#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 6.65 -0.22 1.61 0.15 -1.26 -5.00 113.70 115.63 1r6h s SER 2 Ca 0.00 1.48 0.02 0.00 0.70 0.00 0.00 55.95 58.15 1r6h s SER 2 Cb 0.00 -2.54 0.04 0.00 -1.71 0.00 0.00 66.02 61.81 1r6h s SER 2 CO 0.00 -1.05 -0.14 -1.00 1.20 0.00 0.00 173.24 172.25 1r6h s HIS 3 N 4.39 3.03 -0.33 3.44 0.09 -1.26 -5.08 115.29 119.57 1r6h s HIS 3 Ca 0.61 -1.94 0.02 0.00 -0.00 0.00 0.00 55.06 53.74 1r6h s HIS 3 Cb -0.21 -1.94 0.09 0.00 -0.00 0.00 0.00 32.58 30.52 1r6h s HIS 3 CO 0.23 -0.83 0.04 -1.64 -0.00 0.00 0.00 174.74 172.54 1r6h s MET 4 N 1.21 1.88 -0.01 1.40 1.00 -1.26 -5.09 119.30 118.42 1r6h s MET 4 Ca -0.02 -1.67 0.07 0.00 0.00 0.00 0.00 55.69 54.08 1r6h s MET 4 Cb -0.17 -3.21 -0.02 0.00 0.00 0.00 0.00 34.83 31.43 1r6h s MET 4 CO -0.08 -0.84 -0.24 0.00 0.00 0.00 0.00 175.02 173.85 1r6h s ALA 5 N 1.04 1.99 0.09 3.03 0.00 -1.26 -5.03 121.76 121.62 1r6h s ALA 5 Ca 0.04 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 50.95 1r6h s ALA 5 Cb -0.20 -0.50 0.00 0.00 0.00 0.00 0.00 23.12 22.42 1r6h s ALA 5 CO -0.06 0.49 0.00 -2.13 0.00 0.00 0.00 175.76 174.06 1r6h n ARG 6 N 2.42 0.00 -4.70 0.00 0.63 -1.26 -5.09 116.66 108.66 1r6h n ARG 6 Ca -0.16 0.00 -0.33 0.00 -0.92 0.00 0.00 57.85 56.44 1r6h n ARG 6 Cb 0.52 -0.08 -0.14 0.00 0.45 0.00 0.00 32.46 33.21 1r6h n ARG 6 CO 0.00 0.00 0.00 -1.64 -2.51 0.00 0.00 177.63 173.48 1r6h s MET 7 N -1.41 3.39 -0.05 -0.14 -1.94 -1.26 -4.95 119.30 112.94 1r6h s MET 7 Ca 0.00 -0.65 0.02 0.00 -1.71 0.00 0.00 55.69 53.35 1r6h s MET 7 Cb 0.00 -2.68 0.06 0.00 2.01 0.00 0.00 34.83 34.22 1r6h s MET 7 CO 0.00 0.26 0.91 0.27 -0.01 0.00 0.00 175.02 176.45 1r6h n ASN 8 N 3.42 -0.88 -3.17 3.03 6.94 -1.26 -5.10 115.26 118.24 1r6h n ASN 8 Ca -0.18 -1.69 0.05 0.00 -0.02 0.00 0.00 54.58 52.74 1r6h n ASN 8 Cb 0.53 0.30 -0.02 0.00 -2.36 0.00 0.00 39.78 38.23 1r6h n ASN 8 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1r6h s ARG 9 N 0.02 0.12 -0.36 -3.83 1.70 -1.26 -5.12 118.95 110.22 1r6h s ARG 9 Ca 0.01 0.23 -0.36 0.00 -0.47 0.00 0.00 55.73 55.15 1r6h s ARG 9 Cb 0.07 0.13 -0.12 0.00 -0.57 0.00 0.00 34.95 34.46 1r6h s ARG 9 CO -0.02 -0.11 2.19 -2.30 -1.08 0.00 0.00 175.30 173.98 1r6h n PRO 10 N 5.30 1.00 -2.71 3.89 -0.02 -1.26 -4.92 135.00 136.29 1r6h n PRO 10 Ca -0.08 0.27 -0.40 0.00 -2.02 0.00 0.00 63.50 61.27 1r6h n PRO 10 Cb 0.54 -2.40 -0.06 0.00 -0.02 0.00 0.00 33.50 31.56 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 7.28 3.35 0.84 3.55 0.00 -1.26 -4.77 121.76 130.75 1r6h s ALA 11 Ca 1.10 0.66 -0.12 0.00 0.00 0.00 0.00 51.96 53.61 1r6h s ALA 11 Cb -0.89 -3.23 0.09 0.00 0.00 0.00 0.00 23.12 19.09 1r6h s ALA 11 CO 0.50 0.15 1.10 -1.25 0.00 0.00 0.00 175.76 176.26 1r6h s PRO 12 N -1.24 1.74 -0.03 0.00 0.04 -1.26 -4.93 135.00 129.32 1r6h s PRO 12 Ca 0.42 0.68 -0.00 0.00 0.04 0.00 0.00 61.00 62.14 1r6h s PRO 12 Cb -0.27 -1.88 0.03 0.00 0.04 0.00 0.00 34.50 32.42 1r6h s PRO 12 CO 0.33 -1.87 0.02 0.08 0.04 0.00 0.00 177.00 175.61 1r6h s VAL 13 N -3.08 0.05 -0.29 -0.36 1.01 0.11 -4.95 120.40 112.90 1r6h s VAL 13 Ca 0.62 0.21 -0.08 0.00 0.00 0.00 0.00 61.98 62.72 1r6h s VAL 13 Cb -0.16 -0.21 -0.01 0.00 0.00 0.00 0.00 36.38 36.01 1r6h s VAL 13 CO 0.55 0.14 0.11 -1.83 0.00 0.00 0.00 175.10 174.07 1r6h s GLU 14 N 1.37 3.37 -0.26 2.72 -1.05 -1.26 0.12 118.70 123.71 1r6h s GLU 14 Ca -0.05 -0.68 -0.07 0.00 -0.15 0.00 0.00 54.97 54.02 1r6h s GLU 14 Cb -0.13 -3.44 -0.01 0.00 -0.44 0.00 0.00 34.13 30.11 1r6h s GLU 14 CO -0.03 -0.35 0.06 0.08 0.95 0.00 0.00 175.26 175.97 1r6h s VAL 15 N 1.58 4.04 0.02 1.83 1.01 -0.08 -4.89 120.40 123.91 1r6h s VAL 15 Ca 0.05 -0.42 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 1r6h s VAL 15 Cb -0.16 -2.96 -0.01 0.00 0.00 0.00 0.00 36.38 33.24 1r6h s VAL 15 CO 0.04 0.25 0.04 -0.44 0.00 0.00 0.00 175.10 175.00 1r6h s SER 16 N 1.55 0.19 0.01 3.32 0.01 -1.26 0.12 113.70 117.64 1r6h s SER 16 Ca 0.05 -0.47 -0.08 0.00 1.31 0.00 0.00 55.95 56.76 1r6h s SER 16 Cb -0.16 0.16 0.00 0.00 0.21 0.00 0.00 66.02 66.24 1r6h s SER 16 CO 0.02 -0.39 0.15 -0.72 0.41 0.00 0.00 173.24 172.71 1r6h s TYR 17 N -1.90 0.05 0.00 2.43 1.13 -0.50 -4.99 117.35 113.56 1r6h s TYR 17 Ca -0.11 -0.17 0.00 0.00 -1.41 0.00 0.00 57.07 55.38 1r6h s TYR 17 Cb -0.06 -0.05 0.00 0.00 -1.10 0.00 0.00 41.96 40.75 1r6h s TYR 17 CO -0.02 -0.32 0.00 0.36 -2.51 0.00 0.00 175.55 173.06 1r6h n LYS 18 N 1.27 0.00 0.00 -3.49 -0.00 -1.26 -1.90 118.16 112.78 1r6h n LYS 18 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.09 1r6h n LYS 18 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.59 1r6h n LYS 18 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.40 178.98 1r6h n HIS 19 N 0.00 0.00 -2.05 5.58 -0.00 -1.26 -5.09 115.22 112.39 1r6h n HIS 19 Ca 0.00 0.00 -0.33 0.00 0.46 0.00 0.00 57.72 57.85 1r6h n HIS 19 Cb 0.00 0.04 0.01 0.00 -0.12 0.00 0.00 29.99 29.92 1r6h n HIS 19 CO 0.00 0.00 0.00 1.41 0.46 0.00 0.00 176.34 178.21 1r6h s MET 20 N -1.59 3.29 0.16 1.57 1.75 -0.80 -4.78 119.30 118.91 1r6h s MET 20 Ca 0.00 1.25 0.01 0.00 -1.25 0.00 0.00 55.69 55.71 1r6h s MET 20 Cb 0.00 -2.03 -0.04 0.00 2.84 0.00 0.00 34.83 35.60 1r6h s MET 20 CO 0.00 -0.84 0.01 1.03 -0.65 0.00 0.00 175.02 174.57 1r6h s ARG 21 N -3.99 1.06 0.02 4.11 0.52 -1.23 -1.42 118.95 118.03 1r6h s ARG 21 Ca 0.65 -1.51 0.00 0.00 -0.52 0.00 0.00 55.73 54.35 1r6h s ARG 21 Cb -0.17 -0.18 -0.02 0.00 0.52 0.00 0.00 34.95 35.10 1r6h s ARG 21 CO 0.36 -0.14 -0.04 -0.06 0.02 0.00 0.00 175.30 175.44 1r6h s PHE 22 N -3.71 0.34 -0.08 -0.53 0.08 0.33 -3.65 117.98 110.75 1r6h s PHE 22 Ca 0.23 -0.53 0.05 0.00 0.12 0.00 0.00 56.93 56.80 1r6h s PHE 22 Cb 0.06 -0.23 -0.00 0.00 -0.57 0.00 0.00 43.02 42.28 1r6h s PHE 22 CO 0.03 -0.17 -0.23 -0.51 -0.10 0.00 0.00 175.22 174.24 1r6h s LEU 23 N -1.49 2.03 -0.31 -0.37 2.01 0.20 -0.90 118.68 119.84 1r6h s LEU 23 Ca -0.15 -0.51 0.01 0.00 0.01 0.00 0.00 54.13 53.49 1r6h s LEU 23 Cb -0.10 -1.31 0.07 0.00 0.01 0.00 0.00 46.19 44.86 1r6h s LEU 23 CO -0.01 0.17 0.00 -0.63 1.01 0.00 0.00 176.35 176.90 1r6h s ILE 24 N 0.19 2.62 0.26 -0.59 -1.09 0.33 0.18 121.20 123.10 1r6h s ILE 24 Ca -0.13 -1.75 0.03 0.00 -2.23 0.00 0.00 60.65 56.58 1r6h s ILE 24 Cb -0.16 -2.64 -0.06 0.00 -1.58 0.00 0.00 42.46 38.02 1r6h s ILE 24 CO 0.06 -0.26 0.02 0.42 -1.23 0.00 0.00 174.94 173.96 1r6h s THR 25 N 1.12 1.05 0.46 2.92 -4.23 0.75 0.09 115.64 117.79 1r6h s THR 25 Ca -0.01 -2.03 -0.18 0.00 -1.18 0.00 0.00 61.69 58.29 1r6h s THR 25 Cb -0.20 -2.50 -0.09 0.00 1.34 0.00 0.00 72.50 71.04 1r6h s THR 25 CO -0.04 -0.20 0.94 -1.38 -0.54 0.00 0.00 174.62 173.40 1r6h s HIS 26 N -3.41 3.39 0.73 3.99 -3.43 -1.26 0.27 115.29 115.56 1r6h s HIS 26 Ca 0.32 1.48 -0.15 0.00 -0.80 0.00 0.00 55.06 55.90 1r6h s HIS 26 Cb 0.07 -2.77 0.04 0.00 -1.43 0.00 0.00 32.58 28.48 1r6h s HIS 26 CO 0.11 -0.21 1.21 -0.80 -2.00 0.00 0.00 174.74 173.05 1r6h s ASN 27 N -2.65 4.23 0.40 7.38 0.01 -1.26 -4.82 114.94 118.23 1r6h s ASN 27 Ca 0.59 2.36 -0.26 0.00 -0.71 0.00 0.00 52.86 54.85 1r6h s ASN 27 Cb -0.10 -2.59 -0.11 0.00 0.41 0.00 0.00 41.25 38.87 1r6h s ASN 27 CO 0.23 -2.24 1.16 -2.65 -1.51 0.00 0.00 177.10 172.09 1r6h n PRO 28 N -2.67 1.71 -2.94 -0.60 -0.02 -1.26 -5.02 135.00 124.20 1r6h n PRO 28 Ca 0.13 0.61 -0.19 0.00 -2.02 0.00 0.00 63.50 62.03 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 -1.20 2.51 -0.79 3.45 -4.23 -1.26 -4.99 115.64 109.14 1r6h s THR 29 Ca 0.61 -0.93 0.23 0.00 -1.18 0.00 0.00 61.69 60.42 1r6h s THR 29 Cb -0.55 -2.59 -0.10 0.00 1.34 0.00 0.00 72.50 70.60 1r6h s THR 29 CO 0.58 0.00 1.11 -0.46 -0.54 0.00 0.00 174.62 175.31 1r6h n ASN 30 N -2.17 0.65 -0.05 3.99 0.23 -1.26 -4.33 115.26 112.32 1r6h n ASN 30 Ca 0.12 -0.37 -0.10 0.00 -0.53 0.00 0.00 54.58 53.70 1r6h n ASN 30 Cb 0.60 0.68 -0.15 0.00 -2.08 0.00 0.00 39.78 38.84 1r6h n ASN 30 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1r6h n ALA 31 N -1.68 1.45 -3.46 -2.53 0.00 -1.26 -4.80 120.51 108.24 1r6h n ALA 31 Ca 0.03 -0.95 -0.29 0.00 0.00 0.00 0.00 53.44 52.23 1r6h n ALA 31 Cb 0.39 -0.60 -0.12 0.00 0.00 0.00 0.00 19.45 19.12 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 0.15 -0.13 0.00 -4.23 -1.26 -4.98 115.64 102.63 1r6h s THR 32 Ca -0.09 -1.73 -0.22 0.00 -1.18 0.00 0.00 61.69 58.47 1r6h s THR 32 Cb 0.07 -1.12 -0.20 0.00 1.34 0.00 0.00 72.50 72.59 1r6h s THR 32 CO 0.82 -0.99 0.58 -0.07 -0.54 0.00 0.00 174.62 174.41 1r6h h LEU 33 N 6.99 0.00 -1.39 4.79 -0.00 -1.87 -3.28 115.31 120.54 1r6h h LEU 33 Ca 0.06 -0.76 0.07 0.00 -0.00 0.00 0.00 57.88 57.25 1r6h h LEU 33 Cb 0.97 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 41.58 1r6h h LEU 33 CO 0.27 0.89 0.47 0.28 -0.00 0.00 0.00 178.44 180.35 1r6h h SER 34 N -1.00 0.64 -0.22 -0.43 0.02 -1.96 -1.51 113.55 109.10 1r6h h SER 34 Ca -0.01 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 1r6h h SER 34 Cb 0.78 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.17 1r6h h SER 34 CO -0.00 0.41 -0.11 0.74 -1.14 0.00 0.00 176.83 176.73 1r6h h THR 35 N 0.73 1.24 -0.03 -2.27 2.02 -1.97 -2.29 112.91 110.34 1r6h h THR 35 Ca 0.31 -1.07 -0.05 0.00 0.77 0.00 0.00 66.41 66.37 1r6h h THR 35 Cb 0.28 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.79 1r6h h THR 35 CO -0.10 0.36 -0.17 0.15 0.37 0.00 0.00 175.52 176.13 1r6h h PHE 36 N 0.55 0.22 -0.75 3.16 3.04 -1.36 -2.66 116.94 119.14 1r6h h PHE 36 Ca 0.10 -0.10 0.04 0.00 3.98 0.00 0.00 57.97 61.99 1r6h h PHE 36 Cb 0.53 -0.03 -0.04 0.00 2.56 0.00 0.00 35.95 38.96 1r6h h PHE 36 CO 0.02 0.83 0.49 -0.84 -2.02 0.00 0.00 178.31 176.79 1r6h h ILE 37 N -0.45 1.10 0.15 1.41 3.07 -1.35 0.39 117.51 121.83 1r6h h ILE 37 Ca -0.01 -0.31 -0.01 0.00 1.55 0.00 0.00 64.86 66.08 1r6h h ILE 37 Cb 0.85 0.13 0.00 0.00 -0.27 0.00 0.00 36.82 37.53 1r6h h ILE 37 CO 0.03 0.16 -0.07 -0.08 -1.05 0.00 0.00 178.15 177.14 1r6h h GLU 38 N 0.89 -0.20 -0.00 0.16 4.81 -1.44 -0.53 114.58 118.27 1r6h h GLU 38 Ca 0.30 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.54 1r6h h GLU 38 Cb 0.08 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.51 1r6h h GLU 38 CO -0.09 0.05 -0.00 -0.44 -0.73 0.00 0.00 179.01 177.79 1r6h h ASP 39 N -0.43 0.01 -0.64 1.04 5.19 -1.10 0.64 116.42 121.13 1r6h h ASP 39 Ca -0.02 -0.49 0.08 0.00 -0.62 0.00 0.00 57.03 55.98 1r6h h ASP 39 Cb 0.34 -0.00 -0.07 0.00 0.18 0.00 0.00 39.33 39.78 1r6h h ASP 39 CO 0.03 0.50 0.30 -0.07 -3.12 0.00 0.00 179.24 176.88 1r6h h LEU 40 N -0.47 0.38 -0.19 1.55 3.38 -0.30 -0.35 115.31 119.31 1r6h h LEU 40 Ca 0.00 0.06 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 1r6h h LEU 40 Cb 0.49 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1r6h h LEU 40 CO 0.00 0.23 -0.62 0.50 0.09 0.00 0.00 178.44 178.64 1r6h h LYS 41 N 0.53 0.00 -0.87 1.13 3.64 -1.11 -3.28 116.57 116.62 1r6h h LYS 41 Ca 0.31 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.80 1r6h h LYS 41 Cb 0.32 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.06 1r6h h LYS 41 CO -0.26 0.62 0.50 0.87 -2.27 0.00 0.00 179.45 178.92 1r6h h LYS 42 N 0.00 0.79 -0.68 1.90 1.57 0.21 -1.21 116.57 119.14 1r6h h LYS 42 Ca -0.01 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.68 1r6h h LYS 42 Cb 1.40 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 33.50 1r6h h LYS 42 CO 0.08 0.52 0.22 -0.92 -0.57 0.00 0.00 179.45 178.78 1r6h h TYR 43 N 0.81 1.06 0.00 -1.35 5.03 -1.51 -3.48 116.97 117.53 1r6h h TYR 43 Ca 0.43 -0.09 0.00 0.00 2.58 0.00 0.00 58.73 61.65 1r6h h TYR 43 Cb 0.44 -0.31 0.00 0.00 1.55 0.00 0.00 36.73 38.41 1r6h h TYR 43 CO -0.05 0.84 0.00 0.41 -1.32 0.00 0.00 178.16 178.04 1r6h n GLY 44 N -0.85 -2.04 2.87 1.82 0.00 -0.46 -4.98 105.19 101.56 1r6h n GLY 44 Ca 0.06 -1.17 -0.26 0.00 0.00 0.00 0.00 46.02 44.64 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 -1.88 1.23 0.04 4.61 0.00 -1.24 -4.43 121.76 120.08 1r6h s ALA 45 Ca 0.00 -0.54 -0.03 0.00 0.00 0.00 0.00 51.96 51.39 1r6h s ALA 45 Cb 0.00 -0.94 0.01 0.00 0.00 0.00 0.00 23.12 22.19 1r6h s ALA 45 CO 0.00 -0.55 0.13 2.41 0.00 0.00 0.00 175.76 177.75 1r6h n THR 46 N 4.97 0.00 -0.95 0.00 -1.04 0.24 -3.91 114.28 113.59 1r6h n THR 46 Ca -0.11 -0.10 -0.30 0.00 -2.04 0.00 0.00 64.05 61.49 1r6h n THR 46 Cb 0.49 0.12 0.16 0.00 -1.82 0.00 0.00 70.33 69.28 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 -2.67 2.52 -0.02 12.58 -1.32 -1.26 -4.09 115.64 121.38 1r6h s THR 47 Ca 0.03 0.17 0.01 0.00 -1.21 0.00 0.00 61.69 60.68 1r6h s THR 47 Cb -0.01 -2.44 0.02 0.00 -1.51 0.00 0.00 72.50 68.56 1r6h s THR 47 CO 0.01 -0.22 -0.02 -0.69 -2.21 0.00 0.00 174.62 171.50 1r6h s VAL 48 N -2.77 0.25 -0.34 5.08 1.01 0.19 -2.53 120.40 121.29 1r6h s VAL 48 Ca 0.65 -0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.60 1r6h s VAL 48 Cb -0.20 -0.29 0.08 0.00 0.00 0.00 0.00 36.38 35.97 1r6h s VAL 48 CO 0.58 0.13 0.07 0.54 0.00 0.00 0.00 175.10 176.42 1r6h s VAL 49 N 0.61 2.92 -0.29 2.92 0.11 -0.47 0.40 120.40 126.59 1r6h s VAL 49 Ca -0.06 -1.77 -0.02 0.00 -2.93 0.00 0.00 61.98 57.20 1r6h s VAL 49 Cb -0.09 -2.86 0.05 0.00 -1.53 0.00 0.00 36.38 31.94 1r6h s VAL 49 CO -0.01 -0.37 -0.01 0.00 -3.33 0.00 0.00 175.10 171.38 1r6h s ARG 50 N 1.15 2.50 -0.69 1.54 1.70 -1.12 -2.42 118.95 121.62 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 -3.15 0.18 0.00 -0.57 0.00 0.00 34.95 31.20 1r6h s ARG 50 CO -0.03 -0.58 0.57 0.08 -1.08 0.00 0.00 175.30 174.26 1r6h s VAL 51 N 1.27 4.66 0.29 4.99 1.01 -1.26 -2.35 120.40 129.01 1r6h s VAL 51 Ca -0.04 -2.55 -0.17 0.00 0.00 0.00 0.00 61.98 59.21 1r6h s VAL 51 Cb -0.19 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.25 1r6h s VAL 51 CO -0.01 -0.93 0.66 0.00 0.00 0.00 0.00 175.10 174.82 1r6h s GLU 53 N -3.61 4.22 -0.04 0.00 0.41 -1.26 -4.05 118.70 114.36 1r6h s GLU 53 Ca 0.16 2.36 -0.30 0.00 -0.41 0.00 0.00 54.97 56.78 1r6h s GLU 53 Cb -0.04 -3.15 -0.05 0.00 -1.78 0.00 0.00 34.13 29.11 1r6h s GLU 53 CO 0.09 -0.60 1.52 0.14 -0.49 0.00 0.00 175.26 175.92 1r6h s VAL 54 N 1.07 3.67 0.00 2.63 -7.23 -1.26 -4.85 120.40 114.43 1r6h s VAL 54 Ca 0.69 0.92 0.00 0.00 -1.81 0.00 0.00 61.98 61.79 1r6h s VAL 54 Cb -0.44 -3.60 0.00 0.00 0.56 0.00 0.00 36.38 32.91 1r6h s VAL 54 CO 0.32 -0.05 0.00 0.41 -0.31 0.00 0.00 175.10 175.47 1r6h n THR 55 N 5.16 0.00 -3.66 5.32 -1.04 -1.26 -4.94 114.28 113.85 1r6h n THR 55 Ca 0.15 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.88 1r6h n THR 55 Cb 0.43 -1.22 -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 -1.99 2.11 0.09 -1.42 2.02 -1.26 -4.96 117.35 111.93 1r6h s TYR 56 Ca 0.00 -2.61 -0.06 0.00 -0.37 0.00 0.00 57.07 54.03 1r6h s TYR 56 Cb 0.00 -1.79 -0.23 0.00 -0.40 0.00 0.00 41.96 39.54 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 6.07 0.52 0.03 2.29 5.19 -1.99 -3.36 116.42 125.17 1r6h h ASP 57 Ca 0.11 -0.50 -0.05 0.00 -0.62 0.00 0.00 57.03 55.97 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 0.51 1.35 -0.21 0.11 -3.12 0.00 0.00 179.24 177.88 1r6h h LYS 58 N 0.14 0.09 -0.72 3.56 1.57 -2.01 -3.36 116.57 115.83 1r6h h LYS 58 Ca -0.13 -0.14 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 34.08 1r6h h LYS 58 CO 0.20 1.02 -0.16 1.15 -0.57 0.00 0.00 179.45 181.09 1r6h h THR 59 N -0.77 0.28 -0.81 -0.16 2.02 -1.98 -1.44 112.91 110.05 1r6h h THR 59 Ca -0.04 -0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.20 1r6h h THR 59 Cb 1.12 0.28 -0.06 0.00 -1.74 0.00 0.00 68.15 67.75 1r6h h THR 59 CO 0.04 0.00 0.50 -0.65 0.37 0.00 0.00 175.52 175.78 1r6h h PRO 60 N 0.01 0.90 -0.13 6.66 0.11 -1.73 0.33 132.00 138.15 1r6h h PRO 60 Ca 0.35 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.32 1r6h h PRO 60 Cb 0.55 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.45 1r6h h PRO 60 CO -0.73 0.60 -0.25 1.25 -0.21 0.00 0.00 178.00 178.66 1r6h h LEU 61 N 0.93 0.44 -0.00 2.35 7.12 -1.45 -1.52 115.31 123.19 1r6h h LEU 61 Ca 0.35 -0.55 -0.02 0.00 0.13 0.00 0.00 57.88 57.78 1r6h h LEU 61 Cb 0.14 -0.13 0.00 0.00 -0.53 0.00 0.00 40.66 40.14 1r6h h LEU 61 CO -0.16 0.91 -0.09 -0.33 -0.13 0.00 0.00 178.44 178.64 1r6h h GLU 62 N -0.01 0.07 0.00 1.25 3.07 -1.19 -1.17 114.58 116.60 1r6h h GLU 62 Ca 0.01 -0.07 -0.11 0.00 -0.50 0.00 0.00 59.36 58.69 1r6h h GLU 62 Cb 0.83 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.75 1r6h h GLU 62 CO 0.06 0.83 -0.51 0.87 -1.40 0.00 0.00 179.01 178.85 1r6h h LYS 63 N -0.67 0.00 0.00 2.33 1.57 -0.49 -3.26 116.57 116.06 1r6h h LYS 63 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1r6h h LYS 63 Cb 0.86 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.17 1r6h h LYS 63 CO 0.02 0.51 -1.09 -3.47 -0.57 0.00 0.00 179.45 174.85 1r6h n ASP 64 N -3.46 0.85 -1.92 0.86 -0.08 -0.57 -4.82 116.55 107.42 1r6h n ASP 64 Ca 0.00 -0.84 -0.08 0.00 -1.51 0.00 0.00 54.79 52.36 1r6h n ASP 64 Cb 0.63 1.13 -0.02 0.00 2.34 0.00 0.00 41.12 45.20 1r6h n ASP 64 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1r6h n GLY 65 N 1.45 0.08 3.33 0.27 0.00 -0.44 -4.91 105.19 104.97 1r6h n GLY 65 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.10 2.00 0.14 -0.61 -4.36 -1.25 -5.04 121.20 109.98 1r6h s ILE 66 Ca 0.00 -1.58 -0.30 0.00 -0.26 0.00 0.00 60.65 58.51 1r6h s ILE 66 Cb 0.00 -1.77 -0.07 0.00 1.25 0.00 0.00 42.46 41.87 1r6h s ILE 66 CO 0.00 0.09 1.05 -0.89 0.24 0.00 0.00 174.94 175.43 1r6h s THR 67 N -1.03 4.13 0.00 8.37 2.01 -1.26 -4.55 115.64 123.31 1r6h s THR 67 Ca 0.10 1.79 -0.04 0.00 0.31 0.00 0.00 61.69 63.86 1r6h s THR 67 Cb -0.10 -4.15 -0.01 0.00 0.01 0.00 0.00 72.50 68.26 1r6h s THR 67 CO 0.04 0.29 0.07 0.54 -0.69 0.00 0.00 174.62 174.87 1r6h s VAL 68 N -0.08 0.08 -0.17 3.82 0.11 -1.26 0.52 120.40 123.42 1r6h s VAL 68 Ca 0.49 -0.68 -0.07 0.00 -2.93 0.00 0.00 61.98 58.79 1r6h s VAL 68 Cb -0.27 -0.32 -0.04 0.00 -1.53 0.00 0.00 36.38 34.22 1r6h s VAL 68 CO 0.32 -0.37 0.06 -0.69 -3.33 0.00 0.00 175.10 171.10 1r6h s VAL 69 N -1.21 4.81 -0.44 2.04 1.01 0.16 -4.89 120.40 121.88 1r6h s VAL 69 Ca -0.13 -0.03 -0.14 0.00 0.00 0.00 0.00 61.98 61.68 1r6h s VAL 69 Cb -0.08 -3.15 0.06 0.00 0.00 0.00 0.00 36.38 33.21 1r6h s VAL 69 CO 0.00 0.48 0.34 -0.62 0.00 0.00 0.00 175.10 175.31 1r6h s ASP 70 N 0.20 6.05 -0.41 3.32 -1.08 -1.26 -2.78 116.67 120.70 1r6h s ASP 70 Ca 0.04 -1.22 -0.07 0.00 -0.52 0.00 0.00 52.55 50.78 1r6h s ASP 70 Cb -0.12 -2.14 0.09 0.00 -1.46 0.00 0.00 42.92 39.28 1r6h s ASP 70 CO 0.00 -0.57 0.23 0.26 0.52 0.00 0.00 175.17 175.61 1r6h s TRP 71 N 1.62 3.41 0.43 -5.34 0.52 -0.99 -5.05 118.94 113.54 1r6h s TRP 71 Ca 0.04 -1.84 0.07 0.00 0.02 0.00 0.00 56.10 54.39 1r6h s TRP 71 Cb -0.23 -3.01 -0.02 0.00 -1.15 0.00 0.00 33.47 29.07 1r6h s TRP 71 CO 0.07 -0.90 0.35 -1.25 0.02 0.00 0.00 176.95 175.24 1r6h s PRO 72 N 1.32 2.43 -0.01 4.98 0.04 -1.26 -1.27 135.00 141.24 1r6h s PRO 72 Ca 0.04 -1.66 0.05 0.00 0.04 0.00 0.00 61.00 59.47 1r6h s PRO 72 Cb -0.23 -2.27 -0.01 0.00 0.04 0.00 0.00 34.50 32.03 1r6h s PRO 72 CO -0.00 -0.24 -0.18 -0.06 0.04 0.00 0.00 177.00 176.55 1r6h s PHE 73 N -2.54 1.59 -0.29 0.56 0.40 -1.26 -4.87 117.98 111.58 1r6h s PHE 73 Ca 0.45 -0.30 0.00 0.00 -0.60 0.00 0.00 56.93 56.48 1r6h s PHE 73 Cb -0.02 -1.02 0.00 0.00 0.51 0.00 0.00 43.02 42.49 1r6h s PHE 73 CO 0.26 -0.03 0.00 -0.40 0.70 0.00 0.00 175.22 175.75 1r6h n ASP 74 N 2.64 0.00 0.20 1.36 5.68 -1.26 -4.96 116.55 120.21 1r6h n ASP 74 Ca -0.15 0.00 0.18 0.00 -0.50 0.00 0.00 54.79 54.33 1r6h n ASP 74 Cb 0.54 0.00 0.82 0.00 -1.14 0.00 0.00 41.12 41.34 1r6h n ASP 74 CO 0.00 0.00 0.00 -0.78 -1.33 0.00 0.00 177.20 175.09 1r6h h ASP 75 N 0.00 0.00 -0.98 -1.12 3.58 -2.07 -0.74 116.42 115.09 1r6h h ASP 75 Ca 0.00 0.00 -0.62 0.00 0.42 0.00 0.00 57.03 56.83 1r6h h ASP 75 Cb 0.00 0.00 -0.36 0.00 1.72 0.00 0.00 39.33 40.69 1r6h h ASP 75 CO 0.00 0.00 -0.01 0.61 -2.88 0.00 0.00 179.24 176.96 1r6h n GLY 76 N -1.38 6.11 3.31 -0.78 0.00 -1.26 -4.95 105.19 106.24 1r6h n GLY 76 Ca 0.03 -2.52 -0.43 0.00 0.00 0.00 0.00 46.02 43.09 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 -3.72 3.49 -0.78 4.61 0.00 -0.29 -5.02 121.76 120.06 1r6h s ALA 77 Ca 0.56 -2.31 -0.30 0.00 0.00 0.00 0.00 51.96 49.91 1r6h s ALA 77 Cb 0.45 -2.98 -0.16 0.00 0.00 0.00 0.00 23.12 20.43 1r6h s ALA 77 CO -0.03 -1.82 2.56 -2.30 0.00 0.00 0.00 175.76 174.17 1r6h n PRO 78 N 5.09 0.40 -0.13 0.00 -0.02 -1.26 -4.83 135.00 134.25 1r6h n PRO 78 Ca -0.11 0.02 -0.02 0.00 -2.02 0.00 0.00 63.50 61.36 1r6h n PRO 78 Cb 0.42 -2.18 0.20 0.00 -0.02 0.00 0.00 33.50 31.92 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 14.35 0.83 -6.78 0.52 0.11 -1.97 -3.44 132.00 135.62 1r6h h PRO 79 Ca -0.13 -0.15 -0.56 0.00 0.11 0.00 0.00 66.00 65.28 1r6h h PRO 79 Cb 1.30 -0.13 0.19 0.00 0.11 0.00 0.00 31.00 32.46 1r6h h PRO 79 CO 1.28 0.72 -0.21 -0.35 -0.21 0.00 0.00 178.00 179.23 1r6h n PRO 80 N -4.29 0.31 0.34 1.05 -0.04 -1.26 -4.85 135.00 126.25 1r6h n PRO 80 Ca 0.04 0.15 0.23 0.00 -0.04 0.00 0.00 63.50 63.88 1r6h n PRO 80 Cb 0.20 -1.98 1.21 0.00 -0.04 0.00 0.00 33.50 32.88 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 -0.45 0.00 0.26 0.55 0.00 -2.01 -2.82 103.07 98.60 1r6h h GLY 81 Ca -0.46 0.00 0.25 0.00 0.00 0.00 0.00 47.33 47.12 1r6h h GLY 81 CO 0.43 0.00 0.63 1.70 0.00 0.00 0.00 176.54 179.30 1r6h h LYS 82 N 0.00 0.00 0.00 4.80 3.11 -1.92 0.12 116.57 122.68 1r6h h LYS 82 Ca 0.00 0.00 0.02 0.00 -2.81 0.00 0.00 60.65 57.86 1r6h h LYS 82 Cb 0.03 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.23 1r6h h LYS 82 CO -0.00 0.00 -0.16 0.28 -2.81 0.00 0.00 179.45 176.76 1r6h h VAL 83 N 0.00 0.62 -1.01 2.00 2.07 -1.78 0.02 116.25 118.17 1r6h h VAL 83 Ca 0.40 0.00 0.14 0.00 0.82 0.00 0.00 66.70 68.06 1r6h h VAL 83 Cb 1.66 0.62 -0.09 0.00 -1.52 0.00 0.00 31.29 31.96 1r6h h VAL 83 CO -0.00 0.00 0.63 0.58 0.02 0.00 0.00 177.57 178.79 1r6h h VAL 84 N -0.26 0.87 -0.13 2.57 2.07 -1.01 0.61 116.25 120.98 1r6h h VAL 84 Ca 0.05 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 1r6h h VAL 84 Cb 0.32 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 1r6h h VAL 84 CO -0.15 0.17 0.06 -0.33 0.02 0.00 0.00 177.57 177.34 1r6h h GLU 85 N 0.94 0.17 0.02 1.57 4.39 -0.76 0.44 114.58 121.36 1r6h h GLU 85 Ca 0.52 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 60.20 1r6h h GLU 85 Cb 0.59 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 1r6h h GLU 85 CO -0.29 0.14 -0.01 0.22 -1.16 0.00 0.00 179.01 177.91 1r6h h ASP 86 N 0.18 -0.02 0.05 1.42 1.82 0.20 -1.91 116.42 118.16 1r6h h ASP 86 Ca 0.05 -0.33 -0.10 0.00 -0.39 0.00 0.00 57.03 56.26 1r6h h ASP 86 Cb 0.03 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.03 1r6h h ASP 86 CO -0.01 0.32 -0.31 -0.25 -1.61 0.00 0.00 179.24 177.38 1r6h h TRP 87 N -0.37 0.44 -0.53 0.28 2.91 -1.08 -2.36 115.95 115.23 1r6h h TRP 87 Ca -0.00 -0.10 0.02 0.00 1.13 0.00 0.00 58.89 59.93 1r6h h TRP 87 Cb 0.35 -0.10 -0.03 0.00 -0.51 0.00 0.00 29.16 28.87 1r6h h TRP 87 CO 0.04 0.66 0.34 -0.07 -1.03 0.00 0.00 178.44 178.38 1r6h h LEU 88 N 0.33 0.56 -0.64 0.65 3.38 -0.83 0.33 115.31 119.11 1r6h h LEU 88 Ca 0.04 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 1r6h h LEU 88 Cb 0.72 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1r6h h LEU 88 CO 0.05 0.40 0.02 0.28 0.09 0.00 0.00 178.44 179.29 1r6h h SER 89 N 0.68 1.06 0.12 -0.43 0.02 -1.15 0.57 113.55 114.42 1r6h h SER 89 Ca 0.21 -0.29 -0.01 0.00 -0.84 0.00 0.00 61.79 60.86 1r6h h SER 89 Cb -0.03 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.23 1r6h h SER 89 CO -0.07 1.10 -0.06 0.25 -1.14 0.00 0.00 176.83 176.91 1r6h h LEU 90 N 1.00 -0.14 -0.43 5.07 7.12 -0.88 -1.64 115.31 125.40 1r6h h LEU 90 Ca 0.18 -0.00 -0.18 0.00 0.13 0.00 0.00 57.88 58.01 1r6h h LEU 90 Cb 0.54 0.04 -0.00 0.00 -0.53 0.00 0.00 40.66 40.70 1r6h h LEU 90 CO 0.03 -0.09 -0.65 1.62 -0.13 0.00 0.00 178.44 179.21 1r6h h VAL 91 N -0.17 1.34 -0.59 1.05 3.04 -0.86 -2.50 116.25 117.56 1r6h h VAL 91 Ca -0.02 -1.97 0.06 0.00 -1.01 0.00 0.00 66.70 63.76 1r6h h VAL 91 Cb 0.13 1.95 -0.05 0.00 -2.01 0.00 0.00 31.29 31.31 1r6h h VAL 91 CO 0.03 0.60 0.30 0.11 -1.01 0.00 0.00 177.57 177.60 1r6h h LYS 92 N 0.37 0.54 -0.28 4.17 1.57 0.31 0.65 116.57 123.90 1r6h h LYS 92 Ca -0.02 -0.03 -0.13 0.00 -1.87 0.00 0.00 60.65 58.60 1r6h h LYS 92 Cb 1.22 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 33.40 1r6h h LYS 92 CO 0.12 0.36 -0.34 0.00 -0.57 0.00 0.00 179.45 179.01 1r6h h ALA 93 N 1.33 0.41 0.00 3.86 0.00 -1.30 -0.58 119.26 122.99 1r6h h ALA 93 Ca 0.27 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 1r6h h ALA 93 Cb 0.20 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1r6h h ALA 93 CO -0.19 0.47 -0.27 0.87 0.00 0.00 0.00 179.25 180.13 1r6h h LYS 94 N 0.46 0.00 0.00 0.00 1.79 -0.95 -2.11 116.57 115.77 1r6h h LYS 94 Ca 0.04 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.47 1r6h h LYS 94 Cb 0.93 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.57 1r6h h LYS 94 CO 0.08 0.27 -0.22 0.74 -1.08 0.00 0.00 179.45 179.24 1r6h h PHE 95 N 0.00 0.00 -0.82 -1.35 -1.00 0.43 -2.64 116.94 111.56 1r6h h PHE 95 Ca -0.00 0.00 0.07 0.00 2.81 0.00 0.00 57.97 60.85 1r6h h PHE 95 Cb 0.58 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 40.09 1r6h h PHE 95 CO 0.00 0.87 0.54 0.00 -1.61 0.00 0.00 178.31 178.11 1r6h h GLU 97 N 0.87 0.21 -2.99 0.00 4.81 -1.51 -3.39 114.58 112.58 1r6h h GLU 97 Ca 0.36 -0.24 -0.62 0.00 -0.13 0.00 0.00 59.36 58.74 1r6h h GLU 97 Cb 0.29 0.07 -0.41 0.00 0.63 0.00 0.00 28.75 29.33 1r6h h GLU 97 CO -0.13 0.97 -0.70 0.00 -0.73 0.00 0.00 179.01 178.42 1r6h s ALA 98 N -3.20 2.85 0.27 2.92 0.00 -0.62 -5.10 121.76 118.88 1r6h s ALA 98 Ca -0.03 -3.16 -0.30 0.00 0.00 0.00 0.00 51.96 48.48 1r6h s ALA 98 Cb 0.10 -1.99 -0.10 0.00 0.00 0.00 0.00 23.12 21.13 1r6h s ALA 98 CO 0.83 -2.05 1.38 -2.14 0.00 0.00 0.00 175.76 173.78 1r6h s PRO 99 N -0.49 4.31 -1.14 0.00 0.02 -1.03 -3.53 135.00 133.14 1r6h s PRO 99 Ca 0.23 2.25 -0.08 0.00 0.02 0.00 0.00 61.00 63.42 1r6h s PRO 99 Cb -0.12 -3.10 -0.03 0.00 0.02 0.00 0.00 34.50 31.26 1r6h s PRO 99 CO -0.09 -0.32 0.86 0.41 -0.33 0.00 0.00 177.00 177.52 1r6h n GLY 100 N 1.70 -0.87 0.00 0.52 0.00 -1.26 -5.02 105.19 100.26 1r6h n GLY 100 Ca 0.04 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.47 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 -3.97 1.61 2.88 -1.23 -4.85 113.62 105.11 1r6h n SER 101 Ca -0.15 -0.18 -0.30 0.00 -1.33 0.00 0.00 58.87 56.91 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 1.44 4.31 -0.01 0.00 1.01 -1.24 0.83 120.40 126.74 1r6h s VAL 103 Ca -0.02 -0.93 0.08 0.00 0.00 0.00 0.00 61.98 61.11 1r6h s VAL 103 Cb -0.16 -3.10 -0.02 0.00 0.00 0.00 0.00 36.38 33.10 1r6h s VAL 103 CO -0.08 0.07 -0.24 0.00 0.00 0.00 0.00 175.10 174.85 1r6h s ALA 104 N -1.44 2.27 0.15 5.51 0.00 -1.05 0.59 121.76 127.78 1r6h s ALA 104 Ca 0.28 -1.13 -0.01 0.00 0.00 0.00 0.00 51.96 51.11 1r6h s ALA 104 Cb -0.12 -0.61 -0.04 0.00 0.00 0.00 0.00 23.12 22.36 1r6h s ALA 104 CO 0.21 0.54 0.07 0.08 0.00 0.00 0.00 175.76 176.65 1r6h s VAL 105 N -0.67 0.15 0.72 0.00 1.01 0.47 -1.37 120.40 120.70 1r6h s VAL 105 Ca 0.11 -1.94 -0.14 0.00 0.00 0.00 0.00 61.98 60.01 1r6h s VAL 105 Cb -0.10 -2.16 0.03 0.00 0.00 0.00 0.00 36.38 34.15 1r6h s VAL 105 CO -0.00 -0.36 1.13 -2.28 0.00 0.00 0.00 175.10 173.60 1r6h s HIS 106 N -4.03 2.37 -0.44 5.22 5.65 -1.01 -0.18 115.29 122.87 1r6h s HIS 106 Ca 0.28 1.59 -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 0.04 -2.04 1.84 0.00 -0.65 0.00 0.00 174.74 173.93 1r6h n VAL 108 N 7.36 0.00 0.03 0.00 0.24 -1.26 -3.79 118.33 120.91 1r6h n VAL 108 Ca 0.22 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.53 1r6h n VAL 108 Cb 0.49 -0.60 0.02 0.00 -1.47 0.00 0.00 33.84 32.28 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 -0.99 1.11 -3.00 2.33 0.00 -1.26 -4.31 120.51 114.39 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 -1.01 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 -1.35 4.98 3.33 0.00 0.00 -1.25 -5.05 105.19 105.86 1r6h n GLY 110 Ca 0.00 -1.20 -0.33 0.00 0.00 0.00 0.00 46.02 44.49 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 2.68 0.00 0.99 1.43 -1.26 -4.28 118.68 118.24 1r6h s LEU 111 Ca 0.00 -0.37 0.00 0.00 -1.03 0.00 0.00 54.13 52.73 1r6h s LEU 111 Cb 0.00 -1.62 0.00 0.00 0.03 0.00 0.00 46.19 44.60 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 3.84 2.69 0.00 -3.19 0.00 -1.26 -4.93 105.19 102.34 1r6h n GLY 112 Ca -0.18 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.22 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 2.28 -0.19 1.61 3.00 -1.26 -3.97 116.66 118.13 1r6h n ARG 113 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 57.85 57.83 1r6h n ARG 113 Cb 0.00 -0.80 0.09 0.00 0.00 0.00 0.00 32.46 31.75 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 0.70 -0.46 7.54 0.00 -1.89 -2.74 119.26 122.41 1r6h h ALA 114 Ca 0.00 0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.09 1r6h h ALA 114 Cb 0.00 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.81 1r6h h ALA 114 CO 0.00 -0.24 0.02 -1.00 0.00 0.00 0.00 179.25 178.03 1r6h h PRO 115 N 0.34 0.13 -0.03 0.00 0.13 -1.88 -0.90 132.00 129.80 1r6h h PRO 115 Ca 0.29 -0.01 0.02 0.00 -0.87 0.00 0.00 66.00 65.43 1r6h h PRO 115 Cb 0.37 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 31.44 1r6h h PRO 115 CO -0.32 0.09 -0.12 0.28 -0.23 0.00 0.00 178.00 177.70 1r6h h VAL 116 N 0.14 0.68 -0.46 1.56 2.07 -1.83 -2.54 116.25 115.87 1r6h h VAL 116 Ca 0.23 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.83 1r6h h VAL 116 Cb 0.33 0.68 -0.07 0.00 -1.52 0.00 0.00 31.29 30.71 1r6h h VAL 116 CO -0.36 0.00 0.03 -0.07 0.02 0.00 0.00 177.57 177.19 1r6h h LEU 117 N -0.20 -0.13 -0.38 2.57 3.38 -1.18 -2.24 115.31 117.14 1r6h h LEU 117 Ca 0.05 0.10 0.08 0.00 0.09 0.00 0.00 57.88 58.20 1r6h h LEU 117 Cb 0.27 0.17 -0.08 0.00 0.09 0.00 0.00 40.66 41.11 1r6h h LEU 117 CO -0.14 -0.03 -0.13 0.58 0.09 0.00 0.00 178.44 178.81 1r6h h VAL 118 N 0.15 0.56 -0.56 1.22 2.07 -0.80 -1.06 116.25 117.83 1r6h h VAL 118 Ca 0.23 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.85 1r6h h VAL 118 Cb 0.33 0.56 -0.08 0.00 -1.52 0.00 0.00 31.29 30.58 1r6h h VAL 118 CO -0.36 0.00 0.13 0.00 0.02 0.00 0.00 177.57 177.36 1r6h h ALA 119 N 1.30 0.66 -0.36 1.67 0.00 -1.02 0.17 119.26 121.68 1r6h h ALA 119 Ca 0.19 0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.28 1r6h h ALA 119 Cb 0.33 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1r6h h ALA 119 CO -0.41 -0.29 0.25 -0.07 0.00 0.00 0.00 179.25 178.72 1r6h h LEU 120 N 0.27 0.15 -0.13 0.00 3.38 -0.81 -0.91 115.31 117.26 1r6h h LEU 120 Ca 0.29 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.14 1r6h h LEU 120 Cb 0.40 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1r6h h LEU 120 CO -0.36 0.10 -0.37 0.00 0.09 0.00 0.00 178.44 177.90 1r6h h ALA 121 N 1.82 0.22 0.00 1.53 0.00 0.22 -2.95 119.26 120.10 1r6h h ALA 121 Ca 0.16 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1r6h h ALA 121 Cb 0.43 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1r6h h ALA 121 CO -0.02 0.30 0.00 1.25 0.00 0.00 0.00 179.25 180.78 1r6h h LEU 122 N 0.09 0.00 -1.95 0.00 5.85 -0.19 -2.68 115.31 116.42 1r6h h LEU 122 Ca -0.01 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.79 1r6h h LEU 122 Cb 0.99 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.01 1r6h h LEU 122 CO 0.08 0.00 0.22 0.40 -0.34 0.00 0.00 178.44 178.80 1r6h h ILE 123 N 0.00 0.87 0.00 4.05 2.04 -1.02 0.92 117.51 124.37 1r6h h ILE 123 Ca 0.00 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1r6h h ILE 123 Cb 0.27 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1r6h h ILE 123 CO 0.00 0.01 0.00 -0.08 0.00 0.00 0.00 178.15 178.08 1r6h h GLU 124 N 0.06 0.00 0.00 2.37 4.22 -1.64 -3.01 114.58 116.58 1r6h h GLU 124 Ca 0.15 0.00 -0.07 0.00 0.08 0.00 0.00 59.36 59.52 1r6h h GLU 124 Cb 0.51 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1r6h h GLU 124 CO -0.01 0.00 -0.33 0.77 -2.18 0.00 0.00 179.01 177.26 1r6h h SER 125 N 0.00 0.00 0.00 1.04 0.02 -1.01 -3.50 113.55 110.10 1r6h h SER 125 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1r6h h SER 125 Cb 0.40 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1r6h h SER 125 CO 0.00 0.33 0.00 0.61 -1.14 0.00 0.00 176.83 176.63 1r6h n GLY 126 N 1.18 -0.07 3.41 -3.77 0.00 -1.14 -5.00 105.19 99.81 1r6h n GLY 126 Ca 0.03 0.05 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 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 0.54 0.11 1.61 0.00 -1.26 -4.69 117.12 113.42 1r6h n MET 127 Ca 0.00 -1.44 -0.04 0.00 0.00 0.00 0.00 57.70 56.21 1r6h n MET 127 Cb 0.00 -2.92 -0.02 0.00 0.00 0.00 0.00 33.22 30.28 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 9.67 -0.27 -0.14 3.17 -0.00 -1.83 0.41 116.57 127.57 1r6h h LYS 128 Ca 0.26 0.02 -0.09 0.00 -0.00 0.00 0.00 60.65 60.84 1r6h h LYS 128 Cb 0.75 0.06 -0.01 0.00 -0.00 0.00 0.00 32.23 33.03 1r6h h LYS 128 CO 1.81 -0.18 -0.33 -0.92 -0.00 0.00 0.00 179.45 179.83 1r6h h TYR 129 N -0.34 0.32 0.08 0.07 3.20 -1.90 0.26 116.97 118.66 1r6h h TYR 129 Ca -0.03 -0.07 -0.00 0.00 3.14 0.00 0.00 58.73 61.76 1r6h h TYR 129 Cb 0.22 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.41 1r6h h TYR 129 CO 0.14 0.58 -0.04 0.93 -1.64 0.00 0.00 178.16 178.13 1r6h h GLU 130 N 0.25 -0.10 -0.25 1.82 5.08 -1.93 -2.49 114.58 116.96 1r6h h GLU 130 Ca 0.03 0.01 -0.13 0.00 -1.00 0.00 0.00 59.36 58.27 1r6h h GLU 130 Cb 0.70 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 1r6h h GLU 130 CO 0.05 0.42 -0.39 0.22 -1.00 0.00 0.00 179.01 178.32 1r6h h ASP 131 N -0.73 0.60 0.03 1.42 3.58 -0.17 0.16 116.42 121.31 1r6h h ASP 131 Ca -0.01 -0.26 -0.00 0.00 0.42 0.00 0.00 57.03 57.18 1r6h h ASP 131 Cb 0.58 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.46 1r6h h ASP 131 CO 0.02 0.92 -0.01 0.00 -2.88 0.00 0.00 179.24 177.29 1r6h h ALA 132 N 1.11 -0.04 -0.10 -0.78 0.00 -0.57 0.82 119.26 119.70 1r6h h ALA 132 Ca 0.04 -0.05 -0.22 0.00 0.00 0.00 0.00 54.91 54.69 1r6h h ALA 132 Cb 0.89 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.70 1r6h h ALA 132 CO 0.08 -0.48 -0.81 0.82 0.00 0.00 0.00 179.25 178.86 1r6h h ILE 133 N -0.12 1.32 -0.00 0.00 1.08 -1.42 -1.78 117.51 116.59 1r6h h ILE 133 Ca -0.00 -2.10 -0.01 0.00 -0.39 0.00 0.00 64.86 62.36 1r6h h ILE 133 Cb 0.11 2.10 0.00 0.00 -3.07 0.00 0.00 36.82 35.96 1r6h h ILE 133 CO 0.01 0.65 -0.02 1.56 -0.69 0.00 0.00 178.15 179.65 1r6h h GLN 134 N 0.42 0.02 -0.16 2.37 4.20 -0.59 -1.19 115.11 120.18 1r6h h GLN 134 Ca -0.06 -0.02 -0.13 0.00 0.06 0.00 0.00 58.65 58.50 1r6h h GLN 134 Cb 1.42 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.20 1r6h h GLN 134 CO 0.15 0.72 -0.48 0.35 -0.67 0.00 0.00 178.83 178.91 1r6h h PHE 135 N -0.67 0.49 0.00 2.96 3.57 0.56 -2.49 116.94 121.35 1r6h h PHE 135 Ca -0.00 -0.15 -0.15 0.00 3.53 0.00 0.00 57.97 61.20 1r6h h PHE 135 Cb 0.73 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.35 1r6h h PHE 135 CO 0.17 0.80 -0.70 0.97 -2.23 0.00 0.00 178.31 177.32 1r6h h ILE 136 N 0.32 1.49 -0.38 1.41 2.10 -1.39 -3.06 117.51 118.01 1r6h h ILE 136 Ca 0.02 -2.42 -0.08 0.00 1.08 0.00 0.00 64.86 63.46 1r6h h ILE 136 Cb 0.96 2.31 -0.01 0.00 -1.09 0.00 0.00 36.82 38.98 1r6h h ILE 136 CO 0.08 0.69 -0.07 0.03 -1.08 0.00 0.00 178.15 177.80 1r6h h ARG 137 N 0.00 0.71 -0.46 2.19 3.08 -0.97 -3.11 114.38 115.82 1r6h h ARG 137 Ca -0.01 -0.26 0.01 0.00 0.07 0.00 0.00 59.98 59.79 1r6h h ARG 137 Cb 1.25 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 31.23 1r6h h ARG 137 CO 0.09 0.85 0.29 1.96 -1.07 0.00 0.00 179.97 182.10 1r6h h GLN 138 N 0.52 0.58 -6.68 0.04 4.20 -1.44 -3.42 115.11 108.91 1r6h h GLN 138 Ca 0.10 -0.03 -0.50 0.00 0.06 0.00 0.00 58.65 58.27 1r6h h GLN 138 Cb 0.57 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 1r6h h GLN 138 CO 0.03 0.38 0.04 0.21 -0.67 0.00 0.00 178.83 178.83 1r6h s LYS 139 N -6.15 3.88 -0.23 1.46 2.47 -1.16 -5.01 119.74 114.99 1r6h s LYS 139 Ca -0.13 0.50 -0.29 0.00 -1.56 0.00 0.00 55.97 54.48 1r6h s LYS 139 Cb 0.12 -2.48 -0.01 0.00 -1.46 0.00 0.00 37.83 33.99 1r6h s LYS 139 CO 0.73 0.15 1.39 0.50 0.16 0.00 0.00 175.35 178.28 1r6h s ARG 140 N -3.19 3.98 0.32 4.03 3.00 -1.26 -4.81 118.95 121.02 1r6h s ARG 140 Ca 0.51 1.50 0.09 0.00 -1.00 0.00 0.00 55.73 56.84 1r6h s ARG 140 Cb -0.10 -3.90 -0.05 0.00 0.00 0.00 0.00 34.95 30.90 1r6h s ARG 140 CO 0.22 -1.05 0.01 -0.98 0.00 0.00 0.00 175.30 173.50 1r6h s ARG 141 N 4.12 2.12 0.58 5.12 3.03 -1.26 -4.37 118.95 128.29 1r6h s ARG 141 Ca 0.60 -1.67 -0.09 0.00 2.03 0.00 0.00 55.73 56.61 1r6h s ARG 141 Cb -0.21 -1.98 0.13 0.00 -1.03 0.00 0.00 34.95 31.86 1r6h s ARG 141 CO 0.23 0.19 0.30 0.41 -1.13 0.00 0.00 175.30 175.30 1r6h n GLY 142 N -0.94 -2.71 3.53 3.88 0.00 -1.26 -4.80 105.19 102.90 1r6h n GLY 142 Ca -0.04 -0.88 -0.42 0.00 0.00 0.00 0.00 46.02 44.68 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 -2.04 2.84 -0.46 4.61 0.00 -1.26 -4.89 121.76 120.57 1r6h s ALA 143 Ca 0.23 -1.54 -0.23 0.00 0.00 0.00 0.00 51.96 50.42 1r6h s ALA 143 Cb -0.04 -4.17 0.03 0.00 0.00 0.00 0.00 23.12 18.93 1r6h s ALA 143 CO 0.19 -3.18 0.79 0.96 0.00 0.00 0.00 175.76 174.53 1r6h s ILE 144 N 5.26 4.63 0.00 0.00 -4.36 -1.26 -4.92 121.20 120.56 1r6h s ILE 144 Ca 0.32 0.39 0.00 0.00 -0.26 0.00 0.00 60.65 61.11 1r6h s ILE 144 Cb -0.10 -4.34 0.00 0.00 1.25 0.00 0.00 42.46 39.27 1r6h s ILE 144 CO 0.12 -0.75 0.00 0.59 0.24 0.00 0.00 174.94 175.14 1r6h n ASN 145 N 6.77 0.00 -0.08 4.36 3.02 -1.26 -4.88 115.26 123.18 1r6h n ASN 145 Ca 0.02 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.49 1r6h n ASN 145 Cb 0.48 -0.06 -0.03 0.00 -0.61 0.00 0.00 39.78 39.57 1r6h n ASN 145 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1r6h n SER 146 N -1.61 1.80 0.04 6.41 2.88 -1.26 -4.48 113.62 117.40 1r6h n SER 146 Ca 0.00 0.31 -0.11 0.00 -1.33 0.00 0.00 58.87 57.75 1r6h n SER 146 Cb 0.00 -0.73 -0.04 0.00 -0.75 0.00 0.00 64.21 62.69 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 -0.93 -0.22 0.06 -1.46 3.11 -1.96 0.13 116.57 115.30 1r6h h LYS 147 Ca 0.00 0.01 0.01 0.00 -2.81 0.00 0.00 60.65 57.86 1r6h h LYS 147 Cb 0.92 0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 32.18 1r6h h LYS 147 CO 0.00 -0.14 -0.09 0.37 -2.81 0.00 0.00 179.45 176.77 1r6h h GLN 148 N -0.22 -0.18 -0.22 1.90 -0.00 -1.93 0.58 115.11 115.03 1r6h h GLN 148 Ca 0.06 0.01 -0.18 0.00 -0.00 0.00 0.00 58.65 58.54 1r6h h GLN 148 Cb 0.31 0.04 0.00 0.00 0.00 0.00 0.00 27.48 27.83 1r6h h GLN 148 CO -0.17 -0.12 -0.57 -0.07 0.00 0.00 0.00 178.83 177.90 1r6h h LEU 149 N -0.19 0.88 -0.36 -2.39 -0.00 -1.77 -2.48 115.31 109.00 1r6h h LEU 149 Ca 0.02 -0.57 -0.17 0.00 -0.00 0.00 0.00 57.88 57.16 1r6h h LEU 149 Cb 0.20 -0.26 -0.00 0.00 -0.00 0.00 0.00 40.66 40.61 1r6h h LEU 149 CO -0.05 1.29 -0.47 0.74 -0.00 0.00 0.00 178.44 179.95 1r6h h THR 150 N 0.51 1.27 0.07 0.22 2.02 -0.68 -1.59 112.91 114.74 1r6h h THR 150 Ca -0.01 -1.65 -0.00 0.00 0.77 0.00 0.00 66.41 65.52 1r6h h THR 150 Cb 1.18 1.51 0.00 0.00 -1.74 0.00 0.00 68.15 69.10 1r6h h THR 150 CO 0.12 0.54 -0.03 0.22 0.37 0.00 0.00 175.52 176.74 1r6h h TYR 151 N 0.71 -0.09 -0.07 3.16 3.20 0.12 -1.84 116.97 122.16 1r6h h TYR 151 Ca 0.04 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.83 1r6h h TYR 151 Cb 1.07 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.36 1r6h h TYR 151 CO 0.07 0.19 -0.31 1.25 -1.64 0.00 0.00 178.16 177.71 1r6h h LEU 152 N -0.37 0.13 -1.05 2.82 6.46 -1.51 -0.79 115.31 121.01 1r6h h LEU 152 Ca -0.01 -0.04 -0.03 0.00 -0.12 0.00 0.00 57.88 57.68 1r6h h LEU 152 Cb 0.32 -0.04 -0.03 0.00 -0.73 0.00 0.00 40.66 40.18 1r6h h LEU 152 CO 0.02 0.44 0.27 -0.08 -0.62 0.00 0.00 178.44 178.47 1r6h h GLU 153 N 0.12 0.95 0.00 1.25 4.81 -1.15 0.06 114.58 120.61 1r6h h GLU 153 Ca 0.02 -0.15 -0.06 0.00 -0.13 0.00 0.00 59.36 59.04 1r6h h GLU 153 Cb 0.61 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1r6h h GLU 153 CO 0.04 0.76 -0.27 -0.22 -0.73 0.00 0.00 179.01 178.59 1r6h h LYS 154 N 0.93 0.00 -0.58 1.92 3.11 -0.54 -3.06 116.57 118.35 1r6h h LYS 154 Ca 0.22 0.00 -0.09 0.00 -2.81 0.00 0.00 60.65 57.97 1r6h h LYS 154 Cb 0.16 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.37 1r6h h LYS 154 CO -0.02 0.27 -0.00 -0.92 -2.81 0.00 0.00 179.45 175.97 1r6h h TYR 155 N 0.00 1.11 -3.62 1.91 5.03 0.42 -3.35 116.97 118.46 1r6h h TYR 155 Ca -0.00 -0.19 -0.74 0.00 2.58 0.00 0.00 58.73 60.38 1r6h h TYR 155 Cb 0.90 -0.29 -0.31 0.00 1.55 0.00 0.00 36.73 38.58 1r6h h TYR 155 CO 0.00 0.99 -0.11 0.50 -1.32 0.00 0.00 178.16 178.23 1r6h s ARG 156 N -5.02 3.15 0.66 1.82 3.00 -0.81 -5.06 118.95 116.70 1r6h s ARG 156 Ca -0.12 -2.66 -0.16 0.00 -1.00 0.00 0.00 55.73 51.79 1r6h s ARG 156 Cb 0.13 -4.07 0.00 0.00 0.00 0.00 0.00 34.95 31.01 1r6h s ARG 156 CO 0.85 -1.23 1.17 -1.25 0.00 0.00 0.00 175.30 174.84 1r6h s PRO 157 N -0.25 2.61 -0.13 5.12 0.04 -1.26 -4.90 135.00 136.24 1r6h s PRO 157 Ca 0.20 1.66 -0.05 0.00 0.04 0.00 0.00 61.00 62.85 1r6h s PRO 157 Cb -0.14 -1.90 0.06 0.00 0.04 0.00 0.00 34.50 32.56 1r6h s PRO 157 CO -0.07 -1.45 0.27 0.21 0.04 0.00 0.00 177.00 176.00 1r6h s LYS 158 N -3.78 0.18 0.46 4.56 2.20 -1.26 -5.03 119.74 117.08 1r6h s LYS 158 Ca 0.73 0.70 0.14 0.00 -0.36 0.00 0.00 55.97 57.18 1r6h s LYS 158 Cb -0.27 -0.04 1.07 0.00 -1.51 0.00 0.00 37.83 37.08 1r6h s LYS 158 CO 0.40 -0.24 2.04 1.96 -0.36 0.00 0.00 175.35 179.15 1r6h h GLN 159 N 7.90 0.31 -0.08 4.03 1.08 -1.97 -0.69 115.11 125.70 1r6h h GLN 159 Ca -0.23 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 56.95 1r6h h GLN 159 Cb 1.13 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 28.48 1r6h h GLN 159 CO 0.21 0.21 0.04 -0.09 -0.95 0.00 0.00 178.83 178.25 1r6h h ARG 160 N 0.32 0.11 -0.36 1.46 9.65 -2.00 -2.11 114.38 121.45 1r6h h ARG 160 Ca 0.18 -0.01 -0.13 0.00 -1.10 0.00 0.00 59.98 58.92 1r6h h ARG 160 Cb 0.31 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.86 1r6h h ARG 160 CO -0.04 0.09 -0.29 1.25 2.80 0.00 0.00 179.97 183.77 1r6h h LEU 161 N 0.11 0.88 -7.20 3.80 5.85 -1.55 -3.39 115.31 113.81 1r6h h LEU 161 Ca 0.03 -0.45 -0.62 0.00 0.84 0.00 0.00 57.88 57.68 1r6h h LEU 161 Cb 0.01 -0.25 -0.40 0.00 0.37 0.00 0.00 40.66 40.40 1r6h h LEU 161 CO -0.00 1.14 -0.71 -0.60 -0.34 0.00 0.00 178.44 177.93 1r6h s ARG 162 N -4.45 1.40 0.62 1.25 3.52 -0.80 -5.11 118.95 115.38 1r6h s ARG 162 Ca -0.12 -2.00 -0.14 0.00 -0.13 0.00 0.00 55.73 53.33 1r6h s ARG 162 Cb 0.10 -2.64 -0.02 0.00 -1.56 0.00 0.00 34.95 30.83 1r6h s ARG 162 CO 0.85 -1.09 1.06 -0.59 -0.81 0.00 0.00 175.30 174.72 1r6h s PHE 163 N 0.45 2.99 -0.02 5.12 -0.12 -1.17 -4.78 117.98 120.45 1r6h s PHE 163 Ca 0.15 1.49 0.00 0.00 -0.05 0.00 0.00 56.93 58.53 1r6h s PHE 163 Cb -0.23 -2.99 0.02 0.00 -0.63 0.00 0.00 43.02 39.19 1r6h s PHE 163 CO -0.04 -1.18 -0.00 0.15 -0.05 0.00 0.00 175.22 174.09 1r6h s LYS 164 N -4.32 0.23 0.15 1.99 -0.14 -1.26 -5.14 119.74 111.26 1r6h s LYS 164 Ca 0.62 0.05 -0.27 0.00 -1.36 0.00 0.00 55.97 55.01 1r6h s LYS 164 Cb -0.16 -0.37 -0.07 0.00 -1.68 0.00 0.00 37.83 35.55 1r6h s LYS 164 CO 0.42 -0.09 0.84 -0.51 -0.76 0.00 0.00 175.35 175.25 1r6h s ASP 165 N 0.73 7.44 0.78 2.83 1.11 -1.26 -5.05 116.67 123.25 1r6h s ASP 165 Ca -0.07 1.71 -0.11 0.00 0.18 0.00 0.00 52.55 54.25 1r6h s ASP 165 Cb -0.10 -2.53 0.06 0.00 1.07 0.00 0.00 42.92 41.42 1r6h s ASP 165 CO -0.01 0.12 1.11 -2.16 1.18 0.00 0.00 175.17 175.41 1r6h s PRO 166 N -0.76 2.11 0.11 8.23 0.04 -1.26 -4.97 135.00 138.50 1r6h s PRO 166 Ca 0.39 1.32 -0.08 0.00 0.04 0.00 0.00 61.00 62.67 1r6h s PRO 166 Cb -0.23 -1.87 -0.14 0.00 0.04 0.00 0.00 34.50 32.30 1r6h s PRO 166 CO 0.28 -1.77 1.27 1.12 0.04 0.00 0.00 177.00 177.94 1r6h h HIS 167 N -1.01 0.78 -3.62 0.56 2.07 -2.09 -3.46 115.15 108.39 1r6h h HIS 167 Ca -0.44 -0.42 -0.17 0.00 -2.85 0.00 0.00 60.37 56.49 1r6h h HIS 167 Cb 1.24 -0.09 -0.23 0.00 2.57 0.00 0.00 27.41 30.91 1r6h h HIS 167 CO 0.55 1.24 -0.57 0.95 -3.07 0.00 0.00 177.93 177.03 1r6h s THR 168 N -3.33 0.07 0.20 6.12 -4.23 -1.26 -5.17 115.64 108.03 1r6h s THR 168 Ca -0.07 -0.55 0.10 0.00 -1.18 0.00 0.00 61.69 59.99 1r6h s THR 168 Cb 0.08 -0.31 -0.04 0.00 1.34 0.00 0.00 72.50 73.57 1r6h s THR 168 CO 0.89 -0.30 -0.15 -1.00 -0.54 0.00 0.00 174.62 173.52 1r6h s HIS 169 N -0.99 2.50 -0.21 3.99 3.76 -1.26 -5.05 115.29 118.03 1r6h s HIS 169 Ca -0.11 -0.28 0.12 0.00 -0.15 0.00 0.00 55.06 54.64 1r6h s HIS 169 Cb -0.06 -1.21 -0.21 0.00 1.11 0.00 0.00 32.58 32.21 1r6h s HIS 169 CO 0.01 0.53 -0.03 1.17 -0.85 0.00 0.00 174.74 175.56 1r6h n LYS 170 N 0.04 0.80 -4.24 1.40 4.81 -1.26 -5.04 118.16 114.66 1r6h n LYS 170 Ca -0.11 0.04 -0.16 0.00 -0.87 0.00 0.00 58.31 57.21 1r6h n LYS 170 Cb 0.56 -1.49 -0.08 0.00 0.02 0.00 0.00 35.03 34.04 1r6h n LYS 170 CO 0.00 0.00 0.00 0.95 1.17 0.00 0.00 177.40 179.52 1r6h s THR 171 N -2.47 0.00 0.00 3.15 -4.23 -1.26 -5.37 115.64 105.47 1r6h s THR 171 Ca -0.18 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 58.38 1r6h s THR 171 Cb 0.07 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.40 1r6h s THR 171 CO 0.70 0.00 0.00 0.54 -0.54 0.00 0.00 174.62 175.32