#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 6.16 -0.21 1.61 0.01 -1.26 -5.12 113.70 114.90 1r6h s SER 2 Ca 0.00 -0.01 -0.07 0.00 1.31 0.00 0.00 55.95 57.18 1r6h s SER 2 Cb 0.00 -1.60 0.10 0.00 0.21 0.00 0.00 66.02 64.73 1r6h s SER 2 CO 0.00 -0.25 0.42 -2.28 0.41 0.00 0.00 173.24 171.54 1r6h s HIS 3 N -2.10 -0.83 0.00 2.43 2.46 -1.26 -5.01 115.29 110.99 1r6h s HIS 3 Ca 0.39 1.49 0.00 0.00 0.47 0.00 0.00 55.06 57.41 1r6h s HIS 3 Cb -0.09 0.30 0.00 0.00 -0.13 0.00 0.00 32.58 32.66 1r6h s HIS 3 CO 0.30 -0.51 0.00 -1.33 -2.47 0.00 0.00 174.74 170.73 1r6h n MET 4 N 5.39 0.00 -3.18 2.88 2.81 -1.26 -5.10 117.12 118.66 1r6h n MET 4 Ca -0.08 0.00 0.02 0.00 -1.81 0.00 0.00 57.70 55.83 1r6h n MET 4 Cb 0.49 -0.06 -0.02 0.00 -0.71 0.00 0.00 33.22 32.93 1r6h n MET 4 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1r6h s ALA 5 N -1.69 -2.11 0.35 3.04 0.00 -1.26 -5.15 121.76 114.94 1r6h s ALA 5 Ca 0.00 1.58 -0.28 0.00 0.00 0.00 0.00 51.96 53.26 1r6h s ALA 5 Cb 0.00 -2.16 -0.11 0.00 0.00 0.00 0.00 23.12 20.85 1r6h s ALA 5 CO 0.00 -1.40 1.42 1.03 0.00 0.00 0.00 175.76 176.81 1r6h s ARG 6 N 2.81 4.21 0.00 0.00 0.52 -1.26 -4.84 118.95 120.38 1r6h s ARG 6 Ca 0.18 2.43 0.00 0.00 -0.52 0.00 0.00 55.73 57.82 1r6h s ARG 6 Cb -0.14 -3.02 0.00 0.00 0.52 0.00 0.00 34.95 32.31 1r6h s ARG 6 CO -0.21 -0.41 0.00 -0.12 0.02 0.00 0.00 175.30 174.58 1r6h n MET 7 N 0.77 0.00 -2.11 3.54 1.56 -1.26 -5.14 117.12 114.49 1r6h n MET 7 Ca 0.01 0.00 -0.27 0.00 -0.27 0.00 0.00 57.70 57.17 1r6h n MET 7 Cb 0.40 -0.06 0.11 0.00 2.15 0.00 0.00 33.22 35.83 1r6h n MET 7 CO 0.00 0.00 0.00 -0.80 -0.73 0.00 0.00 175.97 174.44 1r6h s ASN 8 N -2.85 4.16 0.11 6.12 0.01 -1.26 -5.11 114.94 116.11 1r6h s ASN 8 Ca 0.00 0.36 0.03 0.00 -0.71 0.00 0.00 52.86 52.54 1r6h s ASN 8 Cb 0.00 -0.75 -0.04 0.00 0.41 0.00 0.00 41.25 40.87 1r6h s ASN 8 CO 0.00 -2.05 -0.08 -0.13 -1.51 0.00 0.00 177.10 173.33 1r6h s ARG 9 N -5.50 0.87 -0.30 -0.60 0.52 -1.26 -5.09 118.95 107.59 1r6h s ARG 9 Ca 0.66 -1.29 -0.35 0.00 -0.52 0.00 0.00 55.73 54.23 1r6h s ARG 9 Cb -0.08 -0.39 -0.11 0.00 0.52 0.00 0.00 34.95 34.90 1r6h s ARG 9 CO 0.48 0.03 2.13 -2.30 0.02 0.00 0.00 175.30 175.66 1r6h n PRO 10 N 0.15 1.32 -2.69 3.54 -0.02 -1.26 -4.95 135.00 131.09 1r6h n PRO 10 Ca -0.13 0.39 -0.30 0.00 -2.02 0.00 0.00 63.50 61.43 1r6h n PRO 10 Cb 0.60 -2.56 -0.02 0.00 -0.02 0.00 0.00 33.50 31.49 1r6h n PRO 10 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1r6h s ALA 11 N 6.86 3.30 0.82 3.55 0.00 -1.26 -4.78 121.76 130.24 1r6h s ALA 11 Ca 1.06 -0.18 -0.11 0.00 0.00 0.00 0.00 51.96 52.72 1r6h s ALA 11 Cb -0.79 -2.77 0.08 0.00 0.00 0.00 0.00 23.12 19.65 1r6h s ALA 11 CO 0.49 -0.14 1.09 -1.25 0.00 0.00 0.00 175.76 175.95 1r6h s PRO 12 N -4.10 1.88 -0.08 0.00 0.04 -1.26 -4.87 135.00 126.61 1r6h s PRO 12 Ca 0.52 0.97 -0.03 0.00 0.04 0.00 0.00 61.00 62.49 1r6h s PRO 12 Cb -0.10 -1.87 0.04 0.00 0.04 0.00 0.00 34.50 32.61 1r6h s PRO 12 CO 0.35 -1.85 0.17 0.08 0.04 0.00 0.00 177.00 175.79 1r6h s VAL 13 N -2.95 -0.12 -0.26 -0.36 1.01 0.13 -4.96 120.40 112.90 1r6h s VAL 13 Ca 0.62 0.22 -0.05 0.00 0.00 0.00 0.00 61.98 62.78 1r6h s VAL 13 Cb -0.17 -0.29 0.01 0.00 0.00 0.00 0.00 36.38 35.93 1r6h s VAL 13 CO 0.56 0.09 0.01 -1.83 0.00 0.00 0.00 175.10 173.93 1r6h s GLU 14 N 1.53 3.13 -0.25 2.72 -1.05 -1.26 0.14 118.70 123.67 1r6h s GLU 14 Ca -0.06 -0.80 -0.05 0.00 -0.15 0.00 0.00 54.97 53.91 1r6h s GLU 14 Cb -0.12 -3.16 -0.01 0.00 -0.44 0.00 0.00 34.13 30.41 1r6h s GLU 14 CO -0.06 -0.35 0.02 0.08 0.95 0.00 0.00 175.26 175.90 1r6h s VAL 15 N 1.45 3.74 -0.00 1.83 1.01 0.26 -4.92 120.40 123.77 1r6h s VAL 15 Ca 0.03 -0.48 -0.01 0.00 0.00 0.00 0.00 61.98 61.51 1r6h s VAL 15 Cb -0.16 -2.79 -0.00 0.00 0.00 0.00 0.00 36.38 33.43 1r6h s VAL 15 CO -0.01 0.30 0.03 -0.94 0.00 0.00 0.00 175.10 174.48 1r6h s SER 16 N 1.51 0.03 0.11 3.32 1.04 -1.26 -0.35 113.70 118.09 1r6h s SER 16 Ca 0.05 -0.07 0.01 0.00 0.48 0.00 0.00 55.95 56.42 1r6h s SER 16 Cb -0.15 0.08 -0.04 0.00 0.10 0.00 0.00 66.02 66.01 1r6h s SER 16 CO -0.00 -0.09 -0.02 -0.72 0.98 0.00 0.00 173.24 173.39 1r6h s TYR 17 N -0.38 0.88 0.00 5.02 1.13 -1.14 -5.00 117.35 117.85 1r6h s TYR 17 Ca -0.04 -1.04 0.00 0.00 -1.41 0.00 0.00 57.07 54.58 1r6h s TYR 17 Cb -0.03 -0.52 0.00 0.00 -1.10 0.00 0.00 41.96 40.31 1r6h s TYR 17 CO -0.00 -0.29 0.00 0.36 -2.51 0.00 0.00 175.55 173.11 1r6h n LYS 18 N -0.06 0.00 0.00 -3.49 2.85 -1.26 -2.07 118.16 114.12 1r6h n LYS 18 Ca -0.10 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.16 1r6h n LYS 18 Cb 0.62 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 35.00 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 -1.48 5.58 8.25 -1.26 -5.08 115.22 121.23 1r6h n HIS 19 Ca 0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 1r6h n HIS 19 Cb 0.00 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.22 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 -1.69 1.73 0.05 -0.41 0.23 -0.88 -4.78 119.30 113.55 1r6h s MET 20 Ca 0.00 0.60 -0.05 0.00 -1.03 0.00 0.00 55.69 55.21 1r6h s MET 20 Cb 0.00 -1.88 -0.02 0.00 -1.53 0.00 0.00 34.83 31.40 1r6h s MET 20 CO 0.00 -1.86 0.08 1.03 -2.03 0.00 0.00 175.02 172.25 1r6h s ARG 21 N -5.14 0.63 -0.01 3.16 3.00 -1.15 -2.90 118.95 116.55 1r6h s ARG 21 Ca 0.62 -0.88 0.01 0.00 0.00 0.00 0.00 55.73 55.48 1r6h s ARG 21 Cb -0.15 0.24 0.00 0.00 0.00 0.00 0.00 34.95 35.05 1r6h s ARG 21 CO 0.55 -0.16 -0.03 -0.06 0.00 0.00 0.00 175.30 175.60 1r6h s PHE 22 N -3.08 0.31 -0.08 -0.53 0.08 0.52 -3.34 117.98 111.86 1r6h s PHE 22 Ca -0.01 -0.05 0.03 0.00 0.12 0.00 0.00 56.93 57.02 1r6h s PHE 22 Cb 0.02 -0.23 -0.02 0.00 -0.57 0.00 0.00 43.02 42.22 1r6h s PHE 22 CO -0.07 -0.03 -0.16 -0.51 -0.10 0.00 0.00 175.22 174.36 1r6h s LEU 23 N 0.09 2.62 -0.30 -0.37 2.01 0.22 -0.57 118.68 122.38 1r6h s LEU 23 Ca -0.01 -0.30 0.02 0.00 0.01 0.00 0.00 54.13 53.86 1r6h s LEU 23 Cb -0.03 -1.55 0.07 0.00 0.01 0.00 0.00 46.19 44.69 1r6h s LEU 23 CO -0.00 0.26 -0.02 -0.63 1.01 0.00 0.00 176.35 176.97 1r6h s ILE 24 N -0.24 2.48 0.25 -0.59 -1.09 0.38 0.18 121.20 122.57 1r6h s ILE 24 Ca 0.01 -1.80 0.03 0.00 -2.23 0.00 0.00 60.65 56.66 1r6h s ILE 24 Cb -0.13 -2.57 -0.05 0.00 -1.58 0.00 0.00 42.46 38.13 1r6h s ILE 24 CO 0.03 -0.25 0.01 0.42 -1.23 0.00 0.00 174.94 173.92 1r6h s THR 25 N 1.09 1.02 0.44 2.92 -4.23 0.12 0.22 115.64 117.22 1r6h s THR 25 Ca -0.02 -2.03 -0.18 0.00 -1.18 0.00 0.00 61.69 58.29 1r6h s THR 25 Cb -0.20 -2.43 -0.09 0.00 1.34 0.00 0.00 72.50 71.12 1r6h s THR 25 CO -0.05 -0.25 0.92 -1.38 -0.54 0.00 0.00 174.62 173.32 1r6h s HIS 26 N -3.43 3.38 0.72 3.99 -3.43 -1.26 0.25 115.29 115.51 1r6h s HIS 26 Ca 0.30 1.46 -0.15 0.00 -0.80 0.00 0.00 55.06 55.87 1r6h s HIS 26 Cb 0.06 -2.76 0.03 0.00 -1.43 0.00 0.00 32.58 28.49 1r6h s HIS 26 CO 0.10 -0.18 1.21 1.21 -2.00 0.00 0.00 174.74 175.08 1r6h s ASN 27 N -2.59 4.29 0.40 7.38 2.47 -1.26 -4.83 114.94 120.80 1r6h s ASN 27 Ca 0.59 2.36 -0.26 0.00 0.42 0.00 0.00 52.86 55.98 1r6h s ASN 27 Cb -0.10 -2.59 -0.11 0.00 -1.45 0.00 0.00 41.25 37.01 1r6h s ASN 27 CO 0.22 -2.20 1.18 -2.65 -3.72 0.00 0.00 177.10 169.93 1r6h n PRO 28 N -2.61 1.74 -2.95 0.43 -0.02 -1.26 -5.02 135.00 125.31 1r6h n PRO 28 Ca 0.13 0.62 -0.19 0.00 -2.02 0.00 0.00 63.50 62.04 1r6h n PRO 28 Cb 0.50 -2.24 0.04 0.00 -0.02 0.00 0.00 33.50 31.79 1r6h n PRO 28 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1r6h s THR 29 N -1.20 2.53 -0.80 3.45 -4.23 -1.26 -4.97 115.64 109.17 1r6h s THR 29 Ca 0.61 -0.93 0.23 0.00 -1.18 0.00 0.00 61.69 60.41 1r6h s THR 29 Cb -0.54 -2.59 -0.12 0.00 1.34 0.00 0.00 72.50 70.58 1r6h s THR 29 CO 0.58 0.00 1.07 -3.20 -0.54 0.00 0.00 174.62 172.53 1r6h n ASN 30 N -2.15 0.67 -0.05 3.99 2.85 -1.26 -4.33 115.26 114.98 1r6h n ASN 30 Ca 0.12 -0.44 -0.10 0.00 -0.11 0.00 0.00 54.58 54.05 1r6h n ASN 30 Cb 0.60 0.76 -0.15 0.00 1.24 0.00 0.00 39.78 42.24 1r6h n ASN 30 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1r6h n ALA 31 N -1.67 1.46 -3.47 5.20 0.00 -1.26 -4.79 120.51 115.98 1r6h n ALA 31 Ca 0.03 -0.95 -0.29 0.00 0.00 0.00 0.00 53.44 52.24 1r6h n ALA 31 Cb 0.39 -0.61 -0.12 0.00 0.00 0.00 0.00 19.45 19.10 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 0.20 -0.13 0.00 -4.23 -1.26 -4.98 115.64 102.67 1r6h s THR 32 Ca -0.08 -1.76 -0.23 0.00 -1.18 0.00 0.00 61.69 58.44 1r6h s THR 32 Cb 0.07 -1.15 -0.20 0.00 1.34 0.00 0.00 72.50 72.56 1r6h s THR 32 CO 0.82 -0.99 0.59 -0.07 -0.54 0.00 0.00 174.62 174.43 1r6h h LEU 33 N 6.97 0.00 -0.73 4.79 -0.00 -1.87 -3.31 115.31 121.17 1r6h h LEU 33 Ca 0.06 -0.77 0.07 0.00 -0.00 0.00 0.00 57.88 57.24 1r6h h LEU 33 Cb 0.97 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 41.56 1r6h h LEU 33 CO 0.27 0.90 0.40 0.28 -0.00 0.00 0.00 178.44 180.29 1r6h h SER 34 N -1.00 0.58 -0.80 -0.43 0.02 -1.96 -1.86 113.55 108.10 1r6h h SER 34 Ca -0.01 0.04 0.05 0.00 -0.84 0.00 0.00 61.79 61.04 1r6h h SER 34 Cb 0.79 -0.07 -0.05 0.00 0.14 0.00 0.00 62.40 63.21 1r6h h SER 34 CO -0.00 0.35 0.52 0.74 -1.14 0.00 0.00 176.83 177.30 1r6h h THR 35 N 0.71 1.08 -0.06 -2.27 2.02 -1.98 -2.24 112.91 110.17 1r6h h THR 35 Ca 0.34 -0.31 -0.03 0.00 0.77 0.00 0.00 66.41 67.17 1r6h h THR 35 Cb 0.26 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.76 1r6h h THR 35 CO -0.22 0.17 -0.10 0.15 0.37 0.00 0.00 175.52 175.89 1r6h h PHE 36 N 0.91 0.21 -0.99 3.16 3.04 -1.45 -2.69 116.94 119.14 1r6h h PHE 36 Ca 0.33 -0.07 0.09 0.00 3.98 0.00 0.00 57.97 62.30 1r6h h PHE 36 Cb 0.15 -0.04 -0.07 0.00 2.56 0.00 0.00 35.95 38.55 1r6h h PHE 36 CO -0.00 0.69 0.63 -0.84 -2.02 0.00 0.00 178.31 176.77 1r6h h ILE 37 N -0.33 1.00 0.18 1.41 3.07 -1.20 0.42 117.51 122.06 1r6h h ILE 37 Ca 0.00 -0.36 -0.01 0.00 1.55 0.00 0.00 64.86 66.04 1r6h h ILE 37 Cb 0.67 -0.15 0.00 0.00 -0.27 0.00 0.00 36.82 37.08 1r6h h ILE 37 CO 0.02 0.19 -0.08 -0.33 -1.05 0.00 0.00 178.15 176.90 1r6h h GLU 38 N 1.05 -0.23 0.01 0.16 5.08 -1.42 0.56 114.58 119.81 1r6h h GLU 38 Ca 0.46 0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.83 1r6h h GLU 38 Cb 0.35 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1r6h h GLU 38 CO -0.21 -0.04 -0.01 -0.44 -1.00 0.00 0.00 179.01 177.31 1r6h h ASP 39 N -0.38 -0.02 -0.71 1.42 5.19 -1.08 0.92 116.42 121.76 1r6h h ASP 39 Ca -0.02 -0.48 0.07 0.00 -0.62 0.00 0.00 57.03 55.98 1r6h h ASP 39 Cb 0.29 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.75 1r6h h ASP 39 CO 0.04 0.47 0.39 -0.07 -3.12 0.00 0.00 179.24 176.95 1r6h h LEU 40 N -0.51 0.57 -0.16 1.55 3.38 -0.24 -0.49 115.31 119.41 1r6h h LEU 40 Ca -0.00 0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.87 1r6h h LEU 40 Cb 0.49 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1r6h h LEU 40 CO 0.00 0.36 -0.64 0.50 0.09 0.00 0.00 178.44 178.75 1r6h h LYS 41 N 0.70 0.00 -0.76 1.13 3.64 -0.89 -3.28 116.57 117.11 1r6h h LYS 41 Ca 0.32 0.00 0.12 0.00 -1.27 0.00 0.00 60.65 59.83 1r6h h LYS 41 Cb 0.23 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 31.97 1r6h h LYS 41 CO -0.20 0.64 0.35 0.87 -2.27 0.00 0.00 179.45 178.84 1r6h h LYS 42 N 0.00 0.54 -0.68 1.90 1.57 0.26 -0.55 116.57 119.60 1r6h h LYS 42 Ca -0.01 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 1r6h h LYS 42 Cb 1.42 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 33.58 1r6h h LYS 42 CO 0.08 0.35 0.24 -0.92 -0.57 0.00 0.00 179.45 178.63 1r6h h TYR 43 N 0.55 1.04 0.00 -1.35 5.03 -1.53 -3.48 116.97 117.23 1r6h h TYR 43 Ca 0.40 -0.08 0.00 0.00 2.58 0.00 0.00 58.73 61.62 1r6h h TYR 43 Cb 0.52 -0.31 0.00 0.00 1.55 0.00 0.00 36.73 38.49 1r6h h TYR 43 CO -0.12 0.82 0.00 0.41 -1.32 0.00 0.00 178.16 177.94 1r6h n GLY 44 N -0.89 -2.46 2.87 1.82 0.00 -0.21 -4.97 105.19 101.34 1r6h n GLY 44 Ca 0.06 -1.25 -0.27 0.00 0.00 0.00 0.00 46.02 44.56 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 -1.99 1.30 0.00 4.61 0.00 -1.26 -4.40 121.76 120.02 1r6h s ALA 45 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.32 1r6h s ALA 45 Cb 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 23.12 22.11 1r6h s ALA 45 CO 0.00 -0.65 0.00 2.41 0.00 0.00 0.00 175.76 177.52 1r6h n THR 46 N 4.95 0.00 -1.54 0.00 -1.04 0.15 -4.32 114.28 112.48 1r6h n THR 46 Ca -0.11 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.56 1r6h n THR 46 Cb 0.49 0.00 0.08 0.00 -1.82 0.00 0.00 70.33 69.08 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 -2.73 2.51 -0.01 12.58 -1.32 -1.25 -4.09 115.64 121.33 1r6h s THR 47 Ca 0.00 0.25 0.02 0.00 -1.21 0.00 0.00 61.69 60.75 1r6h s THR 47 Cb 0.00 -2.82 0.00 0.00 -1.51 0.00 0.00 72.50 68.17 1r6h s THR 47 CO 0.00 -0.13 -0.07 -0.69 -2.21 0.00 0.00 174.62 171.52 1r6h s VAL 48 N -2.02 0.58 -0.34 5.08 1.01 0.92 -2.72 120.40 122.91 1r6h s VAL 48 Ca 0.73 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 62.43 1r6h s VAL 48 Cb -0.28 -0.52 0.08 0.00 0.00 0.00 0.00 36.38 35.67 1r6h s VAL 48 CO 0.44 0.18 0.06 0.54 0.00 0.00 0.00 175.10 176.32 1r6h s VAL 49 N 0.08 2.89 -0.30 2.92 0.11 0.55 0.28 120.40 126.93 1r6h s VAL 49 Ca -0.01 -1.78 -0.03 0.00 -2.93 0.00 0.00 61.98 57.24 1r6h s VAL 49 Cb -0.06 -2.84 0.04 0.00 -1.53 0.00 0.00 36.38 31.99 1r6h s VAL 49 CO -0.00 -0.37 0.01 0.00 -3.33 0.00 0.00 175.10 171.42 1r6h s ARG 50 N 1.15 2.56 -0.66 1.54 1.04 -1.09 -1.78 118.95 121.71 1r6h s ARG 50 Ca 0.01 -1.19 -0.07 0.00 -1.04 0.00 0.00 55.73 53.45 1r6h s ARG 50 Cb -0.21 -3.21 0.17 0.00 -2.04 0.00 0.00 34.95 29.67 1r6h s ARG 50 CO -0.04 -0.58 0.52 0.08 -0.04 0.00 0.00 175.30 175.24 1r6h s VAL 51 N 1.30 4.35 0.28 4.99 1.01 -1.26 -1.66 120.40 129.41 1r6h s VAL 51 Ca -0.04 -2.61 -0.18 0.00 0.00 0.00 0.00 61.98 59.16 1r6h s VAL 51 Cb -0.19 -3.78 0.02 0.00 0.00 0.00 0.00 36.38 32.42 1r6h s VAL 51 CO -0.01 -0.90 0.65 0.00 0.00 0.00 0.00 175.10 174.84 1r6h s GLU 53 N -3.76 4.22 -0.04 0.00 0.41 -1.26 -3.55 118.70 114.72 1r6h s GLU 53 Ca 0.15 2.34 -0.30 0.00 -0.41 0.00 0.00 54.97 56.76 1r6h s GLU 53 Cb -0.04 -3.16 -0.05 0.00 -1.78 0.00 0.00 34.13 29.10 1r6h s GLU 53 CO 0.08 -0.59 1.53 0.14 -0.49 0.00 0.00 175.26 175.93 1r6h s VAL 54 N 1.09 3.66 0.00 2.63 -7.23 -1.26 -4.85 120.40 114.44 1r6h s VAL 54 Ca 0.69 0.91 0.00 0.00 -1.81 0.00 0.00 61.98 61.77 1r6h s VAL 54 Cb -0.43 -3.58 0.00 0.00 0.56 0.00 0.00 36.38 32.92 1r6h s VAL 54 CO 0.32 -0.05 0.00 0.35 -0.31 0.00 0.00 175.10 175.40 1r6h n THR 55 N 5.17 0.00 -3.65 5.32 -2.24 -1.26 -4.94 114.28 112.67 1r6h n THR 55 Ca 0.16 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.65 1r6h n THR 55 Cb 0.43 -1.24 -0.12 0.00 -2.10 0.00 0.00 70.33 67.30 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 -1.99 2.07 0.09 4.78 2.02 -1.26 -4.96 117.35 118.09 1r6h s TYR 56 Ca 0.00 -2.60 -0.06 0.00 -0.37 0.00 0.00 57.07 54.04 1r6h s TYR 56 Cb 0.00 -1.76 -0.23 0.00 -0.40 0.00 0.00 41.96 39.57 1r6h s TYR 56 CO 0.00 -0.74 1.18 0.38 -1.57 0.00 0.00 175.55 174.80 1r6h h ASP 57 N 6.06 0.52 0.03 2.29 2.03 -1.99 -3.36 116.42 122.00 1r6h h ASP 57 Ca 0.12 -0.51 -0.05 0.00 -0.73 0.00 0.00 57.03 55.87 1r6h h ASP 57 Cb 0.88 -0.17 0.01 0.00 -0.83 0.00 0.00 39.33 39.22 1r6h h ASP 57 CO 0.50 1.36 -0.20 0.11 -1.03 0.00 0.00 179.24 179.98 1r6h h LYS 58 N 0.14 0.09 -0.75 4.15 1.57 -2.01 -3.35 116.57 116.40 1r6h h LYS 58 Ca -0.13 -0.13 0.15 0.00 -1.87 0.00 0.00 60.65 58.66 1r6h h LYS 58 Cb 1.86 0.05 -0.14 0.00 0.08 0.00 0.00 32.23 34.07 1r6h h LYS 58 CO 0.20 1.02 -0.23 1.15 -0.57 0.00 0.00 179.45 181.02 1r6h h THR 59 N -0.77 0.21 -0.97 -0.16 2.02 -1.98 -1.16 112.91 110.09 1r6h h THR 59 Ca -0.03 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.17 1r6h h THR 59 Cb 1.11 0.21 -0.05 0.00 -1.74 0.00 0.00 68.15 67.67 1r6h h THR 59 CO 0.04 0.00 0.64 -0.65 0.37 0.00 0.00 175.52 175.92 1r6h h PRO 60 N -0.03 1.23 -0.15 6.66 0.11 -1.73 -0.57 132.00 137.52 1r6h h PRO 60 Ca 0.35 -0.07 -0.09 0.00 0.11 0.00 0.00 66.00 66.29 1r6h h PRO 60 Cb 0.56 -0.28 -0.00 0.00 0.11 0.00 0.00 31.00 31.40 1r6h h PRO 60 CO -0.79 0.82 -0.26 1.25 -0.21 0.00 0.00 178.00 178.81 1r6h h LEU 61 N 1.27 0.50 -0.00 2.35 7.12 -1.38 -2.74 115.31 122.42 1r6h h LEU 61 Ca 0.37 -0.54 -0.02 0.00 0.13 0.00 0.00 57.88 57.83 1r6h h LEU 61 Cb -0.07 -0.14 0.00 0.00 -0.53 0.00 0.00 40.66 39.92 1r6h h LEU 61 CO -0.10 0.94 -0.07 -0.33 -0.13 0.00 0.00 178.44 178.75 1r6h h GLU 62 N 0.07 0.05 -0.39 1.25 5.08 -1.26 0.28 114.58 119.66 1r6h h GLU 62 Ca 0.01 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 1r6h h GLU 62 Cb 0.84 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 1r6h h GLU 62 CO 0.06 0.80 -0.02 0.87 -1.00 0.00 0.00 179.01 179.72 1r6h h LYS 63 N -0.68 0.63 0.00 2.33 6.56 -1.25 -3.08 116.57 121.09 1r6h h LYS 63 Ca -0.01 -0.16 0.00 0.00 -1.06 0.00 0.00 60.65 59.43 1r6h h LYS 63 Cb 0.82 -0.08 0.00 0.00 -0.57 0.00 0.00 32.23 32.40 1r6h h LYS 63 CO 0.01 0.67 -1.08 -0.25 -2.06 0.00 0.00 179.45 176.73 1r6h n ASP 64 N -4.24 0.85 -1.87 0.86 8.00 -1.03 -4.97 116.55 114.15 1r6h n ASP 64 Ca 0.02 -0.83 -0.12 0.00 0.71 0.00 0.00 54.79 54.57 1r6h n ASP 64 Cb 0.28 1.14 -0.03 0.00 -0.02 0.00 0.00 41.12 42.49 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 0.34 3.63 0.44 0.00 0.97 -4.93 105.19 107.08 1r6h n GLY 65 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.27 3.70 0.14 -0.61 -4.36 -1.23 -5.03 121.20 111.54 1r6h s ILE 66 Ca 0.00 -1.05 -0.30 0.00 -0.26 0.00 0.00 60.65 59.04 1r6h s ILE 66 Cb 0.00 -2.72 -0.07 0.00 1.25 0.00 0.00 42.46 40.93 1r6h s ILE 66 CO 0.00 0.17 1.03 0.28 0.24 0.00 0.00 174.94 176.67 1r6h s THR 67 N -1.21 4.18 0.02 8.37 -1.32 -1.26 -4.58 115.64 119.84 1r6h s THR 67 Ca 0.22 1.84 -0.08 0.00 -1.21 0.00 0.00 61.69 62.46 1r6h s THR 67 Cb -0.11 -4.17 0.00 0.00 -1.51 0.00 0.00 72.50 66.70 1r6h s THR 67 CO 0.14 0.29 0.15 0.54 -2.21 0.00 0.00 174.62 173.54 1r6h s VAL 68 N -0.09 0.10 -0.16 5.08 0.11 -1.26 -0.06 120.40 124.12 1r6h s VAL 68 Ca 0.48 -0.80 -0.06 0.00 -2.93 0.00 0.00 61.98 58.67 1r6h s VAL 68 Cb -0.26 -0.63 -0.04 0.00 -1.53 0.00 0.00 36.38 33.91 1r6h s VAL 68 CO 0.32 -0.44 0.07 -0.69 -3.33 0.00 0.00 175.10 171.03 1r6h s VAL 69 N -1.87 4.85 -0.45 2.04 1.01 0.14 -4.90 120.40 121.24 1r6h s VAL 69 Ca -0.11 -0.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.71 1r6h s VAL 69 Cb -0.05 -3.15 0.06 0.00 0.00 0.00 0.00 36.38 33.24 1r6h s VAL 69 CO -0.01 0.51 0.35 -1.81 0.00 0.00 0.00 175.10 174.14 1r6h s ASP 70 N -0.08 6.06 -0.41 3.32 1.11 -1.26 -2.66 116.67 122.75 1r6h s ASP 70 Ca 0.07 -1.22 -0.06 0.00 0.18 0.00 0.00 52.55 51.52 1r6h s ASP 70 Cb -0.12 -2.15 0.09 0.00 1.07 0.00 0.00 42.92 41.81 1r6h s ASP 70 CO 0.01 -0.57 0.22 0.26 1.18 0.00 0.00 175.17 176.26 1r6h s TRP 71 N 1.62 3.43 0.46 4.23 0.52 -0.67 -5.04 118.94 123.50 1r6h s TRP 71 Ca 0.04 -1.93 0.04 0.00 0.02 0.00 0.00 56.10 54.27 1r6h s TRP 71 Cb -0.23 -3.01 0.04 0.00 -1.15 0.00 0.00 33.47 29.13 1r6h s TRP 71 CO 0.07 -0.90 0.35 -0.35 0.02 0.00 0.00 176.95 176.14 1r6h n PRO 72 N 4.76 0.80 -3.84 4.98 -0.04 -1.23 0.34 135.00 140.77 1r6h n PRO 72 Ca -0.07 -2.90 -0.30 0.00 -0.04 0.00 0.00 63.50 60.19 1r6h n PRO 72 Cb 0.42 0.30 -0.14 0.00 -0.04 0.00 0.00 33.50 34.04 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 -2.30 2.54 0.55 0.54 5.36 -1.26 -4.92 117.98 118.49 1r6h s PHE 73 Ca 0.27 -2.47 0.08 0.00 -0.96 0.00 0.00 56.93 53.85 1r6h s PHE 73 Cb -0.02 -2.24 0.06 0.00 -0.34 0.00 0.00 43.02 40.47 1r6h s PHE 73 CO 0.17 -0.85 0.61 -0.51 -1.46 0.00 0.00 175.22 173.17 1r6h s ASP 74 N 0.82 4.93 0.59 6.13 1.11 -1.26 -4.98 116.67 124.02 1r6h s ASP 74 Ca 0.13 -0.99 0.29 0.00 0.18 0.00 0.00 52.55 52.16 1r6h s ASP 74 Cb -0.21 0.26 1.62 0.00 1.07 0.00 0.00 42.92 45.66 1r6h s ASP 74 CO -0.10 -1.19 2.03 -0.78 1.18 0.00 0.00 175.17 176.31 1r6h h ASP 75 N 0.47 0.00 -2.28 0.27 3.58 -2.09 -3.07 116.42 113.30 1r6h h ASP 75 Ca -0.34 0.00 -0.59 0.00 0.42 0.00 0.00 57.03 56.52 1r6h h ASP 75 Cb 1.29 0.00 -0.41 0.00 1.72 0.00 0.00 39.33 41.93 1r6h h ASP 75 CO 0.48 0.00 -0.74 0.61 -2.88 0.00 0.00 179.24 176.72 1r6h n GLY 76 N -1.42 4.08 3.35 -0.78 0.00 -1.26 -5.05 105.19 104.12 1r6h n GLY 76 Ca 0.03 -2.37 -0.45 0.00 0.00 0.00 0.00 46.02 43.23 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 -1.88 3.60 -0.96 4.61 0.00 -1.16 -5.00 121.76 120.96 1r6h s ALA 77 Ca 0.36 -2.30 -0.27 0.00 0.00 0.00 0.00 51.96 49.75 1r6h s ALA 77 Cb 0.12 -3.16 -0.23 0.00 0.00 0.00 0.00 23.12 19.85 1r6h s ALA 77 CO -0.07 -1.86 2.60 -2.30 0.00 0.00 0.00 175.76 174.13 1r6h n PRO 78 N 5.23 0.08 -0.29 0.00 -0.02 -1.26 -4.81 135.00 133.92 1r6h n PRO 78 Ca -0.13 -0.01 0.03 0.00 -2.02 0.00 0.00 63.50 61.37 1r6h n PRO 78 Cb 0.42 -1.58 0.17 0.00 -0.02 0.00 0.00 33.50 32.49 1r6h n PRO 78 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1r6h h PRO 79 N 12.37 0.76 -6.39 0.52 0.11 -2.02 -3.43 132.00 133.93 1r6h h PRO 79 Ca -0.05 -0.05 -0.60 0.00 0.11 0.00 0.00 66.00 65.41 1r6h h PRO 79 Cb 1.28 -0.17 0.14 0.00 0.11 0.00 0.00 31.00 32.36 1r6h h PRO 79 CO 1.40 0.51 -0.28 -0.35 -0.21 0.00 0.00 178.00 179.07 1r6h n PRO 80 N -4.75 0.72 0.33 1.05 -0.04 -1.26 -4.82 135.00 126.23 1r6h n PRO 80 Ca 0.14 0.26 0.19 0.00 -0.04 0.00 0.00 63.50 64.05 1r6h n PRO 80 Cb 0.29 -1.60 1.03 0.00 -0.04 0.00 0.00 33.50 33.17 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 0.97 0.00 0.18 0.55 0.00 -2.02 -2.70 103.07 100.05 1r6h h GLY 81 Ca -0.41 0.00 0.26 0.00 0.00 0.00 0.00 47.33 47.19 1r6h h GLY 81 CO 0.53 0.00 0.66 1.70 0.00 0.00 0.00 176.54 179.43 1r6h h LYS 82 N 0.00 0.00 -0.31 4.80 3.11 -1.91 0.41 116.57 122.67 1r6h h LYS 82 Ca 0.00 0.00 0.04 0.00 -2.81 0.00 0.00 60.65 57.88 1r6h h LYS 82 Cb 0.26 0.00 -0.04 0.00 -1.00 0.00 0.00 32.23 31.45 1r6h h LYS 82 CO 0.00 0.00 0.06 0.28 -2.81 0.00 0.00 179.45 176.98 1r6h h VAL 83 N 0.00 0.85 -0.94 2.00 2.07 -1.75 0.11 116.25 118.59 1r6h h VAL 83 Ca 0.43 -0.06 0.12 0.00 0.82 0.00 0.00 66.70 68.01 1r6h h VAL 83 Cb 1.74 0.66 -0.08 0.00 -1.52 0.00 0.00 31.29 32.09 1r6h h VAL 83 CO -0.00 0.03 0.56 0.58 0.02 0.00 0.00 177.57 178.76 1r6h h VAL 84 N 0.17 0.88 -0.33 2.57 2.07 -0.43 0.73 116.25 121.91 1r6h h VAL 84 Ca 0.14 -0.30 0.06 0.00 0.82 0.00 0.00 66.70 67.43 1r6h h VAL 84 Cb 0.16 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.83 1r6h h VAL 84 CO -0.19 0.16 0.23 -0.33 0.02 0.00 0.00 177.57 177.46 1r6h h GLU 85 N 0.88 0.17 0.03 1.57 5.08 -0.48 0.17 114.58 122.00 1r6h h GLU 85 Ca 0.47 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.82 1r6h h GLU 85 Cb 0.51 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1r6h h GLU 85 CO -0.28 0.11 -0.01 0.22 -1.00 0.00 0.00 179.01 178.05 1r6h h ASP 86 N 0.18 -0.03 0.01 1.42 1.82 0.18 -1.49 116.42 118.50 1r6h h ASP 86 Ca 0.15 -0.17 -0.07 0.00 -0.39 0.00 0.00 57.03 56.55 1r6h h ASP 86 Cb 0.37 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.37 1r6h h ASP 86 CO -0.02 0.15 -0.20 -0.25 -1.61 0.00 0.00 179.24 177.30 1r6h h TRP 87 N -0.21 0.38 -0.38 0.28 2.91 -0.96 -2.56 115.95 115.40 1r6h h TRP 87 Ca -0.00 -0.06 0.05 0.00 1.13 0.00 0.00 58.89 60.00 1r6h h TRP 87 Cb 0.20 -0.10 -0.05 0.00 -0.51 0.00 0.00 29.16 28.70 1r6h h TRP 87 CO -0.02 0.54 0.11 -0.07 -1.03 0.00 0.00 178.44 177.97 1r6h h LEU 88 N 0.32 0.08 -0.83 0.65 3.38 -0.29 0.21 115.31 118.83 1r6h h LEU 88 Ca 0.05 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 1r6h h LEU 88 Cb 0.54 0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.31 1r6h h LEU 88 CO 0.04 0.08 0.34 -1.28 0.09 0.00 0.00 178.44 177.71 1r6h h SER 89 N 0.25 1.10 0.11 -0.43 0.87 -0.99 0.31 113.55 114.77 1r6h h SER 89 Ca 0.18 -0.16 -0.01 0.00 -1.23 0.00 0.00 61.79 60.57 1r6h h SER 89 Cb 0.19 -0.29 0.00 0.00 -0.44 0.00 0.00 62.40 61.86 1r6h h SER 89 CO -0.21 0.96 -0.05 0.25 -0.53 0.00 0.00 176.83 177.25 1r6h h LEU 90 N 1.17 -0.13 -0.34 2.23 7.12 -0.88 -2.13 115.31 122.36 1r6h h LEU 90 Ca 0.27 -0.06 -0.11 0.00 0.13 0.00 0.00 57.88 58.11 1r6h h LEU 90 Cb 0.19 0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 40.35 1r6h h LEU 90 CO -0.03 -0.02 -0.21 1.62 -0.13 0.00 0.00 178.44 179.68 1r6h h VAL 91 N -0.23 1.29 -0.49 1.05 3.04 -0.46 -2.51 116.25 117.94 1r6h h VAL 91 Ca -0.02 -1.35 0.08 0.00 -1.01 0.00 0.00 66.70 64.41 1r6h h VAL 91 Cb 0.18 1.42 -0.07 0.00 -2.01 0.00 0.00 31.29 30.82 1r6h h VAL 91 CO 0.02 0.44 0.11 0.50 -1.01 0.00 0.00 177.57 177.63 1r6h h LYS 92 N 0.52 0.24 -0.14 4.17 3.11 -0.34 0.86 116.57 124.99 1r6h h LYS 92 Ca 0.07 -0.01 -0.01 0.00 -2.81 0.00 0.00 60.65 57.88 1r6h h LYS 92 Cb 0.76 -0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.93 1r6h h LYS 92 CO 0.06 0.16 0.03 0.00 -2.81 0.00 0.00 179.45 176.89 1r6h h ALA 93 N 1.37 0.18 0.00 5.00 0.00 -1.38 0.16 119.26 124.60 1r6h h ALA 93 Ca 0.24 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1r6h h ALA 93 Cb 0.32 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1r6h h ALA 93 CO -0.31 -0.18 -0.20 0.87 0.00 0.00 0.00 179.25 179.43 1r6h h LYS 94 N 0.02 0.00 0.01 0.00 1.79 -0.96 -2.12 116.57 115.31 1r6h h LYS 94 Ca 0.04 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.51 1r6h h LYS 94 Cb 0.26 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1r6h h LYS 94 CO 0.00 0.20 -0.00 0.74 -1.08 0.00 0.00 179.45 179.31 1r6h h PHE 95 N 0.00 -0.01 -0.57 -1.35 -1.00 0.11 -2.71 116.94 111.41 1r6h h PHE 95 Ca -0.00 -0.00 0.08 0.00 2.81 0.00 0.00 57.97 60.86 1r6h h PHE 95 Cb 0.46 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.99 1r6h h PHE 95 CO 0.00 0.77 0.38 0.00 -1.61 0.00 0.00 178.31 177.85 1r6h h GLU 97 N 0.43 0.22 -2.97 0.00 4.81 -1.48 -3.39 114.58 112.20 1r6h h GLU 97 Ca 0.26 -0.24 -0.61 0.00 -0.13 0.00 0.00 59.36 58.64 1r6h h GLU 97 Cb 0.45 0.07 -0.41 0.00 0.63 0.00 0.00 28.75 29.50 1r6h h GLU 97 CO -0.07 0.96 -0.70 0.00 -0.73 0.00 0.00 179.01 178.48 1r6h s ALA 98 N -3.22 2.87 0.17 2.92 0.00 -0.36 -5.10 121.76 119.04 1r6h s ALA 98 Ca -0.03 -3.18 -0.32 0.00 0.00 0.00 0.00 51.96 48.43 1r6h s ALA 98 Cb 0.10 -1.99 -0.12 0.00 0.00 0.00 0.00 23.12 21.12 1r6h s ALA 98 CO 0.83 -2.05 1.76 -2.30 0.00 0.00 0.00 175.76 174.00 1r6h n PRO 99 N 2.69 2.75 -3.41 0.00 -0.02 -1.07 -3.07 135.00 132.87 1r6h n PRO 99 Ca 0.17 0.99 -0.21 0.00 -2.02 0.00 0.00 63.50 62.43 1r6h n PRO 99 Cb 0.37 -2.86 0.06 0.00 -0.02 0.00 0.00 33.50 31.05 1r6h n PRO 99 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r6h n GLY 100 N 4.04 -1.09 0.51 -1.23 0.00 -1.26 -4.95 105.19 101.20 1r6h n GLY 100 Ca 0.17 0.53 -0.03 0.00 0.00 0.00 0.00 46.02 46.70 1r6h n GLY 100 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1r6h n SER 101 N -3.03 0.38 -4.38 1.61 3.41 -1.17 -4.63 113.62 105.80 1r6h n SER 101 Ca -0.08 -1.20 -0.38 0.00 -0.26 0.00 0.00 58.87 56.94 1r6h n SER 101 Cb 0.61 -0.05 -0.12 0.00 -0.26 0.00 0.00 64.21 64.39 1r6h n SER 101 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1r6h s VAL 103 N 1.54 3.63 0.02 0.00 1.01 -1.21 -0.67 120.40 124.72 1r6h s VAL 103 Ca 0.03 -1.22 0.08 0.00 0.00 0.00 0.00 61.98 60.87 1r6h s VAL 103 Cb -0.18 -2.74 -0.02 0.00 0.00 0.00 0.00 36.38 33.44 1r6h s VAL 103 CO 0.05 0.07 -0.23 0.00 0.00 0.00 0.00 175.10 174.99 1r6h s ALA 104 N -1.34 1.95 0.16 5.51 0.00 -1.10 0.71 121.76 127.64 1r6h s ALA 104 Ca 0.24 -1.08 -0.01 0.00 0.00 0.00 0.00 51.96 51.11 1r6h s ALA 104 Cb -0.11 -0.44 -0.04 0.00 0.00 0.00 0.00 23.12 22.53 1r6h s ALA 104 CO 0.16 0.46 0.09 0.08 0.00 0.00 0.00 175.76 176.55 1r6h s VAL 105 N -0.68 0.06 0.71 0.00 1.01 0.48 -0.33 120.40 121.65 1r6h s VAL 105 Ca 0.09 -1.94 -0.14 0.00 0.00 0.00 0.00 61.98 59.99 1r6h s VAL 105 Cb -0.09 -2.21 0.03 0.00 0.00 0.00 0.00 36.38 34.10 1r6h s VAL 105 CO 0.01 -0.29 1.14 -2.28 0.00 0.00 0.00 175.10 173.67 1r6h s HIS 106 N -4.09 2.40 -0.46 5.22 5.65 -0.73 0.15 115.29 123.43 1r6h s HIS 106 Ca 0.30 1.58 -0.27 0.00 0.25 0.00 0.00 55.06 56.91 1r6h s HIS 106 Cb 0.07 -3.25 -0.02 0.00 -1.18 0.00 0.00 32.58 28.20 1r6h s HIS 106 CO 0.06 -2.02 1.83 0.00 -0.65 0.00 0.00 174.74 173.96 1r6h n VAL 108 N 7.33 0.00 0.04 0.00 0.24 -1.26 -3.73 118.33 120.95 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 -0.62 0.02 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 -1.00 1.10 -3.00 2.33 0.00 -1.25 -3.85 120.51 114.84 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 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.52 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 -1.35 3.92 3.22 0.00 0.00 -1.24 -5.00 105.19 104.75 1r6h n GLY 110 Ca 0.00 -0.78 -0.32 0.00 0.00 0.00 0.00 46.02 44.92 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 2.22 0.00 0.99 1.43 -1.26 -3.65 118.68 118.41 1r6h s LEU 111 Ca 0.00 -0.54 0.00 0.00 -1.03 0.00 0.00 54.13 52.56 1r6h s LEU 111 Cb 0.00 -1.47 0.00 0.00 0.03 0.00 0.00 46.19 44.75 1r6h s LEU 111 CO 0.00 0.12 0.00 0.61 0.23 0.00 0.00 176.35 177.31 1r6h n GLY 112 N 3.81 2.83 0.00 -3.19 0.00 -1.26 -4.94 105.19 102.43 1r6h n GLY 112 Ca -0.19 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 0.75 -0.22 1.61 3.00 -1.26 -4.58 116.66 115.96 1r6h n ARG 113 Ca 0.00 0.00 0.03 0.00 -0.01 0.00 0.00 57.85 57.87 1r6h n ARG 113 Cb 0.00 -0.94 0.14 0.00 0.00 0.00 0.00 32.46 31.66 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 0.82 -0.49 7.54 0.00 -1.92 -2.65 119.26 122.56 1r6h h ALA 114 Ca 0.00 0.14 0.09 0.00 0.00 0.00 0.00 54.91 55.15 1r6h h ALA 114 Cb 0.02 0.19 -0.08 0.00 0.00 0.00 0.00 17.79 17.92 1r6h h ALA 114 CO 0.00 -0.31 0.01 -1.00 0.00 0.00 0.00 179.25 177.95 1r6h h PRO 115 N 0.27 0.12 -0.95 0.00 0.13 -1.89 0.33 132.00 130.02 1r6h h PRO 115 Ca 0.36 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.47 1r6h h PRO 115 Cb 0.56 -0.03 -0.05 0.00 0.13 0.00 0.00 31.00 31.62 1r6h h PRO 115 CO -0.44 0.08 0.57 0.28 -0.23 0.00 0.00 178.00 178.25 1r6h h VAL 116 N 0.12 1.26 0.47 1.56 2.07 -1.83 -2.64 116.25 117.27 1r6h h VAL 116 Ca 0.25 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 1r6h h VAL 116 Cb 0.37 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.07 1r6h h VAL 116 CO -0.40 0.28 -0.25 -0.07 0.02 0.00 0.00 177.57 177.14 1r6h h LEU 117 N 1.31 -0.60 -0.08 2.57 3.38 -0.89 -2.42 115.31 118.58 1r6h h LEU 117 Ca 0.34 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.38 1r6h h LEU 117 Cb -0.05 0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 1r6h h LEU 117 CO -0.06 -0.41 -0.32 0.58 0.09 0.00 0.00 178.44 178.31 1r6h h VAL 118 N -0.67 0.29 -0.15 1.22 2.07 -0.82 -1.29 116.25 116.90 1r6h h VAL 118 Ca -0.06 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.51 1r6h h VAL 118 Cb 0.53 0.29 -0.06 0.00 -1.52 0.00 0.00 31.29 30.53 1r6h h VAL 118 CO 0.09 0.00 -0.23 0.00 0.02 0.00 0.00 177.57 177.45 1r6h h ALA 119 N 0.35 -0.19 -0.52 1.67 0.00 -1.48 0.34 119.26 119.44 1r6h h ALA 119 Ca 0.08 0.05 0.15 0.00 0.00 0.00 0.00 54.91 55.18 1r6h h ALA 119 Cb 0.55 0.45 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1r6h h ALA 119 CO -0.32 -0.68 0.37 -0.07 0.00 0.00 0.00 179.25 178.55 1r6h h LEU 120 N -0.28 0.02 -0.05 0.00 4.07 -1.13 -0.68 115.31 117.25 1r6h h LEU 120 Ca 0.11 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 58.02 1r6h h LEU 120 Cb 0.44 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.18 1r6h h LEU 120 CO -0.31 0.01 -0.15 0.00 -1.08 0.00 0.00 178.44 176.91 1r6h h ALA 121 N 1.74 0.09 0.00 1.53 0.00 0.19 -2.95 119.26 119.86 1r6h h ALA 121 Ca 0.25 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1r6h h ALA 121 Cb 0.96 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1r6h h ALA 121 CO -0.01 0.01 0.00 -0.11 0.00 0.00 0.00 179.25 179.14 1r6h n LEU 122 N -4.61 0.40 -0.19 0.00 7.94 -0.34 -2.60 117.00 117.61 1r6h n LEU 122 Ca -0.08 0.64 0.07 0.00 -1.11 0.00 0.00 56.01 55.53 1r6h n LEU 122 Cb 0.39 -0.63 0.36 0.00 0.53 0.00 0.00 43.42 44.07 1r6h n LEU 122 CO 0.38 -0.62 1.22 0.40 -1.11 0.00 0.00 177.39 177.66 1r6h h ILE 123 N 0.00 0.99 0.00 1.96 2.04 -1.00 -0.07 117.51 121.43 1r6h h ILE 123 Ca 0.00 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.60 1r6h h ILE 123 Cb 0.17 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 36.43 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 0.74 0.00 -0.00 2.37 9.09 -1.67 -2.58 114.58 122.53 1r6h h GLU 124 Ca 0.33 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.74 1r6h h GLU 124 Cb 0.33 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.43 1r6h h GLU 124 CO -0.12 0.00 0.00 0.43 0.05 0.00 0.00 179.01 179.37 1r6h n SER 125 N -2.58 0.01 0.00 3.06 7.64 -0.04 -4.98 113.62 116.73 1r6h n SER 125 Ca -0.01 -1.75 0.00 0.00 1.01 0.00 0.00 58.87 58.13 1r6h n SER 125 Cb 0.12 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 1r6h n SER 125 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1r6h n GLY 126 N 0.63 1.41 3.49 0.23 0.00 -0.97 -4.91 105.19 105.07 1r6h n GLY 126 Ca 0.06 -0.81 -0.31 0.00 0.00 0.00 0.00 46.02 44.97 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 0.43 0.03 1.61 -0.00 -1.26 -4.68 117.12 113.25 1r6h n MET 127 Ca 0.00 -1.57 -0.01 0.00 -0.00 0.00 0.00 57.70 56.12 1r6h n MET 127 Cb 0.00 -3.27 -0.01 0.00 -0.00 0.00 0.00 33.22 29.95 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 10.35 -0.09 -0.17 3.17 2.10 -1.84 -1.76 116.57 128.33 1r6h h LYS 128 Ca 0.18 0.01 -0.08 0.00 -2.00 0.00 0.00 60.65 58.75 1r6h h LYS 128 Cb 0.84 0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 32.18 1r6h h LYS 128 CO 1.53 -0.06 -0.26 -0.92 -2.00 0.00 0.00 179.45 177.74 1r6h h TYR 129 N -0.24 0.34 0.07 0.07 3.20 -1.90 0.36 116.97 118.87 1r6h h TYR 129 Ca -0.01 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 61.79 1r6h h TYR 129 Cb 0.07 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.26 1r6h h TYR 129 CO 0.06 0.54 -0.04 0.93 -1.64 0.00 0.00 178.16 178.02 1r6h h GLU 130 N 0.27 -0.10 -0.35 1.82 3.07 -1.93 -2.53 114.58 114.83 1r6h h GLU 130 Ca 0.04 0.01 -0.16 0.00 -0.50 0.00 0.00 59.36 58.75 1r6h h GLU 130 Cb 0.60 0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 28.53 1r6h h GLU 130 CO 0.04 0.43 -0.41 0.22 -1.40 0.00 0.00 179.01 177.90 1r6h h ASP 131 N -0.71 0.97 -0.17 1.42 3.58 -1.29 -1.62 116.42 118.60 1r6h h ASP 131 Ca -0.01 -0.48 0.02 0.00 0.42 0.00 0.00 57.03 56.98 1r6h h ASP 131 Cb 0.57 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 41.33 1r6h h ASP 131 CO 0.02 1.26 0.03 0.00 -2.88 0.00 0.00 179.24 177.66 1r6h h ALA 132 N 0.74 0.17 -0.29 -0.78 0.00 -0.38 0.96 119.26 119.69 1r6h h ALA 132 Ca 0.05 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 1r6h h ALA 132 Cb 1.00 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1r6h h ALA 132 CO 0.10 -0.41 -0.28 0.82 0.00 0.00 0.00 179.25 179.48 1r6h h ILE 133 N 0.10 1.30 -0.00 0.00 1.08 -1.47 -1.53 117.51 117.00 1r6h h ILE 133 Ca 0.08 -1.45 -0.01 0.00 -0.39 0.00 0.00 64.86 63.10 1r6h h ILE 133 Cb 0.07 1.57 0.00 0.00 -3.07 0.00 0.00 36.82 35.39 1r6h h ILE 133 CO -0.11 0.46 -0.02 -0.61 -0.69 0.00 0.00 178.15 177.19 1r6h h GLN 134 N 0.45 0.02 -0.26 2.37 5.75 -1.12 -1.61 115.11 120.71 1r6h h GLN 134 Ca 0.05 -0.02 -0.08 0.00 -0.15 0.00 0.00 58.65 58.45 1r6h h GLN 134 Cb 0.85 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.39 1r6h h GLN 134 CO 0.07 0.73 -0.18 0.35 -2.65 0.00 0.00 178.83 177.14 1r6h h PHE 135 N -0.68 0.51 -0.03 3.99 3.57 0.85 -2.36 116.94 122.78 1r6h h PHE 135 Ca -0.00 -0.09 -0.18 0.00 3.53 0.00 0.00 57.97 61.23 1r6h h PHE 135 Cb 0.73 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.33 1r6h h PHE 135 CO 0.17 0.63 -0.77 0.97 -2.23 0.00 0.00 178.31 177.08 1r6h h ILE 136 N 0.42 1.43 -0.67 1.41 2.10 -1.36 -3.20 117.51 117.65 1r6h h ILE 136 Ca 0.07 -2.32 -0.06 0.00 1.08 0.00 0.00 64.86 63.63 1r6h h ILE 136 Cb 0.56 2.25 -0.03 0.00 -1.09 0.00 0.00 36.82 38.52 1r6h h ILE 136 CO 0.04 0.68 0.16 0.03 -1.08 0.00 0.00 178.15 177.98 1r6h h ARG 137 N 0.17 1.06 -0.49 2.19 2.47 -0.91 -3.01 114.38 115.87 1r6h h ARG 137 Ca -0.03 -0.26 0.01 0.00 -1.26 0.00 0.00 59.98 58.44 1r6h h ARG 137 Cb 1.35 -0.14 -0.03 0.00 -1.65 0.00 0.00 29.97 29.50 1r6h h ARG 137 CO 0.12 0.95 0.31 1.96 0.56 0.00 0.00 179.97 183.87 1r6h h GLN 138 N 0.99 0.61 -6.69 0.04 1.08 -1.44 -3.43 115.11 106.29 1r6h h GLN 138 Ca 0.21 -0.04 -0.50 0.00 -1.45 0.00 0.00 58.65 56.87 1r6h h GLN 138 Cb 0.36 -0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.64 1r6h h GLN 138 CO 0.00 0.41 0.04 0.15 -0.95 0.00 0.00 178.83 178.48 1r6h s LYS 139 N -6.15 3.87 -0.21 1.46 -0.14 -1.14 -5.02 119.74 112.42 1r6h s LYS 139 Ca -0.13 0.49 -0.29 0.00 -1.36 0.00 0.00 55.97 54.68 1r6h s LYS 139 Cb 0.12 -2.48 -0.02 0.00 -1.68 0.00 0.00 37.83 33.78 1r6h s LYS 139 CO 0.74 0.14 1.40 0.50 -0.76 0.00 0.00 175.35 177.36 1r6h s ARG 140 N -3.23 4.03 0.32 1.68 3.00 -1.26 -4.86 118.95 118.62 1r6h s ARG 140 Ca 0.51 1.58 0.09 0.00 -1.00 0.00 0.00 55.73 56.92 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 -0.99 0.00 1.03 0.00 0.00 0.00 175.30 175.57 1r6h s ARG 141 N 4.04 2.11 0.77 5.12 0.52 -1.25 -3.92 118.95 126.34 1r6h s ARG 141 Ca 0.61 -1.66 -0.12 0.00 -0.52 0.00 0.00 55.73 54.04 1r6h s ARG 141 Cb -0.22 -1.99 0.18 0.00 0.52 0.00 0.00 34.95 33.45 1r6h s ARG 141 CO 0.22 0.20 0.41 0.41 0.02 0.00 0.00 175.30 176.56 1r6h n GLY 142 N -0.93 -3.00 3.55 -3.53 0.00 -1.24 -4.75 105.19 95.29 1r6h n GLY 142 Ca -0.05 -0.98 -0.39 0.00 0.00 0.00 0.00 46.02 44.61 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 2.40 -0.47 4.61 0.00 -1.26 -4.92 121.76 120.08 1r6h s ALA 143 Ca 0.32 -1.09 -0.23 0.00 0.00 0.00 0.00 51.96 50.96 1r6h s ALA 143 Cb -0.06 -4.32 0.03 0.00 0.00 0.00 0.00 23.12 18.78 1r6h s ALA 143 CO 0.27 -3.69 0.79 0.96 0.00 0.00 0.00 175.76 174.08 1r6h s ILE 144 N 7.55 4.64 0.00 0.00 -5.25 -1.26 -4.91 121.20 121.97 1r6h s ILE 144 Ca 0.53 0.34 0.00 0.00 -0.99 0.00 0.00 60.65 60.53 1r6h s ILE 144 Cb -0.10 -4.34 0.00 0.00 2.95 0.00 0.00 42.46 40.97 1r6h s ILE 144 CO 0.15 -0.77 0.00 0.59 -1.79 0.00 0.00 174.94 173.13 1r6h n ASN 145 N 6.76 0.00 -0.08 4.36 3.02 -1.26 -4.95 115.26 123.10 1r6h n ASN 145 Ca 0.02 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.48 1r6h n ASN 145 Cb 0.48 -0.06 -0.03 0.00 -0.61 0.00 0.00 39.78 39.56 1r6h n ASN 145 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1r6h n SER 146 N -1.62 1.82 -0.16 6.41 7.64 -1.26 -4.55 113.62 121.89 1r6h n SER 146 Ca 0.00 0.32 -0.04 0.00 1.01 0.00 0.00 58.87 60.16 1r6h n SER 146 Cb 0.00 -0.73 0.03 0.00 -1.01 0.00 0.00 64.21 62.50 1r6h n SER 146 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 1r6h h LYS 147 N -0.94 -0.08 -0.04 1.43 3.11 -1.96 0.37 116.57 118.46 1r6h h LYS 147 Ca 0.00 0.01 0.03 0.00 -2.81 0.00 0.00 60.65 57.87 1r6h h LYS 147 Cb 0.93 0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 32.14 1r6h h LYS 147 CO 0.00 -0.05 -0.15 0.37 -2.81 0.00 0.00 179.45 176.81 1r6h h GLN 148 N -0.09 -0.22 -0.01 1.90 -0.00 -1.93 0.73 115.11 115.50 1r6h h GLN 148 Ca 0.24 0.01 -0.12 0.00 -0.00 0.00 0.00 58.65 58.78 1r6h h GLN 148 Cb 0.45 0.05 0.01 0.00 0.00 0.00 0.00 27.48 27.99 1r6h h GLN 148 CO -0.56 -0.14 -0.48 -0.07 0.00 0.00 0.00 178.83 177.57 1r6h h LEU 149 N -0.23 0.44 -0.91 -2.39 -0.00 -1.74 -2.69 115.31 107.78 1r6h h LEU 149 Ca 0.06 -0.76 -0.10 0.00 -0.00 0.00 0.00 57.88 57.09 1r6h h LEU 149 Cb 0.31 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 40.83 1r6h h LEU 149 CO -0.18 1.13 -0.29 0.00 -0.00 0.00 0.00 178.44 179.10 1r6h h THR 150 N -0.22 1.27 0.05 0.22 1.03 -0.25 0.12 112.91 115.13 1r6h h THR 150 Ca -0.06 -1.34 -0.00 0.00 -0.01 0.00 0.00 66.41 65.00 1r6h h THR 150 Cb 1.20 1.42 0.00 0.00 -1.07 0.00 0.00 68.15 69.71 1r6h h THR 150 CO 0.10 0.42 -0.02 0.22 -0.01 0.00 0.00 175.52 176.22 1r6h h TYR 151 N 0.39 -0.06 -0.26 0.00 3.20 0.40 -1.55 116.97 119.09 1r6h h TYR 151 Ca 0.05 -0.00 -0.18 0.00 3.14 0.00 0.00 58.73 61.74 1r6h h TYR 151 Cb 0.72 0.02 -0.00 0.00 1.54 0.00 0.00 36.73 39.00 1r6h h TYR 151 CO 0.02 0.34 -0.55 1.25 -1.64 0.00 0.00 178.16 177.58 1r6h h LEU 152 N -0.47 0.88 -1.36 2.82 6.46 -1.47 -1.19 115.31 120.97 1r6h h LEU 152 Ca -0.01 -0.47 0.10 0.00 -0.12 0.00 0.00 57.88 57.38 1r6h h LEU 152 Cb 0.43 -0.25 -0.05 0.00 -0.73 0.00 0.00 40.66 40.05 1r6h h LEU 152 CO 0.01 1.25 0.52 -0.08 -0.62 0.00 0.00 178.44 179.52 1r6h h GLU 153 N 0.61 0.69 0.00 1.25 4.22 -0.79 0.60 114.58 121.16 1r6h h GLU 153 Ca 0.01 -0.04 -0.10 0.00 0.08 0.00 0.00 59.36 59.32 1r6h h GLU 153 Cb 1.14 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 1r6h h GLU 153 CO 0.12 0.46 -0.46 -0.22 -2.18 0.00 0.00 179.01 176.72 1r6h h LYS 154 N 0.71 0.00 0.00 1.92 3.11 -0.96 -2.93 116.57 118.42 1r6h h LYS 154 Ca 0.37 0.00 -0.06 0.00 -2.81 0.00 0.00 60.65 58.15 1r6h h LYS 154 Cb 0.48 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.70 1r6h h LYS 154 CO -0.14 0.46 -0.28 -0.92 -2.81 0.00 0.00 179.45 175.76 1r6h h TYR 155 N 0.00 0.00 -3.60 1.91 5.03 0.14 -3.40 116.97 117.05 1r6h h TYR 155 Ca -0.00 0.00 -0.64 0.00 2.58 0.00 0.00 58.73 60.66 1r6h h TYR 155 Cb 1.08 0.00 -0.22 0.00 1.55 0.00 0.00 36.73 39.15 1r6h h TYR 155 CO 0.00 0.28 -0.62 -0.98 -1.32 0.00 0.00 178.16 175.52 1r6h s ARG 156 N -4.36 3.70 0.60 1.82 1.04 -0.68 -5.09 118.95 115.99 1r6h s ARG 156 Ca -0.03 -0.46 -0.17 0.00 -1.04 0.00 0.00 55.73 54.03 1r6h s ARG 156 Cb 0.15 -3.30 -0.03 0.00 -2.04 0.00 0.00 34.95 29.72 1r6h s ARG 156 CO 0.70 -0.12 1.10 -1.25 -0.04 0.00 0.00 175.30 175.69 1r6h s PRO 157 N 1.42 3.17 -0.13 3.89 0.04 -1.26 -4.89 135.00 137.23 1r6h s PRO 157 Ca 0.05 1.41 -0.05 0.00 0.04 0.00 0.00 61.00 62.45 1r6h s PRO 157 Cb -0.15 -2.00 0.06 0.00 0.04 0.00 0.00 34.50 32.45 1r6h s PRO 157 CO 0.04 -0.96 0.27 0.21 0.04 0.00 0.00 177.00 176.60 1r6h s LYS 158 N -3.78 0.19 0.00 4.56 2.20 -1.26 -5.01 119.74 116.63 1r6h s LYS 158 Ca 0.68 0.70 0.23 0.00 -0.36 0.00 0.00 55.97 57.22 1r6h s LYS 158 Cb -0.20 -0.04 1.20 0.00 -1.51 0.00 0.00 37.83 37.28 1r6h s LYS 158 CO 0.34 -0.24 1.77 1.04 -0.36 0.00 0.00 175.35 177.90 1r6h n GLN 159 N 4.95 0.38 -0.02 4.03 1.13 -1.26 -3.42 117.38 123.18 1r6h n GLN 159 Ca -0.13 0.06 0.06 0.00 -1.94 0.00 0.00 57.00 55.05 1r6h n GLN 159 Cb 0.51 -1.50 0.45 0.00 0.11 0.00 0.00 30.24 29.81 1r6h n GLN 159 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1r6h h ARG 160 N 0.00 0.48 0.10 -1.09 2.47 -2.00 -2.87 114.38 111.47 1r6h h ARG 160 Ca 0.00 -0.03 -0.26 0.00 -1.26 0.00 0.00 59.98 58.43 1r6h h ARG 160 Cb 0.19 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.40 1r6h h ARG 160 CO 0.00 0.32 -1.35 1.25 0.56 0.00 0.00 179.97 180.75 1r6h h LEU 161 N 0.50 0.34 -8.19 3.04 6.46 -2.02 -3.46 115.31 111.98 1r6h h LEU 161 Ca 0.18 -0.84 -0.59 0.00 -0.12 0.00 0.00 57.88 56.52 1r6h h LEU 161 Cb 0.11 -0.11 -0.32 0.00 -0.73 0.00 0.00 40.66 39.61 1r6h h LEU 161 CO -0.04 1.59 -0.84 -0.60 -0.62 0.00 0.00 178.44 177.92 1r6h s ARG 162 N -2.46 2.13 0.66 1.25 6.06 -1.08 -5.14 118.95 120.36 1r6h s ARG 162 Ca -0.20 -0.63 -0.03 0.00 -2.50 0.00 0.00 55.73 52.37 1r6h s ARG 162 Cb 0.04 -1.74 0.07 0.00 0.06 0.00 0.00 34.95 33.38 1r6h s ARG 162 CO 0.75 0.17 0.93 -0.59 -2.50 0.00 0.00 175.30 174.05 1r6h s PHE 163 N 0.30 2.57 -0.28 5.12 -0.12 -1.25 -4.28 117.98 120.04 1r6h s PHE 163 Ca -0.11 0.10 -0.20 0.00 -0.05 0.00 0.00 56.93 56.67 1r6h s PHE 163 Cb -0.15 -3.01 0.13 0.00 -0.63 0.00 0.00 43.02 39.35 1r6h s PHE 163 CO 0.05 -1.31 0.96 0.21 -0.05 0.00 0.00 175.22 175.08 1r6h s LYS 164 N -5.06 0.49 0.26 1.99 2.20 -1.26 -5.11 119.74 113.25 1r6h s LYS 164 Ca 0.61 0.71 -0.29 0.00 -0.36 0.00 0.00 55.97 56.63 1r6h s LYS 164 Cb -0.09 0.17 -0.09 0.00 -1.51 0.00 0.00 37.83 36.30 1r6h s LYS 164 CO 0.42 -0.08 1.21 0.34 -0.36 0.00 0.00 175.35 176.88 1r6h s ASP 165 N 0.87 7.04 0.99 1.43 -1.08 -1.26 -5.03 116.67 119.63 1r6h s ASP 165 Ca -0.04 2.39 -0.13 0.00 -0.52 0.00 0.00 52.55 54.26 1r6h s ASP 165 Cb -0.04 -2.63 0.18 0.00 -1.46 0.00 0.00 42.92 38.97 1r6h s ASP 165 CO -0.11 -0.35 1.12 -2.16 0.52 0.00 0.00 175.17 174.18 1r6h s PRO 166 N -1.08 0.51 0.18 4.34 0.04 -1.26 -5.01 135.00 132.71 1r6h s PRO 166 Ca 0.49 0.35 0.00 0.00 0.04 0.00 0.00 61.00 61.88 1r6h s PRO 166 Cb -0.35 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.43 1r6h s PRO 166 CO 0.43 -2.64 0.00 0.72 0.04 0.00 0.00 177.00 175.55 1r6h n HIS 167 N -4.08 -2.56 -3.38 0.56 8.25 -1.26 -5.11 115.22 107.64 1r6h n HIS 167 Ca 0.06 0.51 -0.11 0.00 -0.26 0.00 0.00 57.72 57.92 1r6h n HIS 167 Cb 0.58 1.46 -0.09 0.00 1.12 0.00 0.00 29.99 33.07 1r6h n HIS 167 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1r6h s THR 168 N -1.42 -0.55 -0.71 1.59 2.01 -1.26 -5.09 115.64 110.21 1r6h s THR 168 Ca 0.00 -0.08 -0.03 0.00 0.31 0.00 0.00 61.69 61.90 1r6h s THR 168 Cb 0.00 -0.78 0.18 0.00 0.01 0.00 0.00 72.50 71.91 1r6h s THR 168 CO 0.00 -0.14 0.54 -1.00 -0.69 0.00 0.00 174.62 173.34 1r6h s HIS 169 N 2.50 3.54 -0.48 4.92 3.76 -1.26 -5.04 115.29 123.24 1r6h s HIS 169 Ca 0.11 -2.80 -0.27 0.00 -0.15 0.00 0.00 55.06 51.95 1r6h s HIS 169 Cb -0.15 -3.21 -0.02 0.00 1.11 0.00 0.00 32.58 30.30 1r6h s HIS 169 CO -0.15 -0.81 1.85 0.21 -0.85 0.00 0.00 174.74 174.99 1r6h s LYS 170 N -0.46 2.94 -0.06 1.40 2.47 -1.26 -4.97 119.74 119.79 1r6h s LYS 170 Ca 0.20 1.02 0.06 0.00 -1.56 0.00 0.00 55.97 55.69 1r6h s LYS 170 Cb -0.16 -4.30 -0.01 0.00 -1.46 0.00 0.00 37.83 31.90 1r6h s LYS 170 CO -0.06 -2.34 -0.24 0.99 0.16 0.00 0.00 175.35 173.85 1r6h s THR 171 N 8.18 2.11 -2.00 3.43 2.01 -1.26 -5.33 115.64 122.78 1r6h s THR 171 Ca 0.74 -1.04 0.01 0.00 0.31 0.00 0.00 61.69 61.70 1r6h s THR 171 Cb -0.17 -1.77 0.02 0.00 0.01 0.00 0.00 72.50 70.59 1r6h s THR 171 CO 0.27 0.57 0.54 0.54 -0.69 0.00 0.00 174.62 175.84