#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 -0.58 -0.27 1.61 0.01 -1.26 -5.15 113.70 108.07 1r6h s SER 2 Ca 0.00 0.14 -0.12 0.00 1.31 0.00 0.00 55.95 57.28 1r6h s SER 2 Cb 0.00 0.58 -0.05 0.00 0.21 0.00 0.00 66.02 66.76 1r6h s SER 2 CO 0.00 -0.89 0.23 -1.00 0.41 0.00 0.00 173.24 171.99 1r6h s HIS 3 N -3.21 3.24 -0.13 2.43 0.09 -1.26 -4.98 115.29 111.47 1r6h s HIS 3 Ca -0.01 0.21 -0.12 0.00 -0.00 0.00 0.00 55.06 55.13 1r6h s HIS 3 Cb -0.01 -2.41 -0.10 0.00 -0.00 0.00 0.00 32.58 30.07 1r6h s HIS 3 CO -0.08 -0.14 0.19 1.98 -0.00 0.00 0.00 174.74 176.69 1r6h h MET 4 N 8.18 0.00 -2.79 1.40 1.85 -2.10 -3.50 114.93 117.97 1r6h h MET 4 Ca -0.35 0.00 0.10 0.00 -0.61 0.00 0.00 59.70 58.84 1r6h h MET 4 Cb 1.18 0.00 -0.07 0.00 0.43 0.00 0.00 31.60 33.14 1r6h h MET 4 CO 0.59 0.39 0.31 0.00 -0.40 0.00 0.00 176.91 177.80 1r6h s ALA 5 N -2.48 -1.38 -0.13 0.39 0.00 -1.26 -5.17 121.76 111.73 1r6h s ALA 5 Ca -0.12 -0.10 -0.07 0.00 0.00 0.00 0.00 51.96 51.67 1r6h s ALA 5 Cb 0.00 0.78 0.05 0.00 0.00 0.00 0.00 23.12 23.96 1r6h s ALA 5 CO 0.30 -1.01 0.31 0.50 0.00 0.00 0.00 175.76 175.86 1r6h s ARG 6 N -3.71 0.29 0.27 0.00 3.52 -1.26 -5.17 118.95 112.89 1r6h s ARG 6 Ca 0.11 0.61 0.10 0.00 -0.13 0.00 0.00 55.73 56.42 1r6h s ARG 6 Cb -0.04 -0.06 -0.05 0.00 -1.56 0.00 0.00 34.95 33.24 1r6h s ARG 6 CO 0.04 -0.15 -0.17 0.00 -0.81 0.00 0.00 175.30 174.21 1r6h s MET 7 N 1.20 1.61 0.18 5.12 0.23 -1.26 -5.07 119.30 121.31 1r6h s MET 7 Ca -0.08 -1.75 0.00 0.00 -1.03 0.00 0.00 55.69 52.83 1r6h s MET 7 Cb -0.09 -1.58 0.00 0.00 -1.53 0.00 0.00 34.83 31.63 1r6h s MET 7 CO -0.09 0.26 0.00 -1.71 -2.03 0.00 0.00 175.02 171.45 1r6h n ASN 8 N -0.58 0.04 -4.88 -1.18 2.85 -1.26 -5.11 115.26 105.14 1r6h n ASN 8 Ca -0.06 0.30 -0.32 0.00 -0.11 0.00 0.00 54.58 54.39 1r6h n ASN 8 Cb 0.61 0.19 -0.05 0.00 1.24 0.00 0.00 39.78 41.77 1r6h n ASN 8 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 1r6h s ARG 9 N -1.67 3.30 0.03 1.20 0.52 -1.26 -5.07 118.95 116.00 1r6h s ARG 9 Ca 0.00 -0.46 -0.30 0.00 -0.52 0.00 0.00 55.73 54.45 1r6h s ARG 9 Cb 0.00 -2.98 -0.06 0.00 0.52 0.00 0.00 34.95 32.43 1r6h s ARG 9 CO 0.00 0.62 1.39 -1.25 0.02 0.00 0.00 175.30 176.08 1r6h s PRO 10 N -2.26 4.30 0.33 3.54 0.04 -1.26 -4.99 135.00 134.70 1r6h s PRO 10 Ca 0.31 1.98 -0.29 0.00 0.04 0.00 0.00 61.00 63.04 1r6h s PRO 10 Cb -0.13 -3.49 -0.10 0.00 0.04 0.00 0.00 34.50 30.82 1r6h s PRO 10 CO 0.23 -0.53 1.35 0.00 0.04 0.00 0.00 177.00 178.09 1r6h s ALA 11 N 2.06 3.52 0.84 8.56 0.00 -1.26 -4.81 121.76 130.67 1r6h s ALA 11 Ca 0.64 1.32 -0.12 0.00 0.00 0.00 0.00 51.96 53.80 1r6h s ALA 11 Cb -0.32 -3.51 0.10 0.00 0.00 0.00 0.00 23.12 19.38 1r6h s ALA 11 CO 0.27 -0.72 1.10 -1.25 0.00 0.00 0.00 175.76 175.16 1r6h s PRO 12 N -1.73 1.72 -0.04 0.00 0.04 -1.26 -4.93 135.00 128.80 1r6h s PRO 12 Ca 0.50 0.69 -0.01 0.00 0.04 0.00 0.00 61.00 62.22 1r6h s PRO 12 Cb -0.41 -1.87 0.03 0.00 0.04 0.00 0.00 34.50 32.29 1r6h s PRO 12 CO 0.54 -1.89 0.07 0.08 0.04 0.00 0.00 177.00 175.84 1r6h s VAL 13 N -3.08 -0.09 -0.07 -0.36 1.01 -0.44 -4.95 120.40 112.43 1r6h s VAL 13 Ca 0.62 0.27 0.04 0.00 0.00 0.00 0.00 61.98 62.91 1r6h s VAL 13 Cb -0.16 -0.14 -0.02 0.00 0.00 0.00 0.00 36.38 36.06 1r6h s VAL 13 CO 0.55 0.11 -0.19 -1.83 0.00 0.00 0.00 175.10 173.74 1r6h s GLU 14 N 1.45 2.69 -0.11 2.72 -1.05 -1.26 0.13 118.70 123.28 1r6h s GLU 14 Ca -0.05 -0.79 -0.03 0.00 -0.15 0.00 0.00 54.97 53.95 1r6h s GLU 14 Cb -0.12 -2.33 -0.03 0.00 -0.44 0.00 0.00 34.13 31.21 1r6h s GLU 14 CO -0.04 0.44 0.00 0.08 0.95 0.00 0.00 175.26 176.69 1r6h s VAL 15 N -0.27 4.31 -0.05 1.83 1.01 -0.47 -4.88 120.40 121.88 1r6h s VAL 15 Ca 0.01 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.76 1r6h s VAL 15 Cb -0.13 -2.84 0.02 0.00 0.00 0.00 0.00 36.38 33.43 1r6h s VAL 15 CO 0.03 0.57 -0.06 -0.94 0.00 0.00 0.00 175.10 174.70 1r6h s SER 16 N -0.52 1.16 -0.09 3.32 1.04 -1.26 0.92 113.70 118.28 1r6h s SER 16 Ca 0.09 -0.17 -0.05 0.00 0.48 0.00 0.00 55.95 56.30 1r6h s SER 16 Cb -0.12 -0.54 0.04 0.00 0.10 0.00 0.00 66.02 65.50 1r6h s SER 16 CO 0.02 -0.04 0.21 -0.47 0.98 0.00 0.00 173.24 173.94 1r6h s TYR 17 N 0.90 -0.26 0.00 5.02 5.04 -1.03 -5.03 117.35 121.98 1r6h s TYR 17 Ca -0.11 0.65 0.00 0.00 -2.44 0.00 0.00 57.07 55.17 1r6h s TYR 17 Cb -0.15 0.02 0.00 0.00 0.35 0.00 0.00 41.96 42.19 1r6h s TYR 17 CO 0.01 -0.18 0.00 1.63 -1.34 0.00 0.00 175.55 175.66 1r6h n LYS 18 N 3.88 0.00 -0.11 4.97 4.76 -1.26 -1.98 118.16 128.42 1r6h n LYS 18 Ca -0.22 0.00 0.02 0.00 -2.87 0.00 0.00 58.31 55.24 1r6h n LYS 18 Cb 0.54 0.00 0.03 0.00 -1.84 0.00 0.00 35.03 33.76 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 -4.55 2.13 -0.00 -1.26 -5.08 115.22 106.46 1r6h n HIS 19 Ca 0.00 -0.37 -0.27 0.00 0.46 0.00 0.00 57.72 57.54 1r6h n HIS 19 Cb 0.00 -0.06 -0.10 0.00 -0.12 0.00 0.00 29.99 29.71 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 -0.93 1.97 0.12 1.57 0.23 -0.84 -4.02 119.30 117.39 1r6h s MET 20 Ca 0.07 -2.04 -0.03 0.00 -1.03 0.00 0.00 55.69 52.66 1r6h s MET 20 Cb 0.06 -1.69 -0.03 0.00 -1.53 0.00 0.00 34.83 31.63 1r6h s MET 20 CO 0.01 -0.02 0.09 1.03 -2.03 0.00 0.00 175.02 174.10 1r6h s ARG 21 N -3.71 0.91 0.05 3.16 0.52 -1.17 -2.48 118.95 116.23 1r6h s ARG 21 Ca 0.35 -1.32 0.03 0.00 -0.52 0.00 0.00 55.73 54.27 1r6h s ARG 21 Cb 0.08 0.27 -0.03 0.00 0.52 0.00 0.00 34.95 35.79 1r6h s ARG 21 CO 0.18 -0.26 -0.09 -0.06 0.02 0.00 0.00 175.30 175.08 1r6h s PHE 22 N -4.00 0.82 -0.04 -0.53 0.08 0.26 -3.37 117.98 111.20 1r6h s PHE 22 Ca 0.19 -0.50 0.04 0.00 0.12 0.00 0.00 56.93 56.78 1r6h s PHE 22 Cb 0.07 -0.48 -0.00 0.00 -0.57 0.00 0.00 43.02 42.03 1r6h s PHE 22 CO -0.01 -0.05 -0.17 -0.51 -0.10 0.00 0.00 175.22 174.38 1r6h s LEU 23 N -1.65 1.92 -0.30 -0.37 2.01 0.12 -1.37 118.68 119.04 1r6h s LEU 23 Ca -0.07 -0.35 0.02 0.00 0.01 0.00 0.00 54.13 53.74 1r6h s LEU 23 Cb -0.10 -0.96 0.07 0.00 0.01 0.00 0.00 46.19 45.22 1r6h s LEU 23 CO 0.01 0.15 -0.01 -0.63 1.01 0.00 0.00 176.35 176.88 1r6h s ILE 24 N 0.03 2.46 0.21 -0.59 -1.09 0.35 0.20 121.20 122.77 1r6h s ILE 24 Ca -0.03 -1.83 0.04 0.00 -2.23 0.00 0.00 60.65 56.60 1r6h s ILE 24 Cb -0.11 -2.57 -0.05 0.00 -1.58 0.00 0.00 42.46 38.15 1r6h s ILE 24 CO 0.02 -0.27 -0.04 0.42 -1.23 0.00 0.00 174.94 173.85 1r6h s THR 25 N 1.08 1.10 0.45 2.92 -4.23 0.13 -1.32 115.64 115.78 1r6h s THR 25 Ca -0.01 -2.05 -0.17 0.00 -1.18 0.00 0.00 61.69 58.28 1r6h s THR 25 Cb -0.20 -2.19 -0.09 0.00 1.34 0.00 0.00 72.50 71.36 1r6h s THR 25 CO -0.05 -0.46 0.92 -1.38 -0.54 0.00 0.00 174.62 173.12 1r6h s HIS 26 N -3.37 3.40 0.75 3.99 -3.43 -1.26 0.28 115.29 115.64 1r6h s HIS 26 Ca 0.25 1.45 -0.14 0.00 -0.80 0.00 0.00 55.06 55.81 1r6h s HIS 26 Cb 0.04 -2.75 0.05 0.00 -1.43 0.00 0.00 32.58 28.49 1r6h s HIS 26 CO 0.06 -0.20 1.20 -0.80 -2.00 0.00 0.00 174.74 173.00 1r6h s ASN 27 N -2.68 4.08 0.26 7.38 0.01 -1.26 -4.81 114.94 117.92 1r6h s ASN 27 Ca 0.59 2.33 -0.30 0.00 -0.71 0.00 0.00 52.86 54.76 1r6h s ASN 27 Cb -0.10 -2.59 -0.13 0.00 0.41 0.00 0.00 41.25 38.84 1r6h s ASN 27 CO 0.23 -2.34 1.31 -2.65 -1.51 0.00 0.00 177.10 172.15 1r6h n PRO 28 N -2.88 1.90 -3.81 -0.60 -0.02 -1.26 -4.98 135.00 123.34 1r6h n PRO 28 Ca 0.13 0.67 -0.35 0.00 -2.02 0.00 0.00 63.50 61.93 1r6h n PRO 28 Cb 0.50 -2.27 -0.05 0.00 -0.02 0.00 0.00 33.50 31.66 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 -0.44 5.37 -0.61 3.45 -4.23 -1.26 -4.96 115.64 112.96 1r6h s THR 29 Ca 0.64 0.14 0.16 0.00 -1.18 0.00 0.00 61.69 61.45 1r6h s THR 29 Cb -0.65 -3.52 0.16 0.00 1.34 0.00 0.00 72.50 69.82 1r6h s THR 29 CO 0.54 0.43 1.49 -3.20 -0.54 0.00 0.00 174.62 173.35 1r6h n ASN 30 N 1.34 0.36 -0.05 3.99 2.85 -1.26 -2.62 115.26 119.87 1r6h n ASN 30 Ca -0.14 0.63 -0.10 0.00 -0.11 0.00 0.00 54.58 54.86 1r6h n ASN 30 Cb 0.53 -0.69 -0.15 0.00 1.24 0.00 0.00 39.78 40.72 1r6h n ASN 30 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1r6h n ALA 31 N -1.66 1.44 -3.45 5.20 0.00 -1.26 -4.78 120.51 116.00 1r6h n ALA 31 Ca 0.01 -0.94 -0.29 0.00 0.00 0.00 0.00 53.44 52.22 1r6h n ALA 31 Cb 0.11 -0.60 -0.12 0.00 0.00 0.00 0.00 19.45 18.84 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 0.16 -0.14 0.00 -4.23 -1.08 -4.98 115.64 102.81 1r6h s THR 32 Ca -0.09 -1.82 -0.22 0.00 -1.18 0.00 0.00 61.69 58.38 1r6h s THR 32 Cb 0.07 -1.13 -0.20 0.00 1.34 0.00 0.00 72.50 72.59 1r6h s THR 32 CO 0.81 -1.02 0.55 -0.07 -0.54 0.00 0.00 174.62 174.35 1r6h h LEU 33 N 6.85 0.00 -0.47 4.79 -0.00 -1.86 -3.32 115.31 121.30 1r6h h LEU 33 Ca 0.08 -0.74 0.05 0.00 -0.00 0.00 0.00 57.88 57.27 1r6h h LEU 33 Cb 0.96 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 41.58 1r6h h LEU 33 CO 0.27 0.93 0.21 0.28 -0.00 0.00 0.00 178.44 180.13 1r6h h SER 34 N -1.00 0.28 -0.39 -0.43 0.02 -1.93 -1.87 113.55 108.23 1r6h h SER 34 Ca -0.02 0.04 0.07 0.00 -0.84 0.00 0.00 61.79 61.03 1r6h h SER 34 Cb 0.80 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.31 1r6h h SER 34 CO -0.01 0.20 0.27 0.74 -1.14 0.00 0.00 176.83 176.88 1r6h h THR 35 N 0.42 0.92 -0.02 -2.27 2.02 -1.98 -2.40 112.91 109.60 1r6h h THR 35 Ca 0.21 -0.08 -0.06 0.00 0.77 0.00 0.00 66.41 67.25 1r6h h THR 35 Cb 0.15 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 1r6h h THR 35 CO -0.17 0.04 -0.23 0.15 0.37 0.00 0.00 175.52 175.68 1r6h h PHE 36 N 0.23 0.26 -0.95 3.16 3.04 -1.46 -2.70 116.94 118.51 1r6h h PHE 36 Ca 0.17 -0.13 0.10 0.00 3.98 0.00 0.00 57.97 62.10 1r6h h PHE 36 Cb 0.40 -0.03 -0.07 0.00 2.56 0.00 0.00 35.95 38.80 1r6h h PHE 36 CO -0.00 0.89 0.61 -0.84 -2.02 0.00 0.00 178.31 176.95 1r6h h ILE 37 N -0.45 0.97 0.15 1.41 3.07 -1.06 0.40 117.51 122.00 1r6h h ILE 37 Ca -0.02 -0.33 -0.01 0.00 1.55 0.00 0.00 64.86 66.05 1r6h h ILE 37 Cb 0.94 -0.09 0.00 0.00 -0.27 0.00 0.00 36.82 37.41 1r6h h ILE 37 CO 0.05 0.18 -0.07 -0.33 -1.05 0.00 0.00 178.15 176.92 1r6h h GLU 38 N 0.97 -0.20 0.01 0.16 4.39 -1.49 -1.15 114.58 117.27 1r6h h GLU 38 Ca 0.45 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 60.16 1r6h h GLU 38 Cb 0.41 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 1r6h h GLU 38 CO -0.21 0.07 -0.00 -0.44 -1.16 0.00 0.00 179.01 177.27 1r6h h ASP 39 N -0.46 -0.01 -0.59 1.42 5.19 -1.08 0.78 116.42 121.66 1r6h h ASP 39 Ca -0.02 -0.39 0.07 0.00 -0.62 0.00 0.00 57.03 56.06 1r6h h ASP 39 Cb 0.36 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.82 1r6h h ASP 39 CO 0.03 0.39 0.28 -0.07 -3.12 0.00 0.00 179.24 176.75 1r6h h LEU 40 N -0.41 0.37 -0.31 1.55 3.38 -0.30 -0.53 115.31 119.07 1r6h h LEU 40 Ca -0.00 0.05 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 1r6h h LEU 40 Cb 0.40 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1r6h h LEU 40 CO 0.00 0.24 -0.58 0.50 0.09 0.00 0.00 178.44 178.69 1r6h h LYS 41 N 0.52 0.00 -0.68 1.13 3.64 -1.21 -3.27 116.57 116.70 1r6h h LYS 41 Ca 0.28 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.77 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 0.58 0.27 0.87 -2.27 0.00 0.00 179.45 178.68 1r6h h LYS 42 N 0.00 0.43 -0.65 1.90 1.57 0.23 -0.80 116.57 119.25 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 1.32 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.50 1r6h h LYS 42 CO 0.08 0.29 0.21 -0.92 -0.57 0.00 0.00 179.45 178.53 1r6h h TYR 43 N 0.45 1.02 0.00 -1.35 5.03 -1.52 -3.48 116.97 117.11 1r6h h TYR 43 Ca 0.35 -0.09 0.00 0.00 2.58 0.00 0.00 58.73 61.57 1r6h h TYR 43 Cb 0.47 -0.30 0.00 0.00 1.55 0.00 0.00 36.73 38.45 1r6h h TYR 43 CO -0.16 0.81 0.00 0.41 -1.32 0.00 0.00 178.16 177.90 1r6h n GLY 44 N -0.86 -2.53 2.90 1.82 0.00 -0.30 -4.94 105.19 101.29 1r6h n GLY 44 Ca 0.05 -1.29 -0.25 0.00 0.00 0.00 0.00 46.02 44.53 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 1.17 0.04 4.61 0.00 -1.23 -4.41 121.76 120.17 1r6h s ALA 45 Ca 0.00 -0.43 -0.03 0.00 0.00 0.00 0.00 51.96 51.51 1r6h s ALA 45 Cb 0.00 -0.80 0.01 0.00 0.00 0.00 0.00 23.12 22.33 1r6h s ALA 45 CO 0.00 -0.31 0.13 2.41 0.00 0.00 0.00 175.76 177.99 1r6h n THR 46 N 4.73 0.00 -0.96 0.00 -1.04 0.30 -3.91 114.28 113.40 1r6h n THR 46 Ca -0.14 -0.11 -0.30 0.00 -2.04 0.00 0.00 64.05 61.46 1r6h n THR 46 Cb 0.50 0.12 0.15 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 -2.68 2.57 -0.01 12.58 -1.32 -1.25 -4.12 115.64 121.41 1r6h s THR 47 Ca 0.03 0.19 0.01 0.00 -1.21 0.00 0.00 61.69 60.70 1r6h s THR 47 Cb -0.01 -2.46 0.00 0.00 -1.51 0.00 0.00 72.50 68.53 1r6h s THR 47 CO 0.01 -0.24 -0.02 -0.69 -2.21 0.00 0.00 174.62 171.47 1r6h s VAL 48 N -2.77 0.19 -0.35 5.08 1.01 -0.27 -2.53 120.40 120.77 1r6h s VAL 48 Ca 0.64 -0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.55 1r6h s VAL 48 Cb -0.20 -0.19 0.08 0.00 0.00 0.00 0.00 36.38 36.07 1r6h s VAL 48 CO 0.58 0.07 0.09 0.54 0.00 0.00 0.00 175.10 176.38 1r6h s VAL 49 N 0.15 2.95 -0.29 2.92 0.11 -0.60 0.35 120.40 126.00 1r6h s VAL 49 Ca -0.01 -1.84 -0.01 0.00 -2.93 0.00 0.00 61.98 57.19 1r6h s VAL 49 Cb -0.04 -2.91 0.05 0.00 -1.53 0.00 0.00 36.38 31.95 1r6h s VAL 49 CO -0.00 -0.43 -0.02 0.00 -3.33 0.00 0.00 175.10 171.32 1r6h s ARG 50 N 1.14 2.49 -0.71 1.54 1.70 -1.14 -2.38 118.95 121.59 1r6h s ARG 50 Ca 0.03 -1.22 -0.09 0.00 -0.47 0.00 0.00 55.73 53.98 1r6h s ARG 50 Cb -0.21 -3.12 0.18 0.00 -0.57 0.00 0.00 34.95 31.24 1r6h s ARG 50 CO -0.04 -0.57 0.59 0.08 -1.08 0.00 0.00 175.30 174.28 1r6h s VAL 51 N 1.25 4.69 0.29 4.99 1.01 -1.26 -2.14 120.40 129.24 1r6h s VAL 51 Ca -0.05 -2.60 -0.18 0.00 0.00 0.00 0.00 61.98 59.15 1r6h s VAL 51 Cb -0.19 -3.97 0.02 0.00 0.00 0.00 0.00 36.38 32.24 1r6h s VAL 51 CO -0.02 -0.94 0.67 0.00 0.00 0.00 0.00 175.10 174.81 1r6h s GLU 53 N -3.72 4.29 -0.11 0.00 0.41 -1.26 -4.14 118.70 114.17 1r6h s GLU 53 Ca 0.15 2.16 -0.30 0.00 -0.41 0.00 0.00 54.97 56.57 1r6h s GLU 53 Cb -0.05 -3.21 -0.03 0.00 -1.78 0.00 0.00 34.13 29.07 1r6h s GLU 53 CO 0.08 -0.47 1.26 0.14 -0.49 0.00 0.00 175.26 175.78 1r6h s VAL 54 N 1.01 4.22 0.00 2.63 -7.23 -1.26 -4.87 120.40 114.90 1r6h s VAL 54 Ca 0.65 1.51 0.00 0.00 -1.81 0.00 0.00 61.98 62.33 1r6h s VAL 54 Cb -0.39 -3.97 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 0.35 -0.31 0.00 0.00 175.10 175.38 1r6h n THR 55 N 5.02 0.00 -3.65 5.32 -2.24 -1.26 -4.94 114.28 112.53 1r6h n THR 55 Ca 0.13 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.63 1r6h n THR 55 Cb 0.45 -1.26 -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 -2.00 2.13 0.07 4.78 2.02 -1.26 -4.96 117.35 118.14 1r6h s TYR 56 Ca 0.00 -2.66 -0.07 0.00 -0.37 0.00 0.00 57.07 53.97 1r6h s TYR 56 Cb 0.00 -1.78 -0.27 0.00 -0.40 0.00 0.00 41.96 39.52 1r6h s TYR 56 CO 0.00 -0.72 1.14 0.38 -1.57 0.00 0.00 175.55 174.77 1r6h h ASP 57 N 5.93 0.56 0.03 2.29 2.03 -1.99 -3.37 116.42 121.89 1r6h h ASP 57 Ca 0.14 -0.56 -0.05 0.00 -0.73 0.00 0.00 57.03 55.83 1r6h h ASP 57 Cb 0.87 -0.18 0.01 0.00 -0.83 0.00 0.00 39.33 39.19 1r6h h ASP 57 CO 0.51 1.42 -0.20 0.11 -1.03 0.00 0.00 179.24 180.05 1r6h h LYS 58 N 0.13 0.09 -0.59 4.15 1.57 -1.98 -3.21 116.57 116.71 1r6h h LYS 58 Ca -0.15 -0.13 0.06 0.00 -1.87 0.00 0.00 60.65 58.56 1r6h h LYS 58 Cb 1.94 0.05 -0.09 0.00 0.08 0.00 0.00 32.23 34.21 1r6h h LYS 58 CO 0.21 1.02 -0.56 1.15 -0.57 0.00 0.00 179.45 180.71 1r6h h THR 59 N -0.78 0.00 -0.17 -0.16 2.02 -1.98 0.21 112.91 112.04 1r6h h THR 59 Ca -0.03 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.02 1r6h h THR 59 Cb 1.12 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 1r6h h THR 59 CO 0.04 0.00 -0.43 1.55 0.37 0.00 0.00 175.52 177.05 1r6h h PRO 60 N -0.26 0.41 -0.15 6.66 0.13 -1.75 -2.37 132.00 134.67 1r6h h PRO 60 Ca 0.10 -0.21 -0.09 0.00 -0.87 0.00 0.00 66.00 64.93 1r6h h PRO 60 Cb 0.52 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.66 1r6h h PRO 60 CO -0.70 0.77 -0.26 -0.07 -0.23 0.00 0.00 178.00 177.52 1r6h h LEU 61 N 0.34 0.48 -0.50 1.56 -0.00 -1.41 -1.61 115.31 114.15 1r6h h LEU 61 Ca 0.03 -0.54 -0.15 0.00 -0.00 0.00 0.00 57.88 57.22 1r6h h LEU 61 Cb 0.90 -0.14 -0.02 0.00 -0.00 0.00 0.00 40.66 41.40 1r6h h LEU 61 CO 0.08 0.93 -0.71 -0.08 -0.00 0.00 0.00 178.44 178.66 1r6h h GLU 62 N 0.04 0.00 0.09 1.13 4.81 -0.67 0.22 114.58 120.21 1r6h h GLU 62 Ca 0.01 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.97 1r6h h GLU 62 Cb 0.84 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.21 1r6h h GLU 62 CO 0.06 0.71 -1.25 0.87 -0.73 0.00 0.00 179.01 178.66 1r6h h LYS 63 N 0.00 0.20 0.00 1.92 6.56 -1.47 -3.34 116.57 120.43 1r6h h LYS 63 Ca -0.01 -0.34 0.00 0.00 -1.06 0.00 0.00 60.65 59.25 1r6h h LYS 63 Cb 1.30 0.13 0.00 0.00 -0.57 0.00 0.00 32.23 33.09 1r6h h LYS 63 CO 0.09 1.13 -1.18 -3.47 -2.06 0.00 0.00 179.45 173.96 1r6h n ASP 64 N -3.46 0.79 -1.77 0.86 2.03 -0.61 -4.97 116.55 109.42 1r6h n ASP 64 Ca -0.08 -0.73 -0.10 0.00 0.52 0.00 0.00 54.79 54.40 1r6h n ASP 64 Cb 1.01 1.23 -0.03 0.00 -0.72 0.00 0.00 41.12 42.61 1r6h n ASP 64 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1r6h n GLY 65 N 1.44 0.32 3.89 0.27 0.00 0.77 -4.92 105.19 106.95 1r6h n GLY 65 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1r6h n GLY 65 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1r6h s ILE 66 N -2.09 5.22 0.08 -0.61 1.01 -1.25 -5.06 121.20 118.49 1r6h s ILE 66 Ca 0.00 0.10 -0.30 0.00 0.00 0.00 0.00 60.65 60.45 1r6h s ILE 66 Cb 0.00 -3.61 -0.05 0.00 0.01 0.00 0.00 42.46 38.81 1r6h s ILE 66 CO 0.00 0.19 1.02 -0.89 0.00 0.00 0.00 174.94 175.27 1r6h s THR 67 N -1.49 4.46 0.02 2.92 2.01 -1.26 -4.88 115.64 117.43 1r6h s THR 67 Ca 0.35 1.91 -0.07 0.00 0.31 0.00 0.00 61.69 64.18 1r6h s THR 67 Cb -0.13 -4.22 -0.00 0.00 0.01 0.00 0.00 72.50 68.16 1r6h s THR 67 CO 0.21 0.23 0.14 0.54 -0.69 0.00 0.00 174.62 175.05 1r6h s VAL 68 N 0.46 0.11 -0.18 3.82 0.11 -1.26 -1.11 120.40 122.35 1r6h s VAL 68 Ca 0.51 -0.87 -0.07 0.00 -2.93 0.00 0.00 61.98 58.62 1r6h s VAL 68 Cb -0.24 -0.71 -0.04 0.00 -1.53 0.00 0.00 36.38 33.86 1r6h s VAL 68 CO 0.30 -0.48 0.06 -0.69 -3.33 0.00 0.00 175.10 170.96 1r6h s VAL 69 N -2.08 4.77 -0.44 2.04 1.01 0.16 -4.87 120.40 120.98 1r6h s VAL 69 Ca -0.09 -0.04 -0.14 0.00 0.00 0.00 0.00 61.98 61.70 1r6h s VAL 69 Cb -0.04 -3.14 0.06 0.00 0.00 0.00 0.00 36.38 33.25 1r6h s VAL 69 CO -0.02 0.47 0.34 -1.81 0.00 0.00 0.00 175.10 174.08 1r6h s ASP 70 N 0.29 6.05 -0.40 3.32 1.11 -1.26 -2.88 116.67 122.89 1r6h s ASP 70 Ca 0.03 -1.21 -0.07 0.00 0.18 0.00 0.00 52.55 51.49 1r6h s ASP 70 Cb -0.12 -2.14 0.09 0.00 1.07 0.00 0.00 42.92 41.81 1r6h s ASP 70 CO 0.00 -0.56 0.22 0.26 1.18 0.00 0.00 175.17 176.27 1r6h s TRP 71 N 1.62 3.40 0.15 4.23 0.52 -0.91 -5.05 118.94 122.90 1r6h s TRP 71 Ca 0.04 -1.82 0.05 0.00 0.02 0.00 0.00 56.10 54.38 1r6h s TRP 71 Cb -0.22 -2.96 -0.04 0.00 -1.15 0.00 0.00 33.47 29.10 1r6h s TRP 71 CO 0.07 -0.89 0.12 -1.25 0.02 0.00 0.00 176.95 175.03 1r6h s PRO 72 N 1.33 2.88 -0.33 4.98 0.04 -1.26 -1.08 135.00 141.56 1r6h s PRO 72 Ca 0.04 -0.84 0.02 0.00 0.04 0.00 0.00 61.00 60.25 1r6h s PRO 72 Cb -0.23 -2.65 0.10 0.00 0.04 0.00 0.00 34.50 31.76 1r6h s PRO 72 CO -0.00 0.50 0.08 0.12 0.04 0.00 0.00 177.00 177.74 1r6h s PHE 73 N -1.68 2.69 1.31 0.56 5.36 -1.26 -4.99 117.98 119.97 1r6h s PHE 73 Ca 0.30 -2.35 -0.17 0.00 -0.96 0.00 0.00 56.93 53.75 1r6h s PHE 73 Cb -0.10 -2.30 0.34 0.00 -0.34 0.00 0.00 43.02 40.62 1r6h s PHE 73 CO 0.23 -0.91 0.97 -0.51 -1.46 0.00 0.00 175.22 173.53 1r6h s ASP 74 N 1.26 -0.23 0.41 6.13 1.11 -1.26 -4.88 116.67 119.21 1r6h s ASP 74 Ca 0.10 1.26 0.09 0.00 0.18 0.00 0.00 52.55 54.18 1r6h s ASP 74 Cb -0.18 -1.90 0.89 0.00 1.07 0.00 0.00 42.92 42.80 1r6h s ASP 74 CO -0.17 -4.91 2.04 0.44 1.18 0.00 0.00 175.17 173.75 1r6h h ASP 75 N -3.11 0.45 -1.39 0.27 5.19 -2.04 -3.14 116.42 112.65 1r6h h ASP 75 Ca -0.55 -0.01 -0.46 0.00 -0.62 0.00 0.00 57.03 55.39 1r6h h ASP 75 Cb 1.34 -0.11 -0.41 0.00 0.18 0.00 0.00 39.33 40.34 1r6h h ASP 75 CO 0.41 0.32 -1.02 0.61 -3.12 0.00 0.00 179.24 176.44 1r6h n GLY 76 N -1.48 3.45 3.29 2.75 0.00 -1.26 -5.04 105.19 106.90 1r6h n GLY 76 Ca 0.05 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.74 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 -3.18 3.44 1.02 4.61 0.00 -1.19 -5.08 121.76 121.38 1r6h s ALA 77 Ca 0.37 -2.30 -0.16 0.00 0.00 0.00 0.00 51.96 49.87 1r6h s ALA 77 Cb 0.41 -2.90 0.04 0.00 0.00 0.00 0.00 23.12 20.67 1r6h s ALA 77 CO -0.06 -1.79 0.07 -2.30 0.00 0.00 0.00 175.76 171.67 1r6h n PRO 78 N 5.04 -0.78 -3.04 0.00 -0.02 -1.26 -4.77 135.00 130.17 1r6h n PRO 78 Ca -0.11 -0.20 -0.43 0.00 -2.02 0.00 0.00 63.50 60.74 1r6h n PRO 78 Cb 0.42 -1.69 0.01 0.00 -0.02 0.00 0.00 33.50 32.22 1r6h n PRO 78 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1r6h n PRO 79 N -1.35 4.39 -2.24 0.52 -0.04 -1.26 -5.04 135.00 129.98 1r6h n PRO 79 Ca 0.03 -4.55 -0.41 0.00 -0.04 0.00 0.00 63.50 58.53 1r6h n PRO 79 Cb 0.58 -2.51 -0.03 0.00 -0.04 0.00 0.00 33.50 31.50 1r6h n PRO 79 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1r6h s PRO 80 N -2.68 4.41 0.54 0.54 0.04 -1.26 -4.92 135.00 131.68 1r6h s PRO 80 Ca 0.31 2.04 0.32 0.00 0.04 0.00 0.00 61.00 63.71 1r6h s PRO 80 Cb 0.04 -3.18 1.52 0.00 0.04 0.00 0.00 34.50 32.91 1r6h s PRO 80 CO 0.09 -0.19 2.06 0.78 0.04 0.00 0.00 177.00 179.78 1r6h h GLY 81 N 4.96 0.00 0.37 0.56 0.00 -2.00 -2.99 103.07 103.96 1r6h h GLY 81 Ca -0.45 0.00 0.15 0.00 0.00 0.00 0.00 47.33 47.03 1r6h h GLY 81 CO 0.74 0.00 0.61 1.70 0.00 0.00 0.00 176.54 179.59 1r6h h LYS 82 N 0.00 0.77 -0.59 4.80 3.64 -2.00 0.04 116.57 123.23 1r6h h LYS 82 Ca -0.00 -0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.36 1r6h h LYS 82 Cb 0.39 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 32.00 1r6h h LYS 82 CO 0.01 0.51 0.36 -0.39 -2.27 0.00 0.00 179.45 177.67 1r6h h VAL 83 N 0.80 1.07 -0.99 2.00 -1.51 -1.93 -0.70 116.25 114.98 1r6h h VAL 83 Ca 0.51 -0.25 0.15 0.00 -1.23 0.00 0.00 66.70 65.88 1r6h h VAL 83 Cb 0.73 0.29 -0.09 0.00 -2.13 0.00 0.00 31.29 30.10 1r6h h VAL 83 CO -0.28 0.13 0.62 0.58 -1.23 0.00 0.00 177.57 177.39 1r6h h VAL 84 N 0.72 0.84 -0.06 7.19 2.07 -1.17 0.41 116.25 126.24 1r6h h VAL 84 Ca 0.24 -0.30 -0.10 0.00 0.82 0.00 0.00 66.70 67.37 1r6h h VAL 84 Cb 0.02 -0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 29.68 1r6h h VAL 84 CO -0.10 0.16 -0.41 -0.33 0.02 0.00 0.00 177.57 176.91 1r6h h GLU 85 N 0.86 0.13 0.07 1.57 4.39 -0.86 -2.20 114.58 118.54 1r6h h GLU 85 Ca 0.52 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 60.15 1r6h h GLU 85 Cb 0.67 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.32 1r6h h GLU 85 CO -0.29 0.53 -0.03 0.22 -1.16 0.00 0.00 179.01 178.27 1r6h h ASP 86 N 0.11 -0.08 0.02 1.42 1.82 0.95 -2.20 116.42 118.47 1r6h h ASP 86 Ca 0.01 -0.23 -0.12 0.00 -0.39 0.00 0.00 57.03 56.30 1r6h h ASP 86 Cb 0.78 0.02 -0.01 0.00 0.68 0.00 0.00 39.33 40.79 1r6h h ASP 86 CO 0.06 0.19 -0.37 -0.25 -1.61 0.00 0.00 179.24 177.26 1r6h h TRP 87 N -0.34 0.55 -0.73 0.28 2.91 -1.44 -2.50 115.95 114.67 1r6h h TRP 87 Ca -0.01 -0.15 0.09 0.00 1.13 0.00 0.00 58.89 59.95 1r6h h TRP 87 Cb 0.30 -0.12 -0.07 0.00 -0.51 0.00 0.00 29.16 28.76 1r6h h TRP 87 CO 0.01 0.78 0.38 -0.07 -1.03 0.00 0.00 178.44 178.51 1r6h h LEU 88 N 0.39 0.52 -0.46 0.65 3.38 -1.30 0.52 115.31 119.02 1r6h h LEU 88 Ca 0.04 0.05 -0.13 0.00 0.09 0.00 0.00 57.88 57.94 1r6h h LEU 88 Cb 0.83 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1r6h h LEU 88 CO 0.07 0.31 -0.20 -1.28 0.09 0.00 0.00 178.44 177.42 1r6h h SER 89 N 0.66 0.98 0.05 -0.43 0.87 -1.19 0.45 113.55 114.93 1r6h h SER 89 Ca 0.35 -0.40 0.01 0.00 -1.23 0.00 0.00 61.79 60.52 1r6h h SER 89 Cb 0.33 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 1r6h h SER 89 CO -0.25 1.15 -0.08 0.25 -0.53 0.00 0.00 176.83 177.37 1r6h h LEU 90 N 0.79 -0.23 -0.32 2.23 7.12 -0.81 -1.86 115.31 122.23 1r6h h LEU 90 Ca 0.11 0.03 -0.20 0.00 0.13 0.00 0.00 57.88 57.95 1r6h h LEU 90 Cb 0.78 0.09 -0.00 0.00 -0.53 0.00 0.00 40.66 41.00 1r6h h LEU 90 CO 0.06 -0.13 -0.78 1.62 -0.13 0.00 0.00 178.44 179.09 1r6h h VAL 91 N -0.17 1.36 -0.75 1.05 3.04 -0.93 -2.58 116.25 117.28 1r6h h VAL 91 Ca 0.02 -2.16 0.13 0.00 -1.01 0.00 0.00 66.70 63.68 1r6h h VAL 91 Cb 0.19 2.14 -0.09 0.00 -2.01 0.00 0.00 31.29 31.52 1r6h h VAL 91 CO -0.05 0.66 0.33 0.11 -1.01 0.00 0.00 177.57 177.60 1r6h h LYS 92 N 0.32 0.49 -0.07 4.17 1.79 0.13 0.75 116.57 124.14 1r6h h LYS 92 Ca -0.04 -0.03 -0.15 0.00 -2.18 0.00 0.00 60.65 58.25 1r6h h LYS 92 Cb 1.37 -0.11 0.01 0.00 -1.58 0.00 0.00 32.23 31.92 1r6h h LYS 92 CO 0.14 0.32 -0.54 0.00 -1.08 0.00 0.00 179.45 178.29 1r6h h ALA 93 N 1.52 0.17 0.00 3.86 0.00 -1.34 -1.97 119.26 121.50 1r6h h ALA 93 Ca 0.40 -0.53 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1r6h h ALA 93 Cb 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1r6h h ALA 93 CO -0.37 0.38 -0.18 0.87 0.00 0.00 0.00 179.25 179.96 1r6h h LYS 94 N 0.07 0.00 0.22 0.00 6.56 -0.92 -0.95 116.57 121.55 1r6h h LYS 94 Ca -0.05 0.00 -0.32 0.00 -1.06 0.00 0.00 60.65 59.22 1r6h h LYS 94 Cb 1.21 0.00 0.03 0.00 -0.57 0.00 0.00 32.23 32.89 1r6h h LYS 94 CO 0.11 0.18 -1.50 0.74 -2.06 0.00 0.00 179.45 176.92 1r6h h PHE 95 N 0.00 0.83 -0.22 -1.35 -1.00 0.49 -1.35 116.94 114.34 1r6h h PHE 95 Ca -0.00 -0.61 -0.04 0.00 2.81 0.00 0.00 57.97 60.13 1r6h h PHE 95 Cb 0.38 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 39.90 1r6h h PHE 95 CO 0.00 1.58 -0.03 0.00 -1.61 0.00 0.00 178.31 178.24 1r6h h GLU 97 N 0.16 0.21 -3.56 0.00 4.81 -1.32 -3.39 114.58 111.50 1r6h h GLU 97 Ca 0.06 -0.23 -0.72 0.00 -0.13 0.00 0.00 59.36 58.34 1r6h h GLU 97 Cb 0.47 0.07 -0.33 0.00 0.63 0.00 0.00 28.75 29.59 1r6h h GLU 97 CO 0.02 0.97 -0.20 0.00 -0.73 0.00 0.00 179.01 179.07 1r6h s ALA 98 N -3.21 3.85 -0.30 2.92 0.00 -0.51 -5.06 121.76 119.46 1r6h s ALA 98 Ca -0.03 -3.42 -0.29 0.00 0.00 0.00 0.00 51.96 48.22 1r6h s ALA 98 Cb 0.10 -2.89 0.01 0.00 0.00 0.00 0.00 23.12 20.34 1r6h s ALA 98 CO 0.83 -2.16 1.22 -1.25 0.00 0.00 0.00 175.76 174.40 1r6h s PRO 99 N -0.33 4.00 -0.58 0.00 0.04 -1.23 -3.76 135.00 133.14 1r6h s PRO 99 Ca 0.20 1.22 -0.01 0.00 0.04 0.00 0.00 61.00 62.45 1r6h s PRO 99 Cb -0.15 -3.82 -0.01 0.00 0.04 0.00 0.00 34.50 30.56 1r6h s PRO 99 CO -0.06 -1.01 0.48 0.41 0.04 0.00 0.00 177.00 176.86 1r6h n GLY 100 N 4.10 0.01 1.68 0.56 0.00 -1.26 -4.98 105.19 105.31 1r6h n GLY 100 Ca 0.14 -0.12 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.11 1.01 -4.24 1.61 2.88 -1.25 -4.76 113.62 106.75 1r6h n SER 101 Ca -0.12 -1.68 -0.35 0.00 -1.33 0.00 0.00 58.87 55.39 1r6h n SER 101 Cb 0.58 -0.16 -0.14 0.00 -0.75 0.00 0.00 64.21 63.74 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 1.37 4.32 0.06 0.00 1.01 -1.22 0.11 120.40 126.06 1r6h s VAL 103 Ca -0.00 -0.94 0.09 0.00 0.00 0.00 0.00 61.98 61.14 1r6h s VAL 103 Cb -0.17 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.07 1r6h s VAL 103 CO -0.02 0.06 -0.25 0.00 0.00 0.00 0.00 175.10 174.90 1r6h s ALA 104 N -1.46 2.14 0.15 5.51 0.00 -1.05 0.15 121.76 127.19 1r6h s ALA 104 Ca 0.28 -1.25 -0.01 0.00 0.00 0.00 0.00 51.96 50.98 1r6h s ALA 104 Cb -0.11 -0.42 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 1r6h s ALA 104 CO 0.21 0.49 0.07 0.08 0.00 0.00 0.00 175.76 176.61 1r6h s VAL 105 N -0.86 0.10 0.69 0.00 1.01 0.53 -1.55 120.40 120.32 1r6h s VAL 105 Ca 0.11 -1.93 -0.14 0.00 0.00 0.00 0.00 61.98 60.01 1r6h s VAL 105 Cb -0.10 -2.14 0.02 0.00 0.00 0.00 0.00 36.38 34.17 1r6h s VAL 105 CO 0.03 -0.37 1.13 -2.28 0.00 0.00 0.00 175.10 173.60 1r6h s HIS 106 N -4.06 2.45 -0.49 5.22 5.65 -1.00 0.21 115.29 123.27 1r6h s HIS 106 Ca 0.27 1.57 -0.27 0.00 0.25 0.00 0.00 55.06 56.88 1r6h s HIS 106 Cb 0.07 -3.23 -0.02 0.00 -1.18 0.00 0.00 32.58 28.22 1r6h s HIS 106 CO 0.04 -1.94 1.82 0.00 -0.65 0.00 0.00 174.74 174.00 1r6h n VAL 108 N 7.29 0.00 0.00 0.00 0.31 -1.26 -3.91 118.33 120.76 1r6h n VAL 108 Ca 0.21 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.54 1r6h n VAL 108 Cb 0.50 -0.54 0.00 0.00 -0.91 0.00 0.00 33.84 32.89 1r6h n VAL 108 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1r6h n ALA 109 N -0.93 1.04 -2.84 3.52 0.00 -1.26 -4.49 120.51 115.55 1r6h n ALA 109 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1r6h n ALA 109 Cb 0.07 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.57 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 -1.40 2.32 2.92 0.00 0.00 -1.25 -5.13 105.19 102.65 1r6h n GLY 110 Ca 0.00 -0.11 -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 1.43 -1.26 -4.60 118.68 116.56 1r6h s LEU 111 Ca 0.00 -0.20 0.00 0.00 -1.03 0.00 0.00 54.13 52.90 1r6h s LEU 111 Cb 0.00 -0.62 0.00 0.00 0.03 0.00 0.00 46.19 45.60 1r6h s LEU 111 CO 0.00 -0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.14 1r6h n GLY 112 N 4.22 2.97 0.00 -3.19 0.00 -1.26 -5.01 105.19 102.92 1r6h n GLY 112 Ca -0.21 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1r6h n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r6h n ARG 113 N 0.00 3.38 -0.18 1.61 3.00 -1.26 -4.40 116.66 118.80 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 -0.70 0.09 0.00 0.00 0.00 0.00 32.46 31.85 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 0.65 -0.48 7.54 0.00 -1.86 -2.65 119.26 122.47 1r6h h ALA 114 Ca 0.00 0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.10 1r6h h ALA 114 Cb 0.00 0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.84 1r6h h ALA 114 CO 0.00 -0.27 0.05 -1.00 0.00 0.00 0.00 179.25 178.03 1r6h h PRO 115 N 0.29 0.16 0.05 0.00 0.13 -1.87 -0.76 132.00 130.00 1r6h h PRO 115 Ca 0.28 -0.01 0.02 0.00 -0.87 0.00 0.00 66.00 65.42 1r6h h PRO 115 Cb 0.37 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 31.43 1r6h h PRO 115 CO -0.33 0.11 -0.20 0.28 -0.23 0.00 0.00 178.00 177.63 1r6h h VAL 116 N 0.17 0.54 -0.37 1.56 2.07 -1.82 -2.41 116.25 115.99 1r6h h VAL 116 Ca 0.24 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.82 1r6h h VAL 116 Cb 0.34 0.54 -0.06 0.00 -1.52 0.00 0.00 31.29 30.59 1r6h h VAL 116 CO -0.35 0.00 0.02 -0.07 0.02 0.00 0.00 177.57 177.18 1r6h h LEU 117 N -0.35 -0.11 -0.45 2.57 3.38 -1.20 -2.35 115.31 116.79 1r6h h LEU 117 Ca 0.04 0.08 0.09 0.00 0.09 0.00 0.00 57.88 58.18 1r6h h LEU 117 Cb 0.40 0.13 -0.08 0.00 0.09 0.00 0.00 40.66 41.20 1r6h h LEU 117 CO -0.15 -0.02 -0.09 0.58 0.09 0.00 0.00 178.44 178.85 1r6h h VAL 118 N 0.12 0.57 -0.59 1.22 2.07 -0.83 -0.80 116.25 118.02 1r6h h VAL 118 Ca 0.18 -0.01 0.07 0.00 0.82 0.00 0.00 66.70 67.76 1r6h h VAL 118 Cb 0.24 0.54 -0.06 0.00 -1.52 0.00 0.00 31.29 30.50 1r6h h VAL 118 CO -0.28 0.00 0.28 0.00 0.02 0.00 0.00 177.57 177.59 1r6h h ALA 119 N 1.44 0.76 -0.31 1.67 0.00 -0.98 -0.18 119.26 121.66 1r6h h ALA 119 Ca 0.22 0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.24 1r6h h ALA 119 Cb 0.33 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1r6h h ALA 119 CO -0.45 -0.09 0.22 -0.07 0.00 0.00 0.00 179.25 178.86 1r6h h LEU 120 N 0.52 0.09 -0.13 0.00 3.38 -0.68 -0.25 115.31 118.25 1r6h h LEU 120 Ca 0.27 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.14 1r6h h LEU 120 Cb 0.24 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1r6h h LEU 120 CO -0.22 0.06 -0.33 0.00 0.09 0.00 0.00 178.44 178.04 1r6h h ALA 121 N 1.84 0.21 0.00 1.53 0.00 -0.20 -2.98 119.26 119.66 1r6h h ALA 121 Ca 0.14 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1r6h h ALA 121 Cb 0.44 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1r6h h ALA 121 CO -0.02 0.26 0.00 1.25 0.00 0.00 0.00 179.25 180.75 1r6h h LEU 122 N 0.05 0.00 -0.85 0.00 6.46 -0.61 -3.10 115.31 117.25 1r6h h LEU 122 Ca -0.01 0.00 0.05 0.00 -0.12 0.00 0.00 57.88 57.80 1r6h h LEU 122 Cb 0.94 0.00 -0.06 0.00 -0.73 0.00 0.00 40.66 40.82 1r6h h LEU 122 CO 0.07 0.00 0.54 0.40 -0.62 0.00 0.00 178.44 178.83 1r6h h ILE 123 N 0.00 1.08 0.00 4.05 2.04 -0.91 -1.64 117.51 122.13 1r6h h ILE 123 Ca 0.00 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.51 1r6h h ILE 123 Cb 0.38 -0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.45 1r6h h ILE 123 CO 0.00 0.18 0.18 1.05 0.00 0.00 0.00 178.15 179.56 1r6h h GLU 124 N 1.01 0.00 -0.15 2.37 4.11 -1.68 -1.91 114.58 118.34 1r6h h GLU 124 Ca 0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.79 1r6h h GLU 124 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1r6h h GLU 124 CO -0.15 0.00 0.00 0.43 0.07 0.00 0.00 179.01 179.36 1r6h n SER 125 N -2.30 0.29 0.00 3.06 7.64 -0.62 -4.95 113.62 116.75 1r6h n SER 125 Ca -0.01 -2.00 0.00 0.00 1.01 0.00 0.00 58.87 57.86 1r6h n SER 125 Cb 0.21 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 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 0.48 2.00 3.56 0.23 0.00 -0.72 -4.95 105.19 105.79 1r6h n GLY 126 Ca 0.01 -0.76 -0.21 0.00 0.00 0.00 0.00 46.02 45.07 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 0.09 1.61 -0.00 -1.26 -4.74 117.12 113.36 1r6h n MET 127 Ca 0.00 -1.88 -0.04 0.00 -0.00 0.00 0.00 57.70 55.78 1r6h n MET 127 Cb 0.00 -3.78 -0.02 0.00 -0.00 0.00 0.00 33.22 29.42 1r6h n MET 127 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 1r6h h LYS 128 N 10.94 -0.22 -0.00 3.17 1.57 -1.88 0.48 116.57 130.62 1r6h h LYS 128 Ca 0.09 0.02 -0.15 0.00 -1.87 0.00 0.00 60.65 58.73 1r6h h LYS 128 Cb 0.96 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.30 1r6h h LYS 128 CO 1.15 -0.15 -0.72 -0.92 -0.57 0.00 0.00 179.45 178.24 1r6h h TYR 129 N -0.25 0.05 -0.06 -1.35 3.20 -1.86 -2.50 116.97 114.19 1r6h h TYR 129 Ca -0.02 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.76 1r6h h TYR 129 Cb 0.18 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.44 1r6h h TYR 129 CO 0.16 0.75 -0.20 0.93 -1.64 0.00 0.00 178.16 178.16 1r6h h GLU 130 N 0.02 0.24 -0.12 1.82 5.08 -1.93 -2.55 114.58 117.14 1r6h h GLU 130 Ca -0.01 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.13 1r6h h GLU 130 Cb 1.28 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.56 1r6h h GLU 130 CO 0.10 0.80 -0.08 0.22 -1.00 0.00 0.00 179.01 179.05 1r6h h ASP 131 N -0.28 0.28 -0.03 1.42 3.58 -0.09 0.24 116.42 121.54 1r6h h ASP 131 Ca -0.01 -0.44 0.01 0.00 0.42 0.00 0.00 57.03 57.01 1r6h h ASP 131 Cb 0.82 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.78 1r6h h ASP 131 CO 0.04 0.66 -0.02 0.00 -2.88 0.00 0.00 179.24 177.04 1r6h h ALA 132 N 0.63 0.01 -0.14 -0.78 0.00 -1.56 0.44 119.26 117.87 1r6h h ALA 132 Ca 0.03 0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.77 1r6h h ALA 132 Cb 0.56 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1r6h h ALA 132 CO 0.02 -0.51 -0.65 0.82 0.00 0.00 0.00 179.25 178.93 1r6h h ILE 133 N -0.02 1.34 -0.00 0.00 1.08 -1.51 -1.42 117.51 116.97 1r6h h ILE 133 Ca 0.02 -1.96 -0.01 0.00 -0.39 0.00 0.00 64.86 62.52 1r6h h ILE 133 Cb 0.05 1.94 0.00 0.00 -3.07 0.00 0.00 36.82 35.74 1r6h h ILE 133 CO -0.04 0.60 -0.04 1.56 -0.69 0.00 0.00 178.15 179.54 1r6h h GLN 134 N 0.38 0.03 -0.30 2.37 4.20 -0.79 -0.84 115.11 120.16 1r6h h GLN 134 Ca -0.02 -0.03 -0.15 0.00 0.06 0.00 0.00 58.65 58.52 1r6h h GLN 134 Cb 1.22 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 29.00 1r6h h GLN 134 CO 0.12 0.74 -0.40 0.74 -0.67 0.00 0.00 178.83 179.35 1r6h h PHE 135 N -0.66 0.85 0.00 2.96 -1.00 -0.22 -2.58 116.94 116.29 1r6h h PHE 135 Ca -0.00 -0.25 -0.13 0.00 2.81 0.00 0.00 57.97 60.39 1r6h h PHE 135 Cb 0.75 -0.18 -0.02 0.00 3.61 0.00 0.00 35.95 40.11 1r6h h PHE 135 CO 0.17 1.00 -0.62 0.97 -1.61 0.00 0.00 178.31 178.23 1r6h h ILE 136 N 0.58 1.30 -0.13 -0.55 2.10 -1.36 -3.00 117.51 116.45 1r6h h ILE 136 Ca 0.05 -2.22 -0.05 0.00 1.08 0.00 0.00 64.86 63.71 1r6h h ILE 136 Cb 0.94 2.25 -0.00 0.00 -1.09 0.00 0.00 36.82 38.92 1r6h h ILE 136 CO 0.09 0.61 -0.12 -0.09 -1.08 0.00 0.00 178.15 177.56 1r6h h ARG 137 N 0.00 0.31 -0.86 2.19 1.12 -1.00 -3.16 114.38 112.99 1r6h h ARG 137 Ca -0.01 -0.16 0.01 0.00 -1.11 0.00 0.00 59.98 58.72 1r6h h ARG 137 Cb 1.20 0.00 -0.04 0.00 -0.01 0.00 0.00 29.97 31.12 1r6h h ARG 137 CO 0.08 0.70 0.57 1.96 -3.11 0.00 0.00 179.97 180.16 1r6h h GLN 138 N -0.06 1.11 -6.73 0.20 1.08 -1.51 -3.42 115.11 105.78 1r6h h GLN 138 Ca 0.02 -0.07 -0.50 0.00 -1.45 0.00 0.00 58.65 56.65 1r6h h GLN 138 Cb 0.63 -0.25 -0.01 0.00 -0.05 0.00 0.00 27.48 27.80 1r6h h GLN 138 CO 0.03 0.74 0.06 0.15 -0.95 0.00 0.00 178.83 178.86 1r6h s LYS 139 N -6.12 3.84 -0.18 1.46 3.01 -1.13 -5.01 119.74 115.60 1r6h s LYS 139 Ca -0.13 0.47 -0.29 0.00 -1.01 0.00 0.00 55.97 55.01 1r6h s LYS 139 Cb 0.16 -2.46 -0.02 0.00 -1.01 0.00 0.00 37.83 34.51 1r6h s LYS 139 CO 0.80 0.09 1.43 0.50 0.51 0.00 0.00 175.35 178.68 1r6h s ARG 140 N -3.42 4.05 0.32 1.68 3.00 -1.26 -4.80 118.95 118.53 1r6h s ARG 140 Ca 0.51 1.69 0.09 0.00 -1.00 0.00 0.00 55.73 57.02 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 -0.96 0.04 -0.98 0.00 0.00 0.00 175.30 173.66 1r6h s ARG 141 N 4.02 2.20 0.00 5.12 1.70 -1.26 -4.75 118.95 125.98 1r6h s ARG 141 Ca 0.63 -1.62 0.00 0.00 -0.47 0.00 0.00 55.73 54.27 1r6h s ARG 141 Cb -0.24 -2.05 0.00 0.00 -0.57 0.00 0.00 34.95 32.09 1r6h s ARG 141 CO 0.23 0.19 0.00 0.41 -1.08 0.00 0.00 175.30 175.04 1r6h n GLY 142 N -0.99 -3.19 3.43 3.88 0.00 -1.26 -4.85 105.19 102.21 1r6h n GLY 142 Ca -0.04 -1.07 -0.44 0.00 0.00 0.00 0.00 46.02 44.47 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 -2.07 3.21 -0.47 4.61 0.00 -1.26 -4.94 121.76 120.84 1r6h s ALA 143 Ca 0.00 -1.95 -0.23 0.00 0.00 0.00 0.00 51.96 49.78 1r6h s ALA 143 Cb 0.00 -3.75 0.03 0.00 0.00 0.00 0.00 23.12 19.40 1r6h s ALA 143 CO 0.00 -2.63 0.82 0.96 0.00 0.00 0.00 175.76 174.91 1r6h s ILE 144 N 3.62 4.59 0.00 0.00 -0.00 -1.26 -4.92 121.20 123.24 1r6h s ILE 144 Ca 0.19 0.41 0.00 0.00 -0.00 0.00 0.00 60.65 61.25 1r6h s ILE 144 Cb -0.19 -4.37 0.00 0.00 -0.00 0.00 0.00 42.46 37.90 1r6h s ILE 144 CO 0.09 -0.80 0.00 0.59 -0.00 0.00 0.00 174.94 174.82 1r6h n ASN 145 N 6.87 0.00 -0.07 4.36 4.13 -1.26 -4.89 115.26 124.40 1r6h n ASN 145 Ca 0.02 0.00 -0.08 0.00 1.68 0.00 0.00 54.58 56.21 1r6h n ASN 145 Cb 0.48 -0.04 -0.03 0.00 -1.54 0.00 0.00 39.78 38.66 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 -1.49 1.65 -0.09 6.41 7.64 -1.26 -4.60 113.62 121.88 1r6h n SER 146 Ca 0.00 0.28 -0.10 0.00 1.01 0.00 0.00 58.87 60.05 1r6h n SER 146 Cb 0.00 -0.70 -0.03 0.00 -1.01 0.00 0.00 64.21 62.47 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 -0.84 0.42 -0.01 1.43 3.11 -1.97 -1.92 116.57 116.80 1r6h h LYS 147 Ca 0.00 -0.10 0.02 0.00 -2.81 0.00 0.00 60.65 57.77 1r6h h LYS 147 Cb 0.84 -0.06 -0.03 0.00 -1.00 0.00 0.00 32.23 31.98 1r6h h LYS 147 CO 0.00 0.50 -0.15 1.96 -2.81 0.00 0.00 179.45 178.95 1r6h h GLN 148 N 0.26 -0.23 -0.03 1.90 4.20 -1.94 0.72 115.11 120.01 1r6h h GLN 148 Ca 0.08 0.02 -0.23 0.00 0.06 0.00 0.00 58.65 58.58 1r6h h GLN 148 Cb 0.26 0.05 0.01 0.00 0.30 0.00 0.00 27.48 28.10 1r6h h GLN 148 CO -0.00 -0.15 -0.93 -0.07 -0.67 0.00 0.00 178.83 177.01 1r6h h LEU 149 N -0.24 0.67 -0.43 1.46 -0.00 -1.81 -2.69 115.31 112.27 1r6h h LEU 149 Ca 0.05 -0.51 -0.17 0.00 -0.00 0.00 0.00 57.88 57.25 1r6h h LEU 149 Cb 0.31 -0.20 -0.00 0.00 -0.00 0.00 0.00 40.66 40.76 1r6h h LEU 149 CO -0.15 1.31 -0.60 0.00 -0.00 0.00 0.00 178.44 179.00 1r6h h THR 150 N 0.31 1.32 0.04 0.22 1.03 -1.24 -1.46 112.91 113.13 1r6h h THR 150 Ca -0.08 -1.85 -0.00 0.00 -0.01 0.00 0.00 66.41 64.47 1r6h h THR 150 Cb 1.56 1.81 0.00 0.00 -1.07 0.00 0.00 68.15 70.45 1r6h h THR 150 CO 0.17 0.58 -0.02 0.22 -0.01 0.00 0.00 175.52 176.46 1r6h h TYR 151 N 0.46 -0.05 -0.10 0.00 3.20 0.42 -1.88 116.97 119.03 1r6h h TYR 151 Ca -0.00 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.79 1r6h h TYR 151 Cb 1.16 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 39.44 1r6h h TYR 151 CO 0.05 0.25 -0.29 1.25 -1.64 0.00 0.00 178.16 177.78 1r6h h LEU 152 N -0.35 0.17 -1.13 2.82 6.46 -1.53 -0.55 115.31 121.21 1r6h h LEU 152 Ca -0.01 -0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 57.68 1r6h h LEU 152 Cb 0.32 -0.05 -0.03 0.00 -0.73 0.00 0.00 40.66 40.17 1r6h h LEU 152 CO 0.01 0.47 0.33 -0.08 -0.62 0.00 0.00 178.44 178.55 1r6h h GLU 153 N 0.16 0.94 0.00 1.25 4.81 -1.11 0.05 114.58 120.67 1r6h h GLU 153 Ca 0.02 -0.12 -0.05 0.00 -0.13 0.00 0.00 59.36 59.09 1r6h h GLU 153 Cb 0.60 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1r6h h GLU 153 CO 0.04 0.72 -0.24 -0.22 -0.73 0.00 0.00 179.01 178.58 1r6h h LYS 154 N 0.94 0.00 -0.38 1.92 3.11 -0.52 -3.19 116.57 118.44 1r6h h LYS 154 Ca 0.23 0.00 -0.06 0.00 -2.81 0.00 0.00 60.65 58.01 1r6h h LYS 154 Cb 0.08 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.30 1r6h h LYS 154 CO -0.03 0.24 -0.00 -0.92 -2.81 0.00 0.00 179.45 175.92 1r6h h TYR 155 N 0.00 0.73 -3.62 1.91 5.03 0.56 -3.40 116.97 118.18 1r6h h TYR 155 Ca -0.00 -0.13 -0.67 0.00 2.58 0.00 0.00 58.73 60.51 1r6h h TYR 155 Cb 0.97 -0.19 -0.25 0.00 1.55 0.00 0.00 36.73 38.82 1r6h h TYR 155 CO 0.00 0.76 -0.60 0.50 -1.32 0.00 0.00 178.16 177.50 1r6h s ARG 156 N -5.00 3.19 0.32 1.82 3.52 -0.83 -4.98 118.95 116.99 1r6h s ARG 156 Ca -0.13 -0.80 -0.29 0.00 -0.13 0.00 0.00 55.73 54.38 1r6h s ARG 156 Cb 0.10 -3.43 -0.10 0.00 -1.56 0.00 0.00 34.95 29.95 1r6h s ARG 156 CO 0.79 -0.42 1.40 -1.25 -0.81 0.00 0.00 175.30 175.01 1r6h s PRO 157 N 1.54 4.26 -0.13 5.12 0.04 -1.26 -4.84 135.00 139.73 1r6h s PRO 157 Ca 0.03 2.35 -0.05 0.00 0.04 0.00 0.00 61.00 63.37 1r6h s PRO 157 Cb -0.17 -3.05 0.06 0.00 0.04 0.00 0.00 34.50 31.38 1r6h s PRO 157 CO 0.04 -0.36 0.27 0.21 0.04 0.00 0.00 177.00 177.20 1r6h s LYS 158 N -1.43 0.19 0.00 4.56 2.20 -1.26 -5.01 119.74 118.99 1r6h s LYS 158 Ca 0.53 0.70 0.23 0.00 -0.36 0.00 0.00 55.97 57.08 1r6h s LYS 158 Cb -0.42 -0.04 1.25 0.00 -1.51 0.00 0.00 37.83 37.11 1r6h s LYS 158 CO 0.53 -0.24 1.82 1.04 -0.36 0.00 0.00 175.35 178.14 1r6h n GLN 159 N 4.97 1.16 -0.20 4.03 3.00 -1.26 -3.89 117.38 125.18 1r6h n GLN 159 Ca -0.13 -0.24 0.03 0.00 -0.01 0.00 0.00 57.00 56.65 1r6h n GLN 159 Cb 0.51 -1.37 0.28 0.00 0.00 0.00 0.00 30.24 29.66 1r6h n GLN 159 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.06 176.97 1r6h h ARG 160 N 0.51 0.90 0.00 -1.09 2.43 -2.01 -1.99 114.38 113.12 1r6h h ARG 160 Ca 0.00 -0.05 -0.21 0.00 -0.81 0.00 0.00 59.98 58.90 1r6h h ARG 160 Cb 0.11 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 1r6h h ARG 160 CO 0.00 0.59 -1.07 1.37 -1.51 0.00 0.00 179.97 179.36 1r6h h LEU 161 N 0.92 0.00 -7.47 3.80 -0.00 -2.03 -3.41 115.31 107.12 1r6h h LEU 161 Ca 0.29 0.00 -0.64 0.00 -0.00 0.00 0.00 57.88 57.53 1r6h h LEU 161 Cb 0.02 0.00 -0.40 0.00 -0.00 0.00 0.00 40.66 40.27 1r6h h LEU 161 CO -0.08 0.96 -0.70 -0.13 -0.00 0.00 0.00 178.44 178.49 1r6h s ARG 162 N -2.72 1.52 -0.73 0.17 3.00 -0.75 -5.06 118.95 114.38 1r6h s ARG 162 Ca 0.00 -2.02 -0.26 0.00 0.00 0.00 0.00 55.73 53.45 1r6h s ARG 162 Cb 0.10 -3.02 -0.00 0.00 0.00 0.00 0.00 34.95 32.02 1r6h s ARG 162 CO 0.81 -1.02 1.67 0.12 0.00 0.00 0.00 175.30 176.89 1r6h s PHE 163 N 0.58 1.94 0.21 -0.53 5.36 -1.18 -4.65 117.98 119.70 1r6h s PHE 163 Ca 0.13 0.38 0.05 0.00 -0.96 0.00 0.00 56.93 56.53 1r6h s PHE 163 Cb -0.21 -4.29 -0.05 0.00 -0.34 0.00 0.00 43.02 38.12 1r6h s PHE 163 CO -0.07 -2.13 -0.07 0.15 -1.46 0.00 0.00 175.22 171.64 1r6h s LYS 164 N 6.48 1.30 -0.55 10.12 1.02 -1.26 -5.11 119.74 131.74 1r6h s LYS 164 Ca 0.56 -1.62 -0.19 0.00 0.02 0.00 0.00 55.97 54.74 1r6h s LYS 164 Cb -0.09 -0.83 0.08 0.00 -0.52 0.00 0.00 37.83 36.46 1r6h s LYS 164 CO 0.13 0.04 0.68 0.34 -0.92 0.00 0.00 175.35 175.62 1r6h s ASP 165 N -3.30 6.21 -0.17 2.83 2.15 -1.26 -5.03 116.67 118.10 1r6h s ASP 165 Ca 0.24 -1.11 -0.29 0.00 0.43 0.00 0.00 52.55 51.81 1r6h s ASP 165 Cb 0.03 -2.30 -0.03 0.00 -0.30 0.00 0.00 42.92 40.32 1r6h s ASP 165 CO 0.07 -1.01 1.58 -2.16 -0.17 0.00 0.00 175.17 173.47 1r6h s PRO 166 N 2.73 3.94 -0.06 4.34 0.04 -1.26 -4.99 135.00 139.75 1r6h s PRO 166 Ca 0.14 1.78 -0.01 0.00 0.04 0.00 0.00 61.00 62.95 1r6h s PRO 166 Cb -0.21 -3.99 0.03 0.00 0.04 0.00 0.00 34.50 30.37 1r6h s PRO 166 CO 0.10 -1.11 0.02 -1.01 0.04 0.00 0.00 177.00 175.04 1r6h s HIS 167 N 4.70 0.41 -0.13 0.56 3.76 -1.26 -5.14 115.29 118.19 1r6h s HIS 167 Ca 0.70 0.01 -0.12 0.00 -0.15 0.00 0.00 55.06 55.50 1r6h s HIS 167 Cb -0.26 -0.65 -0.05 0.00 1.11 0.00 0.00 32.58 32.73 1r6h s HIS 167 CO 0.27 -0.26 0.26 -0.08 -0.85 0.00 0.00 174.74 174.08 1r6h s THR 168 N 1.98 5.32 -0.24 1.30 -1.32 -1.26 -5.08 115.64 116.35 1r6h s THR 168 Ca 0.04 0.47 -0.08 0.00 -1.21 0.00 0.00 61.69 60.92 1r6h s THR 168 Cb -0.12 -3.57 -0.03 0.00 -1.51 0.00 0.00 72.50 67.26 1r6h s THR 168 CO -0.04 0.47 0.08 -1.00 -2.21 0.00 0.00 174.62 171.93 1r6h s HIS 169 N -0.10 3.13 -0.21 9.09 3.76 -1.26 -5.07 115.29 124.63 1r6h s HIS 169 Ca 0.16 -0.25 -0.11 0.00 -0.15 0.00 0.00 55.06 54.71 1r6h s HIS 169 Cb -0.13 -2.22 0.07 0.00 1.11 0.00 0.00 32.58 31.41 1r6h s HIS 169 CO 0.05 -0.23 0.51 0.21 -0.85 0.00 0.00 174.74 174.43 1r6h s LYS 170 N 1.39 0.49 -1.59 1.40 2.20 -1.26 -4.90 119.74 117.46 1r6h s LYS 170 Ca 0.05 1.00 -0.03 0.00 -0.36 0.00 0.00 55.97 56.63 1r6h s LYS 170 Cb -0.15 0.13 0.00 0.00 -1.51 0.00 0.00 37.83 36.30 1r6h s LYS 170 CO 0.04 -0.17 0.38 2.41 -0.36 0.00 0.00 175.35 177.65 1r6h n THR 171 N 4.50 -1.59 -1.33 3.43 -1.04 -1.26 -5.35 114.28 111.63 1r6h n THR 171 Ca -0.20 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.81 1r6h n THR 171 Cb 0.55 -3.23 0.00 0.00 -1.82 0.00 0.00 70.33 65.83 1r6h n THR 171 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29