#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r6h h SER 2 N 0.00 0.00 -3.82 1.61 0.87 -2.13 -3.48 113.55 106.61 1r6h h SER 2 Ca 0.00 -0.32 -0.48 0.00 -1.23 0.00 0.00 61.79 59.76 1r6h h SER 2 Cb 0.00 0.00 0.06 0.00 -0.44 0.00 0.00 62.40 62.02 1r6h h SER 2 CO 0.00 0.99 0.22 -1.00 -0.53 0.00 0.00 176.83 176.51 1r6h s HIS 3 N -2.16 3.26 0.57 2.24 4.02 -1.26 -5.09 115.29 116.88 1r6h s HIS 3 Ca -0.17 0.72 0.02 0.00 1.02 0.00 0.00 55.06 56.65 1r6h s HIS 3 Cb 0.02 -2.81 0.05 0.00 -1.02 0.00 0.00 32.58 28.82 1r6h s HIS 3 CO 0.37 -0.90 0.80 1.41 1.02 0.00 0.00 174.74 177.44 1r6h s MET 4 N -5.07 2.41 -0.36 1.40 -2.45 -1.26 -5.08 119.30 108.89 1r6h s MET 4 Ca 0.55 -0.90 -0.04 0.00 -1.25 0.00 0.00 55.69 54.04 1r6h s MET 4 Cb -0.11 -2.49 0.07 0.00 1.25 0.00 0.00 34.83 33.56 1r6h s MET 4 CO 0.46 -0.81 0.13 0.00 1.05 0.00 0.00 175.02 175.85 1r6h s ALA 5 N -2.79 3.05 -0.04 4.11 0.00 -1.26 -5.07 121.76 119.76 1r6h s ALA 5 Ca 0.59 -2.09 -0.00 0.00 0.00 0.00 0.00 51.96 50.46 1r6h s ALA 5 Cb -0.09 -2.27 0.03 0.00 0.00 0.00 0.00 23.12 20.78 1r6h s ALA 5 CO 0.39 -1.52 0.01 1.03 0.00 0.00 0.00 175.76 175.66 1r6h s ARG 6 N 1.27 0.32 0.00 0.00 0.52 -1.26 -5.01 118.95 114.79 1r6h s ARG 6 Ca 0.01 0.12 0.00 0.00 -0.52 0.00 0.00 55.73 55.34 1r6h s ARG 6 Cb -0.21 -0.59 0.00 0.00 0.52 0.00 0.00 34.95 34.67 1r6h s ARG 6 CO -0.01 -0.19 0.00 -1.33 0.02 0.00 0.00 175.30 173.79 1r6h n MET 7 N 4.49 0.00 -3.57 3.54 2.81 -1.26 -5.15 117.12 117.98 1r6h n MET 7 Ca -0.19 0.00 -0.07 0.00 -1.81 0.00 0.00 57.70 55.63 1r6h n MET 7 Cb 0.50 -0.30 -0.03 0.00 -0.71 0.00 0.00 33.22 32.68 1r6h n MET 7 CO 0.00 0.00 0.00 1.21 1.51 0.00 0.00 175.97 178.69 1r6h s ASN 8 N -4.46 -0.25 0.04 7.83 3.84 -1.26 -5.18 114.94 115.50 1r6h s ASN 8 Ca 0.00 0.11 0.05 0.00 0.21 0.00 0.00 52.86 53.23 1r6h s ASN 8 Cb 0.00 0.23 -0.02 0.00 -0.55 0.00 0.00 41.25 40.91 1r6h s ASN 8 CO 0.00 -0.34 -0.14 0.00 -2.79 0.00 0.00 177.10 173.83 1r6h s ARG 9 N -2.10 0.92 -0.34 0.43 1.70 -1.26 -5.11 118.95 113.19 1r6h s ARG 9 Ca 0.05 -0.76 -0.29 0.00 -0.47 0.00 0.00 55.73 54.26 1r6h s ARG 9 Cb -0.01 -0.92 -0.00 0.00 -0.57 0.00 0.00 34.95 33.45 1r6h s ARG 9 CO -0.05 0.23 1.47 -1.25 -1.08 0.00 0.00 175.30 174.62 1r6h s PRO 10 N -1.17 3.67 0.32 3.89 0.04 -1.26 -5.00 135.00 135.49 1r6h s PRO 10 Ca 0.01 1.20 -0.27 0.00 0.04 0.00 0.00 61.00 61.99 1r6h s PRO 10 Cb -0.08 -4.01 -0.09 0.00 0.04 0.00 0.00 34.50 30.35 1r6h s PRO 10 CO 0.01 -1.44 1.02 0.00 0.04 0.00 0.00 177.00 176.63 1r6h s ALA 11 N 5.31 3.24 0.78 8.56 0.00 -1.26 -4.80 121.76 133.60 1r6h s ALA 11 Ca 0.64 0.69 -0.11 0.00 0.00 0.00 0.00 51.96 53.18 1r6h s ALA 11 Cb -0.17 -3.25 0.06 0.00 0.00 0.00 0.00 23.12 19.75 1r6h s ALA 11 CO 0.30 -0.03 1.08 -1.25 0.00 0.00 0.00 175.76 175.86 1r6h s PRO 12 N -1.89 2.19 -0.08 0.00 0.04 -1.26 -4.86 135.00 129.14 1r6h s PRO 12 Ca 0.50 0.86 -0.03 0.00 0.04 0.00 0.00 61.00 62.36 1r6h s PRO 12 Cb -0.24 -1.91 0.04 0.00 0.04 0.00 0.00 34.50 32.43 1r6h s PRO 12 CO 0.31 -1.60 0.17 0.08 0.04 0.00 0.00 177.00 176.00 1r6h s VAL 13 N -3.04 -0.13 -0.15 -0.36 1.01 -0.19 -4.95 120.40 112.59 1r6h s VAL 13 Ca 0.61 0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.79 1r6h s VAL 13 Cb -0.15 -0.29 -0.02 0.00 0.00 0.00 0.00 36.38 35.91 1r6h s VAL 13 CO 0.55 0.09 -0.06 -1.61 0.00 0.00 0.00 175.10 174.07 1r6h s GLU 14 N 1.56 3.59 -0.26 2.72 8.01 -1.26 0.12 118.70 133.18 1r6h s GLU 14 Ca -0.05 -0.57 -0.07 0.00 0.01 0.00 0.00 54.97 54.29 1r6h s GLU 14 Cb -0.12 -2.84 -0.02 0.00 -4.31 0.00 0.00 34.13 26.85 1r6h s GLU 14 CO -0.07 0.23 0.07 0.08 0.01 0.00 0.00 175.26 175.59 1r6h s VAL 15 N 0.37 4.24 0.16 2.63 1.01 -0.47 -4.88 120.40 123.46 1r6h s VAL 15 Ca -0.06 -0.28 0.08 0.00 0.00 0.00 0.00 61.98 61.72 1r6h s VAL 15 Cb -0.15 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 1r6h s VAL 15 CO 0.04 0.28 -0.10 -0.94 0.00 0.00 0.00 175.10 174.38 1r6h s SER 16 N 1.59 4.29 -0.26 3.32 1.04 -1.26 0.11 113.70 122.53 1r6h s SER 16 Ca 0.06 -0.52 -0.04 0.00 0.48 0.00 0.00 55.95 55.93 1r6h s SER 16 Cb -0.15 -0.75 0.14 0.00 0.10 0.00 0.00 66.02 65.36 1r6h s SER 16 CO 0.03 0.12 0.48 -0.47 0.98 0.00 0.00 173.24 174.39 1r6h s TYR 17 N -1.55 -1.13 0.00 5.02 5.04 -0.54 -5.01 117.35 119.18 1r6h s TYR 17 Ca 0.24 1.39 0.00 0.00 -2.44 0.00 0.00 57.07 56.26 1r6h s TYR 17 Cb -0.09 0.33 0.00 0.00 0.35 0.00 0.00 41.96 42.54 1r6h s TYR 17 CO 0.15 -0.73 0.00 1.63 -1.34 0.00 0.00 175.55 175.26 1r6h n LYS 18 N 5.40 0.00 0.00 4.97 4.76 -1.26 -2.72 118.16 129.31 1r6h n LYS 18 Ca -0.04 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.40 1r6h n LYS 18 Cb 0.50 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.69 1r6h n LYS 18 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1r6h n HIS 19 N 0.00 0.00 -2.48 2.13 8.25 -1.26 -5.08 115.22 116.78 1r6h n HIS 19 Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.11 1r6h n HIS 19 Cb 0.00 0.06 -0.03 0.00 1.12 0.00 0.00 29.99 31.14 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 -1.66 3.75 0.20 -0.41 0.23 -1.10 -4.89 119.30 115.41 1r6h s MET 20 Ca 0.00 1.44 0.03 0.00 -1.03 0.00 0.00 55.69 56.13 1r6h s MET 20 Cb 0.00 -2.13 -0.05 0.00 -1.53 0.00 0.00 34.83 31.12 1r6h s MET 20 CO 0.00 -0.49 -0.02 1.03 -2.03 0.00 0.00 175.02 173.51 1r6h s ARG 21 N -3.16 1.23 0.15 3.16 0.52 -1.24 -1.47 118.95 118.13 1r6h s ARG 21 Ca 0.67 -1.60 0.07 0.00 -0.52 0.00 0.00 55.73 54.35 1r6h s ARG 21 Cb -0.19 -0.54 -0.04 0.00 0.52 0.00 0.00 34.95 34.70 1r6h s ARG 21 CO 0.22 -0.07 -0.15 -0.06 0.02 0.00 0.00 175.30 175.26 1r6h s PHE 22 N -3.45 1.58 -0.04 -0.53 0.08 0.30 -3.53 117.98 112.39 1r6h s PHE 22 Ca 0.25 -0.53 0.05 0.00 0.12 0.00 0.00 56.93 56.81 1r6h s PHE 22 Cb 0.05 -0.80 -0.01 0.00 -0.57 0.00 0.00 43.02 41.70 1r6h s PHE 22 CO 0.06 0.23 -0.18 -0.51 -0.10 0.00 0.00 175.22 174.72 1r6h s LEU 23 N -2.64 1.94 -0.30 -0.37 2.01 0.55 -1.37 118.68 118.50 1r6h s LEU 23 Ca 0.13 -0.36 0.02 0.00 0.01 0.00 0.00 54.13 53.93 1r6h s LEU 23 Cb -0.04 -0.99 0.07 0.00 0.01 0.00 0.00 46.19 45.23 1r6h s LEU 23 CO 0.05 0.17 -0.02 -0.63 1.01 0.00 0.00 176.35 176.93 1r6h s ILE 24 N -0.03 2.48 0.18 -0.59 -1.09 0.32 0.15 121.20 122.62 1r6h s ILE 24 Ca -0.02 -1.81 0.03 0.00 -2.23 0.00 0.00 60.65 56.62 1r6h s ILE 24 Cb -0.11 -2.57 -0.05 0.00 -1.58 0.00 0.00 42.46 38.15 1r6h s ILE 24 CO 0.02 -0.26 -0.04 0.42 -1.23 0.00 0.00 174.94 173.85 1r6h s THR 25 N 1.08 0.99 0.45 2.92 -4.23 0.12 -1.03 115.64 115.95 1r6h s THR 25 Ca -0.01 -2.03 -0.17 0.00 -1.18 0.00 0.00 61.69 58.30 1r6h s THR 25 Cb -0.20 -2.10 -0.09 0.00 1.34 0.00 0.00 72.50 71.46 1r6h s THR 25 CO -0.05 -0.53 0.92 -1.38 -0.54 0.00 0.00 174.62 173.05 1r6h s HIS 26 N -3.45 3.39 0.74 3.99 -3.43 -1.26 0.25 115.29 115.53 1r6h s HIS 26 Ca 0.23 1.45 -0.15 0.00 -0.80 0.00 0.00 55.06 55.79 1r6h s HIS 26 Cb 0.05 -2.75 0.04 0.00 -1.43 0.00 0.00 32.58 28.49 1r6h s HIS 26 CO 0.04 -0.20 1.20 -0.80 -2.00 0.00 0.00 174.74 172.99 1r6h s ASN 27 N -2.68 4.14 0.27 7.38 -0.87 -1.26 -4.82 114.94 117.10 1r6h s ASN 27 Ca 0.59 2.33 -0.30 0.00 -1.57 0.00 0.00 52.86 53.91 1r6h s ASN 27 Cb -0.10 -2.59 -0.13 0.00 -0.02 0.00 0.00 41.25 38.42 1r6h s ASN 27 CO 0.23 -2.30 1.34 -2.65 -2.57 0.00 0.00 177.10 171.15 1r6h n PRO 28 N -2.81 1.97 -3.84 -0.60 -0.02 -1.26 -4.99 135.00 123.45 1r6h n PRO 28 Ca 0.13 0.70 -0.33 0.00 -2.02 0.00 0.00 63.50 61.98 1r6h n PRO 28 Cb 0.50 -2.31 -0.05 0.00 -0.02 0.00 0.00 33.50 31.63 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 -0.41 5.36 -0.96 3.45 2.01 -1.26 -4.93 115.64 118.89 1r6h s THR 29 Ca 0.64 -0.07 0.14 0.00 0.31 0.00 0.00 61.69 62.72 1r6h s THR 29 Cb -0.64 -3.57 0.12 0.00 0.01 0.00 0.00 72.50 68.42 1r6h s THR 29 CO 0.54 0.28 1.45 -0.46 -0.69 0.00 0.00 174.62 175.75 1r6h n ASN 30 N 0.82 0.04 -0.05 3.53 6.94 -1.26 -2.98 115.26 122.30 1r6h n ASN 30 Ca -0.09 0.51 -0.10 0.00 -0.02 0.00 0.00 54.58 54.87 1r6h n ASN 30 Cb 0.52 -0.52 -0.15 0.00 -2.36 0.00 0.00 39.78 37.28 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 -1.52 1.44 -3.46 -2.53 0.00 -1.26 -4.78 120.51 108.41 1r6h n ALA 31 Ca 0.03 -0.94 -0.29 0.00 0.00 0.00 0.00 53.44 52.25 1r6h n ALA 31 Cb 0.16 -0.60 -0.12 0.00 0.00 0.00 0.00 19.45 18.89 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 0.17 -0.14 0.00 -4.23 -1.16 -4.98 115.64 102.74 1r6h s THR 32 Ca -0.09 -1.81 -0.22 0.00 -1.18 0.00 0.00 61.69 58.39 1r6h s THR 32 Cb 0.07 -1.14 -0.20 0.00 1.34 0.00 0.00 72.50 72.58 1r6h s THR 32 CO 0.81 -1.01 0.56 -0.07 -0.54 0.00 0.00 174.62 174.37 1r6h h LEU 33 N 6.87 0.00 -0.44 4.79 -0.00 -1.86 -3.32 115.31 121.35 1r6h h LEU 33 Ca 0.08 -0.75 0.05 0.00 -0.00 0.00 0.00 57.88 57.27 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 0.92 0.16 -1.28 -0.00 0.00 0.00 178.44 178.52 1r6h h SER 34 N -1.00 0.18 -0.39 -0.43 0.87 -1.93 -1.74 113.55 109.10 1r6h h SER 34 Ca -0.02 0.05 0.07 0.00 -1.23 0.00 0.00 61.79 60.65 1r6h h SER 34 Cb 0.81 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.77 1r6h h SER 34 CO -0.01 0.14 0.27 0.74 -0.53 0.00 0.00 176.83 177.43 1r6h h THR 35 N 0.34 0.93 -0.01 2.23 2.02 -1.98 -2.40 112.91 114.04 1r6h h THR 35 Ca 0.21 -0.09 -0.06 0.00 0.77 0.00 0.00 66.41 67.24 1r6h h THR 35 Cb 0.19 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.26 1r6h h THR 35 CO -0.20 0.05 -0.23 0.15 0.37 0.00 0.00 175.52 175.65 1r6h h PHE 36 N 0.25 0.26 -0.94 3.16 3.04 -1.44 -2.70 116.94 118.57 1r6h h PHE 36 Ca 0.18 -0.13 0.10 0.00 3.98 0.00 0.00 57.97 62.10 1r6h h PHE 36 Cb 0.38 -0.03 -0.07 0.00 2.56 0.00 0.00 35.95 38.78 1r6h h PHE 36 CO -0.00 0.91 0.60 -0.84 -2.02 0.00 0.00 178.31 176.96 1r6h h ILE 37 N -0.47 0.95 0.13 1.41 3.07 -1.06 0.41 117.51 121.95 1r6h h ILE 37 Ca -0.03 -0.32 -0.01 0.00 1.55 0.00 0.00 64.86 66.06 1r6h h ILE 37 Cb 0.96 -0.06 0.00 0.00 -0.27 0.00 0.00 36.82 37.45 1r6h h ILE 37 CO 0.05 0.17 -0.06 -0.33 -1.05 0.00 0.00 178.15 176.93 1r6h h GLU 38 N 0.93 -0.17 0.01 0.16 4.39 -1.49 -1.19 114.58 117.24 1r6h h GLU 38 Ca 0.44 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 60.16 1r6h h GLU 38 Cb 0.44 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 1r6h h GLU 38 CO -0.21 0.13 -0.01 -0.44 -1.16 0.00 0.00 179.01 177.32 1r6h h ASP 39 N -0.46 -0.02 -0.59 1.42 3.32 -1.08 0.84 116.42 119.85 1r6h h ASP 39 Ca -0.02 -0.41 0.06 0.00 0.02 0.00 0.00 57.03 56.68 1r6h h ASP 39 Cb 0.37 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.87 1r6h h ASP 39 CO 0.03 0.41 0.30 -0.07 -1.72 0.00 0.00 179.24 178.19 1r6h h LEU 40 N -0.45 0.43 -0.30 1.55 3.38 -0.31 -0.66 115.31 118.95 1r6h h LEU 40 Ca -0.00 0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 1r6h h LEU 40 Cb 0.43 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1r6h h LEU 40 CO 0.00 0.28 -0.57 0.50 0.09 0.00 0.00 178.44 178.74 1r6h h LYS 41 N 0.57 0.00 -0.60 1.13 3.64 -1.23 -3.28 116.57 116.80 1r6h h LYS 41 Ca 0.27 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.75 1r6h h LYS 41 Cb 0.20 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 31.94 1r6h h LYS 41 CO -0.19 0.57 0.19 0.87 -2.27 0.00 0.00 179.45 178.61 1r6h h LYS 42 N 0.00 0.33 -0.67 1.90 1.57 0.23 -1.21 116.57 118.73 1r6h h LYS 42 Ca -0.01 -0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 1r6h h LYS 42 Cb 1.31 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 33.52 1r6h h LYS 42 CO 0.07 0.22 0.21 -0.92 -0.57 0.00 0.00 179.45 178.47 1r6h h TYR 43 N 0.34 1.04 0.00 -1.35 5.03 -1.54 -3.48 116.97 117.01 1r6h h TYR 43 Ca 0.31 -0.09 0.00 0.00 2.58 0.00 0.00 58.73 61.53 1r6h h TYR 43 Cb 0.41 -0.31 0.00 0.00 1.55 0.00 0.00 36.73 38.38 1r6h h TYR 43 CO -0.20 0.83 0.00 0.41 -1.32 0.00 0.00 178.16 177.88 1r6h n GLY 44 N -0.85 -2.51 2.87 1.82 0.00 -0.46 -4.96 105.19 101.10 1r6h n GLY 44 Ca 0.05 -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 -1.93 1.27 0.01 4.61 0.00 -1.25 -4.40 121.76 120.06 1r6h s ALA 45 Ca 0.00 -0.59 -0.01 0.00 0.00 0.00 0.00 51.96 51.37 1r6h s ALA 45 Cb 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 23.12 22.15 1r6h s ALA 45 CO 0.00 -0.59 0.03 2.41 0.00 0.00 0.00 175.76 177.61 1r6h n THR 46 N 4.96 0.00 -1.58 0.00 -1.04 0.11 -4.15 114.28 112.59 1r6h n THR 46 Ca -0.11 -0.02 -0.34 0.00 -2.04 0.00 0.00 64.05 61.54 1r6h n THR 46 Cb 0.49 0.03 0.07 0.00 -1.82 0.00 0.00 70.33 69.10 1r6h n THR 46 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 1r6h s THR 47 N -2.74 2.61 -0.03 12.58 -1.32 -1.25 -4.11 115.64 121.38 1r6h s THR 47 Ca 0.01 0.30 0.03 0.00 -1.21 0.00 0.00 61.69 60.81 1r6h s THR 47 Cb -0.00 -2.87 0.00 0.00 -1.51 0.00 0.00 72.50 68.12 1r6h s THR 47 CO 0.00 -0.16 -0.10 -0.69 -2.21 0.00 0.00 174.62 171.46 1r6h s VAL 48 N -2.06 0.87 -0.34 5.08 1.01 0.14 -2.57 120.40 122.52 1r6h s VAL 48 Ca 0.72 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 62.30 1r6h s VAL 48 Cb -0.27 -0.77 0.08 0.00 0.00 0.00 0.00 36.38 35.42 1r6h s VAL 48 CO 0.43 0.27 0.06 0.54 0.00 0.00 0.00 175.10 176.40 1r6h s VAL 49 N 0.21 2.89 -0.29 2.92 0.11 -0.22 0.46 120.40 126.47 1r6h s VAL 49 Ca -0.04 -1.79 -0.01 0.00 -2.93 0.00 0.00 61.98 57.21 1r6h s VAL 49 Cb -0.09 -2.85 0.05 0.00 -1.53 0.00 0.00 36.38 31.96 1r6h s VAL 49 CO 0.01 -0.37 -0.02 0.00 -3.33 0.00 0.00 175.10 171.39 1r6h s ARG 50 N 1.14 2.48 -0.77 1.54 1.70 -1.13 -2.51 118.95 121.41 1r6h s ARG 50 Ca 0.02 -1.22 -0.12 0.00 -0.47 0.00 0.00 55.73 53.93 1r6h s ARG 50 Cb -0.21 -3.13 0.20 0.00 -0.57 0.00 0.00 34.95 31.24 1r6h s ARG 50 CO -0.04 -0.58 0.69 0.08 -1.08 0.00 0.00 175.30 174.37 1r6h s VAL 51 N 1.26 5.24 0.29 4.99 1.01 -1.26 -2.38 120.40 129.55 1r6h s VAL 51 Ca -0.05 -2.48 -0.18 0.00 0.00 0.00 0.00 61.98 59.27 1r6h s VAL 51 Cb -0.19 -4.27 0.02 0.00 0.00 0.00 0.00 36.38 31.94 1r6h s VAL 51 CO -0.02 -0.99 0.68 0.00 0.00 0.00 0.00 175.10 174.77 1r6h s GLU 53 N -3.67 4.28 -0.15 0.00 8.01 -1.26 -4.14 118.70 121.77 1r6h s GLU 53 Ca 0.14 2.19 -0.29 0.00 0.01 0.00 0.00 54.97 57.02 1r6h s GLU 53 Cb -0.05 -3.22 -0.01 0.00 -4.31 0.00 0.00 34.13 26.55 1r6h s GLU 53 CO 0.08 -0.51 1.09 0.54 0.01 0.00 0.00 175.26 176.48 1r6h s VAL 54 N 1.15 4.57 0.00 2.63 0.11 -1.26 -4.87 120.40 122.73 1r6h s VAL 54 Ca 0.67 1.88 0.00 0.00 -2.93 0.00 0.00 61.98 61.60 1r6h s VAL 54 Cb -0.40 -4.21 0.00 0.00 -1.53 0.00 0.00 36.38 30.24 1r6h s VAL 54 CO 0.31 -0.09 0.00 0.41 -3.33 0.00 0.00 175.10 172.40 1r6h n THR 55 N 4.98 0.00 -3.65 5.04 -1.04 -1.26 -4.94 114.28 113.40 1r6h n THR 55 Ca 0.11 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.84 1r6h n THR 55 Cb 0.47 -1.26 -0.12 0.00 -1.82 0.00 0.00 70.33 67.60 1r6h n THR 55 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1r6h s TYR 56 N -2.00 2.11 0.08 -1.42 2.02 -1.26 -4.96 117.35 111.93 1r6h s TYR 56 Ca 0.00 -2.64 -0.06 0.00 -0.37 0.00 0.00 57.07 54.00 1r6h s TYR 56 Cb 0.00 -1.77 -0.24 0.00 -0.40 0.00 0.00 41.96 39.55 1r6h s TYR 56 CO 0.00 -0.73 1.17 0.38 -1.57 0.00 0.00 175.55 174.80 1r6h h ASP 57 N 5.97 0.50 0.03 2.29 3.04 -1.99 -3.38 116.42 122.87 1r6h h ASP 57 Ca 0.13 -0.50 -0.06 0.00 -3.24 0.00 0.00 57.03 53.37 1r6h h ASP 57 Cb 0.87 -0.16 0.01 0.00 -1.04 0.00 0.00 39.33 39.01 1r6h h ASP 57 CO 0.51 1.36 -0.25 0.11 -2.04 0.00 0.00 179.24 178.93 1r6h h LYS 58 N 0.12 0.12 -0.91 4.15 1.57 -1.99 -3.30 116.57 116.34 1r6h h LYS 58 Ca -0.13 -0.16 0.08 0.00 -1.87 0.00 0.00 60.65 58.57 1r6h h LYS 58 Cb 1.89 0.06 -0.11 0.00 0.08 0.00 0.00 32.23 34.14 1r6h h LYS 58 CO 0.20 1.01 -0.58 1.79 -0.57 0.00 0.00 179.45 181.29 1r6h h THR 59 N -0.69 0.00 -0.52 -0.16 1.35 -1.99 0.54 112.91 111.45 1r6h h THR 59 Ca -0.04 0.00 -0.06 0.00 -0.55 0.00 0.00 66.41 65.76 1r6h h THR 59 Cb 1.11 0.00 -0.02 0.00 -1.73 0.00 0.00 68.15 67.51 1r6h h THR 59 CO 0.05 0.00 0.09 1.55 -0.25 0.00 0.00 175.52 176.95 1r6h h PRO 60 N -0.06 0.85 0.00 4.72 0.13 -1.75 -2.48 132.00 133.41 1r6h h PRO 60 Ca 0.15 -0.23 -0.11 0.00 -0.87 0.00 0.00 66.00 64.94 1r6h h PRO 60 Cb 0.44 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 31.45 1r6h h PRO 60 CO -0.88 0.84 -0.51 -0.07 -0.23 0.00 0.00 178.00 177.14 1r6h h LEU 61 N 0.74 0.00 -0.03 1.56 4.07 -1.47 -0.40 115.31 119.78 1r6h h LEU 61 Ca 0.16 0.00 -0.14 0.00 0.08 0.00 0.00 57.88 57.98 1r6h h LEU 61 Cb 0.40 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.15 1r6h h LEU 61 CO 0.01 0.51 -0.52 -0.08 -1.08 0.00 0.00 178.44 177.28 1r6h h GLU 62 N 0.00 0.40 0.00 1.13 4.81 0.16 0.41 114.58 121.50 1r6h h GLU 62 Ca -0.01 -0.39 -0.18 0.00 -0.13 0.00 0.00 59.36 58.65 1r6h h GLU 62 Cb 0.96 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.42 1r6h h GLU 62 CO 0.07 1.05 -0.92 0.87 -0.73 0.00 0.00 179.01 179.35 1r6h h LYS 63 N -0.10 0.00 0.00 1.92 1.57 -1.48 -3.32 116.57 115.16 1r6h h LYS 63 Ca -0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1r6h h LYS 63 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1r6h h LYS 63 CO 0.10 0.79 -1.09 -0.25 -0.57 0.00 0.00 179.45 178.43 1r6h n ASP 64 N -3.27 0.84 -2.95 0.86 8.00 -0.16 -4.97 116.55 114.89 1r6h n ASP 64 Ca -0.01 -0.81 -0.12 0.00 0.71 0.00 0.00 54.79 54.56 1r6h n ASP 64 Cb 0.88 1.15 -0.01 0.00 -0.02 0.00 0.00 41.12 43.12 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 1.45 -0.48 3.84 0.44 0.00 0.15 -4.91 105.19 105.68 1r6h n GLY 65 Ca 0.03 0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 1r6h n GLY 65 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1r6h s ILE 66 N -2.43 5.00 0.15 -0.61 -4.36 -1.25 -5.05 121.20 112.65 1r6h s ILE 66 Ca 0.20 -0.46 -0.30 0.00 -0.26 0.00 0.00 60.65 59.83 1r6h s ILE 66 Cb -0.11 -3.38 -0.07 0.00 1.25 0.00 0.00 42.46 40.15 1r6h s ILE 66 CO 0.24 0.22 1.02 -0.89 0.24 0.00 0.00 174.94 175.77 1r6h s THR 67 N -1.37 4.20 0.02 8.37 2.01 -1.26 -4.78 115.64 122.83 1r6h s THR 67 Ca 0.29 1.87 -0.08 0.00 0.31 0.00 0.00 61.69 64.09 1r6h s THR 67 Cb -0.12 -4.19 -0.00 0.00 0.01 0.00 0.00 72.50 68.19 1r6h s THR 67 CO 0.21 0.31 0.14 0.54 -0.69 0.00 0.00 174.62 175.14 1r6h s VAL 68 N -0.15 0.10 -0.17 3.82 0.11 -1.26 0.24 120.40 123.09 1r6h s VAL 68 Ca 0.48 -0.82 -0.07 0.00 -2.93 0.00 0.00 61.98 58.64 1r6h s VAL 68 Cb -0.26 -0.64 -0.04 0.00 -1.53 0.00 0.00 36.38 33.91 1r6h s VAL 68 CO 0.32 -0.45 0.07 -0.69 -3.33 0.00 0.00 175.10 171.02 1r6h s VAL 69 N -1.90 4.89 -0.45 2.04 1.01 0.17 -4.89 120.40 121.28 1r6h s VAL 69 Ca -0.11 -0.00 -0.15 0.00 0.00 0.00 0.00 61.98 61.72 1r6h s VAL 69 Cb -0.05 -3.18 0.06 0.00 0.00 0.00 0.00 36.38 33.21 1r6h s VAL 69 CO -0.01 0.49 0.35 -1.81 0.00 0.00 0.00 175.10 174.12 1r6h s ASP 70 N 0.09 6.08 -0.37 3.32 1.01 -1.26 -2.85 116.67 122.69 1r6h s ASP 70 Ca 0.06 -1.20 -0.03 0.00 0.71 0.00 0.00 52.55 52.08 1r6h s ASP 70 Cb -0.12 -2.16 0.08 0.00 1.01 0.00 0.00 42.92 41.73 1r6h s ASP 70 CO 0.00 -0.57 0.13 0.26 0.21 0.00 0.00 175.17 175.20 1r6h s TRP 71 N 1.63 3.43 0.07 4.23 0.52 -1.00 -5.05 118.94 122.78 1r6h s TRP 71 Ca 0.04 -2.08 0.02 0.00 0.02 0.00 0.00 56.10 54.10 1r6h s TRP 71 Cb -0.22 -2.74 -0.04 0.00 -1.15 0.00 0.00 33.47 29.31 1r6h s TRP 71 CO 0.07 -0.88 0.12 -1.25 0.02 0.00 0.00 176.95 175.03 1r6h s PRO 72 N 1.22 3.06 -0.38 4.98 0.04 -1.26 -0.73 135.00 141.92 1r6h s PRO 72 Ca 0.03 -0.61 0.02 0.00 0.04 0.00 0.00 61.00 60.47 1r6h s PRO 72 Cb -0.21 -2.82 0.11 0.00 0.04 0.00 0.00 34.50 31.61 1r6h s PRO 72 CO -0.02 0.58 0.14 0.12 0.04 0.00 0.00 177.00 177.86 1r6h s PHE 73 N -1.43 2.62 0.00 0.56 5.36 -1.26 -4.66 117.98 119.17 1r6h s PHE 73 Ca 0.31 -2.51 0.00 0.00 -0.96 0.00 0.00 56.93 53.77 1r6h s PHE 73 Cb -0.12 -2.29 0.00 0.00 -0.34 0.00 0.00 43.02 40.26 1r6h s PHE 73 CO 0.24 -0.86 0.00 -3.47 -1.46 0.00 0.00 175.22 169.67 1r6h n ASP 74 N 4.08 0.00 0.20 6.13 2.03 -1.26 -4.93 116.55 122.80 1r6h n ASP 74 Ca 0.03 -0.02 0.18 0.00 0.52 0.00 0.00 54.79 55.51 1r6h n ASP 74 Cb 0.39 0.00 0.82 0.00 -0.72 0.00 0.00 41.12 41.61 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 0.00 -2.26 1.67 1.82 -2.07 -2.66 116.42 112.92 1r6h h ASP 75 Ca 0.00 0.00 -0.58 0.00 -0.39 0.00 0.00 57.03 56.06 1r6h h ASP 75 Cb 0.00 0.00 -0.42 0.00 0.68 0.00 0.00 39.33 39.59 1r6h h ASP 75 CO 0.00 0.00 -0.69 0.61 -1.61 0.00 0.00 179.24 177.55 1r6h n GLY 76 N -1.37 5.38 3.03 -0.78 0.00 -1.26 -5.01 105.19 105.18 1r6h n GLY 76 Ca 0.02 -2.69 -0.31 0.00 0.00 0.00 0.00 46.02 43.05 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 -3.31 2.67 -0.85 4.61 0.00 -1.00 -4.96 121.76 118.90 1r6h s ALA 77 Ca 0.48 -2.12 -0.31 0.00 0.00 0.00 0.00 51.96 50.00 1r6h s ALA 77 Cb 0.28 -1.77 -0.19 0.00 0.00 0.00 0.00 23.12 21.44 1r6h s ALA 77 CO -0.13 -1.45 2.59 -2.30 0.00 0.00 0.00 175.76 174.47 1r6h n PRO 78 N 4.37 0.20 0.02 0.00 -0.02 -1.26 -4.83 135.00 133.49 1r6h n PRO 78 Ca -0.05 0.01 -0.02 0.00 -2.02 0.00 0.00 63.50 61.43 1r6h n PRO 78 Cb 0.42 -1.84 0.25 0.00 -0.02 0.00 0.00 33.50 32.31 1r6h n PRO 78 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1r6h h PRO 79 N 12.97 0.46 -6.43 0.52 0.13 -1.98 -3.46 132.00 134.21 1r6h h PRO 79 Ca -0.09 -0.14 -0.59 0.00 -0.87 0.00 0.00 66.00 64.31 1r6h h PRO 79 Cb 1.31 -0.04 0.16 0.00 0.13 0.00 0.00 31.00 32.56 1r6h h PRO 79 CO 1.32 0.61 -0.39 -0.35 -0.23 0.00 0.00 178.00 178.96 1r6h n PRO 80 N -4.18 0.57 0.29 1.56 -0.04 -1.26 -4.86 135.00 127.08 1r6h n PRO 80 Ca 0.00 0.22 0.18 0.00 -0.04 0.00 0.00 63.50 63.85 1r6h n PRO 80 Cb 0.34 -1.63 0.84 0.00 -0.04 0.00 0.00 33.50 33.01 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 0.52 0.00 0.44 0.55 0.00 -2.01 -2.93 103.07 99.64 1r6h h GLY 81 Ca -0.43 0.00 0.23 0.00 0.00 0.00 0.00 47.33 47.12 1r6h h GLY 81 CO 0.49 0.00 0.56 1.70 0.00 0.00 0.00 176.54 179.29 1r6h h LYS 82 N 0.00 0.00 -0.35 4.80 3.11 -1.95 0.32 116.57 122.50 1r6h h LYS 82 Ca -0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1r6h h LYS 82 Cb 0.34 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.55 1r6h h LYS 82 CO 0.01 0.00 0.22 0.28 -2.81 0.00 0.00 179.45 177.15 1r6h h VAL 83 N 0.00 1.10 -0.96 2.00 2.07 -1.83 -0.53 116.25 118.10 1r6h h VAL 83 Ca 0.37 -0.20 0.15 0.00 0.82 0.00 0.00 66.70 67.84 1r6h h VAL 83 Cb 1.49 0.60 -0.08 0.00 -1.52 0.00 0.00 31.29 31.78 1r6h h VAL 83 CO -0.00 0.10 0.61 0.58 0.02 0.00 0.00 177.57 178.87 1r6h h VAL 84 N 0.47 0.83 -0.10 2.57 2.07 -0.58 0.78 116.25 122.27 1r6h h VAL 84 Ca 0.13 -0.28 -0.06 0.00 0.82 0.00 0.00 66.70 67.31 1r6h h VAL 84 Cb -0.04 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 29.68 1r6h h VAL 84 CO -0.03 0.15 -0.21 -0.33 0.02 0.00 0.00 177.57 177.17 1r6h h GLU 85 N 0.80 0.17 0.04 1.57 4.39 -0.84 -1.92 114.58 118.79 1r6h h GLU 85 Ca 0.50 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 60.15 1r6h h GLU 85 Cb 0.71 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 1r6h h GLU 85 CO -0.27 0.38 -0.02 0.22 -1.16 0.00 0.00 179.01 178.16 1r6h h ASP 86 N 0.16 -0.05 0.31 1.42 1.82 0.19 -1.63 116.42 118.64 1r6h h ASP 86 Ca 0.03 -0.14 -0.07 0.00 -0.39 0.00 0.00 57.03 56.46 1r6h h ASP 86 Cb 0.47 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.48 1r6h h ASP 86 CO 0.03 0.11 -0.33 -0.25 -1.61 0.00 0.00 179.24 177.19 1r6h h TRP 87 N -0.21 0.03 -0.19 0.28 2.91 -1.32 -2.50 115.95 114.96 1r6h h TRP 87 Ca -0.01 -0.01 -0.00 0.00 1.13 0.00 0.00 58.89 60.01 1r6h h TRP 87 Cb 0.19 -0.01 -0.01 0.00 -0.51 0.00 0.00 29.16 28.82 1r6h h TRP 87 CO -0.03 0.36 0.12 -0.07 -1.03 0.00 0.00 178.44 177.80 1r6h h LEU 88 N 0.03 0.23 -0.65 0.65 3.38 -0.98 -1.16 115.31 116.80 1r6h h LEU 88 Ca 0.00 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1r6h h LEU 88 Cb 0.61 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 1r6h h LEU 88 CO 0.04 0.20 0.29 0.28 0.09 0.00 0.00 178.44 179.34 1r6h h SER 89 N 0.24 0.88 -0.15 -0.43 0.02 -1.08 0.42 113.55 113.44 1r6h h SER 89 Ca 0.07 -0.15 0.04 0.00 -0.84 0.00 0.00 61.79 60.91 1r6h h SER 89 Cb 0.01 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 62.28 1r6h h SER 89 CO -0.01 0.79 -0.12 0.25 -1.14 0.00 0.00 176.83 176.60 1r6h h LEU 90 N 0.91 -0.37 -0.52 5.07 7.12 -1.10 -0.85 115.31 125.57 1r6h h LEU 90 Ca 0.22 0.08 -0.16 0.00 0.13 0.00 0.00 57.88 58.15 1r6h h LEU 90 Cb 0.16 0.19 -0.01 0.00 -0.53 0.00 0.00 40.66 40.48 1r6h h LEU 90 CO -0.02 -0.15 -0.56 1.62 -0.13 0.00 0.00 178.44 179.19 1r6h h VAL 91 N -0.12 1.33 -0.58 1.05 3.04 -1.01 -2.49 116.25 117.47 1r6h h VAL 91 Ca 0.10 -1.83 0.07 0.00 -1.01 0.00 0.00 66.70 64.02 1r6h h VAL 91 Cb 0.26 1.81 -0.06 0.00 -2.01 0.00 0.00 31.29 31.30 1r6h h VAL 91 CO -0.23 0.56 0.27 0.50 -1.01 0.00 0.00 177.57 177.67 1r6h h LYS 92 N 0.40 0.49 -0.35 4.17 3.11 0.41 0.68 116.57 125.48 1r6h h LYS 92 Ca 0.00 -0.03 -0.14 0.00 -2.81 0.00 0.00 60.65 57.67 1r6h h LYS 92 Cb 1.11 -0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 32.22 1r6h h LYS 92 CO 0.10 0.32 -0.33 0.00 -2.81 0.00 0.00 179.45 176.74 1r6h h ALA 93 N 1.34 0.51 -0.03 5.00 0.00 -1.14 0.04 119.26 124.99 1r6h h ALA 93 Ca 0.27 -0.43 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 1r6h h ALA 93 Cb 0.24 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1r6h h ALA 93 CO -0.22 0.57 -0.44 0.87 0.00 0.00 0.00 179.25 180.03 1r6h h LYS 94 N 0.63 0.06 0.17 0.00 6.56 -0.92 -0.51 116.57 122.56 1r6h h LYS 94 Ca 0.06 -0.03 -0.31 0.00 -1.06 0.00 0.00 60.65 59.31 1r6h h LYS 94 Cb 0.91 -0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.58 1r6h h LYS 94 CO 0.08 0.49 -1.47 0.74 -2.06 0.00 0.00 179.45 177.23 1r6h h PHE 95 N 0.05 0.64 -0.10 -1.35 -1.00 0.45 -1.15 116.94 114.48 1r6h h PHE 95 Ca 0.00 -0.47 -0.08 0.00 2.81 0.00 0.00 57.97 60.23 1r6h h PHE 95 Cb 0.79 -0.03 0.00 0.00 3.61 0.00 0.00 35.95 40.33 1r6h h PHE 95 CO 0.00 1.44 -0.24 0.00 -1.61 0.00 0.00 178.31 177.90 1r6h h GLU 97 N -0.12 0.21 -3.48 0.00 4.81 -1.23 -3.39 114.58 111.38 1r6h h GLU 97 Ca -0.00 -0.23 -0.67 0.00 -0.13 0.00 0.00 59.36 58.32 1r6h h GLU 97 Cb 0.85 0.07 -0.38 0.00 0.63 0.00 0.00 28.75 29.92 1r6h h GLU 97 CO 0.05 0.97 -0.46 0.00 -0.73 0.00 0.00 179.01 178.84 1r6h s ALA 98 N -3.18 3.49 0.02 2.92 0.00 -0.43 -5.07 121.76 119.51 1r6h s ALA 98 Ca -0.03 -3.30 -0.30 0.00 0.00 0.00 0.00 51.96 48.33 1r6h s ALA 98 Cb 0.10 -2.46 -0.04 0.00 0.00 0.00 0.00 23.12 20.71 1r6h s ALA 98 CO 0.83 -2.08 1.13 -1.25 0.00 0.00 0.00 175.76 174.40 1r6h s PRO 99 N -0.22 4.46 -1.03 0.00 0.04 -1.23 -3.87 135.00 133.15 1r6h s PRO 99 Ca 0.17 1.65 -0.03 0.00 0.04 0.00 0.00 61.00 62.83 1r6h s PRO 99 Cb -0.22 -3.41 -0.04 0.00 0.04 0.00 0.00 34.50 30.87 1r6h s PRO 99 CO -0.02 -0.23 0.89 0.41 0.04 0.00 0.00 177.00 178.09 1r6h n GLY 100 N 3.15 -0.75 0.00 0.56 0.00 -1.26 -5.02 105.19 101.87 1r6h n GLY 100 Ca 0.08 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1r6h n GLY 100 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1r6h n SER 101 N -3.06 0.11 -3.98 1.61 2.88 -1.25 -4.84 113.62 105.09 1r6h n SER 101 Ca -0.14 -0.48 -0.30 0.00 -1.33 0.00 0.00 58.87 56.62 1r6h n SER 101 Cb 0.63 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.93 1r6h n SER 101 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1r6h s VAL 103 N 1.40 4.69 -0.05 0.00 1.01 -1.23 0.09 120.40 126.32 1r6h s VAL 103 Ca -0.02 -0.72 0.05 0.00 0.00 0.00 0.00 61.98 61.28 1r6h s VAL 103 Cb -0.17 -3.28 -0.01 0.00 0.00 0.00 0.00 36.38 32.92 1r6h s VAL 103 CO -0.08 0.11 -0.21 0.00 0.00 0.00 0.00 175.10 174.92 1r6h s ALA 104 N -1.44 1.80 0.21 5.51 0.00 -1.06 -0.33 121.76 126.44 1r6h s ALA 104 Ca 0.30 -0.85 0.02 0.00 0.00 0.00 0.00 51.96 51.43 1r6h s ALA 104 Cb -0.12 -0.56 -0.05 0.00 0.00 0.00 0.00 23.12 22.39 1r6h s ALA 104 CO 0.23 0.35 0.03 0.08 0.00 0.00 0.00 175.76 176.45 1r6h s VAL 105 N -0.11 0.70 0.71 0.00 1.01 0.38 -1.06 120.40 122.03 1r6h s VAL 105 Ca -0.02 -2.00 -0.14 0.00 0.00 0.00 0.00 61.98 59.82 1r6h s VAL 105 Cb -0.12 -2.33 0.03 0.00 0.00 0.00 0.00 36.38 33.96 1r6h s VAL 105 CO 0.02 -0.29 1.13 -2.28 0.00 0.00 0.00 175.10 173.68 1r6h s HIS 106 N -3.65 2.42 -0.44 5.22 5.65 -1.04 0.15 115.29 123.59 1r6h s HIS 106 Ca 0.29 1.58 -0.28 0.00 0.25 0.00 0.00 55.06 56.90 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 0.08 -1.99 1.80 0.00 -0.65 0.00 0.00 174.74 173.98 1r6h n VAL 108 N 7.33 0.00 0.00 0.00 0.24 -1.26 -3.90 118.33 120.74 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 -0.57 0.00 0.00 -1.47 0.00 0.00 33.84 32.29 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 1.07 -3.00 2.33 0.00 -1.26 -4.26 120.51 114.42 1r6h n ALA 109 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.62 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 -1.43 5.41 3.53 0.00 0.00 -1.25 -5.03 105.19 106.42 1r6h n GLY 110 Ca 0.00 -1.31 -0.35 0.00 0.00 0.00 0.00 46.02 44.36 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 3.48 0.00 0.99 1.43 -1.26 -4.33 118.68 118.99 1r6h s LEU 111 Ca 0.00 -0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.02 1r6h s LEU 111 Cb 0.00 -1.88 0.00 0.00 0.03 0.00 0.00 46.19 44.34 1r6h s LEU 111 CO 0.00 0.11 0.00 0.61 0.23 0.00 0.00 176.35 177.30 1r6h n GLY 112 N 3.93 2.64 0.00 -3.19 0.00 -1.26 -4.91 105.19 102.39 1r6h n GLY 112 Ca -0.17 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.16 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 3.78 -0.11 1.61 3.00 -1.26 -3.59 116.66 120.08 1r6h n ARG 113 Ca 0.00 0.00 -0.07 0.00 -0.01 0.00 0.00 57.85 57.77 1r6h n ARG 113 Cb 0.00 -0.65 0.01 0.00 0.00 0.00 0.00 32.46 31.82 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 0.46 -0.47 7.54 0.00 -1.89 -2.80 119.26 122.10 1r6h h ALA 114 Ca 0.00 0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.01 1r6h h ALA 114 Cb 0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.66 1r6h h ALA 114 CO 0.00 -0.18 0.01 -1.00 0.00 0.00 0.00 179.25 178.08 1r6h h PRO 115 N 0.38 0.13 0.16 0.00 0.13 -1.87 -0.41 132.00 130.52 1r6h h PRO 115 Ca 0.16 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1r6h h PRO 115 Cb 0.07 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.16 1r6h h PRO 115 CO -0.11 0.08 -0.13 0.28 -0.23 0.00 0.00 178.00 177.89 1r6h h VAL 116 N 0.13 0.71 -0.46 1.56 2.07 -1.88 -2.64 116.25 115.74 1r6h h VAL 116 Ca 0.24 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.85 1r6h h VAL 116 Cb 0.34 0.71 -0.08 0.00 -1.52 0.00 0.00 31.29 30.74 1r6h h VAL 116 CO -0.38 0.00 -0.04 -0.07 0.02 0.00 0.00 177.57 177.11 1r6h h LEU 117 N -0.31 -0.27 -0.45 2.57 3.38 -1.13 -1.73 115.31 117.38 1r6h h LEU 117 Ca -0.00 0.12 0.09 0.00 0.09 0.00 0.00 57.88 58.17 1r6h h LEU 117 Cb 0.28 0.22 -0.08 0.00 0.09 0.00 0.00 40.66 41.17 1r6h h LEU 117 CO -0.02 -0.09 -0.08 0.58 0.09 0.00 0.00 178.44 178.92 1r6h h VAL 118 N 0.08 0.58 -0.43 1.22 2.07 -0.86 -0.89 116.25 118.02 1r6h h VAL 118 Ca 0.23 -0.01 0.07 0.00 0.82 0.00 0.00 66.70 67.81 1r6h h VAL 118 Cb 0.34 0.55 -0.06 0.00 -1.52 0.00 0.00 31.29 30.61 1r6h h VAL 118 CO -0.41 0.00 0.08 0.00 0.02 0.00 0.00 177.57 177.27 1r6h h ALA 119 N 1.43 0.46 -0.58 1.67 0.00 -0.99 0.02 119.26 121.28 1r6h h ALA 119 Ca 0.22 0.09 0.14 0.00 0.00 0.00 0.00 54.91 55.35 1r6h h ALA 119 Cb 0.33 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1r6h h ALA 119 CO -0.44 -0.32 0.40 -0.07 0.00 0.00 0.00 179.25 178.83 1r6h h LEU 120 N 0.22 0.16 0.07 0.00 3.38 -0.47 0.48 115.31 119.14 1r6h h LEU 120 Ca 0.21 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.18 1r6h h LEU 120 Cb 0.26 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1r6h h LEU 120 CO -0.27 0.09 -0.03 0.00 0.09 0.00 0.00 178.44 178.31 1r6h h ALA 121 N 1.72 -0.09 0.00 1.53 0.00 -0.15 -3.04 119.26 119.22 1r6h h ALA 121 Ca 0.28 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1r6h h ALA 121 Cb 0.87 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1r6h h ALA 121 CO -0.04 -0.24 0.00 -0.11 0.00 0.00 0.00 179.25 178.85 1r6h n LEU 122 N -4.85 0.55 -0.18 0.00 7.94 -0.65 -2.72 117.00 117.09 1r6h n LEU 122 Ca -0.08 0.65 0.05 0.00 -1.11 0.00 0.00 56.01 55.52 1r6h n LEU 122 Cb 0.29 -0.60 0.34 0.00 0.53 0.00 0.00 43.42 43.98 1r6h n LEU 122 CO 0.31 -0.58 1.22 0.40 -1.11 0.00 0.00 177.39 177.63 1r6h h ILE 123 N 0.00 1.06 0.00 1.96 2.04 0.05 -0.59 117.51 122.03 1r6h h ILE 123 Ca 0.00 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.59 1r6h h ILE 123 Cb 0.29 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 1r6h h ILE 123 CO 0.00 0.14 0.00 1.05 0.00 0.00 0.00 178.15 179.34 1r6h h GLU 124 N 0.79 0.00 -0.12 2.37 4.11 -1.64 -2.75 114.58 117.35 1r6h h GLU 124 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.73 1r6h h GLU 124 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1r6h h GLU 124 CO -0.09 0.00 0.00 0.45 0.07 0.00 0.00 179.01 179.44 1r6h n SER 125 N -2.46 0.12 0.00 3.06 2.88 -0.23 -4.96 113.62 112.03 1r6h n SER 125 Ca -0.01 -1.98 0.00 0.00 -1.33 0.00 0.00 58.87 55.56 1r6h n SER 125 Cb 0.10 -0.06 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 1r6h n SER 125 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1r6h n GLY 126 N 0.43 1.63 3.50 0.46 0.00 -1.04 -4.93 105.19 105.24 1r6h n GLY 126 Ca 0.00 -0.80 -0.30 0.00 0.00 0.00 0.00 46.02 44.92 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 0.45 0.05 1.61 -0.00 -1.26 -4.69 117.12 113.27 1r6h n MET 127 Ca 0.00 -1.60 -0.02 0.00 -0.00 0.00 0.00 57.70 56.08 1r6h n MET 127 Cb 0.00 -3.31 -0.01 0.00 -0.00 0.00 0.00 33.22 29.90 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 10.39 -0.13 -0.10 3.17 -0.00 -1.86 -1.44 116.57 126.60 1r6h h LYS 128 Ca 0.17 0.01 -0.10 0.00 -0.00 0.00 0.00 60.65 60.73 1r6h h LYS 128 Cb 0.85 0.03 -0.01 0.00 -0.00 0.00 0.00 32.23 33.10 1r6h h LYS 128 CO 1.50 -0.09 -0.40 -0.92 -0.00 0.00 0.00 179.45 179.55 1r6h h TYR 129 N -0.28 0.25 0.02 0.07 3.20 -1.88 0.74 116.97 119.10 1r6h h TYR 129 Ca -0.01 -0.07 -0.00 0.00 3.14 0.00 0.00 58.73 61.79 1r6h h TYR 129 Cb 0.10 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.32 1r6h h TYR 129 CO 0.07 0.59 -0.01 0.93 -1.64 0.00 0.00 178.16 178.10 1r6h h GLU 130 N 0.18 -0.03 -0.37 1.82 5.08 -1.93 -2.47 114.58 116.87 1r6h h GLU 130 Ca 0.02 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.21 1r6h h GLU 130 Cb 0.78 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.04 1r6h h GLU 130 CO 0.06 0.57 -0.42 0.22 -1.00 0.00 0.00 179.01 178.44 1r6h h ASP 131 N -0.65 1.00 -0.13 1.42 3.58 -1.25 0.93 116.42 121.31 1r6h h ASP 131 Ca -0.00 -0.48 -0.00 0.00 0.42 0.00 0.00 57.03 56.96 1r6h h ASP 131 Cb 0.61 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.37 1r6h h ASP 131 CO 0.00 1.28 0.07 0.00 -2.88 0.00 0.00 179.24 177.71 1r6h h ALA 132 N 0.75 0.17 -0.16 -0.78 0.00 -0.95 1.10 119.26 119.40 1r6h h ALA 132 Ca 0.05 -0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.71 1r6h h ALA 132 Cb 1.02 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.76 1r6h h ALA 132 CO 0.10 -0.29 -0.65 0.82 0.00 0.00 0.00 179.25 179.24 1r6h h ILE 133 N 0.11 1.30 0.00 0.00 1.08 -1.46 -1.64 117.51 116.90 1r6h h ILE 133 Ca 0.05 -1.88 -0.00 0.00 -0.39 0.00 0.00 64.86 62.64 1r6h h ILE 133 Cb 0.09 1.99 0.00 0.00 -3.07 0.00 0.00 36.82 35.83 1r6h h ILE 133 CO -0.01 0.59 -0.00 1.56 -0.69 0.00 0.00 178.15 179.60 1r6h h GLN 134 N 0.42 -0.00 -0.49 2.37 4.20 -0.74 -0.72 115.11 120.15 1r6h h GLN 134 Ca -0.04 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.55 1r6h h GLN 134 Cb 1.28 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.05 1r6h h GLN 134 CO 0.14 0.72 -0.20 0.35 -0.67 0.00 0.00 178.83 179.17 1r6h h PHE 135 N -0.74 1.13 0.00 2.96 3.57 0.11 -2.55 116.94 121.42 1r6h h PHE 135 Ca -0.00 -0.27 -0.13 0.00 3.53 0.00 0.00 57.97 61.10 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 1.09 -0.63 0.97 -2.23 0.00 0.00 178.31 177.70 1r6h h ILE 136 N 0.86 1.31 -0.60 1.41 6.09 -1.31 -3.15 117.51 122.13 1r6h h ILE 136 Ca 0.12 -2.25 -0.06 0.00 -1.37 0.00 0.00 64.86 61.30 1r6h h ILE 136 Cb 0.77 2.26 -0.02 0.00 0.47 0.00 0.00 36.82 40.30 1r6h h ILE 136 CO 0.06 0.61 0.15 -0.09 -3.07 0.00 0.00 178.15 175.82 1r6h h ARG 137 N 0.00 0.96 -0.85 2.19 2.43 -0.90 -2.70 114.38 115.50 1r6h h ARG 137 Ca -0.01 -0.23 0.02 0.00 -0.81 0.00 0.00 59.98 58.95 1r6h h ARG 137 Cb 1.21 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 30.59 1r6h h ARG 137 CO 0.08 0.88 0.56 0.37 -1.51 0.00 0.00 179.97 180.35 1r6h h GLN 138 N 0.87 1.09 -6.70 0.20 -0.00 -1.42 -3.42 115.11 105.72 1r6h h GLN 138 Ca 0.19 -0.07 -0.50 0.00 -0.00 0.00 0.00 58.65 58.27 1r6h h GLN 138 Cb 0.35 -0.25 -0.02 0.00 0.00 0.00 0.00 27.48 27.57 1r6h h GLN 138 CO 0.00 0.72 0.05 0.15 0.00 0.00 0.00 178.83 179.75 1r6h s LYS 139 N -6.12 3.87 -0.22 1.69 3.01 -1.02 -5.01 119.74 115.94 1r6h s LYS 139 Ca -0.13 0.50 -0.29 0.00 -1.01 0.00 0.00 55.97 55.04 1r6h s LYS 139 Cb 0.17 -2.47 -0.02 0.00 -1.01 0.00 0.00 37.83 34.50 1r6h s LYS 139 CO 0.79 0.12 1.41 0.50 0.51 0.00 0.00 175.35 178.69 1r6h s ARG 140 N -3.27 3.99 0.32 1.68 3.00 -1.26 -4.85 118.95 118.55 1r6h s ARG 140 Ca 0.51 1.55 0.09 0.00 -1.00 0.00 0.00 55.73 56.89 1r6h s ARG 140 Cb -0.10 -3.90 -0.05 0.00 0.00 0.00 0.00 34.95 30.89 1r6h s ARG 140 CO 0.23 -1.04 0.01 -0.98 0.00 0.00 0.00 175.30 173.53 1r6h s ARG 141 N 4.12 2.14 0.00 5.12 3.03 -1.26 -4.35 118.95 127.75 1r6h s ARG 141 Ca 0.62 -1.65 0.00 0.00 2.03 0.00 0.00 55.73 56.73 1r6h s ARG 141 Cb -0.22 -2.01 0.00 0.00 -1.03 0.00 0.00 34.95 31.70 1r6h s ARG 141 CO 0.23 0.19 0.00 0.41 -1.13 0.00 0.00 175.30 175.00 1r6h n GLY 142 N -0.95 -3.11 3.43 3.88 0.00 -1.24 -4.78 105.19 102.42 1r6h n GLY 142 Ca -0.05 -1.04 -0.44 0.00 0.00 0.00 0.00 46.02 44.50 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 -2.05 3.21 -0.46 4.61 0.00 -1.26 -4.87 121.76 120.93 1r6h s ALA 143 Ca 0.00 -1.97 -0.23 0.00 0.00 0.00 0.00 51.96 49.76 1r6h s ALA 143 Cb 0.00 -3.76 0.03 0.00 0.00 0.00 0.00 23.12 19.39 1r6h s ALA 143 CO 0.00 -2.64 0.82 0.96 0.00 0.00 0.00 175.76 174.89 1r6h s ILE 144 N 3.63 4.60 0.00 0.00 -4.36 -1.26 -4.91 121.20 118.90 1r6h s ILE 144 Ca 0.19 0.44 0.00 0.00 -0.26 0.00 0.00 60.65 61.01 1r6h s ILE 144 Cb -0.19 -4.36 0.00 0.00 1.25 0.00 0.00 42.46 39.16 1r6h s ILE 144 CO 0.09 -0.78 0.00 0.59 0.24 0.00 0.00 174.94 175.08 1r6h n ASN 145 N 6.85 0.00 -0.08 4.36 5.03 -1.26 -4.81 115.26 125.35 1r6h n ASN 145 Ca 0.03 0.00 -0.08 0.00 0.87 0.00 0.00 54.58 55.40 1r6h n ASN 145 Cb 0.48 -0.06 -0.03 0.00 -1.02 0.00 0.00 39.78 39.16 1r6h n ASN 145 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 1r6h n SER 146 N -1.62 1.72 0.01 6.41 2.88 -1.26 -4.51 113.62 117.25 1r6h n SER 146 Ca 0.00 0.30 -0.13 0.00 -1.33 0.00 0.00 58.87 57.71 1r6h n SER 146 Cb 0.00 -0.72 -0.09 0.00 -0.75 0.00 0.00 64.21 62.66 1r6h n SER 146 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1r6h h LYS 147 N -0.89 0.01 -0.01 -1.46 3.11 -1.96 -0.99 116.57 114.37 1r6h h LYS 147 Ca 0.00 -0.00 0.02 0.00 -2.81 0.00 0.00 60.65 57.86 1r6h h LYS 147 Cb 0.88 -0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 32.08 1r6h h LYS 147 CO 0.00 0.30 -0.14 1.96 -2.81 0.00 0.00 179.45 178.76 1r6h h GLN 148 N -0.27 -0.22 -0.07 1.90 1.08 -1.93 0.63 115.11 116.23 1r6h h GLN 148 Ca 0.00 0.01 -0.07 0.00 -1.45 0.00 0.00 58.65 57.14 1r6h h GLN 148 Cb 0.29 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.77 1r6h h GLN 148 CO 0.00 -0.15 -0.24 -0.07 -0.95 0.00 0.00 178.83 177.42 1r6h h LEU 149 N -0.23 0.33 -0.92 1.46 -0.00 -1.79 -2.80 115.31 111.36 1r6h h LEU 149 Ca 0.05 -0.63 -0.03 0.00 -0.00 0.00 0.00 57.88 57.27 1r6h h LEU 149 Cb 0.30 -0.10 -0.04 0.00 -0.00 0.00 0.00 40.66 40.83 1r6h h LEU 149 CO -0.15 0.90 0.34 0.74 -0.00 0.00 0.00 178.44 180.28 1r6h h THR 150 N -0.23 1.25 0.05 0.22 2.02 -1.13 -1.26 112.91 113.83 1r6h h THR 150 Ca -0.01 -0.73 -0.00 0.00 0.77 0.00 0.00 66.41 66.43 1r6h h THR 150 Cb 0.88 0.29 0.00 0.00 -1.74 0.00 0.00 68.15 67.58 1r6h h THR 150 CO 0.05 0.31 -0.02 0.22 0.37 0.00 0.00 175.52 176.44 1r6h h TYR 151 N 1.11 -0.06 -0.63 3.16 3.20 0.23 -1.76 116.97 122.22 1r6h h TYR 151 Ca 0.26 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.11 1r6h h TYR 151 Cb 0.15 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.41 1r6h h TYR 151 CO 0.02 0.07 0.29 1.25 -1.64 0.00 0.00 178.16 178.15 1r6h h LEU 152 N -0.18 0.80 -1.21 2.82 6.46 -1.35 -0.16 115.31 122.49 1r6h h LEU 152 Ca -0.01 -0.08 0.07 0.00 -0.12 0.00 0.00 57.88 57.74 1r6h h LEU 152 Cb 0.16 -0.21 -0.06 0.00 -0.73 0.00 0.00 40.66 39.83 1r6h h LEU 152 CO 0.01 0.69 0.56 -0.08 -0.62 0.00 0.00 178.44 179.00 1r6h h GLU 153 N 0.89 0.90 0.00 1.25 4.81 -0.93 0.45 114.58 121.95 1r6h h GLU 153 Ca 0.22 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.35 1r6h h GLU 153 Cb 0.11 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.28 1r6h h GLU 153 CO -0.03 0.60 -0.20 -0.22 -0.73 0.00 0.00 179.01 178.43 1r6h h LYS 154 N 0.93 0.00 -0.25 1.92 3.11 -0.27 -2.97 116.57 119.04 1r6h h LYS 154 Ca 0.38 0.00 -0.08 0.00 -2.81 0.00 0.00 60.65 58.14 1r6h h LYS 154 Cb 0.27 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.48 1r6h h LYS 154 CO -0.14 0.20 -0.18 -0.92 -2.81 0.00 0.00 179.45 175.59 1r6h h TYR 155 N 0.00 0.48 -3.57 1.91 5.03 0.16 -3.33 116.97 117.65 1r6h h TYR 155 Ca -0.00 -0.08 -0.74 0.00 2.58 0.00 0.00 58.73 60.48 1r6h h TYR 155 Cb 0.88 -0.13 -0.32 0.00 1.55 0.00 0.00 36.73 38.72 1r6h h TYR 155 CO 0.00 0.61 -0.03 0.50 -1.32 0.00 0.00 178.16 177.92 1r6h s ARG 156 N -4.62 3.32 0.63 1.82 3.00 -0.82 -4.97 118.95 117.29 1r6h s ARG 156 Ca -0.07 -2.84 -0.16 0.00 -1.00 0.00 0.00 55.73 51.66 1r6h s ARG 156 Cb 0.14 -4.12 -0.02 0.00 0.00 0.00 0.00 34.95 30.96 1r6h s ARG 156 CO 0.78 -1.24 1.12 -1.25 0.00 0.00 0.00 175.30 174.71 1r6h s PRO 157 N -0.56 2.94 -0.13 5.12 0.04 -1.25 -4.94 135.00 136.22 1r6h s PRO 157 Ca 0.22 1.49 -0.05 0.00 0.04 0.00 0.00 61.00 62.70 1r6h s PRO 157 Cb -0.12 -1.96 0.06 0.00 0.04 0.00 0.00 34.50 32.52 1r6h s PRO 157 CO -0.08 -1.15 0.27 0.21 0.04 0.00 0.00 177.00 176.28 1r6h s LYS 158 N -3.82 0.18 0.06 4.56 2.20 -1.26 -5.01 119.74 116.65 1r6h s LYS 158 Ca 0.69 0.69 0.17 0.00 -0.36 0.00 0.00 55.97 57.16 1r6h s LYS 158 Cb -0.22 -0.05 0.70 0.00 -1.51 0.00 0.00 37.83 36.75 1r6h s LYS 158 CO 0.37 -0.24 1.52 1.04 -0.36 0.00 0.00 175.35 177.68 1r6h n GLN 159 N 4.97 0.05 0.15 4.03 6.02 -1.26 -2.87 117.38 128.46 1r6h n GLN 159 Ca -0.13 0.30 0.09 0.00 -0.01 0.00 0.00 57.00 57.26 1r6h n GLN 159 Cb 0.51 -1.59 0.60 0.00 1.02 0.00 0.00 30.24 30.78 1r6h n GLN 159 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 1r6h h ARG 160 N 0.00 0.12 0.10 -1.09 2.43 -1.96 0.38 114.38 114.37 1r6h h ARG 160 Ca 0.00 -0.01 -0.26 0.00 -0.81 0.00 0.00 59.98 58.90 1r6h h ARG 160 Cb 0.27 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1r6h h ARG 160 CO 0.00 0.08 -1.35 -0.07 -1.51 0.00 0.00 179.97 177.12 1r6h h LEU 161 N 0.13 0.34 0.00 3.80 4.07 -1.98 -3.43 115.31 118.23 1r6h h LEU 161 Ca 0.08 -0.84 0.00 0.00 0.08 0.00 0.00 57.88 57.21 1r6h h LEU 161 Cb 0.18 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 41.81 1r6h h LEU 161 CO -0.01 1.59 0.00 0.54 -1.08 0.00 0.00 178.44 179.48 1r6h n ARG 162 N -3.98 0.00 -1.25 1.13 5.12 -1.02 -4.96 116.66 111.69 1r6h n ARG 162 Ca -0.25 0.15 -0.30 0.00 -1.93 0.00 0.00 57.85 55.53 1r6h n ARG 162 Cb 0.87 -0.62 0.21 0.00 -1.16 0.00 0.00 32.46 31.76 1r6h n ARG 162 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1r6h s PHE 163 N -0.34 1.23 -0.30 -1.55 0.40 0.13 -5.08 117.98 112.47 1r6h s PHE 163 Ca 0.00 0.63 -0.16 0.00 -0.60 0.00 0.00 56.93 56.80 1r6h s PHE 163 Cb 0.00 -3.48 0.17 0.00 0.51 0.00 0.00 43.02 40.22 1r6h s PHE 163 CO 0.00 -3.34 1.15 0.21 0.70 0.00 0.00 175.22 173.94 1r6h s LYS 164 N -5.35 0.11 -0.26 0.44 2.36 -1.26 -4.28 119.74 111.50 1r6h s LYS 164 Ca 0.69 0.20 -0.29 0.00 -2.55 0.00 0.00 55.97 54.02 1r6h s LYS 164 Cb -0.12 0.11 -0.02 0.00 -1.05 0.00 0.00 37.83 36.75 1r6h s LYS 164 CO 0.56 -0.11 1.69 0.16 1.55 0.00 0.00 175.35 179.20 1r6h s ASP 165 N 2.90 6.19 1.03 1.43 -4.77 -1.26 -4.99 116.67 117.20 1r6h s ASP 165 Ca -0.05 1.51 -0.12 0.00 -3.30 0.00 0.00 52.55 50.58 1r6h s ASP 165 Cb -0.09 -2.53 0.19 0.00 -1.09 0.00 0.00 42.92 39.41 1r6h s ASP 165 CO -0.10 -1.43 0.44 -2.65 0.70 0.00 0.00 175.17 172.13 1r6h n PRO 166 N 7.97 -2.03 0.00 2.11 -0.02 -1.26 -5.00 135.00 136.77 1r6h n PRO 166 Ca 0.20 -0.73 0.00 0.00 -2.02 0.00 0.00 63.50 60.95 1r6h n PRO 166 Cb 0.46 -1.23 0.00 0.00 -0.02 0.00 0.00 33.50 32.70 1r6h n PRO 166 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1r6h n HIS 167 N -4.35 -1.46 0.11 6.00 -0.00 -1.26 -4.92 115.22 109.34 1r6h n HIS 167 Ca 0.07 0.00 0.02 0.00 0.46 0.00 0.00 57.72 58.27 1r6h n HIS 167 Cb 0.30 0.30 0.38 0.00 -0.12 0.00 0.00 29.99 30.85 1r6h n HIS 167 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1r6h h THR 168 N 0.00 1.18 -3.26 3.57 1.03 -2.04 -3.42 112.91 109.96 1r6h h THR 168 Ca 0.00 -0.79 -0.64 0.00 -0.01 0.00 0.00 66.41 64.97 1r6h h THR 168 Cb 0.00 1.21 -0.11 0.00 -1.07 0.00 0.00 68.15 68.18 1r6h h THR 168 CO 0.00 0.25 -0.63 -2.28 -0.01 0.00 0.00 175.52 172.84 1r6h s HIS 169 N -4.72 3.08 0.04 0.00 5.04 -1.26 -5.13 115.29 112.33 1r6h s HIS 169 Ca -0.05 0.02 -0.04 0.00 -1.54 0.00 0.00 55.06 53.44 1r6h s HIS 169 Cb 0.15 -1.57 -0.02 0.00 0.04 0.00 0.00 32.58 31.19 1r6h s HIS 169 CO 0.73 0.50 0.06 0.15 -2.34 0.00 0.00 174.74 173.84 1r6h s LYS 170 N -2.37 0.55 -0.03 2.88 1.02 -1.26 -4.93 119.74 115.60 1r6h s LYS 170 Ca 0.27 -0.80 -0.29 0.00 0.02 0.00 0.00 55.97 55.17 1r6h s LYS 170 Cb -0.12 0.21 0.08 0.00 -0.52 0.00 0.00 37.83 37.48 1r6h s LYS 170 CO 0.20 -0.13 0.73 0.95 -0.92 0.00 0.00 175.35 176.19 1r6h s THR 171 N -2.64 0.00 -2.99 2.17 -4.23 -1.26 -5.20 115.64 101.49 1r6h s THR 171 Ca -0.05 0.00 0.24 0.00 -1.18 0.00 0.00 61.69 60.70 1r6h s THR 171 Cb -0.01 -1.00 0.19 0.00 1.34 0.00 0.00 72.50 73.02 1r6h s THR 171 CO -0.05 0.00 1.26 -2.11 -0.54 0.00 0.00 174.62 173.19