#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r6h n SER 2 N 0.00 1.59 -4.48 1.61 2.88 -1.26 -4.90 113.62 109.06 1r6h n SER 2 Ca 0.00 -0.02 -0.35 0.00 -1.33 0.00 0.00 58.87 57.16 1r6h n SER 2 Cb 0.00 -0.22 -0.12 0.00 -0.75 0.00 0.00 64.21 63.12 1r6h n SER 2 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1r6h s HIS 3 N -2.53 3.09 -0.13 0.66 4.02 -1.26 -5.09 115.29 114.06 1r6h s HIS 3 Ca -0.27 -0.35 0.01 0.00 1.02 0.00 0.00 55.06 55.47 1r6h s HIS 3 Cb 0.08 -2.13 0.02 0.00 -1.02 0.00 0.00 32.58 29.53 1r6h s HIS 3 CO 0.68 -0.21 -0.16 1.41 1.02 0.00 0.00 174.74 177.49 1r6h s MET 4 N 1.08 2.34 -0.13 1.40 1.75 -1.26 -5.12 119.30 119.36 1r6h s MET 4 Ca 0.03 -0.59 -0.11 0.00 -1.25 0.00 0.00 55.69 53.77 1r6h s MET 4 Cb -0.14 -2.03 0.04 0.00 2.84 0.00 0.00 34.83 35.54 1r6h s MET 4 CO 0.02 -0.12 0.33 0.00 -0.65 0.00 0.00 175.02 174.61 1r6h s ALA 5 N 1.14 -0.83 -0.32 4.11 0.00 -1.26 -5.14 121.76 119.47 1r6h s ALA 5 Ca -0.03 1.02 -0.08 0.00 0.00 0.00 0.00 51.96 52.87 1r6h s ALA 5 Cb -0.14 -0.60 0.01 0.00 0.00 0.00 0.00 23.12 22.39 1r6h s ALA 5 CO -0.05 -0.17 0.12 1.03 0.00 0.00 0.00 175.76 176.69 1r6h s ARG 6 N 0.43 3.08 -0.03 0.00 0.52 -1.26 -5.08 118.95 116.62 1r6h s ARG 6 Ca -0.02 -0.88 0.02 0.00 -0.52 0.00 0.00 55.73 54.33 1r6h s ARG 6 Cb -0.04 -3.49 0.01 0.00 0.52 0.00 0.00 34.95 31.95 1r6h s ARG 6 CO -0.02 -0.49 -0.09 -1.64 0.02 0.00 0.00 175.30 173.08 1r6h s MET 7 N 1.53 0.99 -0.22 3.54 -1.94 -1.26 -5.03 119.30 116.91 1r6h s MET 7 Ca 0.03 -0.29 0.04 0.00 -1.71 0.00 0.00 55.69 53.76 1r6h s MET 7 Cb -0.18 -0.92 -0.20 0.00 2.01 0.00 0.00 34.83 35.55 1r6h s MET 7 CO 0.04 0.08 -0.06 0.09 -0.01 0.00 0.00 175.02 175.17 1r6h n ASN 8 N 3.41 1.63 -3.82 3.03 3.02 -1.26 -4.91 115.26 116.36 1r6h n ASN 8 Ca -0.19 -0.04 -0.26 0.00 -0.03 0.00 0.00 54.58 54.05 1r6h n ASN 8 Cb 0.54 -0.23 -0.17 0.00 -0.61 0.00 0.00 39.78 39.31 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 -2.52 1.02 -0.40 3.52 0.52 -1.26 -5.10 118.95 114.73 1r6h s ARG 9 Ca -0.28 -0.28 -0.28 0.00 -0.52 0.00 0.00 55.73 54.38 1r6h s ARG 9 Cb 0.08 -1.68 -0.03 0.00 0.52 0.00 0.00 34.95 33.85 1r6h s ARG 9 CO 0.67 -0.42 1.90 -1.25 0.02 0.00 0.00 175.30 176.22 1r6h s PRO 10 N 1.79 3.04 0.64 3.54 0.04 -1.26 -4.98 135.00 137.81 1r6h s PRO 10 Ca 0.02 1.28 -0.16 0.00 0.04 0.00 0.00 61.00 62.19 1r6h s PRO 10 Cb -0.14 -4.29 -0.01 0.00 0.04 0.00 0.00 34.50 30.09 1r6h s PRO 10 CO -0.07 -2.22 1.10 0.00 0.04 0.00 0.00 177.00 175.86 1r6h s ALA 11 N 8.01 2.55 0.91 8.56 0.00 -1.26 -4.85 121.76 135.67 1r6h s ALA 11 Ca 0.80 0.54 -0.12 0.00 0.00 0.00 0.00 51.96 53.19 1r6h s ALA 11 Cb -0.20 -3.30 0.14 0.00 0.00 0.00 0.00 23.12 19.75 1r6h s ALA 11 CO 0.30 -1.14 1.09 -1.25 0.00 0.00 0.00 175.76 174.77 1r6h s PRO 12 N -4.02 1.16 -0.07 0.00 0.04 -1.26 -4.98 135.00 125.87 1r6h s PRO 12 Ca 0.67 0.82 0.01 0.00 0.04 0.00 0.00 61.00 62.54 1r6h s PRO 12 Cb -0.20 -1.80 0.02 0.00 0.04 0.00 0.00 34.50 32.56 1r6h s PRO 12 CO 0.39 -2.31 -0.09 0.08 0.04 0.00 0.00 177.00 175.12 1r6h s VAL 13 N -2.92 0.96 -0.24 -0.36 1.01 0.18 -4.94 120.40 114.09 1r6h s VAL 13 Ca 0.64 -0.33 -0.08 0.00 0.00 0.00 0.00 61.98 62.20 1r6h s VAL 13 Cb -0.18 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 1r6h s VAL 13 CO 0.57 0.33 0.10 -1.61 0.00 0.00 0.00 175.10 174.49 1r6h s GLU 14 N 1.06 3.82 -0.13 2.72 8.01 -1.26 0.34 118.70 133.26 1r6h s GLU 14 Ca -0.08 -0.40 -0.04 0.00 0.01 0.00 0.00 54.97 54.47 1r6h s GLU 14 Cb -0.14 -3.39 -0.03 0.00 -4.31 0.00 0.00 34.13 26.26 1r6h s GLU 14 CO -0.01 -0.06 0.00 0.08 0.01 0.00 0.00 175.26 175.28 1r6h s VAL 15 N 1.32 4.29 -0.04 2.63 1.01 0.13 -4.92 120.40 124.82 1r6h s VAL 15 Ca 0.06 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 61.83 1r6h s VAL 15 Cb -0.15 -2.86 0.01 0.00 0.00 0.00 0.00 36.38 33.38 1r6h s VAL 15 CO 0.05 0.53 -0.09 -0.94 0.00 0.00 0.00 175.10 174.66 1r6h s SER 16 N -0.16 1.23 -0.17 3.32 1.04 -1.26 0.12 113.70 117.81 1r6h s SER 16 Ca 0.05 -0.19 -0.20 0.00 0.48 0.00 0.00 55.95 56.09 1r6h s SER 16 Cb -0.13 -0.43 0.05 0.00 0.10 0.00 0.00 66.02 65.62 1r6h s SER 16 CO 0.02 0.04 0.54 -0.47 0.98 0.00 0.00 173.24 174.34 1r6h s TYR 17 N 0.42 -0.57 0.00 5.02 5.04 -1.05 -5.05 117.35 121.16 1r6h s TYR 17 Ca -0.07 1.31 0.00 0.00 -2.44 0.00 0.00 57.07 55.88 1r6h s TYR 17 Cb -0.11 0.22 0.00 0.00 0.35 0.00 0.00 41.96 42.42 1r6h s TYR 17 CO 0.01 -0.33 0.00 1.63 -1.34 0.00 0.00 175.55 175.52 1r6h n LYS 18 N 2.45 0.00 0.00 4.97 4.76 -1.26 -2.22 118.16 126.85 1r6h n LYS 18 Ca -0.15 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.29 1r6h n LYS 18 Cb 0.56 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.75 1r6h n LYS 18 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1r6h n HIS 19 N 0.00 0.00 -4.12 2.13 8.25 -1.26 -5.09 115.22 115.13 1r6h n HIS 19 Ca 0.00 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.22 1r6h n HIS 19 Cb 0.00 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.04 1r6h n HIS 19 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1r6h s MET 20 N -0.08 2.25 0.27 -0.41 -1.94 -0.94 -4.06 119.30 114.39 1r6h s MET 20 Ca 0.00 -1.76 0.07 0.00 -1.71 0.00 0.00 55.69 52.29 1r6h s MET 20 Cb 0.00 -2.03 -0.06 0.00 2.01 0.00 0.00 34.83 34.75 1r6h s MET 20 CO 0.00 -0.05 -0.07 1.03 -0.01 0.00 0.00 175.02 175.93 1r6h s ARG 21 N -3.88 1.52 -0.01 2.03 0.52 -1.10 -2.53 118.95 115.49 1r6h s ARG 21 Ca 0.40 -1.76 0.01 0.00 -0.52 0.00 0.00 55.73 53.86 1r6h s ARG 21 Cb 0.02 -1.14 0.00 0.00 0.52 0.00 0.00 34.95 34.35 1r6h s ARG 21 CO 0.22 0.05 -0.04 -0.06 0.02 0.00 0.00 175.30 175.50 1r6h s PHE 22 N -3.02 0.41 -0.10 -0.53 0.08 0.32 -3.16 117.98 111.97 1r6h s PHE 22 Ca 0.29 -0.07 0.01 0.00 0.12 0.00 0.00 56.93 57.28 1r6h s PHE 22 Cb 0.03 -0.31 -0.02 0.00 -0.57 0.00 0.00 43.02 42.15 1r6h s PHE 22 CO 0.11 -0.04 -0.15 -0.51 -0.10 0.00 0.00 175.22 174.53 1r6h s LEU 23 N 0.17 2.64 -0.32 -0.37 2.01 0.12 0.18 118.68 123.09 1r6h s LEU 23 Ca -0.01 -0.32 -0.01 0.00 0.01 0.00 0.00 54.13 53.80 1r6h s LEU 23 Cb -0.05 -1.57 0.07 0.00 0.01 0.00 0.00 46.19 44.66 1r6h s LEU 23 CO -0.00 0.21 0.04 -0.63 1.01 0.00 0.00 176.35 176.98 1r6h s ILE 24 N 0.05 2.84 0.21 -0.59 -1.09 0.15 0.16 121.20 122.93 1r6h s ILE 24 Ca -0.06 -1.71 0.01 0.00 -2.23 0.00 0.00 60.65 56.67 1r6h s ILE 24 Cb -0.15 -2.77 -0.05 0.00 -1.58 0.00 0.00 42.46 37.91 1r6h s ILE 24 CO 0.05 -0.30 0.05 -0.89 -1.23 0.00 0.00 174.94 172.62 1r6h s THR 25 N 1.16 0.55 0.44 2.92 2.01 0.91 -0.64 115.64 122.98 1r6h s THR 25 Ca -0.00 -1.99 -0.18 0.00 0.31 0.00 0.00 61.69 59.83 1r6h s THR 25 Cb -0.20 -2.35 -0.10 0.00 0.01 0.00 0.00 72.50 69.86 1r6h s THR 25 CO -0.03 -0.25 0.92 -2.28 -0.69 0.00 0.00 174.62 172.29 1r6h s HIS 26 N -3.75 3.37 0.74 4.92 2.46 -1.26 0.31 115.29 122.07 1r6h s HIS 26 Ca 0.31 1.49 -0.14 0.00 0.47 0.00 0.00 55.06 57.18 1r6h s HIS 26 Cb 0.07 -2.77 0.04 0.00 -0.13 0.00 0.00 32.58 29.79 1r6h s HIS 26 CO 0.08 -0.16 1.19 -0.80 -2.47 0.00 0.00 174.74 172.58 1r6h s ASN 27 N -2.50 4.22 0.33 9.88 -0.87 -1.26 -4.82 114.94 119.93 1r6h s ASN 27 Ca 0.60 2.28 -0.28 0.00 -1.57 0.00 0.00 52.86 53.89 1r6h s ASN 27 Cb -0.09 -2.58 -0.13 0.00 -0.02 0.00 0.00 41.25 38.43 1r6h s ASN 27 CO 0.20 -2.24 1.23 -2.65 -2.57 0.00 0.00 177.10 171.07 1r6h n PRO 28 N -2.82 1.96 -2.95 -0.60 -0.02 -1.26 -5.01 135.00 124.31 1r6h n PRO 28 Ca 0.13 0.69 -0.19 0.00 -2.02 0.00 0.00 63.50 62.11 1r6h n PRO 28 Cb 0.51 -2.23 0.04 0.00 -0.02 0.00 0.00 33.50 31.80 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 -1.09 2.53 -0.75 3.45 -4.23 -1.26 -4.96 115.64 109.33 1r6h s THR 29 Ca 0.56 -0.93 0.23 0.00 -1.18 0.00 0.00 61.69 60.38 1r6h s THR 29 Cb -0.59 -2.60 -0.06 0.00 1.34 0.00 0.00 72.50 70.58 1r6h s THR 29 CO 0.62 0.00 1.17 -3.20 -0.54 0.00 0.00 174.62 172.66 1r6h n ASN 30 N -2.15 0.63 -0.05 3.99 5.15 -1.26 -4.28 115.26 117.29 1r6h n ASN 30 Ca 0.12 -0.23 -0.10 0.00 -0.60 0.00 0.00 54.58 53.77 1r6h n ASN 30 Cb 0.60 0.56 -0.15 0.00 -0.53 0.00 0.00 39.78 40.27 1r6h n ASN 30 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1r6h n ALA 31 N -1.71 1.45 -3.46 5.20 0.00 -1.26 -4.79 120.51 115.94 1r6h n ALA 31 Ca 0.03 -0.94 -0.29 0.00 0.00 0.00 0.00 53.44 52.24 1r6h n ALA 31 Cb 0.40 -0.61 -0.12 0.00 0.00 0.00 0.00 19.45 19.13 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 -4.98 115.64 102.64 1r6h s THR 32 Ca -0.09 -1.76 -0.22 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 0.58 0.25 -0.54 0.00 0.00 174.62 174.73 1r6h h LEU 33 N 6.95 0.00 -0.57 4.79 7.12 -1.87 -3.32 115.31 128.41 1r6h h LEU 33 Ca 0.07 -0.77 0.06 0.00 0.13 0.00 0.00 57.88 57.38 1r6h h LEU 33 Cb 0.97 0.00 -0.06 0.00 -0.53 0.00 0.00 40.66 41.04 1r6h h LEU 33 CO 0.27 0.91 0.27 -1.28 -0.13 0.00 0.00 178.44 178.48 1r6h h SER 34 N -1.00 0.36 -0.58 1.25 0.87 -1.95 -1.81 113.55 110.68 1r6h h SER 34 Ca -0.01 0.05 0.06 0.00 -1.23 0.00 0.00 61.79 60.66 1r6h h SER 34 Cb 0.79 -0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.71 1r6h h SER 34 CO -0.01 0.23 0.38 0.74 -0.53 0.00 0.00 176.83 177.65 1r6h h THR 35 N 0.51 0.99 -0.02 2.23 2.02 -1.98 -2.34 112.91 114.31 1r6h h THR 35 Ca 0.27 -0.19 -0.05 0.00 0.77 0.00 0.00 66.41 67.21 1r6h h THR 35 Cb 0.23 0.40 0.00 0.00 -1.74 0.00 0.00 68.15 67.04 1r6h h THR 35 CO -0.21 0.10 -0.19 0.15 0.37 0.00 0.00 175.52 175.73 1r6h h PHE 36 N 0.54 0.24 -0.96 3.16 3.04 -1.44 -2.68 116.94 118.84 1r6h h PHE 36 Ca 0.25 -0.11 0.10 0.00 3.98 0.00 0.00 57.97 62.19 1r6h h PHE 36 Cb 0.30 -0.03 -0.07 0.00 2.56 0.00 0.00 35.95 38.70 1r6h h PHE 36 CO -0.00 0.85 0.62 -0.84 -2.02 0.00 0.00 178.31 176.92 1r6h h ILE 37 N -0.44 0.96 0.15 1.41 3.07 -1.13 0.42 117.51 121.95 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 0.89 -0.10 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 0.98 -0.19 0.01 0.16 4.39 -1.47 -1.35 114.58 117.11 1r6h h GLU 38 Ca 0.46 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 60.17 1r6h h GLU 38 Cb 0.41 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1r6h h GLU 38 CO -0.22 0.09 -0.01 -0.44 -1.16 0.00 0.00 179.01 177.28 1r6h h ASP 39 N -0.47 -0.01 -0.58 1.42 3.32 -1.07 0.93 116.42 119.96 1r6h h ASP 39 Ca -0.02 -0.41 0.07 0.00 0.02 0.00 0.00 57.03 56.69 1r6h h ASP 39 Cb 0.37 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.86 1r6h h ASP 39 CO 0.03 0.40 0.27 -0.07 -1.72 0.00 0.00 179.24 178.15 1r6h h LEU 40 N -0.43 0.34 -0.18 1.55 3.38 -0.27 -0.64 115.31 119.05 1r6h h LEU 40 Ca -0.00 0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 1r6h h LEU 40 Cb 0.42 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1r6h h LEU 40 CO 0.00 0.22 -0.61 0.50 0.09 0.00 0.00 178.44 178.64 1r6h h LYS 41 N 0.50 0.00 -0.76 1.13 3.11 -1.25 -3.29 116.57 116.00 1r6h h LYS 41 Ca 0.27 0.00 0.14 0.00 -2.81 0.00 0.00 60.65 58.25 1r6h h LYS 41 Cb 0.25 0.00 -0.09 0.00 -1.00 0.00 0.00 32.23 31.39 1r6h h LYS 41 CO -0.23 0.61 0.33 0.87 -2.81 0.00 0.00 179.45 178.23 1r6h h LYS 42 N 0.00 0.48 -0.67 1.90 1.57 0.25 -0.22 116.57 119.88 1r6h h LYS 42 Ca -0.01 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 58.70 1r6h h LYS 42 Cb 1.39 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 33.56 1r6h h LYS 42 CO 0.08 0.32 0.24 -0.92 -0.57 0.00 0.00 179.45 178.59 1r6h h TYR 43 N 0.49 1.03 0.00 -1.35 5.03 -1.54 -3.48 116.97 117.15 1r6h h TYR 43 Ca 0.41 -0.08 0.00 0.00 2.58 0.00 0.00 58.73 61.64 1r6h h TYR 43 Cb 0.60 -0.31 0.00 0.00 1.55 0.00 0.00 36.73 38.57 1r6h h TYR 43 CO -0.14 0.80 0.00 0.41 -1.32 0.00 0.00 178.16 177.91 1r6h n GLY 44 N -0.90 -2.25 2.87 1.82 0.00 -0.09 -4.97 105.19 101.66 1r6h n GLY 44 Ca 0.06 -1.21 -0.27 0.00 0.00 0.00 0.00 46.02 44.59 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 1.29 0.00 4.61 0.00 -1.26 -4.42 121.76 120.10 1r6h s ALA 45 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 51.96 51.33 1r6h s ALA 45 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 23.12 22.12 1r6h s ALA 45 CO 0.00 -0.64 0.00 2.41 0.00 0.00 0.00 175.76 177.53 1r6h n THR 46 N 4.95 0.00 -1.98 0.00 -1.04 -0.16 -4.24 114.28 111.80 1r6h n THR 46 Ca -0.11 0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.50 1r6h n THR 46 Cb 0.49 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.00 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 2.47 -0.08 12.58 -1.32 -1.25 -4.10 115.64 121.20 1r6h s THR 47 Ca 0.00 0.41 0.04 0.00 -1.21 0.00 0.00 61.69 60.94 1r6h s THR 47 Cb 0.00 -3.24 -0.00 0.00 -1.51 0.00 0.00 72.50 67.75 1r6h s THR 47 CO 0.00 0.05 -0.21 -0.69 -2.21 0.00 0.00 174.62 171.56 1r6h s VAL 48 N -1.26 1.82 -0.34 5.08 1.01 0.23 -2.70 120.40 124.24 1r6h s VAL 48 Ca 0.59 -0.90 -0.01 0.00 0.00 0.00 0.00 61.98 61.66 1r6h s VAL 48 Cb -0.39 -1.57 0.08 0.00 0.00 0.00 0.00 36.38 34.49 1r6h s VAL 48 CO 0.50 0.51 0.06 0.54 0.00 0.00 0.00 175.10 176.71 1r6h s VAL 49 N 0.22 2.91 -0.30 2.92 0.11 0.13 0.38 120.40 126.76 1r6h s VAL 49 Ca -0.12 -1.77 -0.03 0.00 -2.93 0.00 0.00 61.98 57.13 1r6h s VAL 49 Cb -0.16 -2.85 0.04 0.00 -1.53 0.00 0.00 36.38 31.89 1r6h s VAL 49 CO 0.06 -0.36 0.01 0.00 -3.33 0.00 0.00 175.10 171.47 1r6h s ARG 50 N 1.15 2.54 -0.72 1.54 1.70 -1.12 -1.64 118.95 122.40 1r6h s ARG 50 Ca 0.01 -1.19 -0.11 0.00 -0.47 0.00 0.00 55.73 53.97 1r6h s ARG 50 Cb -0.21 -3.20 0.19 0.00 -0.57 0.00 0.00 34.95 31.16 1r6h s ARG 50 CO -0.03 -0.59 0.62 0.08 -1.08 0.00 0.00 175.30 174.30 1r6h s VAL 51 N 1.30 4.95 0.29 4.99 1.01 -1.26 -2.50 120.40 129.17 1r6h s VAL 51 Ca -0.04 -2.48 -0.18 0.00 0.00 0.00 0.00 61.98 59.28 1r6h s VAL 51 Cb -0.19 -4.12 0.02 0.00 0.00 0.00 0.00 36.38 32.09 1r6h s VAL 51 CO -0.01 -0.95 0.67 0.00 0.00 0.00 0.00 175.10 174.80 1r6h s GLU 53 N -3.74 4.23 -0.09 0.00 0.41 -1.26 -3.87 118.70 114.38 1r6h s GLU 53 Ca 0.15 2.34 -0.30 0.00 -0.41 0.00 0.00 54.97 56.75 1r6h s GLU 53 Cb -0.05 -3.16 -0.04 0.00 -1.78 0.00 0.00 34.13 29.11 1r6h s GLU 53 CO 0.08 -0.59 1.37 0.54 -0.49 0.00 0.00 175.26 176.18 1r6h s VAL 54 N 1.10 3.99 0.00 2.63 0.11 -1.26 -4.85 120.40 122.11 1r6h s VAL 54 Ca 0.69 1.26 0.00 0.00 -2.93 0.00 0.00 61.98 61.00 1r6h s VAL 54 Cb -0.43 -3.81 0.00 0.00 -1.53 0.00 0.00 36.38 30.61 1r6h s VAL 54 CO 0.32 -0.07 0.00 0.35 -3.33 0.00 0.00 175.10 172.37 1r6h n THR 55 N 5.12 0.00 -3.65 5.04 -2.24 -1.26 -4.95 114.28 112.34 1r6h n THR 55 Ca 0.14 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.64 1r6h n THR 55 Cb 0.44 -1.25 -0.12 0.00 -2.10 0.00 0.00 70.33 67.31 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 0.08 4.78 2.02 -1.26 -4.96 117.35 118.09 1r6h s TYR 56 Ca 0.00 -2.60 -0.07 0.00 -0.37 0.00 0.00 57.07 54.02 1r6h s TYR 56 Cb 0.00 -1.76 -0.25 0.00 -0.40 0.00 0.00 41.96 39.55 1r6h s TYR 56 CO 0.00 -0.74 1.15 0.22 -1.57 0.00 0.00 175.55 174.62 1r6h h ASP 57 N 6.05 0.57 0.03 2.29 1.82 -1.99 -3.36 116.42 121.83 1r6h h ASP 57 Ca 0.12 -0.56 -0.05 0.00 -0.39 0.00 0.00 57.03 56.15 1r6h h ASP 57 Cb 0.88 -0.18 0.01 0.00 0.68 0.00 0.00 39.33 40.71 1r6h h ASP 57 CO 0.50 1.41 -0.20 0.11 -1.61 0.00 0.00 179.24 179.45 1r6h h LYS 58 N 0.15 0.08 -0.78 0.28 1.57 -1.99 -3.28 116.57 112.60 1r6h h LYS 58 Ca -0.15 -0.13 0.16 0.00 -1.87 0.00 0.00 60.65 58.66 1r6h h LYS 58 Cb 1.91 0.05 -0.15 0.00 0.08 0.00 0.00 32.23 34.12 1r6h h LYS 58 CO 0.21 1.04 -0.17 1.15 -0.57 0.00 0.00 179.45 181.11 1r6h h THR 59 N -0.81 0.23 -0.14 -0.16 2.02 -1.98 0.26 112.91 112.32 1r6h h THR 59 Ca -0.03 -0.00 -0.16 0.00 0.77 0.00 0.00 66.41 66.98 1r6h h THR 59 Cb 1.14 0.22 0.01 0.00 -1.74 0.00 0.00 68.15 67.77 1r6h h THR 59 CO 0.04 0.00 -0.55 -0.65 0.37 0.00 0.00 175.52 174.73 1r6h h PRO 60 N 0.01 0.62 -0.14 6.66 0.11 -1.73 -2.64 132.00 134.89 1r6h h PRO 60 Ca 0.38 -0.48 -0.09 0.00 0.11 0.00 0.00 66.00 65.92 1r6h h PRO 60 Cb 0.60 0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.80 1r6h h PRO 60 CO -0.79 1.10 -0.27 1.25 -0.21 0.00 0.00 178.00 179.08 1r6h h LEU 61 N 0.28 0.47 -1.00 2.35 6.46 -1.48 -2.00 115.31 120.40 1r6h h LEU 61 Ca -0.03 -0.55 -0.10 0.00 -0.12 0.00 0.00 57.88 57.08 1r6h h LEU 61 Cb 1.18 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.96 1r6h h LEU 61 CO 0.12 0.94 -0.47 -0.33 -0.62 0.00 0.00 178.44 178.08 1r6h h GLU 62 N 0.03 0.00 0.12 1.25 5.08 -0.64 0.69 114.58 121.11 1r6h h GLU 62 Ca 0.01 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.09 1r6h h GLU 62 Cb 0.86 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 1r6h h GLU 62 CO 0.06 0.47 -1.29 0.87 -1.00 0.00 0.00 179.01 178.12 1r6h h LYS 63 N 0.00 0.25 0.00 2.33 1.79 -1.50 -3.34 116.57 116.10 1r6h h LYS 63 Ca -0.00 -0.42 0.00 0.00 -2.18 0.00 0.00 60.65 58.04 1r6h h LYS 63 Cb 0.89 0.16 0.00 0.00 -1.58 0.00 0.00 32.23 31.69 1r6h h LYS 63 CO 0.06 1.17 -1.06 -0.25 -1.08 0.00 0.00 179.45 178.29 1r6h n ASP 64 N -3.50 0.85 -3.97 0.86 8.00 -0.75 -4.99 116.55 113.05 1r6h n ASP 64 Ca -0.10 -0.83 -0.31 0.00 0.71 0.00 0.00 54.79 54.27 1r6h n ASP 64 Cb 1.02 1.13 0.01 0.00 -0.02 0.00 0.00 41.12 43.26 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 -0.45 3.41 0.44 0.00 0.24 -4.97 105.19 105.31 1r6h n GLY 65 Ca 0.03 0.17 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 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 -3.37 2.43 0.14 -0.61 -4.36 -1.22 -5.04 121.20 109.17 1r6h s ILE 66 Ca 0.59 -1.59 -0.30 0.00 -0.26 0.00 0.00 60.65 59.09 1r6h s ILE 66 Cb -0.30 -2.06 -0.07 0.00 1.25 0.00 0.00 42.46 41.28 1r6h s ILE 66 CO 0.85 0.16 1.05 0.42 0.24 0.00 0.00 174.94 177.66 1r6h s THR 67 N -1.03 4.15 0.00 8.37 -4.23 -1.26 -4.78 115.64 116.86 1r6h s THR 67 Ca 0.15 1.80 -0.08 0.00 -1.18 0.00 0.00 61.69 62.38 1r6h s THR 67 Cb -0.10 -4.15 0.00 0.00 1.34 0.00 0.00 72.50 69.59 1r6h s THR 67 CO 0.06 0.29 0.15 0.54 -0.54 0.00 0.00 174.62 175.12 1r6h s VAL 68 N -0.08 0.08 -0.18 2.29 0.11 -1.26 0.77 120.40 122.14 1r6h s VAL 68 Ca 0.49 -0.66 -0.07 0.00 -2.93 0.00 0.00 61.98 58.80 1r6h s VAL 68 Cb -0.27 -0.44 -0.04 0.00 -1.53 0.00 0.00 36.38 34.10 1r6h s VAL 68 CO 0.32 -0.36 0.07 -0.69 -3.33 0.00 0.00 175.10 171.11 1r6h s VAL 69 N -1.35 4.86 -0.45 2.04 1.01 0.16 -4.90 120.40 121.79 1r6h s VAL 69 Ca -0.14 -0.01 -0.14 0.00 0.00 0.00 0.00 61.98 61.68 1r6h s VAL 69 Cb -0.07 -3.18 0.06 0.00 0.00 0.00 0.00 36.38 33.18 1r6h s VAL 69 CO 0.02 0.48 0.35 -0.62 0.00 0.00 0.00 175.10 175.32 1r6h s ASP 70 N 0.22 6.05 -0.40 3.32 2.15 -1.26 -2.78 116.67 123.97 1r6h s ASP 70 Ca 0.05 -1.23 -0.05 0.00 0.43 0.00 0.00 52.55 51.74 1r6h s ASP 70 Cb -0.12 -2.14 0.09 0.00 -0.30 0.00 0.00 42.92 40.44 1r6h s ASP 70 CO 0.00 -0.57 0.20 0.26 -0.17 0.00 0.00 175.17 174.89 1r6h s TRP 71 N 1.62 3.43 0.38 -5.34 0.52 -1.04 -5.05 118.94 113.46 1r6h s TRP 71 Ca 0.04 -1.96 0.04 0.00 0.02 0.00 0.00 56.10 54.24 1r6h s TRP 71 Cb -0.23 -2.96 0.04 0.00 -1.15 0.00 0.00 33.47 29.17 1r6h s TRP 71 CO 0.07 -0.90 0.32 -0.35 0.02 0.00 0.00 176.95 176.11 1r6h n PRO 72 N 4.74 0.90 -4.86 4.98 -0.04 -1.25 -0.49 135.00 138.98 1r6h n PRO 72 Ca -0.07 -2.35 -0.25 0.00 -0.04 0.00 0.00 63.50 60.79 1r6h n PRO 72 Cb 0.42 0.20 -0.15 0.00 -0.04 0.00 0.00 33.50 33.93 1r6h n PRO 72 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1r6h s PHE 73 N -1.83 1.60 0.29 0.54 5.36 -1.26 -4.94 117.98 117.73 1r6h s PHE 73 Ca 0.24 -0.30 -0.12 0.00 -0.96 0.00 0.00 56.93 55.79 1r6h s PHE 73 Cb -0.02 -1.03 0.01 0.00 -0.34 0.00 0.00 43.02 41.64 1r6h s PHE 73 CO 0.15 -0.03 0.53 0.16 -1.46 0.00 0.00 175.22 174.58 1r6h s ASP 74 N -0.42 0.11 0.60 6.13 -4.77 -1.26 -4.98 116.67 112.08 1r6h s ASP 74 Ca 0.07 -1.04 0.29 0.00 -3.30 0.00 0.00 52.55 48.57 1r6h s ASP 74 Cb -0.07 0.65 1.63 0.00 -1.09 0.00 0.00 42.92 44.04 1r6h s ASP 74 CO -0.01 -1.25 2.05 -0.78 0.70 0.00 0.00 175.17 175.88 1r6h h ASP 75 N 2.17 0.00 -2.28 2.11 1.82 -2.08 -2.69 116.42 115.48 1r6h h ASP 75 Ca -0.27 0.00 -0.59 0.00 -0.39 0.00 0.00 57.03 55.79 1r6h h ASP 75 Cb 1.25 0.00 -0.42 0.00 0.68 0.00 0.00 39.33 40.84 1r6h h ASP 75 CO 0.36 0.00 -0.65 0.61 -1.61 0.00 0.00 179.24 177.94 1r6h n GLY 76 N -1.41 5.57 3.76 -0.78 0.00 -1.26 -5.06 105.19 106.01 1r6h n GLY 76 Ca 0.03 -2.76 -0.40 0.00 0.00 0.00 0.00 46.02 42.89 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 -3.46 3.41 -0.36 4.61 0.00 -1.02 -5.00 121.76 119.95 1r6h s ALA 77 Ca 0.49 0.23 -0.28 0.00 0.00 0.00 0.00 51.96 52.40 1r6h s ALA 77 Cb 0.28 -2.92 -0.03 0.00 0.00 0.00 0.00 23.12 20.45 1r6h s ALA 77 CO -0.14 0.13 1.93 -1.25 0.00 0.00 0.00 175.76 176.43 1r6h s PRO 78 N -0.27 3.11 0.28 0.00 0.04 -1.26 -4.90 135.00 131.99 1r6h s PRO 78 Ca 0.36 1.42 -0.01 0.00 0.04 0.00 0.00 61.00 62.81 1r6h s PRO 78 Cb -0.20 -4.28 0.39 0.00 0.04 0.00 0.00 34.50 30.45 1r6h s PRO 78 CO 0.22 -2.13 1.79 -1.35 0.04 0.00 0.00 177.00 175.57 1r6h h PRO 79 N 14.05 0.76 -7.14 0.56 0.11 -2.02 -3.46 132.00 134.86 1r6h h PRO 79 Ca -0.33 -0.18 -0.54 0.00 0.11 0.00 0.00 66.00 65.05 1r6h h PRO 79 Cb 1.19 -0.10 0.15 0.00 0.11 0.00 0.00 31.00 32.35 1r6h h PRO 79 CO 1.06 0.75 0.44 -1.25 -0.21 0.00 0.00 178.00 178.79 1r6h s PRO 80 N -5.04 2.37 0.56 1.05 0.04 -1.26 -4.91 135.00 127.81 1r6h s PRO 80 Ca -0.09 1.87 0.36 0.00 0.04 0.00 0.00 61.00 63.18 1r6h s PRO 80 Cb 0.15 -1.85 1.71 0.00 0.04 0.00 0.00 34.50 34.55 1r6h s PRO 80 CO 0.80 -1.68 2.09 0.78 0.04 0.00 0.00 177.00 179.03 1r6h h GLY 81 N 0.13 0.00 0.08 0.56 0.00 -1.99 -3.11 103.07 98.74 1r6h h GLY 81 Ca -0.49 0.00 0.27 0.00 0.00 0.00 0.00 47.33 47.11 1r6h h GLY 81 CO 0.51 0.00 0.70 1.70 0.00 0.00 0.00 176.54 179.45 1r6h h LYS 82 N 0.00 0.00 -0.39 4.80 3.64 -1.94 0.59 116.57 123.26 1r6h h LYS 82 Ca 0.00 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.44 1r6h h LYS 82 Cb 0.29 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.06 1r6h h LYS 82 CO 0.00 0.00 0.08 0.28 -2.27 0.00 0.00 179.45 177.54 1r6h h VAL 83 N 0.00 0.81 -1.00 2.00 2.07 -1.87 0.23 116.25 118.49 1r6h h VAL 83 Ca 0.44 -0.07 0.09 0.00 0.82 0.00 0.00 66.70 67.98 1r6h h VAL 83 Cb 1.83 0.58 -0.07 0.00 -1.52 0.00 0.00 31.29 32.11 1r6h h VAL 83 CO -0.00 0.04 0.64 0.58 0.02 0.00 0.00 177.57 178.84 1r6h h VAL 84 N 0.21 1.01 -0.28 2.57 2.07 -0.08 0.51 116.25 122.25 1r6h h VAL 84 Ca 0.19 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.39 1r6h h VAL 84 Cb 0.22 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 29.81 1r6h h VAL 84 CO -0.24 0.20 0.20 -0.33 0.02 0.00 0.00 177.57 177.41 1r6h h GLU 85 N 1.08 0.15 0.02 1.57 5.08 -0.25 0.36 114.58 122.59 1r6h h GLU 85 Ca 0.46 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.81 1r6h h GLU 85 Cb 0.32 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1r6h h GLU 85 CO -0.21 0.10 -0.01 0.22 -1.00 0.00 0.00 179.01 178.11 1r6h h ASP 86 N 0.16 -0.02 0.53 1.42 3.58 0.17 -1.48 116.42 120.77 1r6h h ASP 86 Ca 0.13 -0.24 -0.06 0.00 0.42 0.00 0.00 57.03 57.28 1r6h h ASP 86 Cb 0.31 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.35 1r6h h ASP 86 CO -0.02 0.22 -0.27 -0.25 -2.88 0.00 0.00 179.24 176.04 1r6h h TRP 87 N -0.27 0.00 -0.71 0.28 2.91 -0.93 -2.50 115.95 114.73 1r6h h TRP 87 Ca -0.00 0.00 -0.03 0.00 1.13 0.00 0.00 58.89 59.98 1r6h h TRP 87 Cb 0.26 0.00 -0.03 0.00 -0.51 0.00 0.00 29.16 28.87 1r6h h TRP 87 CO 0.01 0.27 0.32 -0.07 -1.03 0.00 0.00 178.44 177.94 1r6h h LEU 88 N 0.00 0.96 -0.43 0.65 3.38 0.13 -0.58 115.31 119.42 1r6h h LEU 88 Ca -0.00 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 57.71 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 0.84 -0.14 -1.28 0.09 0.00 0.00 178.44 177.99 1r6h h SER 89 N 1.01 0.86 0.07 -0.43 0.87 -0.86 0.48 113.55 115.54 1r6h h SER 89 Ca 0.24 -0.38 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 1r6h h SER 89 Cb 0.16 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.88 1r6h h SER 89 CO -0.03 1.05 -0.07 0.25 -0.53 0.00 0.00 176.83 177.50 1r6h h LEU 90 N 0.67 -0.19 -0.23 2.23 7.12 -1.11 -1.01 115.31 122.80 1r6h h LEU 90 Ca 0.10 0.02 -0.18 0.00 0.13 0.00 0.00 57.88 57.96 1r6h h LEU 90 Cb 0.69 0.07 0.00 0.00 -0.53 0.00 0.00 40.66 40.89 1r6h h LEU 90 CO 0.05 -0.11 -0.54 1.62 -0.13 0.00 0.00 178.44 179.33 1r6h h VAL 91 N -0.16 1.29 -0.93 1.05 3.04 -1.08 -2.36 116.25 117.10 1r6h h VAL 91 Ca 0.01 -1.74 0.11 0.00 -1.01 0.00 0.00 66.70 64.06 1r6h h VAL 91 Cb 0.16 1.78 -0.07 0.00 -2.01 0.00 0.00 31.29 31.15 1r6h h VAL 91 CO -0.03 0.56 0.59 0.50 -1.01 0.00 0.00 177.57 178.19 1r6h h LYS 92 N 0.52 0.87 -0.11 4.17 3.11 0.08 0.55 116.57 125.76 1r6h h LYS 92 Ca -0.00 -0.05 -0.21 0.00 -2.81 0.00 0.00 60.65 57.58 1r6h h LYS 92 Cb 1.16 -0.20 0.01 0.00 -1.00 0.00 0.00 32.23 32.20 1r6h h LYS 92 CO 0.12 0.57 -0.76 0.00 -2.81 0.00 0.00 179.45 176.58 1r6h h ALA 93 N 1.55 0.24 0.00 5.00 0.00 -1.14 -1.94 119.26 122.97 1r6h h ALA 93 Ca 0.44 -0.59 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 1r6h h ALA 93 Cb 0.47 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1r6h h ALA 93 CO -0.20 0.60 -0.42 0.87 0.00 0.00 0.00 179.25 180.09 1r6h h LYS 94 N 0.39 0.00 0.03 0.00 1.79 -0.73 -1.77 116.57 116.28 1r6h h LYS 94 Ca -0.06 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.40 1r6h h LYS 94 Cb 1.40 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.05 1r6h h LYS 94 CO 0.15 0.42 -0.02 0.74 -1.08 0.00 0.00 179.45 179.67 1r6h h PHE 95 N 0.00 -0.04 -0.71 -1.35 -1.00 0.07 -1.57 116.94 112.35 1r6h h PHE 95 Ca -0.00 -0.00 0.01 0.00 2.81 0.00 0.00 57.97 60.79 1r6h h PHE 95 Cb 0.76 0.01 -0.04 0.00 3.61 0.00 0.00 35.95 40.30 1r6h h PHE 95 CO 0.00 0.64 0.47 0.00 -1.61 0.00 0.00 178.31 177.81 1r6h h GLU 97 N 0.94 0.13 -3.57 0.00 4.57 -1.41 -3.40 114.58 111.84 1r6h h GLU 97 Ca 0.26 -0.14 -0.62 0.00 -1.18 0.00 0.00 59.36 57.68 1r6h h GLU 97 Cb -0.08 0.04 -0.40 0.00 -0.16 0.00 0.00 28.75 28.15 1r6h h GLU 97 CO -0.06 0.90 -0.71 0.00 -1.18 0.00 0.00 179.01 177.96 1r6h s ALA 98 N -3.20 2.42 0.09 2.92 0.00 -0.59 -5.08 121.76 118.31 1r6h s ALA 98 Ca -0.02 -2.52 -0.31 0.00 0.00 0.00 0.00 51.96 49.11 1r6h s ALA 98 Cb 0.11 -1.90 -0.07 0.00 0.00 0.00 0.00 23.12 21.25 1r6h s ALA 98 CO 0.82 -1.88 1.36 -1.25 0.00 0.00 0.00 175.76 174.80 1r6h s PRO 99 N 0.62 4.33 -1.07 0.00 0.04 -1.16 -3.66 135.00 134.11 1r6h s PRO 99 Ca 0.14 2.01 -0.07 0.00 0.04 0.00 0.00 61.00 63.12 1r6h s PRO 99 Cb -0.22 -3.33 -0.06 0.00 0.04 0.00 0.00 34.50 30.93 1r6h s PRO 99 CO -0.07 -0.44 0.91 0.41 0.04 0.00 0.00 177.00 177.85 1r6h n GLY 100 N 3.48 -1.11 0.04 0.56 0.00 -1.26 -4.97 105.19 101.94 1r6h n GLY 100 Ca 0.11 0.55 -0.00 0.00 0.00 0.00 0.00 46.02 46.68 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 -3.17 0.14 -4.23 1.61 3.41 -1.24 -4.77 113.62 105.36 1r6h n SER 101 Ca -0.08 -1.01 -0.35 0.00 -0.26 0.00 0.00 58.87 57.16 1r6h n SER 101 Cb 0.62 -0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.43 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 1.36 4.73 -0.01 0.00 1.01 -1.19 -0.99 120.40 125.31 1r6h s VAL 103 Ca -0.01 -0.68 0.07 0.00 0.00 0.00 0.00 61.98 61.37 1r6h s VAL 103 Cb -0.18 -3.29 -0.02 0.00 0.00 0.00 0.00 36.38 32.90 1r6h s VAL 103 CO -0.02 0.13 -0.23 0.00 0.00 0.00 0.00 175.10 174.99 1r6h s ALA 104 N -1.41 1.90 0.15 5.51 0.00 -1.10 0.10 121.76 126.91 1r6h s ALA 104 Ca 0.31 -1.00 -0.02 0.00 0.00 0.00 0.00 51.96 51.25 1r6h s ALA 104 Cb -0.12 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.49 1r6h s ALA 104 CO 0.23 0.46 0.10 0.08 0.00 0.00 0.00 175.76 176.63 1r6h s VAL 105 N -0.57 0.07 0.72 0.00 1.01 0.42 0.17 120.40 122.21 1r6h s VAL 105 Ca 0.09 -1.90 -0.14 0.00 0.00 0.00 0.00 61.98 60.03 1r6h s VAL 105 Cb -0.09 -2.17 0.03 0.00 0.00 0.00 0.00 36.38 34.16 1r6h s VAL 105 CO -0.01 -0.32 1.13 -2.28 0.00 0.00 0.00 175.10 173.63 1r6h s HIS 106 N -4.08 2.41 -0.53 5.22 5.65 -0.65 -0.06 115.29 123.25 1r6h s HIS 106 Ca 0.28 1.58 -0.27 0.00 0.25 0.00 0.00 55.06 56.90 1r6h s HIS 106 Cb 0.07 -3.22 -0.03 0.00 -1.18 0.00 0.00 32.58 28.22 1r6h s HIS 106 CO 0.05 -1.99 1.90 0.00 -0.65 0.00 0.00 174.74 174.05 1r6h n VAL 108 N 7.34 0.00 0.05 0.00 3.14 -1.26 -3.74 118.33 123.86 1r6h n VAL 108 Ca 0.23 0.00 0.01 0.00 -2.96 0.00 0.00 64.34 61.61 1r6h n VAL 108 Cb 0.51 -0.62 0.03 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 1.12 -3.00 1.55 0.00 -1.26 -4.30 120.51 113.61 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 -1.32 3.56 3.08 0.00 0.00 -1.25 -5.02 105.19 104.24 1r6h n GLY 110 Ca 0.00 -0.67 -0.28 0.00 0.00 0.00 0.00 46.02 45.08 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 1.77 0.00 0.99 1.43 -1.26 -4.00 118.68 117.61 1r6h s LEU 111 Ca 0.00 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 52.69 1r6h s LEU 111 Cb 0.00 -1.07 0.00 0.00 0.03 0.00 0.00 46.19 45.15 1r6h s LEU 111 CO 0.00 0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.24 1r6h n GLY 112 N 3.96 2.64 0.00 -3.19 0.00 -1.26 -4.98 105.19 102.37 1r6h n GLY 112 Ca -0.20 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 0.99 -0.22 1.61 3.00 -1.26 -4.69 116.66 116.10 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 -0.92 0.14 0.00 0.00 0.00 0.00 32.46 31.68 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 0.80 -0.50 7.54 0.00 -1.92 -2.55 119.26 122.64 1r6h h ALA 114 Ca 0.00 0.15 0.10 0.00 0.00 0.00 0.00 54.91 55.16 1r6h h ALA 114 Cb 0.00 0.21 -0.08 0.00 0.00 0.00 0.00 17.79 17.92 1r6h h ALA 114 CO 0.00 -0.32 0.02 -1.00 0.00 0.00 0.00 179.25 177.95 1r6h h PRO 115 N 0.26 0.13 -0.77 0.00 0.13 -1.89 0.18 132.00 130.04 1r6h h PRO 115 Ca 0.36 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.46 1r6h h PRO 115 Cb 0.56 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 31.63 1r6h h PRO 115 CO -0.45 0.09 0.40 0.28 -0.23 0.00 0.00 178.00 178.08 1r6h h VAL 116 N 0.13 1.23 -0.06 1.56 2.07 -1.81 -2.51 116.25 116.86 1r6h h VAL 116 Ca 0.25 -0.61 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 1r6h h VAL 116 Cb 0.38 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1r6h h VAL 116 CO -0.40 0.27 0.02 -0.07 0.02 0.00 0.00 177.57 177.40 1r6h h LEU 117 N 1.08 0.10 0.13 2.57 3.38 -0.84 -1.49 115.31 120.24 1r6h h LEU 117 Ca 0.27 -0.23 0.02 0.00 0.09 0.00 0.00 57.88 58.03 1r6h h LEU 117 Cb 0.06 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1r6h h LEU 117 CO -0.04 0.30 -0.31 0.58 0.09 0.00 0.00 178.44 179.06 1r6h h VAL 118 N -0.11 0.34 -0.10 1.22 2.07 -0.48 -0.95 116.25 118.24 1r6h h VAL 118 Ca 0.02 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.55 1r6h h VAL 118 Cb 0.24 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 1r6h h VAL 118 CO 0.00 0.00 0.03 0.00 0.02 0.00 0.00 177.57 177.62 1r6h h ALA 119 N 0.12 0.10 -0.63 1.67 0.00 -1.50 -1.79 119.26 117.23 1r6h h ALA 119 Ca 0.03 0.01 0.17 0.00 0.00 0.00 0.00 54.91 55.12 1r6h h ALA 119 Cb 0.56 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1r6h h ALA 119 CO -0.18 -0.43 0.45 -0.07 0.00 0.00 0.00 179.25 179.03 1r6h h LEU 120 N 0.08 0.06 -0.07 0.00 -0.00 -1.04 -0.22 115.31 114.12 1r6h h LEU 120 Ca 0.04 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.88 1r6h h LEU 120 Cb 0.02 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 40.67 1r6h h LEU 120 CO -0.04 0.03 -0.13 0.00 -0.00 0.00 0.00 178.44 178.30 1r6h h ALA 121 N 1.69 0.11 0.00 1.53 0.00 -0.33 -2.86 119.26 119.39 1r6h h ALA 121 Ca 0.30 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1r6h h ALA 121 Cb 1.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1r6h h ALA 121 CO -0.02 -0.01 0.00 1.25 0.00 0.00 0.00 179.25 180.47 1r6h h LEU 122 N -0.27 0.00 -1.92 0.00 5.85 -0.55 -2.37 115.31 116.05 1r6h h LEU 122 Ca 0.00 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.81 1r6h h LEU 122 Cb 0.70 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 1r6h h LEU 122 CO 0.03 0.00 0.25 0.40 -0.34 0.00 0.00 178.44 178.77 1r6h h ILE 123 N 0.00 0.87 0.00 4.05 2.04 -1.00 0.10 117.51 123.57 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 0.07 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 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 0.09 0.00 -0.25 2.37 4.11 -1.59 -2.80 114.58 116.51 1r6h h GLU 124 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.59 1r6h h GLU 124 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1r6h h GLU 124 CO -0.02 0.00 0.00 0.45 0.07 0.00 0.00 179.01 179.51 1r6h n SER 125 N -2.66 1.07 0.00 3.06 2.88 0.35 -4.97 113.62 113.36 1r6h n SER 125 Ca 0.01 -2.02 0.00 0.00 -1.33 0.00 0.00 58.87 55.52 1r6h n SER 125 Cb 0.23 -0.16 0.00 0.00 -0.75 0.00 0.00 64.21 63.52 1r6h n SER 125 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1r6h n GLY 126 N 0.72 1.87 3.21 0.46 0.00 -1.05 -4.88 105.19 105.51 1r6h n GLY 126 Ca 0.06 -0.64 -0.31 0.00 0.00 0.00 0.00 46.02 45.13 1r6h n GLY 126 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1r6h n MET 127 N 0.00 0.50 0.02 1.61 0.00 -1.26 -4.62 117.12 113.37 1r6h n MET 127 Ca 0.00 -1.08 -0.01 0.00 -0.00 0.00 0.00 57.70 56.61 1r6h n MET 127 Cb 0.00 -2.45 -0.01 0.00 0.00 0.00 0.00 33.22 30.77 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 8.72 -0.07 -0.04 2.12 2.10 -1.81 -2.11 116.57 125.48 1r6h h LYS 128 Ca 0.25 0.01 -0.13 0.00 -2.00 0.00 0.00 60.65 58.77 1r6h h LYS 128 Cb 0.46 0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 31.80 1r6h h LYS 128 CO 1.71 -0.05 -0.58 -0.92 -2.00 0.00 0.00 179.45 177.61 1r6h h TYR 129 N -0.23 0.17 -0.06 0.07 3.20 -1.90 -0.59 116.97 117.63 1r6h h TYR 129 Ca -0.01 -0.06 -0.06 0.00 3.14 0.00 0.00 58.73 61.74 1r6h h TYR 129 Cb 0.06 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.30 1r6h h TYR 129 CO 0.05 0.68 -0.18 0.93 -1.64 0.00 0.00 178.16 178.00 1r6h h GLU 130 N 0.10 0.23 -0.23 1.82 5.08 -1.92 -2.52 114.58 117.14 1r6h h GLU 130 Ca -0.00 -0.17 -0.10 0.00 -1.00 0.00 0.00 59.36 58.09 1r6h h GLU 130 Cb 1.05 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.33 1r6h h GLU 130 CO 0.08 0.79 -0.26 0.22 -1.00 0.00 0.00 179.01 178.84 1r6h h ASP 131 N -0.30 0.63 -0.08 1.42 1.82 -1.39 -0.79 116.42 117.74 1r6h h ASP 131 Ca -0.01 -0.49 0.02 0.00 -0.39 0.00 0.00 57.03 56.16 1r6h h ASP 131 Cb 0.81 -0.18 -0.02 0.00 0.68 0.00 0.00 39.33 40.63 1r6h h ASP 131 CO 0.04 0.99 -0.02 0.00 -1.61 0.00 0.00 179.24 178.64 1r6h h ALA 132 N 0.66 0.05 -0.21 -0.78 0.00 -1.20 0.93 119.26 118.71 1r6h h ALA 132 Ca 0.03 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 1r6h h ALA 132 Cb 0.83 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1r6h h ALA 132 CO 0.06 -0.49 -0.45 0.82 0.00 0.00 0.00 179.25 179.19 1r6h h ILE 133 N -0.01 1.32 -0.01 0.00 1.08 -1.50 -1.50 117.51 116.89 1r6h h ILE 133 Ca 0.04 -1.67 -0.02 0.00 -0.39 0.00 0.00 64.86 62.82 1r6h h ILE 133 Cb 0.06 1.85 0.00 0.00 -3.07 0.00 0.00 36.82 35.67 1r6h h ILE 133 CO -0.08 0.52 -0.05 -0.61 -0.69 0.00 0.00 178.15 177.24 1r6h h GLN 134 N 0.36 0.05 -0.45 2.37 5.75 -1.03 -1.08 115.11 121.09 1r6h h GLN 134 Ca 0.00 -0.04 -0.14 0.00 -0.15 0.00 0.00 58.65 58.32 1r6h h GLN 134 Cb 1.06 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.60 1r6h h GLN 134 CO 0.10 0.71 -0.27 0.74 -2.65 0.00 0.00 178.83 177.46 1r6h h PHE 135 N -0.59 1.11 0.00 3.99 -1.00 0.78 -2.50 116.94 118.74 1r6h h PHE 135 Ca -0.00 -0.29 -0.10 0.00 2.81 0.00 0.00 57.97 60.39 1r6h h PHE 135 Cb 0.72 -0.25 -0.01 0.00 3.61 0.00 0.00 35.95 40.01 1r6h h PHE 135 CO 0.16 1.11 -0.49 0.97 -1.61 0.00 0.00 178.31 178.44 1r6h h ILE 136 N 0.82 1.13 -0.20 -0.55 2.10 -1.32 -2.80 117.51 116.68 1r6h h ILE 136 Ca 0.09 -1.83 -0.02 0.00 1.08 0.00 0.00 64.86 64.19 1r6h h ILE 136 Cb 0.85 2.05 -0.01 0.00 -1.09 0.00 0.00 36.82 38.62 1r6h h ILE 136 CO 0.07 0.48 0.04 0.03 -1.08 0.00 0.00 178.15 177.70 1r6h h ARG 137 N 0.00 0.32 -0.49 2.19 2.47 -0.94 -3.05 114.38 114.88 1r6h h ARG 137 Ca -0.00 -0.08 0.01 0.00 -1.26 0.00 0.00 59.98 58.64 1r6h h ARG 137 Cb 1.01 -0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 29.26 1r6h h ARG 137 CO 0.06 0.46 0.33 1.96 0.56 0.00 0.00 179.97 183.34 1r6h h GLN 138 N 0.13 0.64 -6.76 0.04 4.20 -1.39 -3.43 115.11 108.55 1r6h h GLN 138 Ca 0.06 -0.04 -0.50 0.00 0.06 0.00 0.00 58.65 58.24 1r6h h GLN 138 Cb 0.28 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.91 1r6h h GLN 138 CO 0.00 0.43 0.09 0.15 -0.67 0.00 0.00 178.83 178.82 1r6h s LYS 139 N -6.15 3.86 -0.21 1.46 3.01 -1.07 -5.01 119.74 115.64 1r6h s LYS 139 Ca -0.13 0.52 -0.29 0.00 -1.01 0.00 0.00 55.97 55.06 1r6h s LYS 139 Cb 0.12 -2.43 -0.02 0.00 -1.01 0.00 0.00 37.83 34.49 1r6h s LYS 139 CO 0.74 0.07 1.42 0.50 0.51 0.00 0.00 175.35 178.59 1r6h s ARG 140 N -3.43 4.01 0.32 1.68 3.00 -1.26 -4.78 118.95 118.48 1r6h s ARG 140 Ca 0.52 1.60 0.09 0.00 -1.00 0.00 0.00 55.73 56.94 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 0.25 -1.01 0.01 -0.98 0.00 0.00 0.00 175.30 173.57 1r6h s ARG 141 N 4.10 2.15 1.24 5.12 3.03 -1.26 -4.37 118.95 128.97 1r6h s ARG 141 Ca 0.62 -1.63 -0.16 0.00 2.03 0.00 0.00 55.73 56.58 1r6h s ARG 141 Cb -0.22 -2.02 0.28 0.00 -1.03 0.00 0.00 34.95 31.96 1r6h s ARG 141 CO 0.23 0.20 0.77 0.41 -1.13 0.00 0.00 175.30 175.78 1r6h n GLY 142 N -0.95 -2.62 3.55 3.88 0.00 -1.26 -4.76 105.19 103.03 1r6h n GLY 142 Ca -0.05 -1.23 -0.37 0.00 0.00 0.00 0.00 46.02 44.38 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 -2.28 1.97 -0.47 4.61 0.00 -1.26 -4.92 121.76 119.40 1r6h s ALA 143 Ca 0.65 -0.55 -0.23 0.00 0.00 0.00 0.00 51.96 51.83 1r6h s ALA 143 Cb -0.20 -4.34 0.03 0.00 0.00 0.00 0.00 23.12 18.62 1r6h s ALA 143 CO 0.62 -4.15 0.81 0.96 0.00 0.00 0.00 175.76 174.01 1r6h s ILE 144 N 10.05 4.61 0.00 0.00 -4.36 -1.26 -4.91 121.20 125.33 1r6h s ILE 144 Ca 0.75 0.36 0.00 0.00 -0.26 0.00 0.00 60.65 61.51 1r6h s ILE 144 Cb -0.13 -4.36 0.00 0.00 1.25 0.00 0.00 42.46 39.22 1r6h s ILE 144 CO 0.20 -0.79 0.00 0.59 0.24 0.00 0.00 174.94 175.18 1r6h n ASN 145 N 6.83 0.00 -0.08 4.36 4.13 -1.26 -4.92 115.26 124.31 1r6h n ASN 145 Ca 0.02 0.00 -0.08 0.00 1.68 0.00 0.00 54.58 56.19 1r6h n ASN 145 Cb 0.48 -0.05 -0.03 0.00 -1.54 0.00 0.00 39.78 38.64 1r6h n ASN 145 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1r6h n SER 146 N -1.58 1.82 0.00 6.41 7.64 -1.26 -4.55 113.62 122.10 1r6h n SER 146 Ca 0.00 0.31 -0.09 0.00 1.01 0.00 0.00 58.87 60.10 1r6h n SER 146 Cb 0.00 -0.72 -0.03 0.00 -1.01 0.00 0.00 64.21 62.44 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 -0.19 -0.03 1.43 3.11 -1.96 0.25 116.57 118.26 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 0.94 0.04 -0.03 0.00 -1.00 0.00 0.00 32.23 32.18 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 -0.20 -0.01 1.90 -0.00 -1.93 0.63 115.11 115.30 1r6h h GLN 148 Ca 0.09 0.01 -0.07 0.00 -0.00 0.00 0.00 58.65 58.69 1r6h h GLN 148 Cb 0.32 0.05 0.00 0.00 0.00 0.00 0.00 27.48 27.86 1r6h h GLN 148 CO -0.23 -0.13 -0.25 -0.07 0.00 0.00 0.00 178.83 178.15 1r6h h LEU 149 N -0.21 0.24 -1.11 -2.39 -0.00 -1.79 -2.64 115.31 107.40 1r6h h LEU 149 Ca 0.06 -0.75 -0.06 0.00 -0.00 0.00 0.00 57.88 57.12 1r6h h LEU 149 Cb 0.28 -0.07 -0.02 0.00 -0.00 0.00 0.00 40.66 40.85 1r6h h LEU 149 CO -0.15 0.95 -0.06 0.74 -0.00 0.00 0.00 178.44 179.92 1r6h h THR 150 N -0.46 1.22 0.06 0.22 2.02 -0.49 0.28 112.91 115.76 1r6h h THR 150 Ca -0.03 -0.93 -0.00 0.00 0.77 0.00 0.00 66.41 66.22 1r6h h THR 150 Cb 0.98 1.04 0.00 0.00 -1.74 0.00 0.00 68.15 68.43 1r6h h THR 150 CO 0.05 0.31 -0.03 0.22 0.37 0.00 0.00 175.52 176.44 1r6h h TYR 151 N 0.51 -0.07 -0.07 3.16 3.20 0.20 -1.80 116.97 122.11 1r6h h TYR 151 Ca 0.10 -0.00 -0.15 0.00 3.14 0.00 0.00 58.73 61.82 1r6h h TYR 151 Cb 0.43 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.71 1r6h h TYR 151 CO 0.02 0.33 -0.61 1.25 -1.64 0.00 0.00 178.16 177.50 1r6h h LEU 152 N -0.49 0.27 -1.24 2.82 6.46 -1.41 -1.66 115.31 120.07 1r6h h LEU 152 Ca -0.01 -0.16 0.02 0.00 -0.12 0.00 0.00 57.88 57.61 1r6h h LEU 152 Cb 0.43 -0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.24 1r6h h LEU 152 CO 0.01 0.81 0.52 -0.08 -0.62 0.00 0.00 178.44 179.09 1r6h h GLU 153 N 0.18 1.00 0.00 1.25 4.22 -0.44 0.12 114.58 120.91 1r6h h GLU 153 Ca -0.01 -0.06 -0.11 0.00 0.08 0.00 0.00 59.36 59.26 1r6h h GLU 153 Cb 1.11 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 30.12 1r6h h GLU 153 CO 0.09 0.66 -0.53 -0.22 -2.18 0.00 0.00 179.01 176.84 1r6h h LYS 154 N 1.03 0.00 -0.28 1.92 3.11 -0.99 -3.00 116.57 118.37 1r6h h LYS 154 Ca 0.30 0.00 -0.08 0.00 -2.81 0.00 0.00 60.65 58.06 1r6h h LYS 154 Cb -0.07 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.15 1r6h h LYS 154 CO -0.07 0.53 -0.15 -0.92 -2.81 0.00 0.00 179.45 176.03 1r6h h TYR 155 N 0.00 0.52 -3.66 1.91 5.03 0.15 -3.35 116.97 117.56 1r6h h TYR 155 Ca -0.01 -0.08 -0.74 0.00 2.58 0.00 0.00 58.73 60.48 1r6h h TYR 155 Cb 1.05 -0.14 -0.31 0.00 1.55 0.00 0.00 36.73 38.88 1r6h h TYR 155 CO 0.00 0.61 -0.14 0.50 -1.32 0.00 0.00 178.16 177.81 1r6h s ARG 156 N -4.68 3.07 0.60 1.82 3.00 -0.64 -5.07 118.95 117.04 1r6h s ARG 156 Ca -0.07 -2.56 -0.19 0.00 -1.00 0.00 0.00 55.73 51.91 1r6h s ARG 156 Cb 0.14 -4.05 -0.03 0.00 0.00 0.00 0.00 34.95 31.02 1r6h s ARG 156 CO 0.78 -1.23 1.20 -1.25 0.00 0.00 0.00 175.30 174.80 1r6h s PRO 157 N -0.07 2.94 -0.13 5.12 0.04 -1.26 -4.90 135.00 136.74 1r6h s PRO 157 Ca 0.18 1.81 -0.05 0.00 0.04 0.00 0.00 61.00 62.98 1r6h s PRO 157 Cb -0.15 -1.93 0.06 0.00 0.04 0.00 0.00 34.50 32.52 1r6h s PRO 157 CO -0.06 -1.23 0.27 0.15 0.04 0.00 0.00 177.00 176.17 1r6h s LYS 158 N -3.37 0.19 0.11 4.56 -0.14 -1.26 -5.01 119.74 114.81 1r6h s LYS 158 Ca 0.77 0.70 0.19 0.00 -1.36 0.00 0.00 55.97 56.27 1r6h s LYS 158 Cb -0.30 -0.04 0.78 0.00 -1.68 0.00 0.00 37.83 36.59 1r6h s LYS 158 CO 0.34 -0.24 1.58 0.00 -0.76 0.00 0.00 175.35 176.27 1r6h n GLN 159 N 4.96 0.08 -0.30 1.68 10.64 -1.26 -3.02 117.38 130.16 1r6h n GLN 159 Ca -0.13 0.31 0.01 0.00 -1.83 0.00 0.00 57.00 55.37 1r6h n GLN 159 Cb 0.51 -1.66 0.20 0.00 -0.86 0.00 0.00 30.24 28.44 1r6h n GLN 159 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1r6h h ARG 160 N 0.00 1.09 -0.88 2.61 2.47 -2.01 -1.92 114.38 115.74 1r6h h ARG 160 Ca 0.00 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 1r6h h ARG 160 Cb 0.31 -0.25 -0.04 0.00 -1.65 0.00 0.00 29.97 28.34 1r6h h ARG 160 CO 0.00 0.72 0.56 -0.07 0.56 0.00 0.00 179.97 181.75 1r6h h LEU 161 N 1.13 1.02 0.00 3.04 4.07 -1.99 -3.44 115.31 119.14 1r6h h LEU 161 Ca 0.35 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 58.27 1r6h h LEU 161 Cb 0.00 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 41.49 1r6h h LEU 161 CO -0.10 0.75 0.00 -1.14 -1.08 0.00 0.00 178.44 176.87 1r6h n ARG 162 N -4.39 1.56 -3.98 1.13 3.00 -0.72 -5.12 116.66 108.14 1r6h n ARG 162 Ca 0.10 0.00 -0.31 0.00 -0.00 0.00 0.00 57.85 57.64 1r6h n ARG 162 Cb 0.03 0.00 -0.16 0.00 0.00 0.00 0.00 32.46 32.34 1r6h n ARG 162 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 1r6h s PHE 163 N 0.08 2.61 -0.03 -0.14 0.40 -1.26 -4.90 117.98 114.74 1r6h s PHE 163 Ca 0.00 -1.86 0.06 0.00 -0.60 0.00 0.00 56.93 54.54 1r6h s PHE 163 Cb 0.00 -1.68 -0.01 0.00 0.51 0.00 0.00 43.02 41.84 1r6h s PHE 163 CO 0.00 -0.79 -0.22 0.15 0.70 0.00 0.00 175.22 175.05 1r6h s LYS 164 N 1.32 2.01 -0.49 0.44 1.02 -1.26 -5.10 119.74 117.68 1r6h s LYS 164 Ca -0.06 -0.80 -0.24 0.00 0.02 0.00 0.00 55.97 54.89 1r6h s LYS 164 Cb -0.19 -1.84 0.03 0.00 -0.52 0.00 0.00 37.83 35.32 1r6h s LYS 164 CO -0.06 0.42 0.88 0.16 -0.92 0.00 0.00 175.35 175.83 1r6h s ASP 165 N -0.35 6.42 -0.26 2.83 -4.77 -1.26 -5.00 116.67 114.27 1r6h s ASP 165 Ca 0.04 -0.12 -0.29 0.00 -3.30 0.00 0.00 52.55 48.88 1r6h s ASP 165 Cb -0.10 -2.42 -0.03 0.00 -1.09 0.00 0.00 42.92 39.28 1r6h s ASP 165 CO 0.01 -1.06 1.76 -2.16 0.70 0.00 0.00 175.17 174.41 1r6h s PRO 166 N 3.66 3.55 0.57 2.11 0.04 -1.26 -4.71 135.00 138.95 1r6h s PRO 166 Ca 0.32 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.98 1r6h s PRO 166 Cb -0.12 -4.14 0.00 0.00 0.04 0.00 0.00 34.50 30.28 1r6h s PRO 166 CO 0.23 -1.60 0.00 1.58 0.04 0.00 0.00 177.00 177.24 1r6h n HIS 167 N 9.50 -3.95 -3.91 0.56 -0.00 -1.26 -5.03 115.22 111.13 1r6h n HIS 167 Ca 0.22 2.15 -0.10 0.00 0.46 0.00 0.00 57.72 60.44 1r6h n HIS 167 Cb 0.46 -3.41 -0.10 0.00 -0.12 0.00 0.00 29.99 26.81 1r6h n HIS 167 CO 0.00 0.00 0.00 0.99 0.46 0.00 0.00 176.34 177.79 1r6h s THR 168 N -5.07 0.09 -0.16 3.57 2.01 -1.26 -5.16 115.64 109.66 1r6h s THR 168 Ca 0.00 -0.73 -0.13 0.00 0.31 0.00 0.00 61.69 61.14 1r6h s THR 168 Cb 0.00 -0.35 0.05 0.00 0.01 0.00 0.00 72.50 72.21 1r6h s THR 168 CO 0.00 -0.40 0.41 -2.28 -0.69 0.00 0.00 174.62 171.65 1r6h s HIS 169 N -1.33 -0.49 -0.06 4.92 5.04 -1.26 -5.06 115.29 117.05 1r6h s HIS 169 Ca -0.14 1.15 -0.05 0.00 -1.54 0.00 0.00 55.06 54.47 1r6h s HIS 169 Cb -0.08 0.18 0.02 0.00 0.04 0.00 0.00 32.58 32.74 1r6h s HIS 169 CO 0.01 -0.25 0.10 1.17 -2.34 0.00 0.00 174.74 173.42 1r6h n LYS 170 N 3.27 -4.88 -0.04 2.88 4.81 -1.26 -5.03 118.16 117.91 1r6h n LYS 170 Ca -0.16 3.60 -0.04 0.00 -0.87 0.00 0.00 58.31 60.83 1r6h n LYS 170 Cb 0.57 -4.78 -0.01 0.00 0.02 0.00 0.00 35.03 30.82 1r6h n LYS 170 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1r6h n THR 171 N 1.75 0.78 -0.44 3.15 -1.04 -1.26 -5.33 114.28 111.90 1r6h n THR 171 Ca -0.17 0.30 0.00 0.00 -2.04 0.00 0.00 64.05 62.14 1r6h n THR 171 Cb 0.26 -1.89 0.00 0.00 -1.82 0.00 0.00 70.33 66.87 1r6h n THR 171 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29