#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r6h s SER 2 N 0.00 6.11 -0.08 1.61 1.04 -1.26 -4.98 113.70 116.14 1r6h s SER 2 Ca 0.00 0.11 -0.06 0.00 0.48 0.00 0.00 55.95 56.48 1r6h s SER 2 Cb 0.00 -2.15 -0.02 0.00 0.10 0.00 0.00 66.02 63.95 1r6h s SER 2 CO 0.00 -0.10 -0.12 1.57 0.98 0.00 0.00 173.24 175.58 1r6h n HIS 3 N 5.13 0.44 -2.66 5.02 -0.00 -1.26 -5.08 115.22 116.81 1r6h n HIS 3 Ca -0.12 0.19 -0.01 0.00 -0.00 0.00 0.00 57.72 57.78 1r6h n HIS 3 Cb 0.52 -0.50 -0.01 0.00 -0.00 0.00 0.00 29.99 29.99 1r6h n HIS 3 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.34 175.01 1r6h n MET 4 N -3.60 -3.72 -2.23 1.57 0.00 -1.26 -4.89 117.12 102.99 1r6h n MET 4 Ca -0.05 2.93 -0.42 0.00 0.00 0.00 0.00 57.70 60.16 1r6h n MET 4 Cb 0.18 -5.23 -0.03 0.00 0.00 0.00 0.00 33.22 28.14 1r6h n MET 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1r6h s ALA 5 N -1.36 3.59 -0.47 3.04 0.00 -1.26 -4.98 121.76 120.31 1r6h s ALA 5 Ca -0.07 0.84 -0.17 0.00 0.00 0.00 0.00 51.96 52.57 1r6h s ALA 5 Cb 0.00 -3.61 0.06 0.00 0.00 0.00 0.00 23.12 19.58 1r6h s ALA 5 CO 0.77 -0.96 0.45 0.50 0.00 0.00 0.00 175.76 176.52 1r6h s ARG 6 N 2.60 3.03 -0.07 0.00 3.52 -1.26 -5.03 118.95 121.74 1r6h s ARG 6 Ca 0.64 -1.14 -0.03 0.00 -0.13 0.00 0.00 55.73 55.07 1r6h s ARG 6 Cb -0.31 -4.10 0.04 0.00 -1.56 0.00 0.00 34.95 29.03 1r6h s ARG 6 CO 0.26 -1.04 0.13 -1.64 -0.81 0.00 0.00 175.30 172.20 1r6h s MET 7 N 1.96 0.03 -0.42 5.12 -1.94 -1.26 -5.12 119.30 117.67 1r6h s MET 7 Ca 0.08 0.45 -0.11 0.00 -1.71 0.00 0.00 55.69 54.40 1r6h s MET 7 Cb -0.22 -0.28 0.07 0.00 2.01 0.00 0.00 34.83 36.42 1r6h s MET 7 CO 0.09 -0.26 0.28 -0.80 -0.01 0.00 0.00 175.02 174.32 1r6h s ASN 8 N 1.83 5.75 -0.29 3.03 0.01 -1.26 -5.00 114.94 119.00 1r6h s ASN 8 Ca -0.01 -1.38 0.05 0.00 -0.71 0.00 0.00 52.86 50.80 1r6h s ASN 8 Cb -0.12 -2.03 0.20 0.00 0.41 0.00 0.00 41.25 39.71 1r6h s ASN 8 CO -0.05 -0.53 0.59 -0.60 -1.51 0.00 0.00 177.10 175.00 1r6h s ARG 9 N 1.49 0.56 -0.63 -0.60 3.52 -1.26 -5.11 118.95 116.92 1r6h s ARG 9 Ca 0.03 0.64 -0.26 0.00 -0.13 0.00 0.00 55.73 56.01 1r6h s ARG 9 Cb -0.23 0.31 -0.04 0.00 -1.56 0.00 0.00 34.95 33.43 1r6h s ARG 9 CO 0.04 -0.96 2.00 -1.25 -0.81 0.00 0.00 175.30 174.31 1r6h s PRO 10 N 2.83 2.48 0.34 5.12 0.04 -1.26 -4.97 135.00 139.58 1r6h s PRO 10 Ca 0.12 0.64 -0.13 0.00 0.04 0.00 0.00 61.00 61.67 1r6h s PRO 10 Cb -0.11 -4.53 -0.08 0.00 0.04 0.00 0.00 34.50 29.82 1r6h s PRO 10 CO -0.25 -2.99 0.73 0.00 0.04 0.00 0.00 177.00 174.54 1r6h s ALA 11 N 10.02 3.35 0.56 8.56 0.00 -1.26 -4.70 121.76 138.29 1r6h s ALA 11 Ca 0.74 -0.06 -0.18 0.00 0.00 0.00 0.00 51.96 52.46 1r6h s ALA 11 Cb -0.13 -2.72 -0.05 0.00 0.00 0.00 0.00 23.12 20.22 1r6h s ALA 11 CO 0.18 0.24 1.09 -1.25 0.00 0.00 0.00 175.76 176.02 1r6h s PRO 12 N -3.24 3.35 -0.08 0.00 0.04 -1.26 -4.80 135.00 129.01 1r6h s PRO 12 Ca 0.53 1.41 -0.03 0.00 0.04 0.00 0.00 61.00 62.95 1r6h s PRO 12 Cb -0.10 -2.02 0.04 0.00 0.04 0.00 0.00 34.50 32.46 1r6h s PRO 12 CO 0.22 -0.81 0.17 0.08 0.04 0.00 0.00 177.00 176.70 1r6h s VAL 13 N -2.09 -0.12 -0.25 -0.36 1.01 0.07 -4.96 120.40 113.70 1r6h s VAL 13 Ca 0.68 0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.85 1r6h s VAL 13 Cb -0.19 -0.29 0.01 0.00 0.00 0.00 0.00 36.38 35.91 1r6h s VAL 13 CO 0.30 0.09 -0.03 -1.61 0.00 0.00 0.00 175.10 173.86 1r6h s GLU 14 N 1.54 3.07 -0.26 2.72 8.01 -1.26 0.11 118.70 132.63 1r6h s GLU 14 Ca -0.06 -0.83 -0.07 0.00 0.01 0.00 0.00 54.97 54.02 1r6h s GLU 14 Cb -0.12 -3.07 -0.02 0.00 -4.31 0.00 0.00 34.13 26.62 1r6h s GLU 14 CO -0.06 -0.34 0.07 0.08 0.01 0.00 0.00 175.26 175.02 1r6h s VAL 15 N 1.41 4.20 -0.01 2.63 1.01 -0.33 -4.89 120.40 124.42 1r6h s VAL 15 Ca 0.03 -0.34 -0.02 0.00 0.00 0.00 0.00 61.98 61.65 1r6h s VAL 15 Cb -0.16 -3.03 -0.00 0.00 0.00 0.00 0.00 36.38 33.19 1r6h s VAL 15 CO -0.03 0.25 0.04 -0.94 0.00 0.00 0.00 175.10 174.42 1r6h s SER 16 N 1.58 0.04 0.12 3.32 1.04 -1.26 0.01 113.70 118.54 1r6h s SER 16 Ca 0.05 -0.10 0.03 0.00 0.48 0.00 0.00 55.95 56.42 1r6h s SER 16 Cb -0.16 0.11 -0.04 0.00 0.10 0.00 0.00 66.02 66.03 1r6h s SER 16 CO 0.03 -0.13 -0.09 -0.72 0.98 0.00 0.00 173.24 173.31 1r6h s TYR 17 N -0.52 1.09 0.00 5.02 1.13 -0.93 -4.99 117.35 118.15 1r6h s TYR 17 Ca -0.06 -0.78 0.00 0.00 -1.41 0.00 0.00 57.07 54.82 1r6h s TYR 17 Cb -0.04 -0.58 0.00 0.00 -1.10 0.00 0.00 41.96 40.24 1r6h s TYR 17 CO -0.00 -0.01 0.00 0.36 -2.51 0.00 0.00 175.55 173.38 1r6h n LYS 18 N 0.05 0.00 0.00 -3.49 2.85 -1.26 -1.77 118.16 114.54 1r6h n LYS 18 Ca -0.12 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.14 1r6h n LYS 18 Cb 0.60 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.98 1r6h n LYS 18 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1r6h n HIS 19 N 0.00 0.00 -1.57 5.58 8.25 -1.26 -5.08 115.22 121.13 1r6h n HIS 19 Ca 0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.15 1r6h n HIS 19 Cb 0.00 0.00 0.05 0.00 1.12 0.00 0.00 29.99 31.16 1r6h n HIS 19 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1r6h s MET 20 N -1.62 2.84 0.12 -0.41 0.23 -0.73 -4.82 119.30 114.90 1r6h s MET 20 Ca 0.00 1.05 -0.03 0.00 -1.03 0.00 0.00 55.69 55.68 1r6h s MET 20 Cb 0.00 -1.97 -0.03 0.00 -1.53 0.00 0.00 34.83 31.29 1r6h s MET 20 CO 0.00 -1.18 0.09 1.03 -2.03 0.00 0.00 175.02 172.93 1r6h s ARG 21 N -4.85 0.90 0.01 3.16 0.52 -1.19 -2.19 118.95 115.30 1r6h s ARG 21 Ca 0.60 -1.33 0.01 0.00 -0.52 0.00 0.00 55.73 54.49 1r6h s ARG 21 Cb -0.15 0.26 -0.01 0.00 0.52 0.00 0.00 34.95 35.57 1r6h s ARG 21 CO 0.52 -0.26 -0.04 -0.06 0.02 0.00 0.00 175.30 175.49 1r6h s PHE 22 N -4.00 0.32 -0.06 -0.53 0.08 0.10 -3.54 117.98 110.35 1r6h s PHE 22 Ca 0.19 -0.25 0.06 0.00 0.12 0.00 0.00 56.93 57.05 1r6h s PHE 22 Cb 0.07 -0.20 -0.01 0.00 -0.57 0.00 0.00 43.02 42.30 1r6h s PHE 22 CO -0.01 -0.06 -0.24 -0.51 -0.10 0.00 0.00 175.22 174.29 1r6h s LEU 23 N -0.68 2.14 -0.30 -0.37 2.01 0.30 -1.19 118.68 120.58 1r6h s LEU 23 Ca -0.05 -0.48 0.02 0.00 0.01 0.00 0.00 54.13 53.62 1r6h s LEU 23 Cb -0.05 -1.39 0.07 0.00 0.01 0.00 0.00 46.19 44.83 1r6h s LEU 23 CO -0.00 0.25 -0.03 -0.63 1.01 0.00 0.00 176.35 176.95 1r6h s ILE 24 N -0.19 2.43 0.24 -0.59 -1.09 0.30 0.22 121.20 122.52 1r6h s ILE 24 Ca -0.03 -1.81 0.04 0.00 -2.23 0.00 0.00 60.65 56.63 1r6h s ILE 24 Cb -0.14 -2.54 -0.05 0.00 -1.58 0.00 0.00 42.46 38.15 1r6h s ILE 24 CO 0.03 -0.24 -0.01 0.42 -1.23 0.00 0.00 174.94 173.91 1r6h s THR 25 N 1.08 1.13 0.44 2.92 -4.23 0.14 -0.75 115.64 116.36 1r6h s THR 25 Ca -0.02 -2.05 -0.17 0.00 -1.18 0.00 0.00 61.69 58.28 1r6h s THR 25 Cb -0.20 -2.34 -0.09 0.00 1.34 0.00 0.00 72.50 71.21 1r6h s THR 25 CO -0.05 -0.33 0.90 -1.38 -0.54 0.00 0.00 174.62 173.22 1r6h s HIS 26 N -3.36 3.40 0.75 3.99 -3.43 -1.26 0.19 115.29 115.57 1r6h s HIS 26 Ca 0.28 1.40 -0.14 0.00 -0.80 0.00 0.00 55.06 55.80 1r6h s HIS 26 Cb 0.05 -2.71 0.05 0.00 -1.43 0.00 0.00 32.58 28.54 1r6h s HIS 26 CO 0.09 -0.18 1.20 0.54 -2.00 0.00 0.00 174.74 174.39 1r6h s ASN 27 N -2.71 4.09 0.27 7.38 4.22 -1.26 -4.85 114.94 122.07 1r6h s ASN 27 Ca 0.58 2.33 -0.30 0.00 -2.14 0.00 0.00 52.86 53.33 1r6h s ASN 27 Cb -0.10 -2.59 -0.13 0.00 1.28 0.00 0.00 41.25 39.71 1r6h s ASN 27 CO 0.24 -2.33 1.32 -2.65 -2.04 0.00 0.00 177.10 171.64 1r6h n PRO 28 N -2.87 1.93 -3.83 3.55 -0.02 -1.26 -4.99 135.00 127.51 1r6h n PRO 28 Ca 0.13 0.68 -0.33 0.00 -2.02 0.00 0.00 63.50 61.97 1r6h n PRO 28 Cb 0.50 -2.28 -0.05 0.00 -0.02 0.00 0.00 33.50 31.66 1r6h n PRO 28 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1r6h s THR 29 N -0.44 5.35 -0.72 3.45 2.01 -1.26 -4.97 115.64 119.06 1r6h s THR 29 Ca 0.64 -0.08 0.18 0.00 0.31 0.00 0.00 61.69 62.74 1r6h s THR 29 Cb -0.65 -3.58 0.17 0.00 0.01 0.00 0.00 72.50 68.46 1r6h s THR 29 CO 0.54 0.26 1.56 -0.46 -0.69 0.00 0.00 174.62 175.83 1r6h n ASN 30 N 0.74 0.33 -0.05 3.53 6.94 -1.26 -2.97 115.26 122.52 1r6h n ASN 30 Ca -0.09 0.59 -0.11 0.00 -0.02 0.00 0.00 54.58 54.96 1r6h n ASN 30 Cb 0.52 -0.66 -0.15 0.00 -2.36 0.00 0.00 39.78 37.14 1r6h n ASN 30 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1r6h n ALA 31 N -1.64 1.44 -3.45 -2.53 0.00 -1.26 -4.78 120.51 108.29 1r6h n ALA 31 Ca 0.02 -0.93 -0.29 0.00 0.00 0.00 0.00 53.44 52.24 1r6h n ALA 31 Cb 0.18 -0.61 -0.12 0.00 0.00 0.00 0.00 19.45 18.90 1r6h n ALA 31 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1r6h s THR 32 N -2.56 0.16 -0.14 0.00 -4.23 -1.16 -4.98 115.64 102.73 1r6h s THR 32 Ca -0.09 -1.82 -0.22 0.00 -1.18 0.00 0.00 61.69 58.38 1r6h s THR 32 Cb 0.07 -1.13 -0.20 0.00 1.34 0.00 0.00 72.50 72.59 1r6h s THR 32 CO 0.81 -1.02 0.56 -0.07 -0.54 0.00 0.00 174.62 174.36 1r6h h LEU 33 N 6.85 0.00 -0.50 4.79 -0.00 -1.86 -3.32 115.31 121.27 1r6h h LEU 33 Ca 0.08 -0.74 0.05 0.00 -0.00 0.00 0.00 57.88 57.28 1r6h h LEU 33 Cb 0.96 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 41.57 1r6h h LEU 33 CO 0.27 0.93 0.22 0.28 -0.00 0.00 0.00 178.44 180.14 1r6h h SER 34 N -1.00 0.28 -0.39 -0.43 0.02 -1.93 -1.77 113.55 108.33 1r6h h SER 34 Ca -0.03 0.04 0.07 0.00 -0.84 0.00 0.00 61.79 61.03 1r6h h SER 34 Cb 0.81 -0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.32 1r6h h SER 34 CO -0.02 0.20 0.26 0.74 -1.14 0.00 0.00 176.83 176.88 1r6h h THR 35 N 0.43 0.92 -0.01 -2.27 2.02 -1.98 -2.35 112.91 109.68 1r6h h THR 35 Ca 0.23 -0.08 -0.06 0.00 0.77 0.00 0.00 66.41 67.27 1r6h h THR 35 Cb 0.18 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.27 1r6h h THR 35 CO -0.19 0.04 -0.22 0.15 0.37 0.00 0.00 175.52 175.67 1r6h h PHE 36 N 0.23 0.24 -0.96 3.16 3.04 -1.44 -2.69 116.94 118.52 1r6h h PHE 36 Ca 0.17 -0.12 0.10 0.00 3.98 0.00 0.00 57.97 62.10 1r6h h PHE 36 Cb 0.39 -0.03 -0.07 0.00 2.56 0.00 0.00 35.95 38.80 1r6h h PHE 36 CO -0.00 0.90 0.61 -0.84 -2.02 0.00 0.00 178.31 176.97 1r6h h ILE 37 N -0.50 0.98 0.16 1.41 3.07 -1.10 0.39 117.51 121.92 1r6h h ILE 37 Ca -0.02 -0.34 -0.01 0.00 1.55 0.00 0.00 64.86 66.04 1r6h h ILE 37 Cb 0.96 -0.10 0.00 0.00 -0.27 0.00 0.00 36.82 37.41 1r6h h ILE 37 CO 0.04 0.18 -0.07 -0.33 -1.05 0.00 0.00 178.15 176.92 1r6h h GLU 38 N 0.99 -0.20 0.01 0.16 5.08 -1.49 -1.07 114.58 118.06 1r6h h GLU 38 Ca 0.45 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.82 1r6h h GLU 38 Cb 0.38 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1r6h h GLU 38 CO -0.20 0.08 -0.00 -0.44 -1.00 0.00 0.00 179.01 177.44 1r6h h ASP 39 N -0.48 -0.01 -0.55 1.42 3.32 -1.09 0.88 116.42 119.92 1r6h h ASP 39 Ca -0.02 -0.40 0.07 0.00 0.02 0.00 0.00 57.03 56.70 1r6h h ASP 39 Cb 0.37 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.87 1r6h h ASP 39 CO 0.04 0.39 0.24 -0.07 -1.72 0.00 0.00 179.24 178.12 1r6h h LEU 40 N -0.41 0.30 -0.34 1.55 3.38 -0.32 -0.57 115.31 118.89 1r6h h LEU 40 Ca -0.00 0.05 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 1r6h h LEU 40 Cb 0.41 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1r6h h LEU 40 CO 0.00 0.20 -0.57 0.50 0.09 0.00 0.00 178.44 178.66 1r6h h LYS 41 N 0.46 0.00 -0.69 1.13 3.64 -1.19 -3.27 116.57 116.64 1r6h h LYS 41 Ca 0.26 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.75 1r6h h LYS 41 Cb 0.24 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 31.98 1r6h h LYS 41 CO -0.22 0.57 0.29 0.87 -2.27 0.00 0.00 179.45 178.68 1r6h h LYS 42 N 0.00 0.46 -0.68 1.90 1.57 0.24 -0.88 116.57 119.18 1r6h h LYS 42 Ca -0.01 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 1r6h h LYS 42 Cb 1.29 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.46 1r6h h LYS 42 CO 0.07 0.30 0.23 -0.92 -0.57 0.00 0.00 179.45 178.57 1r6h h TYR 43 N 0.47 1.05 0.00 -1.35 5.03 -1.52 -3.48 116.97 117.17 1r6h h TYR 43 Ca 0.36 -0.09 0.00 0.00 2.58 0.00 0.00 58.73 61.58 1r6h h TYR 43 Cb 0.47 -0.31 0.00 0.00 1.55 0.00 0.00 36.73 38.44 1r6h h TYR 43 CO -0.15 0.82 0.00 0.41 -1.32 0.00 0.00 178.16 177.92 1r6h n GLY 44 N -0.88 -2.50 2.87 1.82 0.00 -0.34 -4.97 105.19 101.20 1r6h n GLY 44 Ca 0.06 -1.26 -0.27 0.00 0.00 0.00 0.00 46.02 44.55 1r6h n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r6h s ALA 45 N -1.96 1.28 0.00 4.61 0.00 -1.26 -4.41 121.76 120.03 1r6h s ALA 45 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.34 1r6h s ALA 45 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 23.12 22.12 1r6h s ALA 45 CO 0.00 -0.63 0.00 2.41 0.00 0.00 0.00 175.76 177.54 1r6h n THR 46 N 4.95 0.00 -0.94 0.00 -1.04 0.63 -4.28 114.28 113.59 1r6h n THR 46 Ca -0.11 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.59 1r6h n THR 46 Cb 0.49 0.00 0.13 0.00 -1.82 0.00 0.00 70.33 69.13 1r6h n THR 46 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1r6h s THR 47 N -2.76 2.62 -0.01 12.58 -4.23 -1.25 -4.11 115.64 118.48 1r6h s THR 47 Ca 0.00 0.20 0.00 0.00 -1.18 0.00 0.00 61.69 60.71 1r6h s THR 47 Cb 0.00 -2.43 0.01 0.00 1.34 0.00 0.00 72.50 71.42 1r6h s THR 47 CO 0.00 -0.26 -0.00 -0.69 -0.54 0.00 0.00 174.62 173.12 1r6h s VAL 48 N -2.76 0.09 -0.35 2.29 1.01 -0.36 -2.60 120.40 117.72 1r6h s VAL 48 Ca 0.64 0.01 -0.01 0.00 0.00 0.00 0.00 61.98 62.62 1r6h s VAL 48 Cb -0.20 -0.12 0.08 0.00 0.00 0.00 0.00 36.38 36.14 1r6h s VAL 48 CO 0.57 0.05 0.08 0.54 0.00 0.00 0.00 175.10 176.34 1r6h s VAL 49 N 0.29 2.90 -0.29 2.92 0.11 -0.37 0.19 120.40 126.16 1r6h s VAL 49 Ca -0.02 -1.84 -0.01 0.00 -2.93 0.00 0.00 61.98 57.17 1r6h s VAL 49 Cb -0.04 -2.88 0.05 0.00 -1.53 0.00 0.00 36.38 31.97 1r6h s VAL 49 CO -0.01 -0.42 -0.02 0.00 -3.33 0.00 0.00 175.10 171.32 1r6h s ARG 50 N 1.13 2.50 -0.69 1.54 1.70 -1.13 -2.46 118.95 121.54 1r6h s ARG 50 Ca 0.03 -1.21 -0.08 0.00 -0.47 0.00 0.00 55.73 53.99 1r6h s ARG 50 Cb -0.21 -3.12 0.18 0.00 -0.57 0.00 0.00 34.95 31.23 1r6h s ARG 50 CO -0.04 -0.57 0.57 0.08 -1.08 0.00 0.00 175.30 174.26 1r6h s VAL 51 N 1.26 4.58 0.29 4.99 1.01 -1.26 -2.15 120.40 129.11 1r6h s VAL 51 Ca -0.04 -2.61 -0.18 0.00 0.00 0.00 0.00 61.98 59.15 1r6h s VAL 51 Cb -0.19 -3.91 0.02 0.00 0.00 0.00 0.00 36.38 32.30 1r6h s VAL 51 CO -0.02 -0.93 0.66 0.00 0.00 0.00 0.00 175.10 174.81 1r6h s GLU 53 N -3.74 4.27 -0.09 0.00 0.41 -1.26 -4.13 118.70 114.15 1r6h s GLU 53 Ca 0.15 2.22 -0.30 0.00 -0.41 0.00 0.00 54.97 56.64 1r6h s GLU 53 Cb -0.04 -3.19 -0.03 0.00 -1.78 0.00 0.00 34.13 29.08 1r6h s GLU 53 CO 0.08 -0.51 1.32 0.54 -0.49 0.00 0.00 175.26 176.21 1r6h s VAL 54 N 1.01 4.08 0.00 2.63 0.11 -1.26 -4.86 120.40 122.10 1r6h s VAL 54 Ca 0.66 1.36 0.00 0.00 -2.93 0.00 0.00 61.98 61.08 1r6h s VAL 54 Cb -0.40 -3.88 0.00 0.00 -1.53 0.00 0.00 36.38 30.57 1r6h s VAL 54 CO 0.32 -0.07 0.00 0.35 -3.33 0.00 0.00 175.10 172.37 1r6h n THR 55 N 5.06 0.00 -3.65 5.04 -2.24 -1.26 -4.94 114.28 112.28 1r6h n THR 55 Ca 0.13 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.63 1r6h n THR 55 Cb 0.45 -1.27 -0.12 0.00 -2.10 0.00 0.00 70.33 67.29 1r6h n THR 55 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1r6h s TYR 56 N -2.00 2.12 0.07 4.78 2.02 -1.26 -4.96 117.35 118.12 1r6h s TYR 56 Ca 0.00 -2.64 -0.08 0.00 -0.37 0.00 0.00 57.07 53.98 1r6h s TYR 56 Cb 0.00 -1.77 -0.27 0.00 -0.40 0.00 0.00 41.96 39.51 1r6h s TYR 56 CO 0.00 -0.73 1.13 0.22 -1.57 0.00 0.00 175.55 174.60 1r6h h ASP 57 N 5.97 0.58 0.03 2.29 3.58 -1.99 -3.37 116.42 123.51 1r6h h ASP 57 Ca 0.13 -0.58 -0.05 0.00 0.42 0.00 0.00 57.03 56.95 1r6h h ASP 57 Cb 0.87 -0.19 0.01 0.00 1.72 0.00 0.00 39.33 41.74 1r6h h ASP 57 CO 0.51 1.44 -0.21 0.11 -2.88 0.00 0.00 179.24 178.21 1r6h h LYS 58 N 0.13 0.08 -0.61 0.28 1.57 -1.98 -3.20 116.57 112.84 1r6h h LYS 58 Ca -0.16 -0.13 0.09 0.00 -1.87 0.00 0.00 60.65 58.58 1r6h h LYS 58 Cb 1.96 0.05 -0.11 0.00 0.08 0.00 0.00 32.23 34.21 1r6h h LYS 58 CO 0.22 1.05 -0.45 1.15 -0.57 0.00 0.00 179.45 180.84 1r6h h THR 59 N -0.82 0.07 -0.09 -0.16 2.02 -1.98 0.22 112.91 112.17 1r6h h THR 59 Ca -0.04 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 66.97 1r6h h THR 59 Cb 1.14 0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.62 1r6h h THR 59 CO 0.04 0.00 -0.69 1.55 0.37 0.00 0.00 175.52 176.79 1r6h h PRO 60 N -0.22 0.39 -0.14 6.66 0.13 -1.75 -2.59 132.00 134.48 1r6h h PRO 60 Ca 0.18 -0.30 -0.08 0.00 -0.87 0.00 0.00 66.00 64.92 1r6h h PRO 60 Cb 0.56 0.06 -0.00 0.00 0.13 0.00 0.00 31.00 31.75 1r6h h PRO 60 CO -0.71 0.93 -0.24 -0.07 -0.23 0.00 0.00 178.00 177.68 1r6h h LEU 61 N 0.27 0.45 -0.50 1.56 -0.00 -1.41 -1.97 115.31 113.70 1r6h h LEU 61 Ca -0.02 -0.54 -0.14 0.00 -0.00 0.00 0.00 57.88 57.17 1r6h h LEU 61 Cb 1.25 -0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 41.76 1r6h h LEU 61 CO 0.12 0.91 -0.68 -0.08 -0.00 0.00 0.00 178.44 178.71 1r6h h GLU 62 N 0.01 0.00 0.13 1.13 4.81 -0.69 0.37 114.58 120.34 1r6h h GLU 62 Ca 0.01 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.96 1r6h h GLU 62 Cb 0.82 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.21 1r6h h GLU 62 CO 0.05 0.68 -1.23 0.87 -0.73 0.00 0.00 179.01 178.66 1r6h h LYS 63 N 0.00 0.39 0.00 1.92 1.57 -1.51 -3.34 116.57 115.60 1r6h h LYS 63 Ca -0.01 -0.59 0.00 0.00 -1.87 0.00 0.00 60.65 58.19 1r6h h LYS 63 Cb 1.28 0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.80 1r6h h LYS 63 CO 0.09 1.26 -1.14 -0.25 -0.57 0.00 0.00 179.45 178.84 1r6h n ASP 64 N -3.64 0.80 -1.76 0.86 8.00 -0.74 -4.97 116.55 115.10 1r6h n ASP 64 Ca -0.10 -0.74 -0.11 0.00 0.71 0.00 0.00 54.79 54.55 1r6h n ASP 64 Cb 1.00 1.21 -0.03 0.00 -0.02 0.00 0.00 41.12 43.27 1r6h n ASP 64 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1r6h n GLY 65 N 1.44 0.42 3.87 0.44 0.00 0.13 -4.92 105.19 106.57 1r6h n GLY 65 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1r6h n GLY 65 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1r6h s ILE 66 N -2.16 5.04 0.01 -0.61 1.01 -1.25 -5.06 121.20 118.18 1r6h s ILE 66 Ca 0.00 0.41 -0.30 0.00 0.00 0.00 0.00 60.65 60.76 1r6h s ILE 66 Cb 0.00 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 1r6h s ILE 66 CO 0.00 0.14 1.04 -0.89 0.00 0.00 0.00 174.94 175.23 1r6h s THR 67 N -1.57 4.65 0.02 2.92 2.01 -1.26 -4.88 115.64 117.54 1r6h s THR 67 Ca 0.39 1.91 -0.08 0.00 0.31 0.00 0.00 61.69 64.22 1r6h s THR 67 Cb -0.13 -4.22 -0.00 0.00 0.01 0.00 0.00 72.50 68.16 1r6h s THR 67 CO 0.20 0.13 0.14 0.54 -0.69 0.00 0.00 174.62 174.95 1r6h s VAL 68 N 1.12 0.10 -0.19 3.82 0.11 -1.26 -1.22 120.40 122.88 1r6h s VAL 68 Ca 0.53 -0.84 -0.07 0.00 -2.93 0.00 0.00 61.98 58.66 1r6h s VAL 68 Cb -0.23 -0.68 -0.04 0.00 -1.53 0.00 0.00 36.38 33.90 1r6h s VAL 68 CO 0.27 -0.47 0.06 -0.69 -3.33 0.00 0.00 175.10 170.95 1r6h s VAL 69 N -2.00 4.77 -0.44 2.04 1.01 0.13 -4.88 120.40 121.02 1r6h s VAL 69 Ca -0.10 -0.04 -0.14 0.00 0.00 0.00 0.00 61.98 61.70 1r6h s VAL 69 Cb -0.04 -3.16 0.06 0.00 0.00 0.00 0.00 36.38 33.24 1r6h s VAL 69 CO -0.01 0.45 0.34 -0.62 0.00 0.00 0.00 175.10 175.26 1r6h s ASP 70 N 0.45 6.06 -0.43 3.32 2.15 -1.26 -2.84 116.67 124.12 1r6h s ASP 70 Ca 0.03 -1.21 -0.09 0.00 0.43 0.00 0.00 52.55 51.71 1r6h s ASP 70 Cb -0.13 -2.15 0.09 0.00 -0.30 0.00 0.00 42.92 40.44 1r6h s ASP 70 CO 0.01 -0.57 0.27 0.26 -0.17 0.00 0.00 175.17 174.97 1r6h s TRP 71 N 1.62 3.37 0.00 -5.34 0.52 -0.92 -5.05 118.94 113.15 1r6h s TRP 71 Ca 0.04 -1.68 0.00 0.00 0.02 0.00 0.00 56.10 54.48 1r6h s TRP 71 Cb -0.22 -3.08 0.00 0.00 -1.15 0.00 0.00 33.47 29.02 1r6h s TRP 71 CO 0.07 -0.89 0.00 -0.35 0.02 0.00 0.00 176.95 175.80 1r6h n PRO 72 N 4.88 2.66 -3.97 4.98 -0.04 -1.25 -1.24 135.00 141.01 1r6h n PRO 72 Ca -0.09 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.06 1r6h n PRO 72 Cb 0.42 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.74 1r6h n PRO 72 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1r6h s PHE 73 N 1.09 3.52 0.00 0.54 2.19 -1.26 -3.88 117.98 120.18 1r6h s PHE 73 Ca 0.00 -3.05 0.00 0.00 0.33 0.00 0.00 56.93 54.21 1r6h s PHE 73 Cb 0.00 -2.91 0.00 0.00 -1.31 0.00 0.00 43.02 38.80 1r6h s PHE 73 CO 0.00 -0.86 0.00 -3.47 1.83 0.00 0.00 175.22 172.72 1r6h n ASP 74 N 3.79 0.00 0.08 6.13 2.03 -1.26 -4.97 116.55 122.35 1r6h n ASP 74 Ca 0.04 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.24 1r6h n ASP 74 Cb 0.38 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.75 1r6h n ASP 74 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 1r6h h ASP 75 N 0.00 0.37 -2.62 1.67 3.58 -2.04 -3.37 116.42 114.01 1r6h h ASP 75 Ca 0.00 -0.30 -0.60 0.00 0.42 0.00 0.00 57.03 56.54 1r6h h ASP 75 Cb 0.00 -0.11 -0.41 0.00 1.72 0.00 0.00 39.33 40.53 1r6h h ASP 75 CO 0.00 1.11 -0.71 0.61 -2.88 0.00 0.00 179.24 177.37 1r6h n GLY 76 N 0.94 3.72 3.87 -0.78 0.00 -1.26 -5.10 105.19 106.58 1r6h n GLY 76 Ca -0.05 -2.28 -0.30 0.00 0.00 0.00 0.00 46.02 43.39 1r6h n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r6h s ALA 77 N -1.38 3.33 0.22 4.61 0.00 -1.25 -3.94 121.76 123.34 1r6h s ALA 77 Ca 0.31 -0.17 -0.08 0.00 0.00 0.00 0.00 51.96 52.02 1r6h s ALA 77 Cb 0.04 -2.73 0.18 0.00 0.00 0.00 0.00 23.12 20.60 1r6h s ALA 77 CO -0.13 -0.03 1.83 -1.35 0.00 0.00 0.00 175.76 176.08 1r6h h PRO 78 N 1.23 1.17 -0.98 0.00 0.11 -1.93 -3.29 132.00 128.30 1r6h h PRO 78 Ca -0.47 -0.15 0.14 0.00 0.11 0.00 0.00 66.00 65.63 1r6h h PRO 78 Cb 1.19 -0.22 -0.15 0.00 0.11 0.00 0.00 31.00 31.92 1r6h h PRO 78 CO 0.64 0.88 -0.42 -1.35 -0.21 0.00 0.00 178.00 177.53 1r6h h PRO 79 N 1.16 -0.01 -6.78 1.05 0.11 -1.96 -3.41 132.00 122.17 1r6h h PRO 79 Ca 0.29 0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.86 1r6h h PRO 79 Cb 0.07 0.00 0.09 0.00 0.11 0.00 0.00 31.00 31.26 1r6h h PRO 79 CO -0.04 -0.01 0.87 -0.35 -0.21 0.00 0.00 178.00 178.26 1r6h n PRO 80 N -5.43 2.67 0.05 1.05 -0.04 -1.24 -4.90 135.00 127.15 1r6h n PRO 80 Ca 0.08 0.95 -0.02 0.00 -0.04 0.00 0.00 63.50 64.47 1r6h n PRO 80 Cb 0.37 -2.73 0.24 0.00 -0.04 0.00 0.00 33.50 31.35 1r6h n PRO 80 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1r6h h GLY 81 N 4.76 0.41 0.34 0.55 0.00 -1.92 -3.14 103.07 104.08 1r6h h GLY 81 Ca -0.47 -0.33 0.10 0.00 0.00 0.00 0.00 47.33 46.63 1r6h h GLY 81 CO 0.79 0.30 0.24 1.70 0.00 0.00 0.00 176.54 179.57 1r6h h LYS 82 N 0.34 0.40 -0.89 4.80 3.64 -1.92 -0.10 116.57 122.84 1r6h h LYS 82 Ca 0.05 -0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.51 1r6h h LYS 82 Cb 0.64 -0.09 -0.08 0.00 -0.41 0.00 0.00 32.23 32.29 1r6h h LYS 82 CO 0.05 0.27 0.53 0.28 -2.27 0.00 0.00 179.45 178.30 1r6h h VAL 83 N 0.41 0.92 -0.89 2.00 2.07 -1.85 0.14 116.25 119.05 1r6h h VAL 83 Ca 0.33 -0.30 0.13 0.00 0.82 0.00 0.00 66.70 67.68 1r6h h VAL 83 Cb 0.42 -0.03 -0.09 0.00 -1.52 0.00 0.00 31.29 30.08 1r6h h VAL 83 CO -0.33 0.16 0.51 1.62 0.02 0.00 0.00 177.57 179.55 1r6h h VAL 84 N 0.87 0.82 -0.08 2.57 3.04 -1.12 0.46 116.25 122.82 1r6h h VAL 84 Ca 0.43 -0.27 -0.06 0.00 -1.01 0.00 0.00 66.70 65.79 1r6h h VAL 84 Cb 0.40 -0.02 -0.01 0.00 -2.01 0.00 0.00 31.29 29.65 1r6h h VAL 84 CO -0.25 0.14 -0.25 -0.33 -1.01 0.00 0.00 177.57 175.87 1r6h h GLU 85 N 0.78 0.13 0.08 4.17 4.39 -0.42 -2.24 114.58 121.47 1r6h h GLU 85 Ca 0.46 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 60.12 1r6h h GLU 85 Cb 0.55 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 1r6h h GLU 85 CO -0.31 0.38 -0.04 0.22 -1.16 0.00 0.00 179.01 178.11 1r6h h ASP 86 N 0.12 -0.09 0.12 1.42 3.58 0.94 -2.06 116.42 120.46 1r6h h ASP 86 Ca 0.02 -0.18 -0.09 0.00 0.42 0.00 0.00 57.03 57.20 1r6h h ASP 86 Cb 0.52 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.58 1r6h h ASP 86 CO 0.04 0.13 -0.31 -0.25 -2.88 0.00 0.00 179.24 175.97 1r6h h TRP 87 N -0.31 0.33 -0.52 0.28 2.91 -1.38 -2.60 115.95 114.67 1r6h h TRP 87 Ca -0.01 -0.07 0.05 0.00 1.13 0.00 0.00 58.89 59.98 1r6h h TRP 87 Cb 0.26 -0.08 -0.05 0.00 -0.51 0.00 0.00 29.16 28.79 1r6h h TRP 87 CO -0.01 0.58 0.26 -0.07 -1.03 0.00 0.00 178.44 178.17 1r6h h LEU 88 N 0.26 0.37 -0.49 0.65 3.38 -1.22 0.30 115.31 118.55 1r6h h LEU 88 Ca 0.04 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1r6h h LEU 88 Cb 0.68 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 1r6h h LEU 88 CO 0.05 0.25 0.12 0.28 0.09 0.00 0.00 178.44 179.23 1r6h h SER 89 N 0.50 0.75 0.07 -0.43 0.02 -1.12 0.50 113.55 113.85 1r6h h SER 89 Ca 0.23 -0.24 0.01 0.00 -0.84 0.00 0.00 61.79 60.95 1r6h h SER 89 Cb 0.15 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 1r6h h SER 89 CO -0.17 0.79 -0.10 0.25 -1.14 0.00 0.00 176.83 176.46 1r6h h LEU 90 N 0.67 -0.27 -0.32 5.07 7.12 -1.02 0.26 115.31 126.83 1r6h h LEU 90 Ca 0.15 0.03 -0.18 0.00 0.13 0.00 0.00 57.88 58.01 1r6h h LEU 90 Cb 0.34 0.10 -0.00 0.00 -0.53 0.00 0.00 40.66 40.57 1r6h h LEU 90 CO 0.00 -0.15 -0.51 1.62 -0.13 0.00 0.00 178.44 179.27 1r6h h VAL 91 N -0.21 1.27 -0.91 1.05 3.04 -0.89 -2.70 116.25 116.90 1r6h h VAL 91 Ca 0.01 -1.69 0.04 0.00 -1.01 0.00 0.00 66.70 64.05 1r6h h VAL 91 Cb 0.22 1.57 -0.05 0.00 -2.01 0.00 0.00 31.29 31.01 1r6h h VAL 91 CO -0.05 0.56 0.59 0.11 -1.01 0.00 0.00 177.57 177.77 1r6h h LYS 92 N 0.70 1.11 -0.13 4.17 1.57 0.18 0.89 116.57 125.06 1r6h h LYS 92 Ca 0.02 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1r6h h LYS 92 Cb 1.12 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 33.18 1r6h h LYS 92 CO 0.12 0.73 0.03 0.00 -0.57 0.00 0.00 179.45 179.76 1r6h h ALA 93 N 1.38 0.17 0.00 3.86 0.00 -0.89 0.11 119.26 123.88 1r6h h ALA 93 Ca 0.37 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 1r6h h ALA 93 Cb 0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1r6h h ALA 93 CO -0.12 -0.19 -0.33 0.87 0.00 0.00 0.00 179.25 179.48 1r6h h LYS 94 N 0.00 0.00 0.04 0.00 6.56 -1.11 -2.35 116.57 119.72 1r6h h LYS 94 Ca 0.04 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.63 1r6h h LYS 94 Cb 0.27 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.93 1r6h h LYS 94 CO 0.00 0.33 -0.02 0.74 -2.06 0.00 0.00 179.45 178.44 1r6h h PHE 95 N 0.00 -0.05 -0.78 -1.35 -1.00 0.11 0.16 116.94 114.02 1r6h h PHE 95 Ca -0.00 -0.00 0.01 0.00 2.81 0.00 0.00 57.97 60.78 1r6h h PHE 95 Cb 0.83 0.02 -0.04 0.00 3.61 0.00 0.00 35.95 40.37 1r6h h PHE 95 CO 0.00 0.59 0.52 0.00 -1.61 0.00 0.00 178.31 177.81 1r6h h GLU 97 N 1.06 0.22 -3.34 0.00 4.81 -1.51 -3.40 114.58 112.41 1r6h h GLU 97 Ca 0.29 -0.24 -0.62 0.00 -0.13 0.00 0.00 59.36 58.66 1r6h h GLU 97 Cb -0.12 0.07 -0.40 0.00 0.63 0.00 0.00 28.75 28.92 1r6h h GLU 97 CO -0.06 0.97 -0.71 0.00 -0.73 0.00 0.00 179.01 178.48 1r6h s ALA 98 N -3.21 2.50 0.21 2.92 0.00 0.55 -5.08 121.76 119.66 1r6h s ALA 98 Ca -0.03 -2.69 -0.30 0.00 0.00 0.00 0.00 51.96 48.94 1r6h s ALA 98 Cb 0.10 -1.95 -0.08 0.00 0.00 0.00 0.00 23.12 21.19 1r6h s ALA 98 CO 0.83 -1.97 1.00 -1.25 0.00 0.00 0.00 175.76 174.37 1r6h s PRO 99 N 0.36 4.75 -1.13 0.00 0.04 -1.04 -4.06 135.00 133.92 1r6h s PRO 99 Ca 0.16 1.58 -0.05 0.00 0.04 0.00 0.00 61.00 62.72 1r6h s PRO 99 Cb -0.24 -3.28 -0.04 0.00 0.04 0.00 0.00 34.50 30.99 1r6h s PRO 99 CO -0.03 0.33 0.90 0.41 0.04 0.00 0.00 177.00 178.65 1r6h n GLY 100 N 1.67 -0.85 1.00 0.56 0.00 -1.26 -4.98 105.19 101.33 1r6h n GLY 100 Ca -0.00 0.40 -0.05 0.00 0.00 0.00 0.00 46.02 46.36 1r6h n GLY 100 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1r6h n SER 101 N -3.12 0.66 -4.33 1.61 7.64 -1.26 -4.69 113.62 110.12 1r6h n SER 101 Ca -0.15 -1.41 -0.38 0.00 1.01 0.00 0.00 58.87 57.94 1r6h n SER 101 Cb 0.64 -0.10 -0.12 0.00 -1.01 0.00 0.00 64.21 63.61 1r6h n SER 101 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1r6h s VAL 103 N 1.48 3.62 0.04 0.00 1.01 -1.23 -0.27 120.40 125.05 1r6h s VAL 103 Ca 0.02 -1.14 0.09 0.00 0.00 0.00 0.00 61.98 60.95 1r6h s VAL 103 Cb -0.18 -2.70 -0.03 0.00 0.00 0.00 0.00 36.38 33.48 1r6h s VAL 103 CO 0.03 0.13 -0.26 0.00 0.00 0.00 0.00 175.10 175.00 1r6h s ALA 104 N -1.24 2.26 0.15 5.51 0.00 -1.07 0.11 121.76 127.48 1r6h s ALA 104 Ca 0.23 -1.27 -0.01 0.00 0.00 0.00 0.00 51.96 50.91 1r6h s ALA 104 Cb -0.11 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.49 1r6h s ALA 104 CO 0.15 0.53 0.08 0.08 0.00 0.00 0.00 175.76 176.60 1r6h s VAL 105 N -0.80 0.08 0.71 0.00 1.01 0.59 -1.24 120.40 120.75 1r6h s VAL 105 Ca 0.12 -1.92 -0.14 0.00 0.00 0.00 0.00 61.98 60.04 1r6h s VAL 105 Cb -0.10 -2.13 0.03 0.00 0.00 0.00 0.00 36.38 34.17 1r6h s VAL 105 CO 0.02 -0.37 1.13 -2.28 0.00 0.00 0.00 175.10 173.61 1r6h s HIS 106 N -4.07 2.41 -0.42 5.22 5.65 -1.03 0.24 115.29 123.29 1r6h s HIS 106 Ca 0.27 1.58 -0.28 0.00 0.25 0.00 0.00 55.06 56.88 1r6h s HIS 106 Cb 0.07 -3.24 -0.02 0.00 -1.18 0.00 0.00 32.58 28.21 1r6h s HIS 106 CO 0.04 -2.00 1.82 0.00 -0.65 0.00 0.00 174.74 173.94 1r6h n VAL 108 N 7.36 0.00 0.01 0.00 0.24 -1.26 -3.81 118.33 120.86 1r6h n VAL 108 Ca 0.22 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.52 1r6h n VAL 108 Cb 0.49 -0.59 0.01 0.00 -1.47 0.00 0.00 33.84 32.27 1r6h n VAL 108 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1r6h n ALA 109 N -0.97 1.08 -2.87 2.33 0.00 -1.26 -4.20 120.51 114.61 1r6h n ALA 109 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1r6h n ALA 109 Cb 0.08 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.53 1r6h n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r6h n GLY 110 N -1.40 2.62 3.01 0.00 0.00 -1.25 -5.04 105.19 103.13 1r6h n GLY 110 Ca 0.00 -0.16 -0.26 0.00 0.00 0.00 0.00 46.02 45.60 1r6h n GLY 110 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r6h s LEU 111 N 0.00 1.58 0.00 0.99 1.43 -1.26 -4.21 118.68 117.21 1r6h s LEU 111 Ca 0.00 -0.33 0.00 0.00 -1.03 0.00 0.00 54.13 52.77 1r6h s LEU 111 Cb 0.00 -0.88 0.00 0.00 0.03 0.00 0.00 46.19 45.34 1r6h s LEU 111 CO 0.00 0.00 0.00 0.61 0.23 0.00 0.00 176.35 177.19 1r6h n GLY 112 N 4.09 2.97 0.00 -3.19 0.00 -1.26 -4.95 105.19 102.85 1r6h n GLY 112 Ca -0.20 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.12 1r6h n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r6h n ARG 113 N 0.00 1.32 -0.20 1.61 3.00 -1.26 -4.39 116.66 116.73 1r6h n ARG 113 Ca 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 57.85 57.85 1r6h n ARG 113 Cb 0.00 -0.89 0.11 0.00 0.00 0.00 0.00 32.46 31.69 1r6h n ARG 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1r6h h ALA 114 N 0.00 0.76 -0.46 7.54 0.00 -1.86 -2.66 119.26 122.57 1r6h h ALA 114 Ca 0.00 0.11 0.09 0.00 0.00 0.00 0.00 54.91 55.10 1r6h h ALA 114 Cb 0.00 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.83 1r6h h ALA 114 CO 0.00 -0.25 0.02 -1.00 0.00 0.00 0.00 179.25 178.02 1r6h h PRO 115 N 0.33 0.13 -0.05 0.00 0.13 -1.87 0.06 132.00 130.73 1r6h h PRO 115 Ca 0.31 -0.01 0.03 0.00 -0.87 0.00 0.00 66.00 65.47 1r6h h PRO 115 Cb 0.44 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 31.50 1r6h h PRO 115 CO -0.36 0.09 -0.14 0.28 -0.23 0.00 0.00 178.00 177.64 1r6h h VAL 116 N 0.14 0.65 -0.55 1.56 2.07 -1.82 -2.32 116.25 115.97 1r6h h VAL 116 Ca 0.23 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.83 1r6h h VAL 116 Cb 0.33 0.65 -0.07 0.00 -1.52 0.00 0.00 31.29 30.69 1r6h h VAL 116 CO -0.37 0.00 0.20 -0.07 0.02 0.00 0.00 177.57 177.35 1r6h h LEU 117 N -0.21 0.19 -0.40 2.57 3.38 -1.17 -2.29 115.31 117.39 1r6h h LEU 117 Ca 0.06 0.07 0.08 0.00 0.09 0.00 0.00 57.88 58.19 1r6h h LEU 117 Cb 0.29 0.05 -0.08 0.00 0.09 0.00 0.00 40.66 41.02 1r6h h LEU 117 CO -0.17 0.13 -0.13 0.58 0.09 0.00 0.00 178.44 178.94 1r6h h VAL 118 N 0.38 0.54 -0.44 1.22 2.07 -0.48 -0.82 116.25 118.72 1r6h h VAL 118 Ca 0.27 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.87 1r6h h VAL 118 Cb 0.32 0.54 -0.06 0.00 -1.52 0.00 0.00 31.29 30.56 1r6h h VAL 118 CO -0.28 0.00 0.06 0.00 0.02 0.00 0.00 177.57 177.37 1r6h h ALA 119 N 1.31 0.46 -0.66 1.67 0.00 -1.01 0.21 119.26 121.25 1r6h h ALA 119 Ca 0.19 0.10 0.17 0.00 0.00 0.00 0.00 54.91 55.37 1r6h h ALA 119 Cb 0.34 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1r6h h ALA 119 CO -0.43 -0.34 0.46 -0.07 0.00 0.00 0.00 179.25 178.87 1r6h h LEU 120 N 0.19 0.12 0.03 0.00 3.38 -0.76 -0.06 115.31 118.20 1r6h h LEU 120 Ca 0.22 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 1r6h h LEU 120 Cb 0.28 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1r6h h LEU 120 CO -0.30 0.06 -0.01 0.00 0.09 0.00 0.00 178.44 178.27 1r6h h ALA 121 N 1.68 -0.04 0.00 1.53 0.00 -0.10 -3.02 119.26 119.31 1r6h h ALA 121 Ca 0.32 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1r6h h ALA 121 Cb 1.07 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1r6h h ALA 121 CO -0.04 -0.23 0.00 -0.11 0.00 0.00 0.00 179.25 178.87 1r6h n LEU 122 N -4.84 0.62 0.13 0.00 7.94 -0.69 -2.43 117.00 117.74 1r6h n LEU 122 Ca -0.09 0.70 0.10 0.00 -1.11 0.00 0.00 56.01 55.61 1r6h n LEU 122 Cb 0.29 -0.66 0.61 0.00 0.53 0.00 0.00 43.42 44.18 1r6h n LEU 122 CO 0.33 -0.69 1.12 0.40 -1.11 0.00 0.00 177.39 177.44 1r6h h ILE 123 N 0.00 0.95 0.00 1.96 2.04 -0.90 -0.35 117.51 121.20 1r6h h ILE 123 Ca 0.00 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.82 1r6h h ILE 123 Cb 0.24 0.82 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1r6h h ILE 123 CO 0.00 0.02 0.00 1.05 0.00 0.00 0.00 178.15 179.22 1r6h h GLU 124 N 0.12 0.00 0.00 2.37 -0.00 -1.62 -3.07 114.58 112.38 1r6h h GLU 124 Ca 0.10 0.00 -0.07 0.00 -0.00 0.00 0.00 59.36 59.39 1r6h h GLU 124 Cb 0.26 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 29.00 1r6h h GLU 124 CO -0.01 0.00 -0.36 1.03 -0.00 0.00 0.00 179.01 179.66 1r6h h SER 125 N 0.00 0.00 0.00 3.06 0.87 -1.26 -3.50 113.55 112.72 1r6h h SER 125 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1r6h h SER 125 Cb 0.43 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 1r6h h SER 125 CO 0.00 0.32 0.00 0.61 -0.53 0.00 0.00 176.83 177.23 1r6h n GLY 126 N 1.19 -0.24 3.46 5.77 0.00 -1.16 -5.01 105.19 109.21 1r6h n GLY 126 Ca 0.02 0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1r6h n GLY 126 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1r6h n MET 127 N 0.00 0.50 0.06 1.61 -0.00 -1.26 -4.68 117.12 113.35 1r6h n MET 127 Ca 0.00 -1.55 -0.02 0.00 -0.00 0.00 0.00 57.70 56.13 1r6h n MET 127 Cb 0.00 -3.15 -0.01 0.00 -0.00 0.00 0.00 33.22 30.05 1r6h n MET 127 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 175.97 177.54 1r6h h LYS 128 N 10.08 -0.15 -0.32 3.17 2.10 -1.83 -1.16 116.57 128.45 1r6h h LYS 128 Ca 0.21 0.01 -0.07 0.00 -2.00 0.00 0.00 60.65 58.80 1r6h h LYS 128 Cb 0.81 0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 32.16 1r6h h LYS 128 CO 1.63 -0.10 -0.10 -0.92 -2.00 0.00 0.00 179.45 177.95 1r6h h TYR 129 N -0.30 0.58 0.06 0.07 3.20 -1.89 0.22 116.97 118.91 1r6h h TYR 129 Ca -0.02 -0.09 -0.00 0.00 3.14 0.00 0.00 58.73 61.76 1r6h h TYR 129 Cb 0.12 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.24 1r6h h TYR 129 CO 0.08 0.63 -0.03 0.93 -1.64 0.00 0.00 178.16 178.13 1r6h h GLU 130 N 0.50 -0.08 -0.09 1.82 5.08 -1.94 -2.61 114.58 117.26 1r6h h GLU 130 Ca 0.09 0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.34 1r6h h GLU 130 Cb 0.48 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1r6h h GLU 130 CO 0.03 0.45 -0.49 0.22 -1.00 0.00 0.00 179.01 178.22 1r6h h ASP 131 N -0.67 0.25 0.01 1.42 3.58 -1.18 0.38 116.42 120.22 1r6h h ASP 131 Ca -0.01 -0.12 -0.00 0.00 0.42 0.00 0.00 57.03 57.32 1r6h h ASP 131 Cb 0.57 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.54 1r6h h ASP 131 CO 0.01 0.70 -0.01 0.00 -2.88 0.00 0.00 179.24 177.07 1r6h h ALA 132 N 1.31 -0.02 -0.09 -0.78 0.00 -0.63 1.32 119.26 120.37 1r6h h ALA 132 Ca 0.01 -0.06 -0.24 0.00 0.00 0.00 0.00 54.91 54.62 1r6h h ALA 132 Cb 0.93 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.74 1r6h h ALA 132 CO 0.08 -0.45 -0.87 0.82 0.00 0.00 0.00 179.25 178.82 1r6h h ILE 133 N -0.13 1.28 0.00 0.00 1.08 -1.41 -2.09 117.51 116.25 1r6h h ILE 133 Ca -0.00 -2.07 -0.00 0.00 -0.39 0.00 0.00 64.86 62.39 1r6h h ILE 133 Cb 0.13 2.17 0.00 0.00 -3.07 0.00 0.00 36.82 36.04 1r6h h ILE 133 CO 0.00 0.65 -0.00 -0.61 -0.69 0.00 0.00 178.15 177.50 1r6h h GLN 134 N 0.45 -0.00 -0.54 2.37 4.15 -0.17 -0.32 115.11 121.05 1r6h h GLN 134 Ca -0.08 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.24 1r6h h GLN 134 Cb 1.51 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 29.18 1r6h h GLN 134 CO 0.18 0.73 -0.06 0.35 -1.93 0.00 0.00 178.83 178.10 1r6h h PHE 135 N -0.74 1.06 0.00 3.99 3.57 0.16 -2.50 116.94 122.49 1r6h h PHE 135 Ca -0.00 -0.19 -0.12 0.00 3.53 0.00 0.00 57.97 61.19 1r6h h PHE 135 Cb 0.73 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.18 1r6h h PHE 135 CO 0.18 0.98 -0.57 0.97 -2.23 0.00 0.00 178.31 177.63 1r6h h ILE 136 N 0.87 1.21 -0.54 1.41 2.10 -1.37 -3.20 117.51 118.01 1r6h h ILE 136 Ca 0.15 -2.12 -0.06 0.00 1.08 0.00 0.00 64.86 63.91 1r6h h ILE 136 Cb 0.60 2.21 -0.02 0.00 -1.09 0.00 0.00 36.82 38.51 1r6h h ILE 136 CO 0.04 0.56 0.09 -0.09 -1.08 0.00 0.00 178.15 177.67 1r6h h ARG 137 N 0.00 0.88 -0.47 2.19 2.43 -0.67 -3.00 114.38 115.74 1r6h h ARG 137 Ca -0.01 -0.23 0.01 0.00 -0.81 0.00 0.00 59.98 58.94 1r6h h ARG 137 Cb 1.16 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 30.58 1r6h h ARG 137 CO 0.07 0.86 0.30 0.37 -1.51 0.00 0.00 179.97 180.06 1r6h h GLN 138 N 0.77 0.59 -6.67 0.20 -0.00 -1.45 -3.42 115.11 105.14 1r6h h GLN 138 Ca 0.16 -0.04 -0.51 0.00 -0.00 0.00 0.00 58.65 58.27 1r6h h GLN 138 Cb 0.40 -0.13 -0.02 0.00 0.00 0.00 0.00 27.48 27.72 1r6h h GLN 138 CO 0.01 0.39 0.03 0.15 0.00 0.00 0.00 178.83 179.41 1r6h s LYS 139 N -6.15 3.86 -0.22 1.69 -0.14 -1.13 -5.02 119.74 112.63 1r6h s LYS 139 Ca -0.13 0.46 -0.29 0.00 -1.36 0.00 0.00 55.97 54.65 1r6h s LYS 139 Cb 0.12 -2.49 -0.02 0.00 -1.68 0.00 0.00 37.83 33.76 1r6h s LYS 139 CO 0.73 0.15 1.40 0.50 -0.76 0.00 0.00 175.35 177.37 1r6h s ARG 140 N -3.23 4.01 0.32 1.68 3.00 -1.26 -4.83 118.95 118.64 1r6h s ARG 140 Ca 0.51 1.56 0.09 0.00 -1.00 0.00 0.00 55.73 56.89 1r6h s ARG 140 Cb -0.10 -3.89 -0.05 0.00 0.00 0.00 0.00 34.95 30.91 1r6h s ARG 140 CO 0.23 -1.01 0.03 -0.98 0.00 0.00 0.00 175.30 173.57 1r6h s ARG 141 N 4.07 2.17 0.42 5.12 3.03 -1.26 -4.28 118.95 128.22 1r6h s ARG 141 Ca 0.61 -1.64 -0.06 0.00 2.03 0.00 0.00 55.73 56.67 1r6h s ARG 141 Cb -0.22 -2.02 0.10 0.00 -1.03 0.00 0.00 34.95 31.78 1r6h s ARG 141 CO 0.22 0.18 0.21 0.41 -1.13 0.00 0.00 175.30 175.20 1r6h n GLY 142 N -0.97 -2.59 3.50 3.88 0.00 -1.26 -4.81 105.19 102.94 1r6h n GLY 142 Ca -0.04 -0.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.71 1r6h n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r6h s ALA 143 N -2.03 2.94 -0.46 4.61 0.00 -1.26 -4.90 121.76 120.66 1r6h s ALA 143 Ca 0.17 -1.66 -0.23 0.00 0.00 0.00 0.00 51.96 50.24 1r6h s ALA 143 Cb -0.03 -4.07 0.03 0.00 0.00 0.00 0.00 23.12 19.05 1r6h s ALA 143 CO 0.14 -3.04 0.80 0.96 0.00 0.00 0.00 175.76 174.62 1r6h s ILE 144 N 4.84 4.62 0.00 0.00 -4.36 -1.26 -4.92 121.20 120.12 1r6h s ILE 144 Ca 0.29 0.41 0.00 0.00 -0.26 0.00 0.00 60.65 61.09 1r6h s ILE 144 Cb -0.12 -4.35 0.00 0.00 1.25 0.00 0.00 42.46 39.24 1r6h s ILE 144 CO 0.11 -0.77 0.00 -3.20 0.24 0.00 0.00 174.94 171.33 1r6h n ASN 145 N 6.80 0.00 -0.08 4.36 5.15 -1.26 -4.89 115.26 125.34 1r6h n ASN 145 Ca 0.02 0.00 -0.08 0.00 -0.60 0.00 0.00 54.58 53.92 1r6h n ASN 145 Cb 0.48 -0.06 -0.03 0.00 -0.53 0.00 0.00 39.78 39.64 1r6h n ASN 145 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 1r6h n SER 146 N -1.64 1.77 0.05 1.20 3.41 -1.26 -4.51 113.62 112.65 1r6h n SER 146 Ca 0.00 0.31 -0.11 0.00 -0.26 0.00 0.00 58.87 58.81 1r6h n SER 146 Cb 0.00 -0.72 -0.05 0.00 -0.26 0.00 0.00 64.21 63.18 1r6h n SER 146 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1r6h h LYS 147 N -0.92 -0.21 -0.06 4.33 3.11 -1.96 0.41 116.57 121.28 1r6h h LYS 147 Ca 0.00 0.01 0.03 0.00 -2.81 0.00 0.00 60.65 57.88 1r6h h LYS 147 Cb 0.90 0.05 -0.03 0.00 -1.00 0.00 0.00 32.23 32.15 1r6h h LYS 147 CO 0.00 -0.14 -0.10 0.37 -2.81 0.00 0.00 179.45 176.77 1r6h h GLN 148 N -0.22 -0.13 -0.13 1.90 -0.00 -1.93 0.67 115.11 115.27 1r6h h GLN 148 Ca 0.05 0.01 -0.15 0.00 -0.00 0.00 0.00 58.65 58.55 1r6h h GLN 148 Cb 0.27 0.03 0.01 0.00 0.00 0.00 0.00 27.48 27.79 1r6h h GLN 148 CO -0.13 -0.09 -0.51 -0.07 0.00 0.00 0.00 178.83 178.04 1r6h h LEU 149 N -0.14 0.67 -0.38 -2.39 -0.00 -1.78 -2.41 115.31 108.88 1r6h h LEU 149 Ca 0.06 -0.62 -0.17 0.00 -0.00 0.00 0.00 57.88 57.15 1r6h h LEU 149 Cb 0.22 -0.20 -0.00 0.00 -0.00 0.00 0.00 40.66 40.68 1r6h h LEU 149 CO -0.14 1.18 -0.44 0.74 -0.00 0.00 0.00 178.44 179.77 1r6h h THR 150 N 0.20 1.27 0.06 0.22 2.02 -0.86 -1.39 112.91 114.43 1r6h h THR 150 Ca -0.03 -1.62 -0.00 0.00 0.77 0.00 0.00 66.41 65.53 1r6h h THR 150 Cb 1.14 1.47 0.00 0.00 -1.74 0.00 0.00 68.15 69.02 1r6h h THR 150 CO 0.11 0.54 -0.03 0.22 0.37 0.00 0.00 175.52 176.72 1r6h h TYR 151 N 0.72 -0.08 -0.01 3.16 3.20 0.29 -1.88 116.97 122.37 1r6h h TYR 151 Ca 0.05 -0.00 -0.07 0.00 3.14 0.00 0.00 58.73 61.84 1r6h h TYR 151 Cb 1.04 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.32 1r6h h TYR 151 CO 0.06 0.25 -0.32 1.25 -1.64 0.00 0.00 178.16 177.76 1r6h h LEU 152 N -0.41 0.02 -0.81 2.82 6.46 -1.50 -1.10 115.31 120.78 1r6h h LEU 152 Ca -0.01 -0.01 -0.04 0.00 -0.12 0.00 0.00 57.88 57.71 1r6h h LEU 152 Cb 0.36 -0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.25 1r6h h LEU 152 CO 0.01 0.34 0.35 -0.08 -0.62 0.00 0.00 178.44 178.44 1r6h h GLU 153 N 0.02 1.20 0.00 1.25 4.81 -1.11 -0.42 114.58 120.33 1r6h h GLU 153 Ca -0.00 -0.20 -0.03 0.00 -0.13 0.00 0.00 59.36 58.99 1r6h h GLU 153 Cb 0.57 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.75 1r6h h GLU 153 CO 0.04 0.95 -0.16 -0.22 -0.73 0.00 0.00 179.01 178.89 1r6h h LYS 154 N 1.18 0.00 -0.13 1.92 3.11 -0.58 -3.11 116.57 118.96 1r6h h LYS 154 Ca 0.27 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 58.09 1r6h h LYS 154 Cb 0.18 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.41 1r6h h LYS 154 CO -0.03 0.16 -0.00 -0.92 -2.81 0.00 0.00 179.45 175.85 1r6h h TYR 155 N 0.00 0.24 -3.41 1.91 5.03 0.14 -3.38 116.97 117.51 1r6h h TYR 155 Ca -0.00 -0.04 -0.73 0.00 2.58 0.00 0.00 58.73 60.54 1r6h h TYR 155 Cb 0.72 -0.06 -0.30 0.00 1.55 0.00 0.00 36.73 38.64 1r6h h TYR 155 CO 0.00 0.46 -0.32 0.50 -1.32 0.00 0.00 178.16 177.48 1r6h s ARG 156 N -4.97 2.63 0.21 1.82 3.00 -0.88 -5.07 118.95 115.69 1r6h s ARG 156 Ca -0.14 -1.99 -0.31 0.00 -1.00 0.00 0.00 55.73 52.29 1r6h s ARG 156 Cb 0.05 -3.96 -0.10 0.00 0.00 0.00 0.00 34.95 30.95 1r6h s ARG 156 CO 0.71 -1.20 1.47 -1.25 0.00 0.00 0.00 175.30 175.03 1r6h s PRO 157 N 0.96 4.26 -0.13 5.12 0.04 -1.26 -4.87 135.00 139.11 1r6h s PRO 157 Ca 0.09 2.30 -0.05 0.00 0.04 0.00 0.00 61.00 63.38 1r6h s PRO 157 Cb -0.23 -3.14 0.06 0.00 0.04 0.00 0.00 34.50 31.23 1r6h s PRO 157 CO -0.02 -0.48 0.27 0.15 0.04 0.00 0.00 177.00 176.96 1r6h s LYS 158 N 0.23 0.18 0.00 4.56 1.02 -1.26 -5.01 119.74 119.46 1r6h s LYS 158 Ca 0.63 0.69 0.28 0.00 0.02 0.00 0.00 55.97 57.59 1r6h s LYS 158 Cb -0.42 -0.05 1.55 0.00 -0.52 0.00 0.00 37.83 38.39 1r6h s LYS 158 CO 0.38 -0.24 1.99 0.94 -0.92 0.00 0.00 175.35 177.51 1r6h n GLN 159 N 4.95 0.64 0.14 1.68 7.27 -1.26 -3.56 117.38 127.25 1r6h n GLN 159 Ca -0.13 0.01 0.09 0.00 0.07 0.00 0.00 57.00 57.05 1r6h n GLN 159 Cb 0.51 -1.50 0.60 0.00 2.41 0.00 0.00 30.24 32.25 1r6h n GLN 159 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1r6h h ARG 160 N 0.00 0.14 -0.68 3.69 3.08 -2.00 -1.25 114.38 117.36 1r6h h ARG 160 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1r6h h ARG 160 Cb 0.13 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 1r6h h ARG 160 CO 0.00 0.09 0.44 1.25 -1.07 0.00 0.00 179.97 180.68 1r6h h LEU 161 N 0.14 0.79 -3.88 3.04 5.85 -1.95 -1.79 115.31 117.52 1r6h h LEU 161 Ca 0.09 -0.03 -0.46 0.00 0.84 0.00 0.00 57.88 58.32 1r6h h LEU 161 Cb 0.19 -0.20 -0.27 0.00 0.37 0.00 0.00 40.66 40.75 1r6h h LEU 161 CO -0.01 0.59 0.52 -1.14 -0.34 0.00 0.00 178.44 178.05 1r6h n ARG 162 N -4.42 2.19 -0.06 1.25 0.63 -0.49 -4.54 116.66 111.22 1r6h n ARG 162 Ca 0.07 -3.06 -0.06 0.00 -0.92 0.00 0.00 57.85 53.88 1r6h n ARG 162 Cb 0.05 -2.12 -0.02 0.00 0.45 0.00 0.00 32.46 30.82 1r6h n ARG 162 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1r6h n PHE 163 N -1.14 0.00 -3.65 -0.14 7.35 -0.67 -4.98 117.46 114.23 1r6h n PHE 163 Ca 0.55 0.00 -0.37 0.00 -0.76 0.00 0.00 57.45 56.87 1r6h n PHE 163 Cb 1.53 -0.34 -0.06 0.00 0.35 0.00 0.00 39.48 40.95 1r6h n PHE 163 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 1r6h s LYS 164 N -2.34 3.86 0.14 -4.13 1.02 -1.25 -5.05 119.74 111.98 1r6h s LYS 164 Ca -0.20 0.12 -0.31 0.00 0.02 0.00 0.00 55.97 55.60 1r6h s LYS 164 Cb 0.03 -3.27 -0.09 0.00 -0.52 0.00 0.00 37.83 33.97 1r6h s LYS 164 CO 0.29 0.58 1.49 -0.51 -0.92 0.00 0.00 175.35 176.29 1r6h s ASP 165 N -0.58 6.69 0.03 2.83 1.01 -1.26 -4.94 116.67 120.45 1r6h s ASP 165 Ca 0.18 2.49 -0.19 0.00 0.71 0.00 0.00 52.55 55.74 1r6h s ASP 165 Cb -0.14 -2.59 -0.18 0.00 1.01 0.00 0.00 42.92 41.02 1r6h s ASP 165 CO 0.07 -0.75 1.22 1.55 0.21 0.00 0.00 175.17 177.46 1r6h h PRO 166 N 6.85 0.46 0.00 8.23 0.13 -1.97 -3.32 132.00 142.39 1r6h h PRO 166 Ca -0.42 -0.37 -0.25 0.00 -0.87 0.00 0.00 66.00 64.08 1r6h h PRO 166 Cb 1.21 0.08 0.02 0.00 0.13 0.00 0.00 31.00 32.43 1r6h h PRO 166 CO 0.89 1.00 -0.98 1.12 -0.23 0.00 0.00 178.00 179.81 1r6h h HIS 167 N 0.04 0.99 -3.03 1.56 2.07 -2.04 -3.44 115.15 111.30 1r6h h HIS 167 Ca -0.03 -0.54 -0.54 0.00 -2.85 0.00 0.00 60.37 56.42 1r6h h HIS 167 Cb 1.08 -0.11 0.01 0.00 2.57 0.00 0.00 27.41 30.96 1r6h h HIS 167 CO 0.12 1.37 0.71 0.99 -3.07 0.00 0.00 177.93 178.05 1r6h s THR 168 N -3.30 3.65 -0.21 6.12 2.01 -1.25 -5.00 115.64 117.66 1r6h s THR 168 Ca -0.10 1.14 -0.18 0.00 0.31 0.00 0.00 61.69 62.86 1r6h s THR 168 Cb 0.06 -3.73 -0.03 0.00 0.01 0.00 0.00 72.50 68.81 1r6h s THR 168 CO 0.91 0.06 0.49 -1.00 -0.69 0.00 0.00 174.62 174.39 1r6h s HIS 169 N 1.49 3.35 -0.27 4.92 3.76 -1.26 -4.67 115.29 122.61 1r6h s HIS 169 Ca 0.62 0.71 0.03 0.00 -0.15 0.00 0.00 55.06 56.27 1r6h s HIS 169 Cb -0.33 -2.65 0.07 0.00 1.11 0.00 0.00 32.58 30.78 1r6h s HIS 169 CO 0.29 -0.12 -0.06 0.21 -0.85 0.00 0.00 174.74 174.20 1r6h s LYS 170 N 1.71 1.93 -0.08 1.40 2.36 -1.26 -5.11 119.74 120.70 1r6h s LYS 170 Ca 0.22 -1.39 -0.12 0.00 -2.55 0.00 0.00 55.97 52.13 1r6h s LYS 170 Cb -0.15 -2.88 -0.05 0.00 -1.05 0.00 0.00 37.83 33.69 1r6h s LYS 170 CO 0.09 -0.67 0.30 0.95 1.55 0.00 0.00 175.35 177.57 1r6h s THR 171 N 1.12 5.25 0.00 3.43 -4.23 -1.26 -5.20 115.64 114.75 1r6h s THR 171 Ca -0.04 0.57 0.00 0.00 -1.18 0.00 0.00 61.69 61.05 1r6h s THR 171 Cb -0.20 -3.60 0.00 0.00 1.34 0.00 0.00 72.50 70.05 1r6h s THR 171 CO -0.06 0.54 0.00 -1.14 -0.54 0.00 0.00 174.62 173.42