#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 0.47 0.43 1.61 1.04 -1.26 -5.15 113.70 110.84 1r6h s SER 2 Ca 0.00 -0.68 -0.22 0.00 0.48 0.00 0.00 55.95 55.53 1r6h s SER 2 Cb 0.00 0.12 -0.10 0.00 0.10 0.00 0.00 66.02 66.14 1r6h s SER 2 CO 0.00 -0.38 1.00 -1.00 0.98 0.00 0.00 173.24 173.85 1r6h s HIS 3 N -2.26 3.24 -0.00 5.02 0.09 -1.26 -5.07 115.29 115.05 1r6h s HIS 3 Ca -0.07 1.63 0.02 0.00 -0.00 0.00 0.00 55.06 56.64 1r6h s HIS 3 Cb -0.04 -3.00 -0.00 0.00 -0.00 0.00 0.00 32.58 29.54 1r6h s HIS 3 CO -0.03 -0.43 -0.06 -1.64 -0.00 0.00 0.00 174.74 172.57 1r6h s MET 4 N -2.89 0.48 -0.14 1.40 1.00 -1.26 -5.15 119.30 112.74 1r6h s MET 4 Ca 0.61 -0.22 -0.09 0.00 0.00 0.00 0.00 55.69 55.99 1r6h s MET 4 Cb -0.16 -0.46 0.05 0.00 0.00 0.00 0.00 34.83 34.26 1r6h s MET 4 CO 0.20 0.13 0.34 0.00 0.00 0.00 0.00 175.02 175.69 1r6h s ALA 5 N -0.16 -0.84 -0.02 3.03 0.00 -1.26 -5.16 121.76 117.35 1r6h s ALA 5 Ca 0.02 1.20 -0.15 0.00 0.00 0.00 0.00 51.96 53.03 1r6h s ALA 5 Cb -0.02 -0.73 0.03 0.00 0.00 0.00 0.00 23.12 22.39 1r6h s ALA 5 CO -0.00 -0.21 0.33 -0.98 0.00 0.00 0.00 175.76 174.89 1r6h s ARG 6 N 1.01 0.68 -0.21 0.00 1.70 -1.26 -5.15 118.95 115.73 1r6h s ARG 6 Ca -0.07 -0.17 -0.02 0.00 -0.47 0.00 0.00 55.73 55.00 1r6h s ARG 6 Cb -0.07 0.30 0.06 0.00 -0.57 0.00 0.00 34.95 34.68 1r6h s ARG 6 CO -0.08 -0.19 0.04 0.00 -1.08 0.00 0.00 175.30 173.99 1r6h s MET 7 N -1.32 0.71 -0.03 3.89 0.23 -1.26 -4.97 119.30 116.56 1r6h s MET 7 Ca -0.13 -0.51 0.00 0.00 -1.03 0.00 0.00 55.69 54.02 1r6h s MET 7 Cb -0.05 -2.12 -0.02 0.00 -1.53 0.00 0.00 34.83 31.11 1r6h s MET 7 CO 0.04 -0.67 -0.03 0.09 -2.03 0.00 0.00 175.02 172.43 1r6h n ASN 8 N 5.02 3.66 -4.14 -1.18 3.02 -1.26 -5.07 115.26 115.31 1r6h n ASN 8 Ca -0.09 -0.01 -0.16 0.00 -0.03 0.00 0.00 54.58 54.29 1r6h n ASN 8 Cb 0.46 -0.05 -0.12 0.00 -0.61 0.00 0.00 39.78 39.47 1r6h n ASN 8 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1r6h s ARG 9 N -2.06 0.73 0.47 3.52 3.00 -1.26 -5.13 118.95 118.22 1r6h s ARG 9 Ca -0.04 -0.93 -0.22 0.00 0.00 0.00 0.00 55.73 54.54 1r6h s ARG 9 Cb 0.01 -0.59 -0.09 0.00 0.00 0.00 0.00 34.95 34.28 1r6h s ARG 9 CO 0.07 0.12 0.88 -2.30 0.00 0.00 0.00 175.30 174.07 1r6h n PRO 10 N 1.21 1.06 -2.69 3.54 -0.02 -1.26 -4.95 135.00 131.89 1r6h n PRO 10 Ca -0.21 0.39 -0.38 0.00 -2.02 0.00 0.00 63.50 61.28 1r6h n PRO 10 Cb 0.55 -1.95 -0.06 0.00 -0.02 0.00 0.00 33.50 32.02 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 -1.40 3.22 0.78 3.55 0.00 -1.26 -4.71 121.76 121.94 1r6h s ALA 11 Ca 0.66 0.62 -0.11 0.00 0.00 0.00 0.00 51.96 53.13 1r6h s ALA 11 Cb -0.52 -3.22 0.06 0.00 0.00 0.00 0.00 23.12 19.43 1r6h s ALA 11 CO 0.55 0.06 1.08 -1.25 0.00 0.00 0.00 175.76 176.20 1r6h s PRO 12 N -1.96 2.23 -0.08 0.00 0.04 -1.26 -4.80 135.00 129.17 1r6h s PRO 12 Ca 0.50 0.87 -0.03 0.00 0.04 0.00 0.00 61.00 62.38 1r6h s PRO 12 Cb -0.22 -1.92 0.04 0.00 0.04 0.00 0.00 34.50 32.45 1r6h s PRO 12 CO 0.28 -1.58 0.17 0.08 0.04 0.00 0.00 177.00 175.99 1r6h s VAL 13 N -3.03 -0.12 -0.22 -0.36 1.01 0.51 -4.96 120.40 113.23 1r6h s VAL 13 Ca 0.60 0.23 -0.05 0.00 0.00 0.00 0.00 61.98 62.76 1r6h s VAL 13 Cb -0.15 -0.28 -0.02 0.00 0.00 0.00 0.00 36.38 35.92 1r6h s VAL 13 CO 0.55 0.09 0.01 -1.61 0.00 0.00 0.00 175.10 174.15 1r6h s GLU 14 N 1.54 3.57 -0.24 2.72 8.01 -1.26 0.12 118.70 133.15 1r6h s GLU 14 Ca -0.06 -0.53 -0.07 0.00 0.01 0.00 0.00 54.97 54.32 1r6h s GLU 14 Cb -0.12 -3.14 -0.03 0.00 -4.31 0.00 0.00 34.13 26.54 1r6h s GLU 14 CO -0.06 -0.11 0.06 0.08 0.01 0.00 0.00 175.26 175.23 1r6h s VAL 15 N 1.32 4.22 0.07 2.63 1.01 0.14 -4.92 120.40 124.86 1r6h s VAL 15 Ca 0.04 -0.21 0.08 0.00 0.00 0.00 0.00 61.98 61.89 1r6h s VAL 15 Cb -0.15 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.24 1r6h s VAL 15 CO 0.01 0.36 -0.18 -0.94 0.00 0.00 0.00 175.10 174.35 1r6h s SER 16 N 1.53 3.86 -0.22 3.32 1.04 -1.26 0.12 113.70 122.08 1r6h s SER 16 Ca 0.06 -0.47 -0.11 0.00 0.48 0.00 0.00 55.95 55.91 1r6h s SER 16 Cb -0.15 -0.60 0.08 0.00 0.10 0.00 0.00 66.02 65.45 1r6h s SER 16 CO 0.03 0.23 0.52 -0.47 0.98 0.00 0.00 173.24 174.53 1r6h s TYR 17 N -1.01 -0.85 0.00 5.02 5.04 -1.03 -5.02 117.35 119.50 1r6h s TYR 17 Ca 0.16 1.69 0.00 0.00 -2.44 0.00 0.00 57.07 56.48 1r6h s TYR 17 Cb -0.11 0.44 0.00 0.00 0.35 0.00 0.00 41.96 42.65 1r6h s TYR 17 CO 0.07 -0.45 0.00 1.63 -1.34 0.00 0.00 175.55 175.46 1r6h n LYS 18 N 4.56 0.00 0.00 4.97 4.76 -1.26 -2.55 118.16 128.64 1r6h n LYS 18 Ca -0.19 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.25 1r6h n LYS 18 Cb 0.55 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.74 1r6h n LYS 18 CO 0.00 0.00 0.00 1.58 -1.37 0.00 0.00 177.40 177.61 1r6h n HIS 19 N 0.00 0.00 -2.44 2.13 -0.00 -1.26 -5.07 115.22 108.58 1r6h n HIS 19 Ca 0.00 0.00 -0.40 0.00 0.46 0.00 0.00 57.72 57.78 1r6h n HIS 19 Cb 0.00 0.15 -0.04 0.00 -0.12 0.00 0.00 29.99 29.98 1r6h n HIS 19 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1r6h s MET 20 N -1.84 4.61 0.33 1.57 0.23 -1.06 -4.49 119.30 118.66 1r6h s MET 20 Ca 0.00 1.84 0.09 0.00 -1.03 0.00 0.00 55.69 56.59 1r6h s MET 20 Cb 0.00 -3.18 -0.05 0.00 -1.53 0.00 0.00 34.83 30.07 1r6h s MET 20 CO 0.00 0.17 0.02 1.03 -2.03 0.00 0.00 175.02 174.21 1r6h s ARG 21 N -1.44 2.12 -0.02 3.16 0.52 -1.09 -2.45 118.95 119.76 1r6h s ARG 21 Ca 0.45 -1.70 0.03 0.00 -0.52 0.00 0.00 55.73 53.99 1r6h s ARG 21 Cb -0.33 -1.97 -0.00 0.00 0.52 0.00 0.00 34.95 33.17 1r6h s ARG 21 CO 0.42 0.15 -0.10 -0.06 0.02 0.00 0.00 175.30 175.73 1r6h s PHE 22 N -2.49 0.95 -0.10 -0.53 0.08 0.32 -3.30 117.98 112.92 1r6h s PHE 22 Ca 0.35 -0.20 0.02 0.00 0.12 0.00 0.00 56.93 57.21 1r6h s PHE 22 Cb -0.01 -0.64 -0.02 0.00 -0.57 0.00 0.00 43.02 41.78 1r6h s PHE 22 CO 0.20 -0.05 -0.15 -0.51 -0.10 0.00 0.00 175.22 174.61 1r6h s LEU 23 N -0.08 2.64 -0.32 -0.37 2.01 0.94 0.25 118.68 123.75 1r6h s LEU 23 Ca 0.01 -0.31 -0.01 0.00 0.01 0.00 0.00 54.13 53.84 1r6h s LEU 23 Cb -0.06 -1.56 0.07 0.00 0.01 0.00 0.00 46.19 44.65 1r6h s LEU 23 CO -0.00 0.23 0.03 -0.63 1.01 0.00 0.00 176.35 176.99 1r6h s ILE 24 N -0.05 2.84 0.18 -0.59 -1.09 0.32 0.16 121.20 122.96 1r6h s ILE 24 Ca -0.03 -1.69 0.03 0.00 -2.23 0.00 0.00 60.65 56.73 1r6h s ILE 24 Cb -0.14 -2.77 -0.05 0.00 -1.58 0.00 0.00 42.46 37.93 1r6h s ILE 24 CO 0.04 -0.29 -0.04 0.42 -1.23 0.00 0.00 174.94 173.84 1r6h s THR 25 N 1.16 0.99 0.44 2.92 -4.23 0.12 -0.36 115.64 116.68 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 -2.07 -0.09 0.00 1.34 0.00 0.00 72.50 71.47 1r6h s THR 25 CO -0.03 -0.55 0.92 -1.38 -0.54 0.00 0.00 174.62 173.04 1r6h s HIS 26 N -3.44 3.39 0.73 3.99 -3.43 -1.26 0.27 115.29 115.54 1r6h s HIS 26 Ca 0.22 1.45 -0.15 0.00 -0.80 0.00 0.00 55.06 55.78 1r6h s HIS 26 Cb 0.04 -2.74 0.04 0.00 -1.43 0.00 0.00 32.58 28.49 1r6h s HIS 26 CO 0.04 -0.18 1.20 0.54 -2.00 0.00 0.00 174.74 174.34 1r6h s ASN 27 N -2.62 4.20 0.35 7.38 2.20 -1.26 -4.82 114.94 120.38 1r6h s ASN 27 Ca 0.59 2.33 -0.27 0.00 -0.94 0.00 0.00 52.86 54.57 1r6h s ASN 27 Cb -0.10 -2.59 -0.12 0.00 -2.00 0.00 0.00 41.25 36.45 1r6h s ASN 27 CO 0.22 -2.26 1.21 -2.65 -2.94 0.00 0.00 177.10 170.68 1r6h n PRO 28 N -2.76 1.88 -2.94 3.55 -0.02 -1.26 -5.01 135.00 128.44 1r6h n PRO 28 Ca 0.13 0.66 -0.19 0.00 -2.02 0.00 0.00 63.50 62.08 1r6h n PRO 28 Cb 0.50 -2.22 0.04 0.00 -0.02 0.00 0.00 33.50 31.81 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 -1.13 2.52 -0.86 3.45 -4.23 -1.26 -4.97 115.64 109.16 1r6h s THR 29 Ca 0.58 -0.92 0.23 0.00 -1.18 0.00 0.00 61.69 60.40 1r6h s THR 29 Cb -0.58 -2.60 -0.08 0.00 1.34 0.00 0.00 72.50 70.58 1r6h s THR 29 CO 0.61 0.00 1.18 -3.20 -0.54 0.00 0.00 174.62 172.66 1r6h n ASN 30 N -2.16 0.65 -0.05 3.99 4.05 -1.26 -4.29 115.26 116.19 1r6h n ASN 30 Ca 0.12 -0.38 -0.10 0.00 0.45 0.00 0.00 54.58 54.66 1r6h n ASN 30 Cb 0.60 0.58 -0.15 0.00 1.23 0.00 0.00 39.78 42.05 1r6h n ASN 30 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1r6h n ALA 31 N -1.62 1.45 -3.47 5.20 0.00 -1.26 -4.79 120.51 116.03 1r6h n ALA 31 Ca 0.04 -0.95 -0.29 0.00 0.00 0.00 0.00 53.44 52.24 1r6h n ALA 31 Cb 0.37 -0.60 -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 0.17 -0.13 0.00 -4.23 -1.26 -4.98 115.64 102.65 1r6h s THR 32 Ca -0.09 -1.76 -0.23 0.00 -1.18 0.00 0.00 61.69 58.44 1r6h s THR 32 Cb 0.07 -1.14 -0.20 0.00 1.34 0.00 0.00 72.50 72.57 1r6h s THR 32 CO 0.81 -1.00 0.59 -0.07 -0.54 0.00 0.00 174.62 174.41 1r6h h LEU 33 N 6.96 0.00 -0.53 4.79 -0.00 -1.87 -3.31 115.31 121.35 1r6h h LEU 33 Ca 0.07 -0.77 0.05 0.00 -0.00 0.00 0.00 57.88 57.23 1r6h h LEU 33 Cb 0.97 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 41.58 1r6h h LEU 33 CO 0.27 0.91 0.26 0.77 -0.00 0.00 0.00 178.44 180.65 1r6h h SER 34 N -1.00 0.36 -0.50 -0.43 4.64 -1.96 -1.91 113.55 112.76 1r6h h SER 34 Ca -0.01 0.03 0.06 0.00 -0.47 0.00 0.00 61.79 61.41 1r6h h SER 34 Cb 0.80 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 62.83 1r6h h SER 34 CO -0.01 0.25 0.33 0.74 -0.87 0.00 0.00 176.83 177.27 1r6h h THR 35 N 0.50 0.97 -0.02 2.95 2.02 -1.98 -2.32 112.91 115.03 1r6h h THR 35 Ca 0.24 -0.14 -0.05 0.00 0.77 0.00 0.00 66.41 67.22 1r6h h THR 35 Cb 0.17 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 67.09 1r6h h THR 35 CO -0.18 0.08 -0.18 0.15 0.37 0.00 0.00 175.52 175.76 1r6h h PHE 36 N 0.42 0.22 -0.95 3.16 3.04 -1.45 -2.67 116.94 118.71 1r6h h PHE 36 Ca 0.22 -0.11 0.10 0.00 3.98 0.00 0.00 57.97 62.16 1r6h h PHE 36 Cb 0.32 -0.03 -0.07 0.00 2.56 0.00 0.00 35.95 38.73 1r6h h PHE 36 CO -0.00 0.85 0.61 -0.84 -2.02 0.00 0.00 178.31 176.91 1r6h h ILE 37 N -0.46 0.98 0.14 1.41 3.07 -1.14 0.35 117.51 121.87 1r6h h ILE 37 Ca -0.02 -0.34 -0.01 0.00 1.55 0.00 0.00 64.86 66.05 1r6h h ILE 37 Cb 0.88 -0.09 0.00 0.00 -0.27 0.00 0.00 36.82 37.34 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 -0.18 0.00 0.16 5.08 -1.47 -1.13 114.58 118.03 1r6h h GLU 38 Ca 0.44 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.82 1r6h h GLU 38 Cb 0.37 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1r6h h GLU 38 CO -0.20 0.09 -0.00 -0.44 -1.00 0.00 0.00 179.01 177.46 1r6h h ASP 39 N -0.45 -0.00 -0.62 1.42 3.32 -1.08 0.95 116.42 119.96 1r6h h ASP 39 Ca -0.02 -0.43 0.07 0.00 0.02 0.00 0.00 57.03 56.67 1r6h h ASP 39 Cb 0.36 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.85 1r6h h ASP 39 CO 0.03 0.43 0.31 -0.07 -1.72 0.00 0.00 179.24 178.22 1r6h h LEU 40 N -0.44 0.42 -0.17 1.55 3.38 -0.40 -0.60 115.31 119.04 1r6h h LEU 40 Ca -0.00 0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 1r6h h LEU 40 Cb 0.43 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1r6h h LEU 40 CO 0.00 0.27 -0.61 0.50 0.09 0.00 0.00 178.44 178.68 1r6h h LYS 41 N 0.56 0.00 -0.82 1.13 3.64 -1.21 -3.28 116.57 116.59 1r6h h LYS 41 Ca 0.29 0.00 0.12 0.00 -1.27 0.00 0.00 60.65 59.79 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 0.61 0.43 0.87 -2.27 0.00 0.00 179.45 178.88 1r6h h LYS 42 N 0.00 0.64 -0.68 1.90 1.57 0.26 -0.82 116.57 119.43 1r6h h LYS 42 Ca -0.01 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 1r6h h LYS 42 Cb 1.40 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.53 1r6h h LYS 42 CO 0.08 0.42 0.24 -0.92 -0.57 0.00 0.00 179.45 178.70 1r6h h TYR 43 N 0.66 1.05 0.00 -1.35 5.03 -1.53 -3.48 116.97 117.34 1r6h h TYR 43 Ca 0.43 -0.08 0.00 0.00 2.58 0.00 0.00 58.73 61.65 1r6h h TYR 43 Cb 0.53 -0.31 0.00 0.00 1.55 0.00 0.00 36.73 38.50 1r6h h TYR 43 CO -0.09 0.82 0.00 0.41 -1.32 0.00 0.00 178.16 177.98 1r6h n GLY 44 N -0.89 -2.26 2.87 1.82 0.00 -0.31 -4.96 105.19 101.46 1r6h n GLY 44 Ca 0.06 -1.23 -0.27 0.00 0.00 0.00 0.00 46.02 44.58 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 -1.77 1.27 0.01 4.61 0.00 -1.25 -4.47 121.76 120.17 1r6h s ALA 45 Ca 0.00 -0.60 -0.00 0.00 0.00 0.00 0.00 51.96 51.36 1r6h s ALA 45 Cb 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 23.12 22.14 1r6h s ALA 45 CO 0.00 -0.60 0.02 2.41 0.00 0.00 0.00 175.76 177.59 1r6h n THR 46 N 4.96 0.00 -1.09 0.00 -1.04 0.24 -4.10 114.28 113.25 1r6h n THR 46 Ca -0.11 -0.02 -0.32 0.00 -2.04 0.00 0.00 64.05 61.56 1r6h n THR 46 Cb 0.49 0.02 0.12 0.00 -1.82 0.00 0.00 70.33 69.14 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 2.63 -0.02 12.58 -1.32 -1.25 -4.09 115.64 121.42 1r6h s THR 47 Ca 0.00 0.23 0.01 0.00 -1.21 0.00 0.00 61.69 60.72 1r6h s THR 47 Cb -0.00 -2.53 0.01 0.00 -1.51 0.00 0.00 72.50 68.46 1r6h s THR 47 CO 0.00 -0.24 -0.03 -0.69 -2.21 0.00 0.00 174.62 171.44 1r6h s VAL 48 N -2.61 0.34 -0.34 5.08 1.01 0.17 -2.54 120.40 121.52 1r6h s VAL 48 Ca 0.66 -0.12 -0.01 0.00 0.00 0.00 0.00 61.98 62.52 1r6h s VAL 48 Cb -0.22 -0.34 0.08 0.00 0.00 0.00 0.00 36.38 35.90 1r6h s VAL 48 CO 0.54 0.13 0.06 0.54 0.00 0.00 0.00 175.10 176.37 1r6h s VAL 49 N 0.31 2.88 -0.30 2.92 0.11 -0.19 0.40 120.40 126.53 1r6h s VAL 49 Ca -0.03 -1.78 -0.02 0.00 -2.93 0.00 0.00 61.98 57.21 1r6h s VAL 49 Cb -0.07 -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 0.00 175.10 171.41 1r6h s ARG 50 N 1.14 2.52 -0.72 1.54 1.70 -1.13 -2.20 118.95 121.80 1r6h s ARG 50 Ca 0.01 -1.21 -0.09 0.00 -0.47 0.00 0.00 55.73 53.97 1r6h s ARG 50 Cb -0.21 -3.19 0.19 0.00 -0.57 0.00 0.00 34.95 31.17 1r6h s ARG 50 CO -0.04 -0.59 0.61 0.08 -1.08 0.00 0.00 175.30 174.28 1r6h s VAL 51 N 1.29 4.77 0.30 4.99 1.01 -1.26 -2.54 120.40 128.95 1r6h s VAL 51 Ca -0.04 -2.62 -0.18 0.00 0.00 0.00 0.00 61.98 59.14 1r6h s VAL 51 Cb -0.19 -4.01 0.02 0.00 0.00 0.00 0.00 36.38 32.20 1r6h s VAL 51 CO -0.01 -0.95 0.69 0.00 0.00 0.00 0.00 175.10 174.83 1r6h s GLU 53 N -3.63 4.24 -0.10 0.00 8.01 -1.26 -4.24 118.70 121.72 1r6h s GLU 53 Ca 0.14 2.29 -0.30 0.00 0.01 0.00 0.00 54.97 57.11 1r6h s GLU 53 Cb -0.05 -3.18 -0.03 0.00 -4.31 0.00 0.00 34.13 26.57 1r6h s GLU 53 CO 0.08 -0.56 1.28 0.14 0.01 0.00 0.00 175.26 176.21 1r6h s VAL 54 N 1.13 4.17 0.00 2.63 -7.23 -1.26 -4.86 120.40 114.97 1r6h s VAL 54 Ca 0.69 1.46 0.00 0.00 -1.81 0.00 0.00 61.98 62.32 1r6h s VAL 54 Cb -0.42 -3.94 0.00 0.00 0.56 0.00 0.00 36.38 32.58 1r6h s VAL 54 CO 0.31 -0.07 0.00 0.41 -0.31 0.00 0.00 175.10 175.44 1r6h n THR 55 N 5.04 0.00 -3.66 5.32 -1.04 -1.26 -4.94 114.28 113.74 1r6h n THR 55 Ca 0.13 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.86 1r6h n THR 55 Cb 0.45 -1.25 -0.12 0.00 -1.82 0.00 0.00 70.33 67.59 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 2.10 0.09 -1.42 2.02 -1.26 -4.96 117.35 111.92 1r6h s TYR 56 Ca 0.00 -2.62 -0.06 0.00 -0.37 0.00 0.00 57.07 54.03 1r6h s TYR 56 Cb 0.00 -1.78 -0.23 0.00 -0.40 0.00 0.00 41.96 39.55 1r6h s TYR 56 CO 0.00 -0.73 1.18 -0.44 -1.57 0.00 0.00 175.55 173.99 1r6h h ASP 57 N 6.05 0.52 0.03 2.29 5.19 -1.99 -3.36 116.42 125.14 1r6h h ASP 57 Ca 0.12 -0.50 -0.05 0.00 -0.62 0.00 0.00 57.03 55.98 1r6h h ASP 57 Cb 0.88 -0.16 0.01 0.00 0.18 0.00 0.00 39.33 40.23 1r6h h ASP 57 CO 0.50 1.36 -0.22 0.11 -3.12 0.00 0.00 179.24 177.87 1r6h h LYS 58 N 0.14 0.09 -0.77 3.56 1.57 -1.99 -3.22 116.57 115.95 1r6h h LYS 58 Ca -0.13 -0.14 0.16 0.00 -1.87 0.00 0.00 60.65 58.67 1r6h h LYS 58 Cb 1.86 0.05 -0.15 0.00 0.08 0.00 0.00 32.23 34.07 1r6h h LYS 58 CO 0.20 1.02 -0.18 1.15 -0.57 0.00 0.00 179.45 181.07 1r6h h THR 59 N -0.76 0.23 -0.16 -0.16 2.02 -1.98 0.83 112.91 112.93 1r6h h THR 59 Ca -0.04 -0.00 -0.22 0.00 0.77 0.00 0.00 66.41 66.93 1r6h h THR 59 Cb 1.12 0.23 0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1r6h h THR 59 CO 0.04 0.00 -0.75 -0.65 0.37 0.00 0.00 175.52 174.54 1r6h h PRO 60 N 0.01 0.77 -0.27 6.66 0.11 -1.72 -2.41 132.00 135.15 1r6h h PRO 60 Ca 0.38 -0.61 -0.05 0.00 0.11 0.00 0.00 66.00 65.82 1r6h h PRO 60 Cb 0.58 0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.80 1r6h h PRO 60 CO -0.79 1.22 -0.04 -0.07 -0.21 0.00 0.00 178.00 178.12 1r6h h LEU 61 N 0.54 0.50 -0.32 2.35 -0.00 -1.35 0.17 115.31 117.20 1r6h h LEU 61 Ca -0.04 -0.34 -0.19 0.00 -0.00 0.00 0.00 57.88 57.30 1r6h h LEU 61 Cb 1.37 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 41.88 1r6h h LEU 61 CO 0.15 0.73 -0.84 -0.08 -0.00 0.00 0.00 178.44 178.40 1r6h h GLU 62 N 0.27 0.24 0.05 1.13 4.81 -0.97 0.16 114.58 120.27 1r6h h GLU 62 Ca 0.07 -0.25 -0.24 0.00 -0.13 0.00 0.00 59.36 58.81 1r6h h GLU 62 Cb 0.49 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.92 1r6h h GLU 62 CO 0.02 0.95 -1.17 0.87 -0.73 0.00 0.00 179.01 178.95 1r6h h LYS 63 N 0.14 0.11 0.00 1.92 1.79 -1.45 -3.34 116.57 115.75 1r6h h LYS 63 Ca -0.04 -0.18 0.00 0.00 -2.18 0.00 0.00 60.65 58.24 1r6h h LYS 63 Cb 1.45 0.07 0.00 0.00 -1.58 0.00 0.00 32.23 32.17 1r6h h LYS 63 CO 0.13 1.04 -1.08 -0.25 -1.08 0.00 0.00 179.45 178.21 1r6h n ASP 64 N -3.39 0.84 -3.36 0.86 8.00 0.04 -4.95 116.55 114.59 1r6h n ASP 64 Ca -0.05 -0.82 -0.21 0.00 0.71 0.00 0.00 54.79 54.42 1r6h n ASP 64 Cb 0.98 1.14 -0.02 0.00 -0.02 0.00 0.00 41.12 43.20 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 -0.47 3.52 0.44 0.00 0.56 -4.92 105.19 105.77 1r6h n GLY 65 Ca 0.03 0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.73 3.08 0.15 -0.61 -4.36 -1.25 -5.05 121.20 110.42 1r6h s ILE 66 Ca 0.37 -1.32 -0.30 0.00 -0.26 0.00 0.00 60.65 59.14 1r6h s ILE 66 Cb -0.21 -2.40 -0.07 0.00 1.25 0.00 0.00 42.46 41.03 1r6h s ILE 66 CO 0.46 0.16 1.04 0.42 0.24 0.00 0.00 174.94 177.26 1r6h s THR 67 N -1.13 4.15 0.02 8.37 -4.23 -1.26 -4.82 115.64 116.74 1r6h s THR 67 Ca 0.19 1.82 -0.07 0.00 -1.18 0.00 0.00 61.69 62.44 1r6h s THR 67 Cb -0.11 -4.16 -0.00 0.00 1.34 0.00 0.00 72.50 69.57 1r6h s THR 67 CO 0.10 0.30 0.14 0.54 -0.54 0.00 0.00 174.62 175.16 1r6h s VAL 68 N -0.12 0.10 -0.16 2.29 0.11 -1.26 0.41 120.40 121.77 1r6h s VAL 68 Ca 0.48 -0.80 -0.07 0.00 -2.93 0.00 0.00 61.98 58.66 1r6h s VAL 68 Cb -0.27 -0.61 -0.04 0.00 -1.53 0.00 0.00 36.38 33.94 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 -1.82 4.86 -0.45 2.04 1.01 0.16 -4.89 120.40 121.31 1r6h s VAL 69 Ca -0.11 -0.02 -0.15 0.00 0.00 0.00 0.00 61.98 61.70 1r6h s VAL 69 Cb -0.05 -3.16 0.06 0.00 0.00 0.00 0.00 36.38 33.22 1r6h s VAL 69 CO -0.00 0.50 0.35 -1.81 0.00 0.00 0.00 175.10 174.13 1r6h s ASP 70 N 0.02 6.07 -0.38 3.32 1.01 -1.26 -2.82 116.67 122.62 1r6h s ASP 70 Ca 0.06 -1.21 -0.04 0.00 0.71 0.00 0.00 52.55 52.07 1r6h s ASP 70 Cb -0.12 -2.15 0.08 0.00 1.01 0.00 0.00 42.92 41.74 1r6h s ASP 70 CO 0.01 -0.57 0.16 0.26 0.21 0.00 0.00 175.17 175.24 1r6h s TRP 71 N 1.63 3.44 0.41 4.23 0.52 -1.05 -5.06 118.94 123.05 1r6h s TRP 71 Ca 0.04 -2.04 0.08 0.00 0.02 0.00 0.00 56.10 54.20 1r6h s TRP 71 Cb -0.22 -2.84 -0.02 0.00 -1.15 0.00 0.00 33.47 29.23 1r6h s TRP 71 CO 0.07 -0.89 0.37 -1.25 0.02 0.00 0.00 176.95 175.27 1r6h s PRO 72 N 1.24 2.55 -0.38 4.98 0.04 -1.26 -1.43 135.00 140.74 1r6h s PRO 72 Ca 0.03 -1.52 0.02 0.00 0.04 0.00 0.00 61.00 59.58 1r6h s PRO 72 Cb -0.22 -2.38 0.11 0.00 0.04 0.00 0.00 34.50 32.05 1r6h s PRO 72 CO -0.02 -0.17 0.14 0.12 0.04 0.00 0.00 177.00 177.12 1r6h s PHE 73 N -2.46 2.60 0.23 0.56 2.19 -1.26 -4.95 117.98 114.89 1r6h s PHE 73 Ca 0.47 -2.50 0.03 0.00 0.33 0.00 0.00 56.93 55.27 1r6h s PHE 73 Cb -0.03 -2.28 0.03 0.00 -1.31 0.00 0.00 43.02 39.43 1r6h s PHE 73 CO 0.28 -0.85 0.26 -0.25 1.83 0.00 0.00 175.22 176.48 1r6h n ASP 74 N 4.09 1.25 0.20 6.13 8.00 -1.26 -4.98 116.55 129.97 1r6h n ASP 74 Ca 0.03 -1.70 0.16 0.00 0.71 0.00 0.00 54.79 53.99 1r6h n ASP 74 Cb 0.39 -0.10 0.79 0.00 -0.02 0.00 0.00 41.12 42.17 1r6h n ASP 74 CO 0.00 0.00 0.00 -2.24 -0.39 0.00 0.00 177.20 174.57 1r6h h ASP 75 N 0.14 0.00 -2.20 -2.24 2.03 -2.08 -3.02 116.42 109.05 1r6h h ASP 75 Ca -0.13 0.00 -0.58 0.00 -0.73 0.00 0.00 57.03 55.59 1r6h h ASP 75 Cb 0.52 0.00 -0.42 0.00 -0.83 0.00 0.00 39.33 38.60 1r6h h ASP 75 CO 0.19 0.00 -0.70 0.61 -1.03 0.00 0.00 179.24 178.31 1r6h n GLY 76 N -1.45 4.91 3.45 7.15 0.00 -1.26 -5.04 105.19 112.96 1r6h n GLY 76 Ca 0.01 -2.60 -0.44 0.00 0.00 0.00 0.00 46.02 43.00 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 -2.81 3.41 -1.00 4.61 0.00 -1.14 -4.98 121.76 119.85 1r6h s ALA 77 Ca 0.43 -1.69 -0.25 0.00 0.00 0.00 0.00 51.96 50.46 1r6h s ALA 77 Cb 0.22 -3.25 -0.25 0.00 0.00 0.00 0.00 23.12 19.84 1r6h s ALA 77 CO -0.08 -1.86 2.54 -2.30 0.00 0.00 0.00 175.76 174.06 1r6h n PRO 78 N 5.93 0.01 -0.30 0.00 -0.02 -1.26 -4.81 135.00 134.55 1r6h n PRO 78 Ca -0.07 -0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.43 1r6h n PRO 78 Cb 0.46 -1.37 0.16 0.00 -0.02 0.00 0.00 33.50 32.73 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 11.76 0.84 -6.44 0.52 0.11 -2.02 -3.44 132.00 133.33 1r6h h PRO 79 Ca -0.03 -0.05 -0.58 0.00 0.11 0.00 0.00 66.00 65.46 1r6h h PRO 79 Cb 1.26 -0.19 0.18 0.00 0.11 0.00 0.00 31.00 32.36 1r6h h PRO 79 CO 1.46 0.56 -0.61 -0.35 -0.21 0.00 0.00 178.00 178.85 1r6h n PRO 80 N -4.69 0.32 0.29 1.05 -0.04 -1.26 -4.85 135.00 125.82 1r6h n PRO 80 Ca 0.13 0.13 0.19 0.00 -0.04 0.00 0.00 63.50 63.92 1r6h n PRO 80 Cb 0.24 -1.58 0.89 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 -0.06 0.00 0.13 0.55 0.00 -1.98 -3.08 103.07 98.62 1r6h h GLY 81 Ca -0.45 0.00 0.27 0.00 0.00 0.00 0.00 47.33 47.15 1r6h h GLY 81 CO 0.43 0.00 0.68 1.70 0.00 0.00 0.00 176.54 179.35 1r6h h LYS 82 N 0.00 0.00 -0.36 4.80 3.64 -1.92 0.56 116.57 123.29 1r6h h LYS 82 Ca 0.00 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.43 1r6h h LYS 82 Cb 0.29 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.07 1r6h h LYS 82 CO 0.00 0.00 0.09 0.28 -2.27 0.00 0.00 179.45 177.55 1r6h h VAL 83 N 0.00 0.85 -0.88 2.00 2.07 -1.83 0.22 116.25 118.68 1r6h h VAL 83 Ca 0.44 -0.08 0.10 0.00 0.82 0.00 0.00 66.70 67.98 1r6h h VAL 83 Cb 1.79 0.61 -0.06 0.00 -1.52 0.00 0.00 31.29 32.10 1r6h h VAL 83 CO -0.00 0.04 0.57 0.58 0.02 0.00 0.00 177.57 178.78 1r6h h VAL 84 N 0.22 0.96 -0.18 2.57 2.07 -0.12 0.58 116.25 122.35 1r6h h VAL 84 Ca 0.17 -0.30 0.02 0.00 0.82 0.00 0.00 66.70 67.41 1r6h h VAL 84 Cb 0.18 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 29.96 1r6h h VAL 84 CO -0.20 0.16 0.12 -0.33 0.02 0.00 0.00 177.57 177.34 1r6h h GLU 85 N 0.87 0.17 0.05 1.57 5.08 -0.20 0.47 114.58 122.58 1r6h h GLU 85 Ca 0.41 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.76 1r6h h GLU 85 Cb 0.42 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1r6h h GLU 85 CO -0.17 0.11 -0.03 0.22 -1.00 0.00 0.00 179.01 178.15 1r6h h ASP 86 N 0.18 -0.06 0.52 1.42 1.82 0.16 -1.72 116.42 118.74 1r6h h ASP 86 Ca 0.07 -0.28 -0.06 0.00 -0.39 0.00 0.00 57.03 56.37 1r6h h ASP 86 Cb 0.08 0.02 -0.01 0.00 0.68 0.00 0.00 39.33 40.09 1r6h h ASP 86 CO -0.01 0.25 -0.28 -0.25 -1.61 0.00 0.00 179.24 177.34 1r6h h TRP 87 N -0.38 0.00 -0.80 0.28 2.91 -1.02 -2.45 115.95 114.49 1r6h h TRP 87 Ca -0.01 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.01 1r6h h TRP 87 Cb 0.34 0.00 -0.04 0.00 -0.51 0.00 0.00 29.16 28.95 1r6h h TRP 87 CO 0.03 0.28 0.47 -0.07 -1.03 0.00 0.00 178.44 178.12 1r6h h LEU 88 N 0.00 0.97 -0.39 0.65 3.38 0.27 0.14 115.31 120.33 1r6h h LEU 88 Ca -0.00 -0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 1r6h h LEU 88 Cb 0.61 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1r6h h LEU 88 CO 0.04 0.76 -0.11 -1.28 0.09 0.00 0.00 178.44 177.94 1r6h h SER 89 N 1.10 0.78 0.15 -0.43 0.87 -0.86 0.41 113.55 115.57 1r6h h SER 89 Ca 0.29 -0.37 -0.01 0.00 -1.23 0.00 0.00 61.79 60.47 1r6h h SER 89 Cb -0.02 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.72 1r6h h SER 89 CO -0.05 0.97 -0.07 0.25 -0.53 0.00 0.00 176.83 177.40 1r6h h LEU 90 N 0.58 -0.17 -0.29 2.23 7.12 -1.11 -1.17 115.31 122.50 1r6h h LEU 90 Ca 0.10 -0.01 -0.08 0.00 0.13 0.00 0.00 57.88 58.02 1r6h h LEU 90 Cb 0.64 0.04 -0.01 0.00 -0.53 0.00 0.00 40.66 40.80 1r6h h LEU 90 CO 0.04 -0.11 -0.15 1.62 -0.13 0.00 0.00 178.44 179.72 1r6h h VAL 91 N -0.22 1.30 -0.98 1.05 3.04 -0.71 -2.63 116.25 117.10 1r6h h VAL 91 Ca -0.02 -1.24 0.12 0.00 -1.01 0.00 0.00 66.70 64.54 1r6h h VAL 91 Cb 0.17 1.49 -0.08 0.00 -2.01 0.00 0.00 31.29 30.85 1r6h h VAL 91 CO 0.03 0.40 0.61 0.11 -1.01 0.00 0.00 177.57 177.71 1r6h h LYS 92 N 0.35 0.95 -0.25 4.17 1.57 -0.10 0.82 116.57 124.07 1r6h h LYS 92 Ca 0.06 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1r6h h LYS 92 Cb 0.67 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 1r6h h LYS 92 CO 0.04 0.63 -0.02 0.00 -0.57 0.00 0.00 179.45 179.53 1r6h h ALA 93 N 1.53 0.34 0.00 3.86 0.00 -1.12 0.14 119.26 124.01 1r6h h ALA 93 Ca 0.48 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 1r6h h ALA 93 Cb 0.47 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1r6h h ALA 93 CO -0.26 0.09 -0.35 0.87 0.00 0.00 0.00 179.25 179.60 1r6h h LYS 94 N 0.22 0.00 0.10 0.00 1.79 -0.96 -1.19 116.57 116.53 1r6h h LYS 94 Ca 0.07 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.36 1r6h h LYS 94 Cb 0.45 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.11 1r6h h LYS 94 CO 0.02 0.35 -0.86 0.74 -1.08 0.00 0.00 179.45 178.62 1r6h h PHE 95 N 0.00 0.40 -0.20 -1.35 -1.00 0.76 -1.96 116.94 113.59 1r6h h PHE 95 Ca -0.00 -0.29 -0.18 0.00 2.81 0.00 0.00 57.97 60.30 1r6h h PHE 95 Cb 1.00 -0.02 -0.00 0.00 3.61 0.00 0.00 35.95 40.54 1r6h h PHE 95 CO 0.00 1.33 -0.61 0.00 -1.61 0.00 0.00 178.31 177.42 1r6h h GLU 97 N 0.50 0.21 -3.11 0.00 4.22 -1.36 -3.39 114.58 111.66 1r6h h GLU 97 Ca -0.01 -0.23 -0.62 0.00 0.08 0.00 0.00 59.36 58.58 1r6h h GLU 97 Cb 1.20 0.07 -0.40 0.00 0.50 0.00 0.00 28.75 30.11 1r6h h GLU 97 CO 0.12 0.97 -0.70 0.00 -2.18 0.00 0.00 179.01 177.22 1r6h s ALA 98 N -3.20 2.65 0.12 2.92 0.00 -0.73 -5.06 121.76 118.45 1r6h s ALA 98 Ca -0.03 -2.92 -0.30 0.00 0.00 0.00 0.00 51.96 48.71 1r6h s ALA 98 Cb 0.10 -1.99 -0.06 0.00 0.00 0.00 0.00 23.12 21.17 1r6h s ALA 98 CO 0.83 -2.05 1.06 -1.25 0.00 0.00 0.00 175.76 174.35 1r6h s PRO 99 N -0.02 4.60 -0.49 0.00 0.04 -1.19 -3.84 135.00 134.09 1r6h s PRO 99 Ca 0.18 1.61 -0.01 0.00 0.04 0.00 0.00 61.00 62.82 1r6h s PRO 99 Cb -0.22 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 30.98 1r6h s PRO 99 CO -0.02 0.05 0.42 0.41 0.04 0.00 0.00 177.00 177.90 1r6h n GLY 100 N 2.39 0.22 0.00 0.56 0.00 -1.26 -4.88 105.19 102.21 1r6h n GLY 100 Ca 0.04 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.27 0.12 -3.92 1.61 2.88 -1.25 -4.72 113.62 107.08 1r6h n SER 101 Ca -0.07 -0.51 -0.29 0.00 -1.33 0.00 0.00 58.87 56.67 1r6h n SER 101 Cb 0.55 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.85 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 1.53 3.73 0.05 0.00 1.01 -1.21 0.81 120.40 126.33 1r6h s VAL 103 Ca -0.01 -1.20 0.09 0.00 0.00 0.00 0.00 61.98 60.86 1r6h s VAL 103 Cb -0.16 -2.80 -0.03 0.00 0.00 0.00 0.00 36.38 33.39 1r6h s VAL 103 CO -0.08 0.05 -0.24 0.00 0.00 0.00 0.00 175.10 174.84 1r6h s ALA 104 N -1.39 2.35 0.16 5.51 0.00 -1.05 -0.04 121.76 127.29 1r6h s ALA 104 Ca 0.25 -1.26 -0.01 0.00 0.00 0.00 0.00 51.96 50.94 1r6h s ALA 104 Cb -0.11 -0.54 -0.04 0.00 0.00 0.00 0.00 23.12 22.43 1r6h s ALA 104 CO 0.17 0.54 0.09 0.08 0.00 0.00 0.00 175.76 176.65 1r6h s VAL 105 N -0.85 0.06 0.73 0.00 1.01 0.41 -1.02 120.40 120.75 1r6h s VAL 105 Ca 0.13 -1.92 -0.14 0.00 0.00 0.00 0.00 61.98 60.05 1r6h s VAL 105 Cb -0.10 -2.20 0.04 0.00 0.00 0.00 0.00 36.38 34.11 1r6h s VAL 105 CO 0.03 -0.29 1.13 -2.28 0.00 0.00 0.00 175.10 173.70 1r6h s HIS 106 N -4.09 2.36 -0.55 5.22 5.65 -0.94 0.10 115.29 123.06 1r6h s HIS 106 Ca 0.29 1.59 -0.27 0.00 0.25 0.00 0.00 55.06 56.93 1r6h s HIS 106 Cb 0.07 -3.24 -0.03 0.00 -1.18 0.00 0.00 32.58 28.21 1r6h s HIS 106 CO 0.06 -2.06 1.92 0.00 -0.65 0.00 0.00 174.74 174.01 1r6h n VAL 108 N 7.35 0.00 0.03 0.00 3.14 -1.26 -3.81 118.33 123.77 1r6h n VAL 108 Ca 0.23 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.61 1r6h n VAL 108 Cb 0.52 -0.61 0.02 0.00 -1.06 0.00 0.00 33.84 32.70 1r6h n VAL 108 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1r6h n ALA 109 N -1.00 1.10 -2.93 1.55 0.00 -1.26 -4.24 120.51 113.73 1r6h n ALA 109 Ca 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1r6h n ALA 109 Cb 0.08 -1.01 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 -1.36 2.39 2.92 0.00 0.00 -1.25 -5.01 105.19 102.88 1r6h n GLY 110 Ca 0.00 -0.10 -0.23 0.00 0.00 0.00 0.00 46.02 45.69 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 1.33 0.00 0.99 1.02 -1.26 -4.14 118.68 116.61 1r6h s LEU 111 Ca 0.00 -0.20 0.00 0.00 0.02 0.00 0.00 54.13 53.95 1r6h s LEU 111 Cb 0.00 -0.62 0.00 0.00 0.02 0.00 0.00 46.19 45.59 1r6h s LEU 111 CO 0.00 -0.05 0.00 0.61 0.02 0.00 0.00 176.35 176.93 1r6h n GLY 112 N 4.22 2.74 0.00 -3.19 0.00 -1.26 -4.95 105.19 102.75 1r6h n GLY 112 Ca -0.21 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 1.28 -0.23 1.61 3.00 -1.26 -4.56 116.66 116.49 1r6h n ARG 113 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 57.85 57.88 1r6h n ARG 113 Cb 0.00 -0.94 0.15 0.00 0.00 0.00 0.00 32.46 31.67 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 0.85 -0.51 7.54 0.00 -1.92 -2.56 119.26 122.65 1r6h h ALA 114 Ca 0.00 0.16 0.10 0.00 0.00 0.00 0.00 54.91 55.17 1r6h h ALA 114 Cb 0.18 0.23 -0.08 0.00 0.00 0.00 0.00 17.79 18.12 1r6h h ALA 114 CO 0.00 -0.34 0.01 -1.00 0.00 0.00 0.00 179.25 177.93 1r6h h PRO 115 N 0.25 0.12 -0.70 0.00 0.13 -1.89 -0.24 132.00 129.68 1r6h h PRO 115 Ca 0.38 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.49 1r6h h PRO 115 Cb 0.62 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 31.69 1r6h h PRO 115 CO -0.49 0.08 0.41 0.28 -0.23 0.00 0.00 178.00 178.05 1r6h h VAL 116 N 0.13 1.20 0.33 1.56 2.07 -1.81 -2.49 116.25 117.24 1r6h h VAL 116 Ca 0.26 -0.47 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 1r6h h VAL 116 Cb 0.39 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1r6h h VAL 116 CO -0.42 0.22 -0.27 -0.07 0.02 0.00 0.00 177.57 177.04 1r6h h LEU 117 N 0.95 -0.71 -0.01 2.57 3.38 -1.00 -1.07 115.31 119.42 1r6h h LEU 117 Ca 0.25 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.31 1r6h h LEU 117 Cb -0.01 0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 1r6h h LEU 117 CO -0.04 -0.40 -0.32 0.58 0.09 0.00 0.00 178.44 178.35 1r6h h VAL 118 N -0.61 0.31 -0.14 1.22 2.07 -0.96 -0.17 116.25 117.98 1r6h h VAL 118 Ca -0.02 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.54 1r6h h VAL 118 Cb 0.54 0.31 -0.06 0.00 -1.52 0.00 0.00 31.29 30.56 1r6h h VAL 118 CO -0.02 0.00 -0.22 0.00 0.02 0.00 0.00 177.57 177.35 1r6h h ALA 119 N 0.28 -0.18 -0.60 1.67 0.00 -1.39 0.73 119.26 119.76 1r6h h ALA 119 Ca 0.06 0.05 0.16 0.00 0.00 0.00 0.00 54.91 55.18 1r6h h ALA 119 Cb 0.55 0.44 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1r6h h ALA 119 CO -0.27 -0.68 0.42 -0.07 0.00 0.00 0.00 179.25 178.65 1r6h h LEU 120 N -0.28 0.07 -0.03 0.00 -0.00 -0.81 -0.79 115.31 113.47 1r6h h LEU 120 Ca 0.10 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 57.97 1r6h h LEU 120 Cb 0.43 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.08 1r6h h LEU 120 CO -0.30 0.04 -0.07 0.00 -0.00 0.00 0.00 178.44 178.10 1r6h h ALA 121 N 1.70 0.04 0.00 1.53 0.00 0.95 -2.96 119.26 120.52 1r6h h ALA 121 Ca 0.29 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1r6h h ALA 121 Cb 1.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1r6h h ALA 121 CO -0.02 -0.10 0.00 -0.11 0.00 0.00 0.00 179.25 179.02 1r6h n LEU 122 N -4.70 0.58 0.07 0.00 0.00 -0.24 -2.11 117.00 110.60 1r6h n LEU 122 Ca -0.08 0.73 0.14 0.00 0.00 0.00 0.00 56.01 56.79 1r6h n LEU 122 Cb 0.35 -0.75 0.63 0.00 0.00 0.00 0.00 43.42 43.64 1r6h n LEU 122 CO 0.36 -0.83 1.15 0.40 0.00 0.00 0.00 177.39 178.46 1r6h h ILE 123 N 0.00 0.87 0.00 1.96 2.04 -1.02 0.19 117.51 121.55 1r6h h ILE 123 Ca 0.00 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.83 1r6h h ILE 123 Cb 0.11 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 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 0.10 0.00 -0.20 2.37 -0.00 -1.60 -3.05 114.58 112.20 1r6h h GLU 124 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.53 1r6h h GLU 124 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.29 1r6h h GLU 124 CO -0.02 0.00 0.00 0.43 -0.00 0.00 0.00 179.01 179.42 1r6h n SER 125 N -2.56 0.74 0.00 3.06 7.64 0.68 -4.99 113.62 118.20 1r6h n SER 125 Ca 0.02 -2.02 0.00 0.00 1.01 0.00 0.00 58.87 57.88 1r6h n SER 125 Cb 0.28 -0.12 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 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 1.39 3.56 0.23 0.00 -1.15 -4.93 105.19 104.92 1r6h n GLY 126 Ca 0.04 -0.85 -0.21 0.00 0.00 0.00 0.00 46.02 44.99 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 0.47 0.04 1.61 0.00 -1.26 -4.71 117.12 113.26 1r6h n MET 127 Ca 0.00 -1.81 -0.02 0.00 0.00 0.00 0.00 57.70 55.87 1r6h n MET 127 Cb 0.00 -3.73 -0.01 0.00 0.00 0.00 0.00 33.22 29.48 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 10.95 -0.11 -0.11 3.17 2.10 -1.83 -1.63 116.57 129.12 1r6h h LYS 128 Ca 0.09 0.01 -0.09 0.00 -2.00 0.00 0.00 60.65 58.66 1r6h h LYS 128 Cb 0.94 0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 32.29 1r6h h LYS 128 CO 1.19 -0.07 -0.32 -0.92 -2.00 0.00 0.00 179.45 177.32 1r6h h TYR 129 N -0.27 0.24 0.05 0.07 3.20 -1.90 0.22 116.97 118.59 1r6h h TYR 129 Ca -0.01 -0.05 -0.00 0.00 3.14 0.00 0.00 58.73 61.80 1r6h h TYR 129 Cb 0.09 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.30 1r6h h TYR 129 CO 0.06 0.52 -0.03 0.93 -1.64 0.00 0.00 178.16 178.01 1r6h h GLU 130 N 0.19 -0.07 -0.33 1.82 5.08 -1.94 -2.49 114.58 116.84 1r6h h GLU 130 Ca 0.03 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.24 1r6h h GLU 130 Cb 0.67 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 1r6h h GLU 130 CO 0.05 0.49 -0.39 0.22 -1.00 0.00 0.00 179.01 178.38 1r6h h ASP 131 N -0.69 0.85 -0.01 1.42 3.58 -1.27 0.97 116.42 121.28 1r6h h ASP 131 Ca -0.01 -0.38 0.00 0.00 0.42 0.00 0.00 57.03 57.06 1r6h h ASP 131 Cb 0.59 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.40 1r6h h ASP 131 CO 0.01 1.13 0.00 0.00 -2.88 0.00 0.00 179.24 177.51 1r6h h ALA 132 N 0.90 0.01 -0.12 -0.78 0.00 -0.64 0.84 119.26 119.47 1r6h h ALA 132 Ca 0.06 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.75 1r6h h ALA 132 Cb 0.95 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1r6h h ALA 132 CO 0.09 -0.48 -0.77 0.82 0.00 0.00 0.00 179.25 178.90 1r6h h ILE 133 N -0.01 1.32 -0.00 0.00 1.08 -1.44 -1.69 117.51 116.76 1r6h h ILE 133 Ca 0.00 -2.05 -0.01 0.00 -0.39 0.00 0.00 64.86 62.42 1r6h h ILE 133 Cb 0.02 2.05 0.00 0.00 -3.07 0.00 0.00 36.82 35.81 1r6h h ILE 133 CO -0.00 0.64 -0.02 -0.61 -0.69 0.00 0.00 178.15 177.46 1r6h h GLN 134 N 0.43 0.02 -0.25 2.37 -0.00 -0.68 -0.79 115.11 116.22 1r6h h GLN 134 Ca -0.05 -0.02 -0.14 0.00 -0.00 0.00 0.00 58.65 58.44 1r6h h GLN 134 Cb 1.38 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 28.86 1r6h h GLN 134 CO 0.15 0.72 -0.43 0.35 0.00 0.00 0.00 178.83 179.62 1r6h h PHE 135 N -0.67 0.73 0.00 3.99 3.57 0.59 -2.55 116.94 122.60 1r6h h PHE 135 Ca -0.00 -0.22 -0.12 0.00 3.53 0.00 0.00 57.97 61.16 1r6h h PHE 135 Cb 0.73 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 1r6h h PHE 135 CO 0.17 0.93 -0.56 0.97 -2.23 0.00 0.00 178.31 177.59 1r6h h ILE 136 N 0.49 1.19 -0.02 1.41 2.10 -1.38 -2.89 117.51 118.41 1r6h h ILE 136 Ca 0.04 -2.07 -0.00 0.00 1.08 0.00 0.00 64.86 63.90 1r6h h ILE 136 Cb 0.95 2.19 -0.00 0.00 -1.09 0.00 0.00 36.82 38.87 1r6h h ILE 136 CO 0.09 0.55 0.00 0.03 -1.08 0.00 0.00 178.15 177.73 1r6h h ARG 137 N 0.00 0.04 -0.50 2.19 2.47 -0.89 -3.16 114.38 114.53 1r6h h ARG 137 Ca -0.01 -0.01 0.01 0.00 -1.26 0.00 0.00 59.98 58.71 1r6h h ARG 137 Cb 1.15 -0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 29.44 1r6h h ARG 137 CO 0.07 0.33 0.32 1.96 0.56 0.00 0.00 179.97 183.22 1r6h h GLN 138 N -0.26 0.64 -6.88 0.04 1.08 -1.48 -3.43 115.11 104.81 1r6h h GLN 138 Ca 0.01 -0.04 -0.48 0.00 -1.45 0.00 0.00 58.65 56.69 1r6h h GLN 138 Cb 0.32 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.59 1r6h h GLN 138 CO 0.00 0.42 0.18 0.15 -0.95 0.00 0.00 178.83 178.64 1r6h s LYS 139 N -6.15 3.96 -0.20 1.46 -0.14 -1.09 -5.00 119.74 112.57 1r6h s LYS 139 Ca -0.13 0.72 -0.29 0.00 -1.36 0.00 0.00 55.97 54.91 1r6h s LYS 139 Cb 0.12 -2.34 -0.02 0.00 -1.68 0.00 0.00 37.83 33.92 1r6h s LYS 139 CO 0.74 0.01 1.40 0.50 -0.76 0.00 0.00 175.35 177.24 1r6h s ARG 140 N -3.43 4.03 0.32 1.68 3.00 -1.26 -4.78 118.95 118.50 1r6h s ARG 140 Ca 0.55 1.60 0.09 0.00 -1.00 0.00 0.00 55.73 56.97 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 -0.98 0.03 -0.98 0.00 0.00 0.00 175.30 173.60 1r6h s ARG 141 N 4.04 2.18 0.16 5.12 3.03 -1.26 -4.33 118.95 127.88 1r6h s ARG 141 Ca 0.61 -1.62 -0.02 0.00 2.03 0.00 0.00 55.73 56.72 1r6h s ARG 141 Cb -0.22 -2.04 0.04 0.00 -1.03 0.00 0.00 34.95 31.70 1r6h s ARG 141 CO 0.22 0.19 0.09 0.41 -1.13 0.00 0.00 175.30 175.08 1r6h n GLY 142 N -0.98 -3.07 3.54 3.88 0.00 -1.26 -4.79 105.19 102.52 1r6h n GLY 142 Ca -0.04 -1.01 -0.41 0.00 0.00 0.00 0.00 46.02 44.55 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 -2.01 2.78 -0.48 4.61 0.00 -1.26 -4.91 121.76 120.49 1r6h s ALA 143 Ca 0.07 -1.51 -0.23 0.00 0.00 0.00 0.00 51.96 50.29 1r6h s ALA 143 Cb -0.01 -4.26 0.03 0.00 0.00 0.00 0.00 23.12 18.88 1r6h s ALA 143 CO 0.06 -3.29 0.80 0.96 0.00 0.00 0.00 175.76 174.29 1r6h s ILE 144 N 5.52 4.62 0.00 0.00 -4.36 -1.26 -4.90 121.20 120.82 1r6h s ILE 144 Ca 0.35 0.28 0.00 0.00 -0.26 0.00 0.00 60.65 61.02 1r6h s ILE 144 Cb -0.08 -4.37 0.00 0.00 1.25 0.00 0.00 42.46 39.27 1r6h s ILE 144 CO 0.12 -0.82 0.00 0.59 0.24 0.00 0.00 174.94 175.07 1r6h n ASN 145 N 6.82 0.00 -0.08 4.36 5.03 -1.26 -4.93 115.26 125.20 1r6h n ASN 145 Ca 0.01 0.00 -0.08 0.00 0.87 0.00 0.00 54.58 55.38 1r6h n ASN 145 Cb 0.48 -0.04 -0.03 0.00 -1.02 0.00 0.00 39.78 39.17 1r6h n ASN 145 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1r6h n SER 146 N -1.51 1.78 -0.01 6.41 7.64 -1.26 -4.58 113.62 122.09 1r6h n SER 146 Ca 0.00 0.30 -0.09 0.00 1.01 0.00 0.00 58.87 60.09 1r6h n SER 146 Cb 0.00 -0.71 -0.03 0.00 -1.01 0.00 0.00 64.21 62.46 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 -0.90 -0.19 -0.03 1.43 3.11 -1.96 0.18 116.57 118.22 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 0.04 -0.03 0.00 -1.00 0.00 0.00 32.23 32.14 1r6h h LYS 147 CO 0.00 -0.13 -0.13 0.37 -2.81 0.00 0.00 179.45 176.75 1r6h h GLN 148 N -0.20 -0.21 -0.03 1.90 -0.00 -1.93 0.67 115.11 115.32 1r6h h GLN 148 Ca 0.10 0.01 -0.14 0.00 -0.00 0.00 0.00 58.65 58.62 1r6h h GLN 148 Cb 0.34 0.05 0.01 0.00 0.00 0.00 0.00 27.48 27.88 1r6h h GLN 148 CO -0.26 -0.14 -0.53 -0.07 0.00 0.00 0.00 178.83 177.83 1r6h h LEU 149 N -0.21 0.52 -0.79 -2.39 -0.00 -1.79 -2.67 115.31 107.97 1r6h h LEU 149 Ca 0.06 -0.73 -0.12 0.00 -0.00 0.00 0.00 57.88 57.09 1r6h h LEU 149 Cb 0.29 -0.16 -0.01 0.00 -0.00 0.00 0.00 40.66 40.78 1r6h h LEU 149 CO -0.15 1.17 -0.37 0.74 -0.00 0.00 0.00 178.44 179.83 1r6h h THR 150 N -0.09 1.29 0.03 0.22 2.02 -0.61 -0.45 112.91 115.33 1r6h h THR 150 Ca -0.06 -1.49 -0.00 0.00 0.77 0.00 0.00 66.41 65.63 1r6h h THR 150 Cb 1.23 1.53 0.00 0.00 -1.74 0.00 0.00 68.15 69.17 1r6h h THR 150 CO 0.11 0.47 -0.02 0.22 0.37 0.00 0.00 175.52 176.67 1r6h h TYR 151 N 0.41 -0.04 -0.14 3.16 3.20 0.29 -2.27 116.97 121.57 1r6h h TYR 151 Ca 0.04 -0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.79 1r6h h TYR 151 Cb 0.83 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.10 1r6h h TYR 151 CO 0.03 0.38 -0.43 1.25 -1.64 0.00 0.00 178.16 177.75 1r6h h LEU 152 N -0.48 0.34 -0.60 2.82 6.46 -1.50 -1.40 115.31 120.95 1r6h h LEU 152 Ca -0.00 -0.15 0.05 0.00 -0.12 0.00 0.00 57.88 57.65 1r6h h LEU 152 Cb 0.44 -0.09 -0.05 0.00 -0.73 0.00 0.00 40.66 40.23 1r6h h LEU 152 CO 0.01 0.73 0.33 -0.08 -0.62 0.00 0.00 178.44 178.81 1r6h h GLU 153 N 0.26 0.62 0.00 1.25 4.81 -1.05 0.12 114.58 120.59 1r6h h GLU 153 Ca 0.02 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.14 1r6h h GLU 153 Cb 0.86 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 1r6h h GLU 153 CO 0.07 0.41 -0.36 -0.22 -0.73 0.00 0.00 179.01 178.18 1r6h h LYS 154 N 0.64 0.00 0.00 1.92 3.11 -1.13 -2.59 116.57 118.52 1r6h h LYS 154 Ca 0.26 0.00 -0.06 0.00 -2.81 0.00 0.00 60.65 58.04 1r6h h LYS 154 Cb 0.13 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.35 1r6h h LYS 154 CO -0.15 0.36 -0.30 -0.92 -2.81 0.00 0.00 179.45 175.63 1r6h h TYR 155 N 0.00 0.00 -3.62 1.91 5.03 0.32 -3.40 116.97 117.21 1r6h h TYR 155 Ca -0.00 0.00 -0.68 0.00 2.58 0.00 0.00 58.73 60.63 1r6h h TYR 155 Cb 0.75 0.00 -0.25 0.00 1.55 0.00 0.00 36.73 38.78 1r6h h TYR 155 CO 0.00 0.30 -0.59 0.50 -1.32 0.00 0.00 178.16 177.05 1r6h s ARG 156 N -4.27 3.14 0.64 1.82 3.00 -0.47 -5.05 118.95 117.75 1r6h s ARG 156 Ca -0.03 -0.84 -0.16 0.00 -1.00 0.00 0.00 55.73 53.70 1r6h s ARG 156 Cb 0.14 -3.47 -0.01 0.00 0.00 0.00 0.00 34.95 31.62 1r6h s ARG 156 CO 0.70 -0.46 1.15 -1.25 0.00 0.00 0.00 175.30 175.44 1r6h s PRO 157 N 1.54 2.80 -0.13 5.12 0.04 -1.26 -4.89 135.00 138.23 1r6h s PRO 157 Ca 0.03 1.57 -0.05 0.00 0.04 0.00 0.00 61.00 62.59 1r6h s PRO 157 Cb -0.17 -1.94 0.06 0.00 0.04 0.00 0.00 34.50 32.49 1r6h s PRO 157 CO 0.04 -1.28 0.27 0.15 0.04 0.00 0.00 177.00 176.22 1r6h s LYS 158 N -3.79 0.18 0.00 4.56 1.02 -1.26 -5.01 119.74 115.44 1r6h s LYS 158 Ca 0.71 0.69 0.22 0.00 0.02 0.00 0.00 55.97 57.61 1r6h s LYS 158 Cb -0.24 -0.05 1.23 0.00 -0.52 0.00 0.00 37.83 38.25 1r6h s LYS 158 CO 0.38 -0.24 1.80 0.94 -0.92 0.00 0.00 175.35 177.31 1r6h n GLN 159 N 4.95 1.08 0.22 1.68 -0.06 -1.26 -3.82 117.38 120.17 1r6h n GLN 159 Ca -0.13 -0.12 0.12 0.00 -2.00 0.00 0.00 57.00 54.87 1r6h n GLN 159 Cb 0.51 -1.34 0.70 0.00 -4.06 0.00 0.00 30.24 26.04 1r6h n GLN 159 CO 0.00 0.00 0.00 -0.09 -0.20 0.00 0.00 177.06 176.77 1r6h h ARG 160 N 0.25 0.00 -0.61 3.69 1.12 -1.99 -1.41 114.38 115.42 1r6h h ARG 160 Ca 0.00 0.00 -0.08 0.00 -1.11 0.00 0.00 59.98 58.79 1r6h h ARG 160 Cb 0.05 0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 29.99 1r6h h ARG 160 CO 0.00 0.00 0.06 -0.07 -3.11 0.00 0.00 179.97 176.85 1r6h h LEU 161 N 0.00 1.00-10.62 3.80 3.38 -2.03 -3.44 115.31 107.39 1r6h h LEU 161 Ca 0.05 -0.25 -0.48 0.00 0.09 0.00 0.00 57.88 57.28 1r6h h LEU 161 Cb 0.20 -0.27 0.03 0.00 0.09 0.00 0.00 40.66 40.72 1r6h h LEU 161 CO -0.00 1.02 -0.11 -0.60 0.09 0.00 0.00 178.44 178.83 1r6h s ARG 162 N -5.11 2.36 0.07 1.13 3.52 -0.53 -5.08 118.95 115.31 1r6h s ARG 162 Ca -0.11 -1.60 0.00 0.00 -0.13 0.00 0.00 55.73 53.89 1r6h s ARG 162 Cb 0.14 -2.66 0.00 0.00 -1.56 0.00 0.00 34.95 30.87 1r6h s ARG 162 CO 0.84 -0.80 0.00 1.97 -0.81 0.00 0.00 175.30 176.50 1r6h n PHE 163 N -2.20 -0.07 -2.33 5.12 -1.74 -1.26 -4.95 117.46 110.02 1r6h n PHE 163 Ca 0.15 0.01 0.00 0.00 -0.56 0.00 0.00 57.45 57.05 1r6h n PHE 163 Cb 0.61 0.02 0.00 0.00 1.52 0.00 0.00 39.48 41.64 1r6h n PHE 163 CO 0.00 0.00 0.00 1.17 -0.56 0.00 0.00 176.76 177.37 1r6h n LYS 164 N -3.29 -5.16 -3.13 3.97 4.81 -1.26 -4.89 118.16 109.21 1r6h n LYS 164 Ca 0.00 3.72 -0.44 0.00 -0.87 0.00 0.00 58.31 60.72 1r6h n LYS 164 Cb 0.19 -4.62 -0.06 0.00 0.02 0.00 0.00 35.03 30.57 1r6h n LYS 164 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1r6h s ASP 165 N -0.58 6.21 -0.99 3.14 2.15 -1.26 -4.96 116.67 120.38 1r6h s ASP 165 Ca 0.00 -1.05 -0.10 0.00 0.43 0.00 0.00 52.55 51.83 1r6h s ASP 165 Cb 0.00 -2.30 -0.07 0.00 -0.30 0.00 0.00 42.92 40.25 1r6h s ASP 165 CO 0.00 -0.97 2.17 -0.81 -0.17 0.00 0.00 175.17 175.39 1r6h n PRO 166 N 6.27 2.18 -2.95 4.34 -0.04 -1.26 -4.88 135.00 138.66 1r6h n PRO 166 Ca -0.07 -1.68 -0.42 0.00 -0.04 0.00 0.00 63.50 61.29 1r6h n PRO 166 Cb 0.45 -2.63 -0.05 0.00 -0.04 0.00 0.00 33.50 31.22 1r6h n PRO 166 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1r6h s HIS 167 N 3.60 3.06 0.06 0.54 2.46 -1.26 -5.03 115.29 118.72 1r6h s HIS 167 Ca 0.47 0.42 0.01 0.00 0.47 0.00 0.00 55.06 56.43 1r6h s HIS 167 Cb 0.12 -3.53 -0.03 0.00 -0.13 0.00 0.00 32.58 29.01 1r6h s HIS 167 CO -0.01 -0.84 -0.05 0.95 -2.47 0.00 0.00 174.74 172.32 1r6h s THR 168 N 3.21 0.45 -0.05 0.89 -4.23 -1.26 -5.07 115.64 109.59 1r6h s THR 168 Ca 0.31 -1.54 -0.24 0.00 -1.18 0.00 0.00 61.69 59.05 1r6h s THR 168 Cb -0.13 -1.16 -0.25 0.00 1.34 0.00 0.00 72.50 72.30 1r6h s THR 168 CO 0.19 -0.73 1.00 -0.74 -0.54 0.00 0.00 174.62 173.81 1r6h h HIS 169 N 3.64 0.34 -2.37 3.99 2.76 -2.05 -3.46 115.15 118.00 1r6h h HIS 169 Ca -0.35 -0.20 -0.45 0.00 -2.20 0.00 0.00 60.37 57.18 1r6h h HIS 169 Cb 1.17 -0.03 0.03 0.00 1.55 0.00 0.00 27.41 30.13 1r6h h HIS 169 CO 0.60 1.03 -0.16 0.21 -1.30 0.00 0.00 177.93 178.32 1r6h s LYS 170 N -2.97 2.96 0.01 5.26 2.20 -1.26 -5.11 119.74 120.82 1r6h s LYS 170 Ca -0.15 -0.73 0.06 0.00 -0.36 0.00 0.00 55.97 54.78 1r6h s LYS 170 Cb 0.01 -2.62 -0.03 0.00 -1.51 0.00 0.00 37.83 33.68 1r6h s LYS 170 CO 0.76 -0.28 -0.17 0.99 -0.36 0.00 0.00 175.35 176.30 1r6h s THR 171 N -2.49 2.87 0.00 3.43 2.01 -1.26 -5.15 115.64 115.05 1r6h s THR 171 Ca 0.50 -1.04 0.00 0.00 0.31 0.00 0.00 61.69 61.45 1r6h s THR 171 Cb -0.10 -2.18 0.00 0.00 0.01 0.00 0.00 72.50 70.23 1r6h s THR 171 CO 0.36 0.42 0.00 0.54 -0.69 0.00 0.00 174.62 175.24