6z h GLU 462 CO 0.09 0.69 -0.34 1.49 -1.00 0.00 0.00 179.01 179.94 3i6z h GLU 463 N 0.18 0.85 -0.58 2.33 4.81 -1.25 -0.67 114.58 120.26 3i6z h GLU 463 Ca 0.01 -0.41 -0.05 0.00 -0.13 0.00 0.00 59.36 58.78 3i6z h GLU 463 Cb 0.96 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.31 3i6z h GLU 463 CO 0.08 1.05 0.18 0.00 -0.73 0.00 0.00 179.01 179.59 3i6z h ALA 464 N 0.91 0.76 -0.43 2.92 0.00 -0.93 -0.81 119.26 121.68 3i6z h ALA 464 Ca 0.07 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3i6z h ALA 464 Cb 0.90 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 3i6z h ALA 464 CO 0.08 0.42 0.27 1.25 0.00 0.00 0.00 179.25 181.27 3i6z h LEU 465 N 0.81 0.50 -0.14 0.00 5.85 -0.58 -1.21 115.31 120.54 3i6z h LEU 465 Ca 0.19 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.89 3i6z h LEU 465 Cb 0.29 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 3i6z h LEU 465 CO -0.01 0.39 0.02 -1.28 -0.34 0.00 0.00 178.44 177.23 3i6z h SER 466 N 0.57 -0.01 -0.68 1.25 0.87 -0.83 -0.64 113.55 114.07 3i6z h SER 466 Ca 0.15 0.02 0.03 0.00 -1.23 0.00 0.00 61.79 60.77 3i6z h SER 466 Cb -0.03 0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 61.93 3i6z h SER 466 CO -0.03 0.02 0.43 0.03 -0.53 0.00 0.00 176.83 176.74 3i6z h ARG 467 N 0.08 0.81 -0.06 2.24 3.08 -0.91 0.11 114.38 119.73 3i6z h ARG 467 Ca 0.06 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 3i6z h ARG 467 Cb 0.06 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 29.92 3i6z h ARG 467 CO -0.09 0.54 0.04 0.00 -1.07 0.00 0.00 179.97 179.38 3i6z h ARG 468 N 0.84 0.08 -0.18 0.04 3.08 -0.88 -1.37 114.38 115.98 3i6z h ARG 468 Ca 0.27 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.31 3i6z h ARG 468 Cb 0.01 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 3i6z h ARG 468 CO -0.10 0.09 0.11 0.82 -1.07 0.00 0.00 179.97 179.81 3i6z h ILE 469 N 0.05 1.08 -0.97 2.04 2.04 -0.72 0.56 117.51 121.59 3i6z h ILE 469 Ca 0.02 -0.19 0.07 0.00 1.00 0.00 0.00 64.86 65.76 3i6z h ILE 469 Cb 0.03 0.88 -0.07 0.00 -0.74 0.00 0.00 36.82 36.92 3i6z h ILE 469 CO -0.00 0.07 0.62 0.24 0.00 0.00 0.00 178.15 179.08 3i6z h MET 470 N 0.21 1.08 -0.01 2.37 2.86 -0.73 0.10 114.93 120.82 3i6z h MET 470 Ca 0.06 -0.07 -0.16 0.00 -2.06 0.00 0.00 59.70 57.48 3i6z h MET 470 Cb 0.03 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.42 3i6z h MET 470 CO -0.01 0.72 -0.74 1.25 1.06 0.00 0.00 176.91 179.18 3i6z h HIS 471 N 1.11 0.09 0.03 -0.22 -0.00 -0.92 -1.18 115.15 114.06 3i6z h HIS 471 Ca 0.42 -0.04 -0.00 0.00 -0.00 0.00 0.00 60.37 60.75 3i6z h HIS 471 Cb 0.19 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 27.59 3i6z h HIS 471 CO -0.01 0.78 -0.01 1.88 -0.00 0.00 0.00 177.93 180.56 3i6z h TYR 472 N 0.04 -0.04 -0.04 5.26 0.05 0.10 -0.81 116.97 121.53 3i6z h TYR 472 Ca -0.01 -0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.78 3i6z h TYR 472 Cb 1.30 0.01 -0.02 0.00 1.01 0.00 0.00 36.73 39.04 3i6z h TYR 472 CO 0.01 0.25 -0.05 -1.49 -1.05 0.00 0.00 178.16 175.83 3i6z h TRP 473 N -0.33 -0.12 -0.50 4.88 -0.00 -0.76 -0.80 115.95 118.33 3i6z h TRP 473 Ca -0.00 0.01 -0.11 0.00 -0.00 0.00 0.00 58.89 58.78 3i6z h TRP 473 Cb 0.31 0.06 -0.02 0.00 -0.00 0.00 0.00 29.16 29.51 3i6z h TRP 473 CO 0.02 -0.08 -0.13 0.00 -0.00 0.00 0.00 178.44 178.25 3i6z h ALA 474 N 0.97 0.69 -0.53 1.49 0.00 -1.26 0.60 119.26 121.21 3i6z h ALA 474 Ca 0.03 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.51 3i6z h ALA 474 Cb 0.12 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3i6z h ALA 474 CO -0.08 0.61 0.03 1.15 0.00 0.00 0.00 179.25 180.96 3i6z h THR 475 N 0.83 1.25 -0.42 0.00 2.02 -1.08 -0.16 112.91 115.34 3i6z h THR 475 Ca 0.12 -1.03 -0.06 0.00 0.77 0.00 0.00 66.41 66.22 3i6z h THR 475 Cb 0.70 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.90 3i6z h THR 475 CO 0.05 0.37 0.04 0.15 0.37 0.00 0.00 175.52 176.50 3i6z h PHE 476 N 0.83 0.77 -0.96 3.16 3.57 -0.84 0.11 116.94 123.57 3i6z h PHE 476 Ca 0.16 -0.12 0.05 0.00 3.53 0.00 0.00 57.97 61.59 3i6z h PHE 476 Cb 0.46 -0.21 -0.06 0.00 2.79 0.00 0.00 35.95 38.93 3i6z h PHE 476 CO 0.03 0.76 0.62 0.00 -2.23 0.00 0.00 178.31 177.49 3i6z h ALA 477 N 0.91 1.31 -0.08 2.41 0.00 -0.33 0.36 119.26 123.84 3i6z h ALA 477 Ca 0.12 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.82 3i6z h ALA 477 Cb 0.43 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 17.92 3i6z h ALA 477 CO 0.01 0.44 -0.68 -0.22 0.00 0.00 0.00 179.25 178.81 3i6z h LYS 478 N 1.16 0.60 0.00 0.00 3.64 -0.73 -3.41 116.57 117.83 3i6z h LYS 478 Ca 0.40 -0.54 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 3i6z h LYS 478 Cb 0.10 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 3i6z h LYS 478 CO -0.15 1.16 -0.95 0.25 -2.27 0.00 0.00 179.45 177.49 3i6z n THR 479 N -4.09 0.00 -0.42 1.00 -2.24 0.36 -4.99 114.28 103.89 3i6z n THR 479 Ca -0.09 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 3i6z n THR 479 Cb 0.70 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 69.48 3i6z n THR 479 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3i6z n GLY 480 N 1.97 0.79 3.01 3.38 0.00 0.12 -5.03 105.19 109.43 3i6z n GLY 480 Ca -0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 3i6z n GLY 480 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3i6z s ASN 481 N -2.01 0.15 0.49 1.61 3.84 -1.25 -4.92 114.94 112.85 3i6z s ASN 481 Ca 0.00 0.55 0.32 0.00 0.21 0.00 0.00 52.86 53.94 3i6z s ASN 481 Cb 0.00 0.56 1.31 0.00 -0.55 0.00 0.00 41.25 42.57 3i6z s ASN 481 CO 0.00 -0.21 1.93 1.55 -2.79 0.00 0.00 177.10 177.58 3i6z h PRO 482 N 7.88 0.00 -6.66 0.43 0.13 -1.82 -3.16 132.00 128.80 3i6z h PRO 482 Ca -0.24 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.38 3i6z h PRO 482 Cb 1.13 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.24 3i6z h PRO 482 CO 0.23 0.00 0.31 -0.80 -0.23 0.00 0.00 178.00 177.50 3i6z s ASN 483 N -5.37 7.56 -0.04 1.44 0.01 -1.26 -4.49 114.94 112.79 3i6z s ASN 483 Ca 0.02 1.84 -0.30 0.00 -0.71 0.00 0.00 52.86 53.71 3i6z s ASN 483 Cb 0.09 -2.58 -0.04 0.00 0.41 0.00 0.00 41.25 39.13 3i6z s ASN 483 CO 0.51 0.14 1.32 -0.70 -1.51 0.00 0.00 177.10 176.86 3i6z s GLU 484 N -0.97 4.30 0.22 -0.60 2.56 -1.26 -4.96 118.70 117.99 3i6z s GLU 484 Ca 0.41 1.84 -0.30 0.00 0.00 0.00 0.00 54.97 56.91 3i6z s GLU 484 Cb -0.25 -3.60 -0.10 0.00 2.00 0.00 0.00 34.13 32.19 3i6z s GLU 484 CO 0.30 -0.55 1.45 -1.25 -0.56 0.00 0.00 175.26 174.66 3i6z s PRO 485 N 2.48 4.27 -1.20 4.30 0.04 -1.26 -2.37 135.00 141.25 3i6z s PRO 485 Ca 0.60 2.28 0.00 0.00 0.04 0.00 0.00 61.00 63.93 3i6z s PRO 485 Cb -0.28 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.13 3i6z s PRO 485 CO 0.24 -0.45 0.00 0.72 0.04 0.00 0.00 177.00 177.55 3i6z n HIS 486 N 2.78 -0.15 -2.31 0.56 8.25 -1.26 -5.01 115.22 118.08 3i6z n HIS 486 Ca 0.08 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.27 3i6z n HIS 486 Cb 0.40 -2.33 0.04 0.00 1.12 0.00 0.00 29.99 29.22 3i6z n HIS 486 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3i6z s SER 487 N -2.77 5.50 -0.01 0.41 0.15 -1.00 -5.00 113.70 110.98 3i6z s SER 487 Ca 0.00 0.75 0.19 0.00 0.70 0.00 0.00 55.95 57.59 3i6z s SER 487 Cb 0.00 -1.68 -0.26 0.00 -1.71 0.00 0.00 66.02 62.37 3i6z s SER 487 CO 0.00 -1.15 0.60 0.00 1.20 0.00 0.00 173.24 173.89 3i6z n GLN 488 N -2.67 0.66 -0.64 5.44 1.13 -1.26 -4.99 117.38 115.05 3i6z n GLN 488 Ca 0.05 -0.10 -0.30 0.00 -1.94 0.00 0.00 57.00 54.71 3i6z n GLN 488 Cb 0.58 -1.43 0.19 0.00 0.11 0.00 0.00 30.24 29.69 3i6z n GLN 488 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3i6z s GLU 489 N -3.09 0.43 0.31 -1.09 8.01 -1.26 -4.93 118.70 117.08 3i6z s GLU 489 Ca -0.01 1.36 -0.29 0.00 0.01 0.00 0.00 54.97 56.04 3i6z s GLU 489 Cb 0.13 -1.67 -0.10 0.00 -4.31 0.00 0.00 34.13 28.18 3i6z s GLU 489 CO 0.80 -2.97 1.37 -1.12 0.01 0.00 0.00 175.26 173.35 3i6z s SER 490 N -2.61 6.67 -0.10 -0.19 0.01 -1.26 -4.99 113.70 111.23 3i6z s SER 490 Ca 0.67 2.74 -0.19 0.00 1.31 0.00 0.00 55.95 60.48 3i6z s SER 490 Cb -0.24 -2.64 -0.04 0.00 0.21 0.00 0.00 66.02 63.31 3i6z s SER 490 CO 0.60 -0.63 0.50 -0.54 0.41 0.00 0.00 173.24 173.58 3i6z s LYS 491 N -1.43 4.34 -0.38 12.44 -0.14 -1.26 -5.03 119.74 128.28 3i6z s LYS 491 Ca 0.52 0.50 -0.29 0.00 -1.36 0.00 0.00 55.97 55.34 3i6z s LYS 491 Cb -0.41 -3.43 0.01 0.00 -1.68 0.00 0.00 37.83 32.33 3i6z s LYS 491 CO 0.52 0.18 1.22 -0.46 -0.76 0.00 0.00 175.35 176.04 3i6z s TRP 492 N 0.55 2.79 0.58 3.18 -0.11 -1.26 -4.99 118.94 119.67 3i6z s TRP 492 Ca 0.27 0.87 -0.14 0.00 1.22 0.00 0.00 56.10 58.32 3i6z s TRP 492 Cb -0.16 -4.08 -0.05 0.00 -1.50 0.00 0.00 33.47 27.68 3i6z s TRP 492 CO 0.11 -1.40 1.02 -1.25 -4.62 0.00 0.00 176.95 170.81 3i6z s PRO 493 N 4.26 3.61 0.33 5.86 0.04 -1.26 -4.86 135.00 142.98 3i6z s PRO 493 Ca 0.52 0.95 -0.29 0.00 0.04 0.00 0.00 61.00 62.22 3i6z s PRO 493 Cb -0.12 -2.08 -0.10 0.00 0.04 0.00 0.00 34.50 32.23 3i6z s PRO 493 CO 0.25 -0.56 1.33 -1.17 0.04 0.00 0.00 177.00 176.90 3i6z s LEU 494 N -4.63 4.42 -0.18 -3.56 2.96 -1.26 -4.69 118.68 111.73 3i6z s LEU 494 Ca 0.59 2.71 -0.24 0.00 -0.22 0.00 0.00 54.13 56.97 3i6z s LEU 494 Cb -0.12 -3.65 -0.02 0.00 0.50 0.00 0.00 46.19 42.90 3i6z s LEU 494 CO 0.41 -0.57 0.75 0.12 -1.32 0.00 0.00 176.35 175.74 3i6z s PHE 495 N -1.04 3.41 0.24 5.38 2.19 0.18 -4.52 117.98 123.81 3i6z s PHE 495 Ca 0.50 1.13 0.11 0.00 0.33 0.00 0.00 56.93 59.00 3i6z s PHE 495 Cb -0.40 -2.93 -0.05 0.00 -1.31 0.00 0.00 43.02 38.33 3i6z s PHE 495 CO 0.53 -0.20 -0.20 0.95 1.83 0.00 0.00 175.22 178.13 3i6z s THR 496 N 2.01 2.26 0.38 0.12 -4.23 -1.26 -4.31 115.64 110.60 3i6z s THR 496 Ca 0.35 -2.24 0.09 0.00 -1.18 0.00 0.00 61.69 58.71 3i6z s THR 496 Cb -0.16 -2.17 0.32 0.00 1.34 0.00 0.00 72.50 71.83 3i6z s THR 496 CO 0.12 -0.36 1.92 0.74 -0.54 0.00 0.00 174.62 176.49 3i6z h THR 497 N 2.63 0.89 0.00 3.99 2.02 -1.95 0.14 112.91 120.63 3i6z h THR 497 Ca -0.41 -0.22 -0.00 0.00 0.77 0.00 0.00 66.41 66.55 3i6z h THR 497 Cb 1.24 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.84 3i6z h THR 497 CO 0.57 0.12 -0.00 0.50 0.37 0.00 0.00 175.52 177.07 3i6z h LYS 498 N 0.64 -0.00 0.00 6.66 3.64 -2.01 -3.40 116.57 122.10 3i6z h LYS 498 Ca 0.38 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.57 3i6z h LYS 498 Cb 0.58 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.37 3i6z h LYS 498 CO -0.15 0.92 -1.64 0.39 -2.27 0.00 0.00 179.45 176.70 3i6z n GLU 499 N -4.64 0.64 -4.07 1.90 -0.58 -1.20 -5.00 120.64 107.69 3i6z n GLU 499 Ca -0.10 0.14 -0.32 0.00 -0.42 0.00 0.00 57.16 56.47 3i6z n GLU 499 Cb 0.44 -1.73 -0.01 0.00 -0.57 0.00 0.00 31.44 29.58 3i6z n GLU 499 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 3i6z n GLN 500 N -2.80 -3.78 -2.65 3.49 6.02 0.49 -4.44 117.38 113.71 3i6z n GLN 500 Ca -0.13 0.44 -0.34 0.00 -0.01 0.00 0.00 57.00 56.96 3i6z n GLN 500 Cb 0.86 -5.04 -0.05 0.00 1.02 0.00 0.00 30.24 27.04 3i6z n GLN 500 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 3i6z s LYS 501 N -6.74 3.99 0.17 -1.09 1.02 -1.26 -1.76 119.74 114.08 3i6z s LYS 501 Ca 0.51 1.28 -0.12 0.00 0.02 0.00 0.00 55.97 57.66 3i6z s LYS 501 Cb -0.27 -2.17 0.01 0.00 -0.52 0.00 0.00 37.83 34.88 3i6z s LYS 501 CO 0.89 -0.25 0.37 -0.59 -0.92 0.00 0.00 175.35 174.85 3i6z s PHE 502 N -2.03 0.16 0.22 3.18 -0.71 -0.56 -4.23 117.98 114.02 3i6z s PHE 502 Ca 0.64 -0.52 0.11 0.00 -1.04 0.00 0.00 56.93 56.13 3i6z s PHE 502 Cb -0.14 0.13 -0.05 0.00 -1.21 0.00 0.00 43.02 41.75 3i6z s PHE 502 CO 0.18 -0.78 -0.22 0.96 -1.34 0.00 0.00 175.22 174.01 3i6z s ILE 503 N -3.92 2.41 0.44 -4.49 -4.36 -1.00 -0.39 121.20 109.89 3i6z s ILE 503 Ca 0.13 -2.12 -0.10 0.00 -0.26 0.00 0.00 60.65 58.29 3i6z s ILE 503 Cb 0.02 -2.19 -0.06 0.00 1.25 0.00 0.00 42.46 41.48 3i6z s ILE 503 CO -0.02 -0.19 0.81 -1.81 0.24 0.00 0.00 174.94 173.96 3i6z s ASP 504 N -2.90 6.49 -0.27 4.36 1.01 -0.87 -0.72 116.67 123.77 3i6z s ASP 504 Ca 0.23 1.17 0.01 0.00 0.71 0.00 0.00 52.55 54.67 3i6z s ASP 504 Cb -0.07 -2.34 0.08 0.00 1.01 0.00 0.00 42.92 41.59 3i6z s ASP 504 CO 0.11 -0.47 0.01 -0.22 0.21 0.00 0.00 175.17 174.82 3i6z s LEU 505 N -4.05 2.83 0.00 1.23 2.96 0.32 -4.60 118.68 117.37 3i6z s LEU 505 Ca 0.52 -1.45 -0.05 0.00 -0.22 0.00 0.00 54.13 52.92 3i6z s LEU 505 Cb -0.10 -1.16 0.02 0.00 0.50 0.00 0.00 46.19 45.45 3i6z s LEU 505 CO 0.34 -0.31 0.26 -0.46 -1.32 0.00 0.00 176.35 174.86 3i6z n ASN 506 N 4.65 -0.62 -0.04 3.68 0.23 -1.26 -2.59 115.26 119.31 3i6z n ASN 506 Ca -0.06 -1.39 0.14 0.00 -0.53 0.00 0.00 54.58 52.74 3i6z n ASN 506 Cb 0.43 1.02 0.82 0.00 -2.08 0.00 0.00 39.78 39.97 3i6z n ASN 506 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 3i6z n THR 507 N -0.18 0.00 -3.04 5.53 -2.24 -1.26 -4.85 114.28 108.25 3i6z n THR 507 Ca -0.02 -0.02 -0.24 0.00 -2.27 0.00 0.00 64.05 61.50 3i6z n THR 507 Cb 0.17 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 3i6z n THR 507 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3i6z s GLU 508 N -2.00 3.26 0.29 -0.78 8.01 -1.26 -5.02 118.70 121.21 3i6z s GLU 508 Ca 0.42 -0.32 -0.30 0.00 0.01 0.00 0.00 54.97 54.78 3i6z s GLU 508 Cb 0.20 -2.55 -0.12 0.00 -4.31 0.00 0.00 34.13 27.34 3i6z s GLU 508 CO 0.33 -0.14 1.48 -0.35 0.01 0.00 0.00 175.26 176.59 3i6z n PRO 509 N -2.03 2.40 -1.38 0.39 -0.04 -1.26 -4.83 135.00 128.25 3i6z n PRO 509 Ca -0.01 0.85 -0.45 0.00 -0.04 0.00 0.00 63.50 63.86 3i6z n PRO 509 Cb 0.57 -2.56 -0.01 0.00 -0.04 0.00 0.00 33.50 31.45 3i6z n PRO 509 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 3i6z n MET 510 N 1.74 0.16 -3.81 0.54 1.56 -1.26 -4.99 117.12 111.06 3i6z n MET 510 Ca 0.08 0.06 -0.13 0.00 -0.27 0.00 0.00 57.70 57.44 3i6z n MET 510 Cb 0.35 -1.12 -0.14 0.00 2.15 0.00 0.00 33.22 34.45 3i6z n MET 510 CO 0.00 0.00 0.00 0.21 -0.73 0.00 0.00 175.97 175.45 3i6z s LYS 511 N -1.12 0.04 -0.10 2.12 2.20 -1.26 -5.05 119.74 116.58 3i6z s LYS 511 Ca 0.62 0.16 -0.04 0.00 -0.36 0.00 0.00 55.97 56.35 3i6z s LYS 511 Cb -0.76 -0.08 -0.04 0.00 -1.51 0.00 0.00 37.83 35.44 3i6z s LYS 511 CO 0.59 -0.08 0.06 0.08 -0.36 0.00 0.00 175.35 175.64 3i6z s VAL 512 N 0.53 4.80 0.27 4.02 1.01 -1.26 -2.04 120.40 127.72 3i6z s VAL 512 Ca -0.04 -0.07 0.04 0.00 0.00 0.00 0.00 61.98 61.91 3i6z s VAL 512 Cb -0.06 -3.06 -0.02 0.00 0.00 0.00 0.00 36.38 33.25 3i6z s VAL 512 CO -0.02 0.60 0.15 1.41 0.00 0.00 0.00 175.10 177.25 3i6z n HIS 513 N 2.04 -0.22 -3.93 5.22 -0.00 0.47 -4.98 115.22 113.83 3i6z n HIS 513 Ca -0.19 -1.96 -0.10 0.00 -0.00 0.00 0.00 57.72 55.47 3i6z n HIS 513 Cb 0.54 0.10 -0.11 0.00 -0.00 0.00 0.00 29.99 30.52 3i6z n HIS 513 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 3i6z s GLN 514 N -3.06 0.32 -0.86 -0.41 -0.21 -1.26 -1.49 119.66 112.69 3i6z s GLN 514 Ca 0.22 -0.45 -0.04 0.00 0.02 0.00 0.00 55.36 55.10 3i6z s GLN 514 Cb 0.01 0.12 -0.01 0.00 1.00 0.00 0.00 33.01 34.13 3i6z s GLN 514 CO 0.15 -0.06 0.72 0.54 -2.12 0.00 0.00 175.29 174.52 3i6z n ARG 515 N 1.78 -1.46 -1.65 2.91 1.74 -0.72 -4.83 116.66 114.43 3i6z n ARG 515 Ca -0.22 1.11 -0.49 0.00 -0.77 0.00 0.00 57.85 57.48 3i6z n ARG 515 Cb 0.56 -4.77 -0.05 0.00 -1.02 0.00 0.00 32.46 27.18 3i6z n ARG 515 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 3i6z n LEU 516 N -2.49 3.19 -4.33 0.55 7.94 -1.26 -2.29 117.00 118.31 3i6z n LEU 516 Ca -0.09 0.85 -0.36 0.00 -1.11 0.00 0.00 56.01 55.29 3i6z n LEU 516 Cb 0.57 -1.35 -0.06 0.00 0.53 0.00 0.00 43.42 43.11 3i6z n LEU 516 CO 0.58 -0.22 -0.20 0.54 -1.11 0.00 0.00 177.39 176.99 3i6z n ARG 517 N 6.93 -1.83 -0.22 1.96 1.74 -1.26 -4.87 116.66 119.10 3i6z n ARG 517 Ca 0.26 0.23 -0.02 0.00 -0.77 0.00 0.00 57.85 57.56 3i6z n ARG 517 Cb 0.28 -4.57 0.10 0.00 -1.02 0.00 0.00 32.46 27.25 3i6z n ARG 517 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 3i6z h VAL 518 N -1.38 0.96 0.08 1.55 -1.51 -1.82 -1.50 116.25 112.63 3i6z h VAL 518 Ca -0.61 -0.23 0.02 0.00 -1.23 0.00 0.00 66.70 64.65 3i6z h VAL 518 Cb 1.39 0.24 -0.05 0.00 -2.13 0.00 0.00 31.29 30.74 3i6z h VAL 518 CO 0.79 0.12 -0.45 1.56 -1.23 0.00 0.00 177.57 178.36 3i6z h GLN 519 N 0.66 -0.64 -0.43 5.19 1.08 -1.89 -0.88 115.11 118.20 3i6z h GLN 519 Ca 0.29 0.04 -0.09 0.00 -1.45 0.00 0.00 58.65 57.45 3i6z h GLN 519 Cb 0.19 0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.75 3i6z h GLN 519 CO -0.19 -0.43 -0.08 0.52 -0.95 0.00 0.00 178.83 177.71 3i6z h MET 520 N -0.66 0.76 0.00 1.46 2.86 -1.94 -3.08 114.93 114.33 3i6z h MET 520 Ca 0.02 -0.24 -0.07 0.00 -2.06 0.00 0.00 59.70 57.36 3i6z h MET 520 Cb 0.70 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.28 3i6z h MET 520 CO -0.28 0.82 -0.34 0.00 1.06 0.00 0.00 176.91 178.17 3i6z h VAL 522 N 0.00 1.26 0.21 0.00 2.07 -1.08 0.38 116.25 119.10 3i6z h VAL 522 Ca -0.00 -1.25 -0.01 0.00 0.82 0.00 0.00 66.70 66.26 3i6z h VAL 522 Cb 0.85 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 3i6z h VAL 522 CO 0.04 0.41 -0.10 0.15 0.02 0.00 0.00 177.57 178.09 3i6z h PHE 523 N 0.52 -0.26 -0.16 1.57 3.57 -1.27 -0.64 116.94 120.27 3i6z h PHE 523 Ca 0.08 -0.01 -0.17 0.00 3.53 0.00 0.00 57.97 61.41 3i6z h PHE 523 Cb 0.66 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 39.48 3i6z h PHE 523 CO 0.03 -0.01 -0.59 -1.49 -2.23 0.00 0.00 178.31 174.02 3i6z h TRP 524 N -0.48 0.68 0.00 0.41 4.06 -1.11 0.68 115.95 120.19 3i6z h TRP 524 Ca -0.03 -0.25 0.00 0.00 2.06 0.00 0.00 58.89 60.67 3i6z h TRP 524 Cb 0.37 -0.12 0.00 0.00 -1.00 0.00 0.00 29.16 28.40 3i6z h TRP 524 CO -0.01 0.99 -1.26 0.09 -3.56 0.00 0.00 178.44 174.69 3i6z n ASN 525 N -3.94 0.63 0.03 -3.49 3.02 0.13 -4.42 115.26 107.22 3i6z n ASN 525 Ca -0.03 0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.75 3i6z n ASN 525 Cb 0.63 0.85 0.00 0.00 -0.61 0.00 0.00 39.78 40.65 3i6z n ASN 525 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3i6z n GLN 526 N -2.56 0.00 0.16 3.52 6.02 -0.33 -4.82 117.38 119.37 3i6z n GLN 526 Ca -0.01 0.00 -0.12 0.00 -0.01 0.00 0.00 57.00 56.86 3i6z n GLN 526 Cb 0.55 -0.41 -0.07 0.00 1.02 0.00 0.00 30.24 31.33 3i6z n GLN 526 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 3i6z h PHE 527 N 0.00 -0.41 -0.40 1.08 3.57 -1.24 -3.09 116.94 116.45 3i6z h PHE 527 Ca 0.00 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.54 3i6z h PHE 527 Cb 0.48 0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.31 3i6z h PHE 527 CO 0.00 -0.07 0.14 1.25 -2.23 0.00 0.00 178.31 177.40 3i6z h LEU 528 N -0.88 0.15 -1.67 0.59 5.85 -1.11 0.46 115.31 118.69 3i6z h LEU 528 Ca -0.05 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 3i6z h LEU 528 Cb 0.52 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.58 3i6z h LEU 528 CO 0.07 0.12 -0.18 1.55 -0.34 0.00 0.00 178.44 179.67 3i6z h PRO 529 N 0.30 0.00 -0.38 5.25 0.13 -1.77 0.89 132.00 136.42 3i6z h PRO 529 Ca 0.18 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.22 3i6z h PRO 529 Cb 0.16 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.28 3i6z h PRO 529 CO -0.19 0.18 -0.11 -0.22 -0.23 0.00 0.00 178.00 177.43 3i6z h LYS 530 N 0.00 0.75 -0.27 0.86 3.64 -1.13 -1.30 116.57 119.12 3i6z h LYS 530 Ca -0.00 -0.29 -0.01 0.00 -1.27 0.00 0.00 60.65 59.07 3i6z h LYS 530 Cb 0.32 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 3i6z h LYS 530 CO 0.02 0.90 0.13 1.25 -2.27 0.00 0.00 179.45 179.48 3i6z h LEU 531 N 0.55 0.36 -1.28 5.20 6.46 -0.10 -1.70 115.31 124.81 3i6z h LEU 531 Ca 0.10 -0.13 -0.07 0.00 -0.12 0.00 0.00 57.88 57.65 3i6z h LEU 531 Cb 0.63 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.46 3i6z h LEU 531 CO 0.04 0.39 -0.27 -0.07 -0.62 0.00 0.00 178.44 177.91 3i6z h LEU 532 N 0.31 0.14 -0.23 2.25 3.38 -0.79 -1.01 115.31 119.36 3i6z h LEU 532 Ca 0.09 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 3i6z h LEU 532 Cb 0.13 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3i6z h LEU 532 CO -0.01 0.42 -0.47 -1.13 0.09 0.00 0.00 178.44 177.33 3i6z h ASN 533 N 0.13 0.00 0.19 -0.43 -0.73 -1.01 -3.31 115.58 110.41 3i6z h ASN 533 Ca 0.02 0.00 -0.35 0.00 1.87 0.00 0.00 56.30 57.84 3i6z h ASN 533 Cb 0.56 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.14 3i6z h ASN 533 CO 0.04 0.47 -1.88 0.00 -0.37 0.00 0.00 177.43 175.69 3i6z h ALA 534 N 1.53 0.36 -0.03 1.57 0.00 -0.95 -3.51 119.26 118.23 3i6z h ALA 534 Ca -0.00 -1.31 0.00 0.00 0.00 0.00 0.00 54.91 53.60 3i6z h ALA 534 Cb 1.27 0.60 0.00 0.00 0.00 0.00 0.00 17.79 19.66 3i6z h ALA 534 CO 0.06 1.23 0.00 0.25 0.00 0.00 0.00 179.25 180.80