#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b1c s SER 8 N 0.00 5.88 0.43 4.04 0.15 -1.26 -4.74 113.70 118.20 1b1c s SER 8 Ca 0.00 0.26 0.20 0.00 0.70 0.00 0.00 55.95 57.11 1b1c s SER 8 Cb 0.00 -1.89 0.99 0.00 -1.71 0.00 0.00 66.02 63.41 1b1c s SER 8 CO 0.00 0.32 1.90 2.19 1.20 0.00 0.00 173.24 178.84 1b1c h PHE 9 N 5.64 0.00 -0.24 3.44 -5.15 -1.96 -2.04 116.94 116.63 1b1c h PHE 9 Ca -0.48 0.00 -0.16 0.00 -0.20 0.00 0.00 57.97 57.14 1b1c h PHE 9 Cb 1.20 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 37.36 1b1c h PHE 9 CO 0.66 0.27 -0.49 0.28 -2.00 0.00 0.00 178.31 177.02 1b1c h VAL 10 N 0.00 1.30 -0.51 0.88 2.07 -1.94 -1.18 116.25 116.87 1b1c h VAL 10 Ca -0.00 -1.70 -0.13 0.00 0.82 0.00 0.00 66.70 65.69 1b1c h VAL 10 Cb 0.60 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 1b1c h VAL 10 CO 0.03 0.54 -0.17 -0.08 0.02 0.00 0.00 177.57 177.91 1b1c h GLU 11 N 0.52 1.02 -0.42 1.57 4.57 -1.88 -1.23 114.58 118.73 1b1c h GLU 11 Ca 0.02 -0.41 -0.03 0.00 -1.18 0.00 0.00 59.36 57.76 1b1c h GLU 11 Cb 1.04 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.56 1b1c h GLU 11 CO 0.10 1.10 0.15 -0.22 -1.18 0.00 0.00 179.01 178.95 1b1c h LYS 12 N 0.89 0.64 -0.39 1.92 3.64 -1.16 -1.88 116.57 120.23 1b1c h LYS 12 Ca 0.12 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1b1c h LYS 12 Cb 0.75 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.45 1b1c h LYS 12 CO 0.06 0.62 0.24 0.52 -2.27 0.00 0.00 179.45 178.62 1b1c h MET 13 N 0.54 0.53 -0.34 1.90 2.86 -1.03 -2.11 114.93 117.28 1b1c h MET 13 Ca 0.14 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.75 1b1c h MET 13 Cb 0.23 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.76 1b1c h MET 13 CO -0.01 0.40 0.19 0.87 1.06 0.00 0.00 176.91 179.42 1b1c h LYS 14 N 0.51 0.38 0.00 1.72 1.57 -1.06 0.20 116.57 119.90 1b1c h LYS 14 Ca 0.14 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1b1c h LYS 14 Cb 0.00 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.23 1b1c h LYS 14 CO -0.03 0.25 0.00 0.36 -0.57 0.00 0.00 179.45 179.46 1b1c n LYS 15 N -4.91 0.21 -0.10 3.15 2.85 -0.72 -3.24 118.16 115.40 1b1c n LYS 15 Ca 0.00 0.30 0.04 0.00 -1.05 0.00 0.00 58.31 57.60 1b1c n LYS 15 Cb 0.06 -1.82 0.09 0.00 -0.65 0.00 0.00 35.03 32.72 1b1c n LYS 15 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1b1c n THR 16 N -2.20 0.86 -1.20 0.58 -2.24 -0.80 -5.00 114.28 104.27 1b1c n THR 16 Ca 0.04 -0.93 -0.07 0.00 -2.27 0.00 0.00 64.05 60.82 1b1c n THR 16 Cb 0.33 0.59 -0.03 0.00 -2.10 0.00 0.00 70.33 69.12 1b1c n THR 16 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1b1c n GLY 17 N 0.20 0.91 3.83 3.38 0.00 -0.58 -5.03 105.19 107.89 1b1c n GLY 17 Ca 0.07 -0.56 -0.37 0.00 0.00 0.00 0.00 46.02 45.16 1b1c n GLY 17 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b1c s ARG 18 N -2.40 4.10 0.00 1.61 3.00 -0.04 -4.64 118.95 120.57 1b1c s ARG 18 Ca 0.00 0.63 0.02 0.00 0.00 0.00 0.00 55.73 56.38 1b1c s ARG 18 Cb 0.00 -3.08 -0.01 0.00 0.00 0.00 0.00 34.95 31.86 1b1c s ARG 18 CO 0.00 0.55 0.20 0.27 0.00 0.00 0.00 175.30 176.32 1b1c n ASN 19 N 1.25 0.35 -4.16 0.23 0.23 -0.40 -4.43 115.26 108.33 1b1c n ASN 19 Ca -0.08 -0.68 -0.29 0.00 -0.53 0.00 0.00 54.58 53.01 1b1c n ASN 19 Cb 0.51 0.76 -0.17 0.00 -2.08 0.00 0.00 39.78 38.80 1b1c n ASN 19 CO 0.00 0.00 0.00 -0.63 -0.93 0.00 0.00 177.26 175.70 1b1c s ILE 20 N -0.93 1.68 -0.05 1.53 1.01 -0.87 -1.39 121.20 122.19 1b1c s ILE 20 Ca 0.01 -0.83 0.03 0.00 0.00 0.00 0.00 60.65 59.86 1b1c s ILE 20 Cb 0.01 -1.45 0.01 0.00 0.01 0.00 0.00 42.46 41.04 1b1c s ILE 20 CO 0.06 0.48 -0.11 -0.51 0.00 0.00 0.00 174.94 174.85 1b1c s ILE 21 N 0.21 1.02 -0.24 2.92 2.07 -0.86 -2.01 121.20 124.32 1b1c s ILE 21 Ca -0.10 -0.45 0.01 0.00 -1.41 0.00 0.00 60.65 58.70 1b1c s ILE 21 Cb -0.15 -0.92 0.04 0.00 0.13 0.00 0.00 42.46 41.56 1b1c s ILE 21 CO 0.05 0.32 -0.12 -0.69 -1.91 0.00 0.00 174.94 172.59 1b1c s VAL 22 N 0.43 2.32 0.03 4.00 1.01 0.05 -1.20 120.40 127.04 1b1c s VAL 22 Ca -0.09 -1.31 -0.13 0.00 0.00 0.00 0.00 61.98 60.45 1b1c s VAL 22 Cb -0.13 -2.22 -0.06 0.00 0.00 0.00 0.00 36.38 33.97 1b1c s VAL 22 CO 0.02 0.17 0.40 -0.36 0.00 0.00 0.00 175.10 175.34 1b1c s PHE 23 N 1.21 3.67 -0.08 5.22 0.08 0.20 -0.10 117.98 128.18 1b1c s PHE 23 Ca -0.03 0.91 0.04 0.00 0.12 0.00 0.00 56.93 57.97 1b1c s PHE 23 Cb -0.17 -2.24 0.00 0.00 -0.57 0.00 0.00 43.02 40.04 1b1c s PHE 23 CO -0.07 0.60 -0.21 1.52 -0.10 0.00 0.00 175.22 176.96 1b1c s TYR 24 N -1.20 2.20 -0.40 0.36 -0.85 -0.92 -0.85 117.35 115.68 1b1c s TYR 24 Ca 0.27 -0.81 -0.08 0.00 -0.52 0.00 0.00 57.07 55.93 1b1c s TYR 24 Cb -0.16 -1.48 0.07 0.00 0.38 0.00 0.00 41.96 40.77 1b1c s TYR 24 CO 0.15 -0.32 0.23 0.20 -1.52 0.00 0.00 175.55 174.28 1b1c s GLY 25 N 0.28 1.95 -0.02 5.49 0.00 -0.11 -4.32 107.32 110.59 1b1c s GLY 25 Ca -0.13 -2.10 -0.03 0.00 0.00 0.00 0.00 44.72 42.46 1b1c s GLY 25 CO 0.06 0.94 0.07 -0.45 0.00 0.00 0.00 173.10 173.72 1b1c s SER 26 N 1.96 -0.01 -0.13 1.64 0.15 -1.26 -1.35 113.70 114.69 1b1c s SER 26 Ca 0.03 -0.01 -0.08 0.00 0.70 0.00 0.00 55.95 56.59 1b1c s SER 26 Cb -0.22 0.17 -0.06 0.00 -1.71 0.00 0.00 66.02 64.19 1b1c s SER 26 CO 0.02 -0.14 -0.19 0.00 1.20 0.00 0.00 173.24 174.13 1b1c n GLN 27 N 2.51 0.30 -0.48 5.44 1.13 -1.26 -4.67 117.38 120.35 1b1c n GLN 27 Ca -0.16 0.13 0.10 0.00 -1.94 0.00 0.00 57.00 55.13 1b1c n GLN 27 Cb 0.58 -1.01 0.33 0.00 0.11 0.00 0.00 30.24 30.24 1b1c n GLN 27 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1b1c n THR 28 N -3.70 1.34 -0.28 5.09 -2.24 -1.26 -4.97 114.28 108.26 1b1c n THR 28 Ca -0.26 -1.03 0.00 0.00 -2.27 0.00 0.00 64.05 60.49 1b1c n THR 28 Cb 0.64 0.28 0.00 0.00 -2.10 0.00 0.00 70.33 69.15 1b1c n THR 28 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1b1c n GLY 29 N 1.36 1.18 0.11 3.38 0.00 -1.26 -4.96 105.19 105.01 1b1c n GLY 29 Ca 0.24 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.14 1b1c n GLY 29 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1b1c h THR 30 N 0.00 1.23 0.00 2.61 2.02 -1.96 -2.06 112.91 114.75 1b1c h THR 30 Ca 0.00 -0.76 -0.07 0.00 0.77 0.00 0.00 66.41 66.34 1b1c h THR 30 Cb 0.00 1.45 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 1b1c h THR 30 CO 0.00 0.23 -0.34 0.00 0.37 0.00 0.00 175.52 175.78 1b1c h ALA 31 N 0.79 1.42 -0.44 6.16 0.00 -1.89 -1.66 119.26 123.64 1b1c h ALA 31 Ca 0.05 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.50 1b1c h ALA 31 Cb 0.33 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1b1c h ALA 31 CO 0.01 0.43 -0.28 1.49 0.00 0.00 0.00 179.25 180.89 1b1c h GLU 32 N 0.00 0.97 -0.38 0.00 4.81 -1.86 -1.08 114.58 117.04 1b1c h GLU 32 Ca -0.00 -0.45 -0.11 0.00 -0.13 0.00 0.00 59.36 58.66 1b1c h GLU 32 Cb 0.61 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 1b1c h GLU 32 CO 0.04 1.12 -0.19 1.49 -0.73 0.00 0.00 179.01 180.75 1b1c h GLU 33 N 0.81 0.80 -0.71 1.92 4.81 -1.00 -0.97 114.58 120.24 1b1c h GLU 33 Ca 0.09 -0.35 -0.02 0.00 -0.13 0.00 0.00 59.36 58.95 1b1c h GLU 33 Cb 0.87 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.20 1b1c h GLU 33 CO 0.08 0.98 0.36 0.74 -0.73 0.00 0.00 179.01 180.43 1b1c h PHE 34 N 0.60 0.99 -0.41 0.92 -1.00 -1.24 -1.23 116.94 115.57 1b1c h PHE 34 Ca 0.08 -0.03 -0.05 0.00 2.81 0.00 0.00 57.97 60.79 1b1c h PHE 34 Cb 0.74 -0.31 -0.02 0.00 3.61 0.00 0.00 35.95 39.97 1b1c h PHE 34 CO 0.06 0.71 0.08 0.00 -1.61 0.00 0.00 178.31 177.55 1b1c h ALA 35 N 1.39 0.54 -0.81 2.45 0.00 -0.91 -0.72 119.26 121.20 1b1c h ALA 35 Ca 0.25 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1b1c h ALA 35 Cb 0.08 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1b1c h ALA 35 CO -0.04 0.24 0.47 -0.91 0.00 0.00 0.00 179.25 179.01 1b1c h ASN 36 N 0.52 0.99 -0.40 0.00 2.35 -0.85 -0.74 115.58 117.45 1b1c h ASN 36 Ca 0.12 -0.08 -0.06 0.00 -0.55 0.00 0.00 56.30 55.73 1b1c h ASN 36 Cb 0.35 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.46 1b1c h ASN 36 CO 0.01 0.78 0.01 0.03 -1.65 0.00 0.00 177.43 176.61 1b1c h ARG 37 N 1.11 0.69 -0.61 0.81 3.08 -0.98 -2.40 114.38 116.08 1b1c h ARG 37 Ca 0.29 -0.21 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 1b1c h ARG 37 Cb -0.01 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 29.95 1b1c h ARG 37 CO -0.05 0.78 0.18 -0.07 -1.07 0.00 0.00 179.97 179.73 1b1c h LEU 38 N 0.52 0.90 -1.13 3.04 3.38 -0.90 -2.05 115.31 119.08 1b1c h LEU 38 Ca 0.11 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 1b1c h LEU 38 Cb 0.45 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1b1c h LEU 38 CO 0.02 0.88 0.04 0.77 0.09 0.00 0.00 178.44 180.24 1b1c h SER 39 N 0.88 0.61 -0.16 -0.43 4.64 -1.01 -2.50 113.55 115.59 1b1c h SER 39 Ca 0.20 -0.12 -0.16 0.00 -0.47 0.00 0.00 61.79 61.24 1b1c h SER 39 Cb 0.31 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1b1c h SER 39 CO -0.00 0.66 -0.49 0.11 -0.87 0.00 0.00 176.83 176.23 1b1c h LYS 40 N 0.62 0.73 -0.90 4.77 1.57 -1.27 -3.07 116.57 119.02 1b1c h LYS 40 Ca 0.13 -0.43 0.18 0.00 -1.87 0.00 0.00 60.65 58.67 1b1c h LYS 40 Cb 0.33 0.04 -0.07 0.00 0.08 0.00 0.00 32.23 32.61 1b1c h LYS 40 CO 0.01 1.05 0.59 -0.44 -0.57 0.00 0.00 179.45 180.08 1b1c h ASP 41 N 0.57 0.52 -0.94 0.86 3.32 -0.91 -2.41 116.42 117.43 1b1c h ASP 41 Ca 0.03 0.05 0.26 0.00 0.02 0.00 0.00 57.03 57.38 1b1c h ASP 41 Cb 1.05 -0.05 -0.14 0.00 0.22 0.00 0.00 39.33 40.42 1b1c h ASP 41 CO 0.10 0.22 0.43 0.00 -1.72 0.00 0.00 179.24 178.27 1b1c h ALA 42 N 1.61 1.59 0.00 3.45 0.00 -1.42 0.32 119.26 124.81 1b1c h ALA 42 Ca 0.47 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.55 1b1c h ALA 42 Cb 1.00 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1b1c h ALA 42 CO -0.21 -0.43 -0.07 1.25 0.00 0.00 0.00 179.25 179.79 1b1c h HIS 43 N 0.35 0.00 0.00 0.00 -0.00 -1.17 -0.75 115.15 113.57 1b1c h HIS 43 Ca 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.99 1b1c h HIS 43 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.69 1b1c h HIS 43 CO -0.12 0.07 0.00 0.54 -0.00 0.00 0.00 177.93 178.42 1b1c n ARG 44 N -4.39 0.17 -0.33 5.26 5.12 0.10 -2.68 116.66 119.91 1b1c n ARG 44 Ca -0.03 0.46 0.07 0.00 -1.93 0.00 0.00 57.85 56.42 1b1c n ARG 44 Cb 0.15 -1.87 0.18 0.00 -1.16 0.00 0.00 32.46 29.76 1b1c n ARG 44 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1b1c n TYR 45 N -2.20 0.22 -1.05 -1.55 4.02 -0.36 -4.96 117.16 111.27 1b1c n TYR 45 Ca 0.01 -1.17 -0.02 0.00 -0.01 0.00 0.00 57.90 56.71 1b1c n TYR 45 Cb 0.19 -0.23 -0.01 0.00 -0.02 0.00 0.00 39.34 39.27 1b1c n TYR 45 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1b1c n GLY 46 N -1.21 0.53 3.78 2.72 0.00 -1.09 -5.02 105.19 104.90 1b1c n GLY 46 Ca 0.19 -0.35 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 1b1c n GLY 46 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1b1c s MET 47 N -1.22 2.22 -0.02 1.61 -1.94 -0.78 -5.00 119.30 114.16 1b1c s MET 47 Ca 0.00 -2.40 0.01 0.00 -1.71 0.00 0.00 55.69 51.59 1b1c s MET 47 Cb 0.00 -1.56 0.02 0.00 2.01 0.00 0.00 34.83 35.29 1b1c s MET 47 CO 0.00 -0.40 -0.02 1.03 -0.01 0.00 0.00 175.02 175.62 1b1c s ARG 48 N -3.92 0.37 0.27 2.03 0.52 -1.26 -2.61 118.95 114.34 1b1c s ARG 48 Ca 0.06 -0.02 0.02 0.00 -0.52 0.00 0.00 55.73 55.27 1b1c s ARG 48 Cb 0.01 -0.46 -0.05 0.00 0.52 0.00 0.00 34.95 34.96 1b1c s ARG 48 CO 0.03 -0.06 0.07 0.20 0.02 0.00 0.00 175.30 175.57 1b1c s GLY 49 N 0.63 1.79 0.02 -3.53 0.00 -1.24 -1.27 107.32 103.72 1b1c s GLY 49 Ca -0.07 -1.90 -0.07 0.00 0.00 0.00 0.00 44.72 42.68 1b1c s GLY 49 CO -0.01 -1.66 0.14 -3.16 0.00 0.00 0.00 173.10 168.40 1b1c s MET 50 N -3.97 0.56 0.18 2.90 0.23 -0.85 -4.77 119.30 113.59 1b1c s MET 50 Ca 0.36 -0.57 0.04 0.00 -1.03 0.00 0.00 55.69 54.49 1b1c s MET 50 Cb 0.08 0.23 -0.04 0.00 -1.53 0.00 0.00 34.83 33.57 1b1c s MET 50 CO 0.13 -0.14 0.25 -1.54 -2.03 0.00 0.00 175.02 171.69 1b1c s SER 51 N -1.79 6.04 -0.02 -1.18 1.04 -1.26 -0.77 113.70 115.76 1b1c s SER 51 Ca -0.09 0.03 -0.20 0.00 0.48 0.00 0.00 55.95 56.16 1b1c s SER 51 Cb -0.04 -1.73 0.04 0.00 0.10 0.00 0.00 66.02 64.39 1b1c s SER 51 CO -0.02 0.03 0.44 0.00 0.98 0.00 0.00 173.24 174.67 1b1c s ALA 52 N -1.82 -1.12 -0.35 5.32 0.00 0.86 -4.85 121.76 119.79 1b1c s ALA 52 Ca 0.33 0.64 -0.22 0.00 0.00 0.00 0.00 51.96 52.71 1b1c s ALA 52 Cb -0.10 0.08 0.01 0.00 0.00 0.00 0.00 23.12 23.11 1b1c s ALA 52 CO 0.27 -0.32 0.75 0.34 0.00 0.00 0.00 175.76 176.80 1b1c s ASP 53 N -1.36 6.54 0.53 0.00 -1.08 -1.26 -2.16 116.67 117.89 1b1c s ASP 53 Ca -0.12 0.38 0.21 0.00 -0.52 0.00 0.00 52.55 52.50 1b1c s ASP 53 Cb -0.03 -2.38 1.37 0.00 -1.46 0.00 0.00 42.92 40.41 1b1c s ASP 53 CO 0.05 -0.67 2.09 1.55 0.52 0.00 0.00 175.17 178.72 1b1c h PRO 54 N 8.39 0.00 0.00 4.34 0.13 -1.81 -1.57 132.00 141.48 1b1c h PRO 54 Ca -0.25 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1b1c h PRO 54 Cb 1.10 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 1b1c h PRO 54 CO 0.88 0.00 -0.01 1.49 -0.23 0.00 0.00 178.00 180.13 1b1c h GLU 55 N 0.00 0.00 -0.00 0.86 4.81 -1.89 0.05 114.58 118.40 1b1c h GLU 55 Ca 0.11 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1b1c h GLU 55 Cb 0.44 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.82 1b1c h GLU 55 CO -0.00 0.01 -0.11 0.39 -0.73 0.00 0.00 179.01 178.57 1b1c n GLU 56 N -3.38 0.79 -4.60 1.92 1.02 -0.59 -4.92 120.64 110.88 1b1c n GLU 56 Ca -0.03 -0.30 -0.28 0.00 -0.02 0.00 0.00 57.16 56.53 1b1c n GLU 56 Cb 0.11 -1.49 -0.08 0.00 -0.02 0.00 0.00 31.44 29.96 1b1c n GLU 56 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1b1c s TYR 57 N -2.42 1.80 -0.33 -0.32 2.02 0.00 -4.96 117.35 113.14 1b1c s TYR 57 Ca 0.30 -1.20 -0.02 0.00 -0.37 0.00 0.00 57.07 55.78 1b1c s TYR 57 Cb 0.20 -1.29 0.07 0.00 -0.40 0.00 0.00 41.96 40.54 1b1c s TYR 57 CO 0.47 -0.15 0.06 0.34 -1.57 0.00 0.00 175.55 174.69 1b1c s ASP 58 N -3.70 4.97 0.00 2.29 -1.08 -1.26 -4.97 116.67 112.93 1b1c s ASP 58 Ca 0.17 -1.56 0.12 0.00 -0.52 0.00 0.00 52.55 50.76 1b1c s ASP 58 Cb 0.02 -1.73 0.66 0.00 -1.46 0.00 0.00 42.92 40.40 1b1c s ASP 58 CO 0.11 -0.35 1.20 0.18 0.52 0.00 0.00 175.17 176.83 1b1c n LEU 59 N 4.58 0.00 0.27 -1.34 4.32 -1.26 -1.30 117.00 122.26 1b1c n LEU 59 Ca -0.09 0.12 0.14 0.00 -0.02 0.00 0.00 56.01 56.16 1b1c n LEU 59 Cb 0.43 -0.12 0.74 0.00 -1.62 0.00 0.00 43.42 42.85 1b1c n LEU 59 CO 0.28 -0.07 0.98 0.00 -1.22 0.00 0.00 177.39 177.35 1b1c h ALA 60 N 2.66 1.23 0.00 -1.18 0.00 -2.01 -1.29 119.26 118.67 1b1c h ALA 60 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1b1c h ALA 60 Cb 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1b1c h ALA 60 CO 0.00 0.14 0.00 -0.25 0.00 0.00 0.00 179.25 179.14 1b1c n ASP 61 N -3.55 0.00 0.02 0.00 8.00 -0.42 -2.77 116.55 117.84 1b1c n ASP 61 Ca -0.02 0.22 0.19 0.00 0.71 0.00 0.00 54.79 55.90 1b1c n ASP 61 Cb 0.24 -0.33 0.69 0.00 -0.02 0.00 0.00 41.12 41.71 1b1c n ASP 61 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1b1c h LEU 62 N 0.00 0.00 -1.50 0.64 3.38 -1.47 0.36 115.31 116.72 1b1c h LEU 62 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1b1c h LEU 62 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1b1c h LEU 62 CO 0.00 0.00 0.00 0.77 0.09 0.00 0.00 178.44 179.30 1b1c h SER 63 N 0.00 0.00 0.57 -0.43 4.64 -1.77 -2.13 113.55 114.42 1b1c h SER 63 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1b1c h SER 63 Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 1b1c h SER 63 CO -0.00 0.00 -0.48 -1.20 -0.87 0.00 0.00 176.83 174.28 1b1c n SER 64 N -2.81 0.48 -0.33 4.97 7.64 0.11 -4.27 113.62 119.41 1b1c n SER 64 Ca 0.00 -0.16 0.11 0.00 1.01 0.00 0.00 58.87 59.84 1b1c n SER 64 Cb 0.23 0.19 0.31 0.00 -1.01 0.00 0.00 64.21 63.94 1b1c n SER 64 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1b1c h LEU 65 N 0.00 0.79 0.00 -3.43 5.85 -1.39 -1.92 115.31 115.21 1b1c h LEU 65 Ca 0.00 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1b1c h LEU 65 Cb 0.53 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.47 1b1c h LEU 65 CO 0.00 0.36 0.00 -2.65 -0.34 0.00 0.00 178.44 175.81 1b1c n PRO 66 N -4.65 0.02 0.18 5.25 -0.02 -1.26 -1.37 135.00 133.14 1b1c n PRO 66 Ca 0.20 0.16 0.05 0.00 -2.02 0.00 0.00 63.50 61.89 1b1c n PRO 66 Cb 0.48 -1.50 0.27 0.00 -0.02 0.00 0.00 33.50 32.73 1b1c n PRO 66 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1b1c h GLU 67 N 0.00 0.00 -5.52 -0.52 5.08 -1.67 -3.43 114.58 108.51 1b1c h GLU 67 Ca 0.00 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.77 1b1c h GLU 67 Cb 0.00 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.15 1b1c h GLU 67 CO 0.00 0.41 -0.16 0.42 -1.00 0.00 0.00 179.01 178.68 1b1c s ILE 68 N -3.45 5.18 0.32 3.13 1.01 -0.47 -5.06 121.20 121.86 1b1c s ILE 68 Ca 0.01 0.81 -0.29 0.00 0.00 0.00 0.00 60.65 61.18 1b1c s ILE 68 Cb 0.10 -3.77 -0.10 0.00 0.01 0.00 0.00 42.46 38.70 1b1c s ILE 68 CO 0.70 0.26 1.34 -1.81 0.00 0.00 0.00 174.94 175.43 1b1c s ASP 69 N 0.94 6.72 -1.37 3.58 1.11 -1.26 -2.89 116.67 123.50 1b1c s ASP 69 Ca 0.21 2.71 -0.06 0.00 0.18 0.00 0.00 52.55 55.59 1b1c s ASP 69 Cb -0.15 -2.65 0.04 0.00 1.07 0.00 0.00 42.92 41.23 1b1c s ASP 69 CO 0.08 -0.59 0.47 0.59 1.18 0.00 0.00 175.17 176.90 1b1c n ASN 70 N 1.05 -4.65 -4.77 0.27 3.02 -1.26 -4.87 115.26 104.05 1b1c n ASN 70 Ca 0.01 -0.28 -0.39 0.00 -0.03 0.00 0.00 54.58 53.89 1b1c n ASN 70 Cb 0.41 -3.82 -0.03 0.00 -0.61 0.00 0.00 39.78 35.74 1b1c n ASN 70 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1b1c s ALA 71 N -2.99 3.26 -0.10 5.41 0.00 -1.14 -4.73 121.76 121.47 1b1c s ALA 71 Ca 0.31 0.97 -0.07 0.00 0.00 0.00 0.00 51.96 53.17 1b1c s ALA 71 Cb -0.16 -3.37 0.04 0.00 0.00 0.00 0.00 23.12 19.63 1b1c s ALA 71 CO 0.39 -0.43 0.26 -1.17 0.00 0.00 0.00 175.76 174.80 1b1c s LEU 72 N -2.15 0.67 -0.12 0.00 2.96 -0.49 -4.50 118.68 115.04 1b1c s LEU 72 Ca 0.53 0.54 0.02 0.00 -0.22 0.00 0.00 54.13 55.00 1b1c s LEU 72 Cb -0.32 0.83 -0.00 0.00 0.50 0.00 0.00 46.19 47.20 1b1c s LEU 72 CO 0.40 -0.13 -0.19 0.54 -1.32 0.00 0.00 176.35 175.65 1b1c s VAL 73 N 0.76 2.49 -0.04 1.68 0.11 -0.65 -2.03 120.40 122.72 1b1c s VAL 73 Ca -0.05 -0.86 0.07 0.00 -2.93 0.00 0.00 61.98 58.21 1b1c s VAL 73 Cb -0.06 -2.00 -0.02 0.00 -1.53 0.00 0.00 36.38 32.77 1b1c s VAL 73 CO -0.05 0.54 -0.24 -0.69 -3.33 0.00 0.00 175.10 171.33 1b1c s VAL 74 N 0.43 2.18 -0.16 2.04 1.01 -0.34 -2.14 120.40 123.42 1b1c s VAL 74 Ca -0.14 -1.05 0.01 0.00 0.00 0.00 0.00 61.98 60.80 1b1c s VAL 74 Cb -0.17 -1.77 0.01 0.00 0.00 0.00 0.00 36.38 34.44 1b1c s VAL 74 CO 0.06 0.58 -0.17 -0.36 0.00 0.00 0.00 175.10 175.21 1b1c s PHE 75 N -0.48 2.77 -0.41 5.22 0.08 -0.55 -0.63 117.98 123.99 1b1c s PHE 75 Ca 0.06 -1.25 -0.04 0.00 0.12 0.00 0.00 56.93 55.82 1b1c s PHE 75 Cb -0.11 -1.90 0.10 0.00 -0.57 0.00 0.00 43.02 40.54 1b1c s PHE 75 CO 0.01 -0.59 0.20 0.00 -0.10 0.00 0.00 175.22 174.74 1b1c s MET 77 N 1.20 2.80 0.33 0.00 1.00 -0.36 -0.93 119.30 123.34 1b1c s MET 77 Ca 0.06 -0.78 -0.07 0.00 0.00 0.00 0.00 55.69 54.90 1b1c s MET 77 Cb -0.23 -2.25 -0.06 0.00 0.00 0.00 0.00 34.83 32.29 1b1c s MET 77 CO -0.03 0.01 0.64 0.00 0.00 0.00 0.00 175.02 175.64 1b1c s ALA 78 N 0.76 3.51 -0.12 3.03 0.00 -0.46 -0.85 121.76 127.63 1b1c s ALA 78 Ca -0.09 -0.40 0.01 0.00 0.00 0.00 0.00 51.96 51.48 1b1c s ALA 78 Cb -0.16 -2.47 -0.01 0.00 0.00 0.00 0.00 23.12 20.48 1b1c s ALA 78 CO 0.00 0.17 -0.15 0.99 0.00 0.00 0.00 175.76 176.77 1b1c s THR 79 N -2.17 2.85 0.00 0.00 2.01 -0.79 -4.09 115.64 113.44 1b1c s THR 79 Ca 0.47 -0.74 0.00 0.00 0.31 0.00 0.00 61.69 61.73 1b1c s THR 79 Cb -0.11 -2.18 0.00 0.00 0.01 0.00 0.00 72.50 70.23 1b1c s THR 79 CO 0.30 0.53 0.00 -1.22 -0.69 0.00 0.00 174.62 173.54 1b1c n TYR 80 N 3.48 0.00 0.00 4.92 4.02 0.02 -4.88 117.16 124.72 1b1c n TYR 80 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.71 1b1c n TYR 80 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.85 1b1c n TYR 80 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1b1c n GLY 81 N 4.51 1.08 2.27 2.72 0.00 -1.26 -0.84 105.19 113.66 1b1c n GLY 81 Ca 0.00 0.12 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 1b1c n GLY 81 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b1c n GLU 82 N 6.80 2.26 -1.11 1.61 -0.58 -1.26 -4.56 120.64 123.81 1b1c n GLU 82 Ca 0.00 -2.35 0.00 0.00 -0.42 0.00 0.00 57.16 54.39 1b1c n GLU 82 Cb 0.00 -1.98 0.00 0.00 -0.57 0.00 0.00 31.44 28.89 1b1c n GLU 82 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1b1c n GLY 83 N 0.16 0.64 3.89 0.62 0.00 -0.35 -4.95 105.19 105.20 1b1c n GLY 83 Ca 0.45 -0.76 -0.29 0.00 0.00 0.00 0.00 46.02 45.42 1b1c n GLY 83 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1b1c s ASP 84 N -2.76 6.25 0.85 1.61 1.01 -0.02 -4.41 116.67 119.21 1b1c s ASP 84 Ca 0.00 1.09 -0.12 0.00 0.71 0.00 0.00 52.55 54.23 1b1c s ASP 84 Cb 0.00 -2.32 0.11 0.00 1.01 0.00 0.00 42.92 41.71 1b1c s ASP 84 CO 0.00 -0.67 1.18 -2.16 0.21 0.00 0.00 175.17 173.72 1b1c s PRO 85 N -4.88 1.60 0.79 8.23 0.04 -1.26 -0.80 135.00 138.71 1b1c s PRO 85 Ca 0.50 0.11 -0.11 0.00 0.04 0.00 0.00 61.00 61.54 1b1c s PRO 85 Cb -0.11 -1.91 0.06 0.00 0.04 0.00 0.00 34.50 32.59 1b1c s PRO 85 CO 0.48 -1.85 1.09 0.95 0.04 0.00 0.00 177.00 177.71 1b1c s THR 86 N -3.52 3.29 0.25 1.26 -4.23 -1.26 -4.59 115.64 106.84 1b1c s THR 86 Ca 0.64 0.42 -0.04 0.00 -1.18 0.00 0.00 61.69 61.52 1b1c s THR 86 Cb -0.11 -3.07 0.22 0.00 1.34 0.00 0.00 72.50 70.88 1b1c s THR 86 CO 0.51 -0.55 1.81 0.44 -0.54 0.00 0.00 174.62 176.29 1b1c h ASP 87 N -1.09 0.69 0.56 3.99 3.32 -1.96 -1.58 116.42 120.35 1b1c h ASP 87 Ca -0.46 0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.64 1b1c h ASP 87 Cb 1.25 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.72 1b1c h ASP 87 CO 0.56 0.39 0.00 -0.46 -1.72 0.00 0.00 179.24 178.01 1b1c n ASN 88 N -4.74 0.01 -0.62 6.45 6.94 -1.26 -2.62 115.26 119.41 1b1c n ASN 88 Ca 0.14 0.50 0.05 0.00 -0.02 0.00 0.00 54.58 55.26 1b1c n ASN 88 Cb 0.28 -0.50 0.15 0.00 -2.36 0.00 0.00 39.78 37.35 1b1c n ASN 88 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1b1c n ALA 89 N -1.50 2.19 -0.07 -2.53 0.00 -0.61 -3.03 120.51 114.96 1b1c n ALA 89 Ca 0.04 -1.12 -0.12 0.00 0.00 0.00 0.00 53.44 52.24 1b1c n ALA 89 Cb 0.19 -0.43 -0.05 0.00 0.00 0.00 0.00 19.45 19.16 1b1c n ALA 89 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1b1c h GLN 90 N 2.01 0.41 -0.80 0.00 5.75 -1.35 0.00 115.11 121.12 1b1c h GLN 90 Ca 0.00 -0.15 0.03 0.00 -0.15 0.00 0.00 58.65 58.37 1b1c h GLN 90 Cb 0.72 -0.02 -0.05 0.00 1.07 0.00 0.00 27.48 29.20 1b1c h GLN 90 CO 0.00 0.65 0.52 -0.44 -2.65 0.00 0.00 178.83 176.91 1b1c h ASP 91 N 0.14 0.86 -0.37 -0.69 3.32 -1.82 0.15 116.42 118.01 1b1c h ASP 91 Ca 0.05 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.05 1b1c h ASP 91 Cb 0.50 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 1b1c h ASP 91 CO 0.02 0.60 0.07 0.15 -1.72 0.00 0.00 179.24 178.36 1b1c h PHE 92 N 1.02 0.65 -0.25 4.55 3.57 -1.84 -0.96 116.94 123.68 1b1c h PHE 92 Ca 0.32 -0.09 0.01 0.00 3.53 0.00 0.00 57.97 61.74 1b1c h PHE 92 Cb -0.02 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.52 1b1c h PHE 92 CO -0.03 0.66 0.13 -0.92 -2.23 0.00 0.00 178.31 175.92 1b1c h TYR 93 N 0.46 0.24 -0.23 0.41 3.20 -0.35 0.09 116.97 120.79 1b1c h TYR 93 Ca 0.11 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.02 1b1c h TYR 93 Cb 0.35 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 1b1c h TYR 93 CO 0.02 0.14 0.08 -0.44 -1.64 0.00 0.00 178.16 176.32 1b1c h ASP 94 N 0.28 0.09 -0.32 -2.11 3.32 -0.85 -2.53 116.42 114.29 1b1c h ASP 94 Ca 0.10 0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.20 1b1c h ASP 94 Cb 0.02 0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.56 1b1c h ASP 94 CO -0.06 0.08 0.16 -0.25 -1.72 0.00 0.00 179.24 177.45 1b1c h TRP 95 N 0.19 0.30 -0.73 4.55 7.01 -0.86 -2.62 115.95 123.78 1b1c h TRP 95 Ca 0.10 0.01 0.11 0.00 2.11 0.00 0.00 58.89 61.23 1b1c h TRP 95 Cb 0.07 -0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 26.99 1b1c h TRP 95 CO -0.12 0.17 0.48 -0.07 -2.79 0.00 0.00 178.44 176.11 1b1c h LEU 96 N 0.34 0.51 -0.42 0.65 3.38 -0.63 -0.72 115.31 118.41 1b1c h LEU 96 Ca 0.13 0.02 -0.18 0.00 0.09 0.00 0.00 57.88 57.94 1b1c h LEU 96 Cb 0.04 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 1b1c h LEU 96 CO -0.09 0.29 -0.68 1.56 0.09 0.00 0.00 178.44 179.62 1b1c h GLN 97 N 0.55 0.48 0.00 1.13 4.20 -1.09 -3.34 115.11 117.04 1b1c h GLN 97 Ca 0.35 -0.36 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1b1c h GLN 97 Cb 0.59 0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.44 1b1c h GLN 97 CO -0.12 0.99 -1.58 -0.85 -0.67 0.00 0.00 178.83 176.59 1b1c n GLU 98 N -3.88 0.54 -1.98 1.46 0.28 -0.96 -5.00 120.64 111.10 1b1c n GLU 98 Ca -0.04 -0.09 -0.33 0.00 -0.16 0.00 0.00 57.16 56.54 1b1c n GLU 98 Cb 0.68 -1.59 0.02 0.00 1.43 0.00 0.00 31.44 31.98 1b1c n GLU 98 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 177.13 176.89 1b1c s THR 99 N -3.40 3.62 -0.00 3.84 -1.32 -0.32 -4.96 115.64 113.09 1b1c s THR 99 Ca -0.04 0.78 0.00 0.00 -1.21 0.00 0.00 61.69 61.22 1b1c s THR 99 Cb 0.13 -3.30 0.00 0.00 -1.51 0.00 0.00 72.50 67.83 1b1c s THR 99 CO 0.87 -0.44 0.71 -0.67 -2.21 0.00 0.00 174.62 172.87 1b1c n ASP 100 N -2.09 0.82 -4.65 8.08 -0.08 -1.26 -5.01 116.55 112.36 1b1c n ASP 100 Ca 0.09 -1.42 -0.38 0.00 -1.51 0.00 0.00 54.79 51.57 1b1c n ASP 100 Cb 0.52 -0.00 0.05 0.00 2.34 0.00 0.00 41.12 44.03 1b1c n ASP 100 CO 0.00 0.00 0.00 1.33 0.12 0.00 0.00 177.20 178.65 1b1c n VAL 101 N -0.21 3.91 -3.09 5.18 0.24 -1.26 -4.95 118.33 118.15 1b1c n VAL 101 Ca 0.00 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.34 61.39 1b1c n VAL 101 Cb 0.40 -1.25 -0.06 0.00 -1.47 0.00 0.00 33.84 31.46 1b1c n VAL 101 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1b1c s ASP 102 N -1.23 6.58 -0.40 -1.34 2.15 -1.26 -4.82 116.67 116.35 1b1c s ASP 102 Ca 0.76 0.69 0.06 0.00 0.43 0.00 0.00 52.55 54.49 1b1c s ASP 102 Cb -0.41 -2.34 0.65 0.00 -0.30 0.00 0.00 42.92 40.51 1b1c s ASP 102 CO 0.46 -0.40 1.81 0.18 -0.17 0.00 0.00 175.17 177.05 1b1c n LEU 103 N 5.77 6.13 -4.77 -1.34 4.77 0.37 -4.87 117.00 123.06 1b1c n LEU 103 Ca -0.00 -3.59 -0.41 0.00 -0.03 0.00 0.00 56.01 51.97 1b1c n LEU 103 Cb 0.49 -0.79 -0.01 0.00 -2.33 0.00 0.00 43.42 40.79 1b1c n LEU 103 CO 0.44 1.06 1.17 -0.44 -1.33 0.00 0.00 177.39 178.28 1b1c s SER 104 N -1.52 6.35 0.00 -1.43 0.01 -1.23 -2.09 113.70 113.79 1b1c s SER 104 Ca 0.54 3.03 0.00 0.00 1.31 0.00 0.00 55.95 60.83 1b1c s SER 104 Cb 0.46 -2.66 0.00 0.00 0.21 0.00 0.00 66.02 64.03 1b1c s SER 104 CO 0.09 -0.89 0.00 0.61 0.41 0.00 0.00 173.24 173.47 1b1c n GLY 105 N 0.89 2.79 3.77 3.44 0.00 -1.26 -4.94 105.19 109.88 1b1c n GLY 105 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 1b1c n GLY 105 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1b1c s VAL 106 N -2.49 4.44 -0.10 1.61 1.01 -0.89 -4.67 120.40 119.31 1b1c s VAL 106 Ca 0.00 1.71 0.04 0.00 0.00 0.00 0.00 61.98 63.73 1b1c s VAL 106 Cb 0.00 -4.15 -0.00 0.00 0.00 0.00 0.00 36.38 32.23 1b1c s VAL 106 CO 0.00 0.48 -0.23 -0.54 0.00 0.00 0.00 175.10 174.82 1b1c s LYS 107 N -0.89 3.02 0.17 2.72 1.02 -1.26 -0.27 119.74 124.24 1b1c s LYS 107 Ca 0.37 -0.86 -0.02 0.00 0.02 0.00 0.00 55.97 55.47 1b1c s LYS 107 Cb -0.23 -2.32 -0.04 0.00 -0.52 0.00 0.00 37.83 34.73 1b1c s LYS 107 CO 0.26 0.21 0.13 -0.59 -0.92 0.00 0.00 175.35 174.45 1b1c s PHE 108 N 0.26 0.93 -0.06 3.18 -0.71 -0.16 -1.64 117.98 119.78 1b1c s PHE 108 Ca -0.16 -1.23 -0.14 0.00 -1.04 0.00 0.00 56.93 54.36 1b1c s PHE 108 Cb -0.17 -0.44 0.03 0.00 -1.21 0.00 0.00 43.02 41.23 1b1c s PHE 108 CO 0.08 -0.62 0.34 0.00 -1.34 0.00 0.00 175.22 173.68 1b1c s ALA 109 N -4.09 -0.85 -0.03 1.99 0.00 -0.91 -0.46 121.76 117.41 1b1c s ALA 109 Ca 0.30 0.61 0.03 0.00 0.00 0.00 0.00 51.96 52.90 1b1c s ALA 109 Cb 0.06 -0.17 0.00 0.00 0.00 0.00 0.00 23.12 23.01 1b1c s ALA 109 CO 0.07 -0.23 -0.12 0.08 0.00 0.00 0.00 175.76 175.55 1b1c s VAL 110 N -0.76 1.06 -0.20 0.00 1.01 -1.26 -1.48 120.40 118.77 1b1c s VAL 110 Ca -0.08 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.40 1b1c s VAL 110 Cb -0.04 -0.93 0.04 0.00 0.00 0.00 0.00 36.38 35.45 1b1c s VAL 110 CO 0.03 0.32 -0.14 0.12 0.00 0.00 0.00 175.10 175.43 1b1c s PHE 111 N 0.15 2.69 -0.10 5.22 5.36 0.60 -1.35 117.98 130.55 1b1c s PHE 111 Ca -0.04 -1.73 -0.10 0.00 -0.96 0.00 0.00 56.93 54.11 1b1c s PHE 111 Cb -0.10 -1.79 -0.05 0.00 -0.34 0.00 0.00 43.02 40.74 1b1c s PHE 111 CO 0.01 -0.79 0.23 0.20 -1.46 0.00 0.00 175.22 173.42 1b1c s GLY 112 N 1.31 2.24 -0.25 13.12 0.00 0.59 -1.23 107.32 123.10 1b1c s GLY 112 Ca -0.00 -0.51 -0.08 0.00 0.00 0.00 0.00 44.72 44.13 1b1c s GLY 112 CO -0.09 -0.10 0.09 1.08 0.00 0.00 0.00 173.10 174.07 1b1c s LEU 113 N -0.77 3.56 0.00 0.66 1.02 -0.03 -0.43 118.68 122.69 1b1c s LEU 113 Ca 0.17 -0.16 0.00 0.00 0.02 0.00 0.00 54.13 54.16 1b1c s LEU 113 Cb -0.13 -1.96 0.00 0.00 0.02 0.00 0.00 46.19 44.12 1b1c s LEU 113 CO 0.06 -0.03 0.00 0.61 0.02 0.00 0.00 176.35 177.01 1b1c n GLY 114 N 4.91 4.32 3.23 -3.19 0.00 -0.68 -1.89 105.19 111.89 1b1c n GLY 114 Ca -0.16 -1.19 -0.04 0.00 0.00 0.00 0.00 46.02 44.64 1b1c n GLY 114 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1b1c s ASN 115 N 1.25 -0.63 0.00 1.61 3.84 -1.26 -0.13 114.94 119.62 1b1c s ASN 115 Ca 0.00 0.89 0.00 0.00 0.21 0.00 0.00 52.86 53.96 1b1c s ASN 115 Cb 0.00 1.72 0.00 0.00 -0.55 0.00 0.00 41.25 42.42 1b1c s ASN 115 CO 0.00 -0.25 0.79 2.29 -2.79 0.00 0.00 177.10 177.14 1b1c n LYS 116 N 5.41 0.00 0.09 0.43 2.85 -1.26 -2.19 118.16 123.49 1b1c n LYS 116 Ca -0.06 0.30 0.13 0.00 -1.05 0.00 0.00 58.31 57.63 1b1c n LYS 116 Cb 0.50 -1.52 0.29 0.00 -0.65 0.00 0.00 35.03 33.65 1b1c n LYS 116 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 1b1c h THR 117 N 0.00 0.00 -3.62 0.58 1.35 -2.00 -3.46 112.91 105.77 1b1c h THR 117 Ca 0.00 -0.53 -0.51 0.00 -0.55 0.00 0.00 66.41 64.82 1b1c h THR 117 Cb 0.04 1.35 -0.02 0.00 -1.73 0.00 0.00 68.15 67.79 1b1c h THR 117 CO 0.00 0.00 0.03 -0.31 -0.25 0.00 0.00 175.52 174.99 1b1c s TYR 118 N -3.14 3.41 0.23 4.73 2.02 -0.93 -5.00 117.35 118.67 1b1c s TYR 118 Ca 0.08 1.07 -0.05 0.00 -0.37 0.00 0.00 57.07 57.79 1b1c s TYR 118 Cb 0.12 -2.42 0.22 0.00 -0.40 0.00 0.00 41.96 39.48 1b1c s TYR 118 CO 0.66 0.11 1.74 1.49 -1.57 0.00 0.00 175.55 177.98 1b1c h GLU 119 N 2.14 1.00 -3.15 -0.62 4.81 -1.89 -3.28 114.58 113.58 1b1c h GLU 119 Ca -0.47 -0.25 -0.78 0.00 -0.13 0.00 0.00 59.36 57.73 1b1c h GLU 119 Cb 1.18 -0.13 -0.21 0.00 0.63 0.00 0.00 28.75 30.22 1b1c h GLU 119 CO 0.66 0.91 1.49 0.72 -0.73 0.00 0.00 179.01 182.06 1b1c n HIS 120 N -4.23 2.59 -2.03 0.92 8.25 -1.26 -4.99 115.22 114.47 1b1c n HIS 120 Ca 0.04 -2.68 -0.43 0.00 -0.26 0.00 0.00 57.72 54.39 1b1c n HIS 120 Cb 0.27 -1.62 -0.03 0.00 1.12 0.00 0.00 29.99 29.74 1b1c n HIS 120 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1b1c s PHE 121 N -1.23 1.97 -1.40 4.41 5.36 -1.24 -3.23 117.98 122.61 1b1c s PHE 121 Ca 0.37 0.42 -0.03 0.00 -0.96 0.00 0.00 56.93 56.73 1b1c s PHE 121 Cb 0.08 -3.98 0.02 0.00 -0.34 0.00 0.00 43.02 38.81 1b1c s PHE 121 CO 0.04 -3.34 0.28 0.09 -1.46 0.00 0.00 175.22 170.84 1b1c n ASN 122 N 8.39 -4.90 -0.23 6.13 3.02 -1.26 -4.87 115.26 121.53 1b1c n ASN 122 Ca 0.19 -0.12 0.02 0.00 -0.03 0.00 0.00 54.58 54.65 1b1c n ASN 122 Cb 0.44 -4.06 0.14 0.00 -0.61 0.00 0.00 39.78 35.70 1b1c n ASN 122 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1b1c h ALA 123 N 1.00 0.91 -0.13 5.41 0.00 -1.86 -0.87 119.26 123.72 1b1c h ALA 123 Ca -0.43 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1b1c h ALA 123 Cb 1.31 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 1b1c h ALA 123 CO 0.50 -0.19 0.06 1.98 0.00 0.00 0.00 179.25 181.60 1b1c h MET 124 N 0.43 0.19 -0.60 0.00 1.85 -1.87 -0.87 114.93 114.07 1b1c h MET 124 Ca 0.36 -0.03 -0.01 0.00 -0.61 0.00 0.00 59.70 59.40 1b1c h MET 124 Cb 0.49 -0.03 -0.03 0.00 0.43 0.00 0.00 31.60 32.46 1b1c h MET 124 CO -0.35 0.26 0.32 0.78 -0.40 0.00 0.00 176.91 177.52 1b1c h GLY 125 N 0.08 0.90 1.04 1.39 0.00 -1.67 -1.62 103.07 103.20 1b1c h GLY 125 Ca 0.05 -0.42 -0.05 0.00 0.00 0.00 0.00 47.33 46.91 1b1c h GLY 125 CO -0.01 0.40 0.28 0.50 0.00 0.00 0.00 176.54 177.72 1b1c h LYS 126 N 0.82 1.13 0.18 4.80 1.57 -1.01 -2.38 116.57 121.67 1b1c h LYS 126 Ca 0.21 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1b1c h LYS 126 Cb 0.06 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.20 1b1c h LYS 126 CO -0.03 0.93 -0.09 -0.92 -0.57 0.00 0.00 179.45 178.77 1b1c h TYR 127 N 1.08 -0.23 -0.72 -1.35 3.20 -0.87 -1.82 116.97 116.26 1b1c h TYR 127 Ca 0.25 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.18 1b1c h TYR 127 Cb 0.23 0.07 -0.06 0.00 1.54 0.00 0.00 36.73 38.52 1b1c h TYR 127 CO 0.02 0.04 0.40 0.28 -1.64 0.00 0.00 178.16 177.26 1b1c h VAL 128 N -0.48 0.94 -0.42 1.81 2.07 -1.29 0.98 116.25 119.87 1b1c h VAL 128 Ca -0.02 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1b1c h VAL 128 Cb 0.37 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 1b1c h VAL 128 CO 0.04 0.13 0.24 -0.78 0.02 0.00 0.00 177.57 177.22 1b1c h ASP 129 N 0.72 0.52 -0.11 0.57 3.58 -1.38 -1.80 116.42 118.52 1b1c h ASP 129 Ca 0.33 -0.08 -0.04 0.00 0.42 0.00 0.00 57.03 57.66 1b1c h ASP 129 Cb 0.25 -0.13 -0.00 0.00 1.72 0.00 0.00 39.33 41.16 1b1c h ASP 129 CO -0.21 0.45 -0.07 0.50 -2.88 0.00 0.00 179.24 177.03 1b1c h LYS 130 N 0.55 0.25 -0.60 0.28 3.64 -0.85 -3.22 116.57 116.61 1b1c h LYS 130 Ca 0.15 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.38 1b1c h LYS 130 Cb 0.04 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 1b1c h LYS 130 CO -0.02 0.62 0.24 -0.09 -2.27 0.00 0.00 179.45 177.93 1b1c h ARG 131 N -0.12 0.90 -0.87 1.90 9.65 -0.78 -1.83 114.38 123.22 1b1c h ARG 131 Ca 0.02 -0.16 -0.02 0.00 -1.10 0.00 0.00 59.98 58.72 1b1c h ARG 131 Cb 0.56 -0.15 -0.04 0.00 -1.39 0.00 0.00 29.97 28.95 1b1c h ARG 131 CO 0.02 0.76 0.47 -0.07 2.80 0.00 0.00 179.97 183.96 1b1c h LEU 132 N 0.84 1.09 -0.63 3.80 3.38 -1.42 -0.71 115.31 121.66 1b1c h LEU 132 Ca 0.20 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 57.95 1b1c h LEU 132 Cb 0.20 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1b1c h LEU 132 CO -0.02 0.88 -0.20 -0.08 0.09 0.00 0.00 178.44 179.12 1b1c h GLU 133 N 1.22 0.87 -0.54 1.13 4.81 -1.53 -1.42 114.58 119.13 1b1c h GLU 133 Ca 0.31 -0.35 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1b1c h GLU 133 Cb 0.04 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 1b1c h GLU 133 CO -0.05 0.99 0.20 1.96 -0.73 0.00 0.00 179.01 181.38 1b1c h GLN 134 N 0.76 0.78 0.00 1.92 4.20 -0.66 -2.22 115.11 119.89 1b1c h GLN 134 Ca 0.11 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1b1c h GLN 134 Cb 0.73 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.38 1b1c h GLN 134 CO 0.06 0.66 0.00 1.28 -0.67 0.00 0.00 178.83 180.16 1b1c n LEU 135 N -4.32 0.00 0.00 1.46 4.77 -0.33 -4.89 117.00 113.68 1b1c n LEU 135 Ca 0.04 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1b1c n LEU 135 Cb 0.17 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1b1c n LEU 135 CO 0.39 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1b1c n GLY 136 N 0.92 0.82 3.82 -0.72 0.00 -0.84 -0.48 105.19 108.72 1b1c n GLY 136 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 1b1c n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b1c s ALA 137 N -2.00 2.66 -0.22 4.61 0.00 -0.56 -3.52 121.76 122.73 1b1c s ALA 137 Ca 0.00 0.01 -0.06 0.00 0.00 0.00 0.00 51.96 51.91 1b1c s ALA 137 Cb 0.00 -3.15 -0.02 0.00 0.00 0.00 0.00 23.12 19.95 1b1c s ALA 137 CO 0.00 -1.25 0.02 -1.14 0.00 0.00 0.00 175.76 173.39 1b1c s GLN 138 N -5.08 3.59 -0.13 0.00 0.74 0.62 -4.40 119.66 115.00 1b1c s GLN 138 Ca 0.58 -0.52 -0.29 0.00 0.05 0.00 0.00 55.36 55.18 1b1c s GLN 138 Cb -0.14 -3.15 -0.01 0.00 1.10 0.00 0.00 33.01 30.82 1b1c s GLN 138 CO 0.55 -0.08 1.06 0.50 -0.55 0.00 0.00 175.29 176.76 1b1c s ARG 139 N 1.26 4.36 0.06 1.67 3.52 -1.26 -0.99 118.95 127.57 1b1c s ARG 139 Ca 0.04 1.44 0.22 0.00 -0.13 0.00 0.00 55.73 57.30 1b1c s ARG 139 Cb -0.15 -3.58 -0.08 0.00 -1.56 0.00 0.00 34.95 29.58 1b1c s ARG 139 CO 0.01 -0.44 0.88 0.44 -0.81 0.00 0.00 175.30 175.39 1b1c n ILE 140 N 4.80 0.20 -3.77 4.11 -6.64 0.39 -4.89 119.36 113.56 1b1c n ILE 140 Ca 0.10 -0.35 -0.13 0.00 -1.77 0.00 0.00 62.75 60.60 1b1c n ILE 140 Cb 0.47 0.10 -0.10 0.00 -1.44 0.00 0.00 39.64 38.68 1b1c n ILE 140 CO 0.00 0.00 0.00 0.12 -1.77 0.00 0.00 176.55 174.90 1b1c s PHE 141 N -3.30 -0.24 0.68 4.28 5.36 -1.26 -4.86 117.98 118.64 1b1c s PHE 141 Ca 0.00 0.52 -0.17 0.00 -0.96 0.00 0.00 56.93 56.32 1b1c s PHE 141 Cb 0.13 0.10 -0.03 0.00 -0.34 0.00 0.00 43.02 42.88 1b1c s PHE 141 CO 0.83 -0.27 0.74 -0.85 -1.46 0.00 0.00 175.22 174.21 1b1c n GLU 142 N 2.09 0.49 -2.01 10.12 0.28 -1.26 -4.51 120.64 125.83 1b1c n GLU 142 Ca -0.17 0.21 -0.42 0.00 -0.16 0.00 0.00 57.16 56.62 1b1c n GLU 142 Cb 0.57 -1.99 -0.03 0.00 1.43 0.00 0.00 31.44 31.42 1b1c n GLU 142 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 1b1c s LEU 143 N -1.31 4.37 -0.10 -1.84 0.20 -1.26 -4.66 118.68 114.08 1b1c s LEU 143 Ca 0.70 2.48 -0.16 0.00 0.69 0.00 0.00 54.13 57.84 1b1c s LEU 143 Cb -0.37 -3.58 -0.05 0.00 -0.43 0.00 0.00 46.19 41.76 1b1c s LEU 143 CO 0.53 -0.78 0.42 -0.83 -0.29 0.00 0.00 176.35 175.40 1b1c s GLY 144 N 1.44 2.37 -0.65 7.98 0.00 -0.46 -4.99 107.32 113.01 1b1c s GLY 144 Ca 0.69 -0.25 0.01 0.00 0.00 0.00 0.00 44.72 45.17 1b1c s GLY 144 CO 0.31 0.55 0.44 1.08 0.00 0.00 0.00 173.10 175.48 1b1c s LEU 145 N 0.18 4.90 0.29 0.66 1.43 -1.26 -0.30 118.68 124.57 1b1c s LEU 145 Ca 0.23 -3.25 -0.29 0.00 -1.03 0.00 0.00 54.13 49.79 1b1c s LEU 145 Cb -0.15 -1.75 -0.10 0.00 0.03 0.00 0.00 46.19 44.23 1b1c s LEU 145 CO 0.10 -0.24 1.11 -0.83 0.23 0.00 0.00 176.35 176.72 1b1c s GLY 146 N -0.21 3.05 -0.31 -3.19 0.00 0.43 -4.98 107.32 102.12 1b1c s GLY 146 Ca 0.20 0.92 0.04 0.00 0.00 0.00 0.00 44.72 45.87 1b1c s GLY 146 CO -0.06 1.52 -0.01 -0.35 0.00 0.00 0.00 173.10 174.19 1b1c s ASP 147 N -0.88 4.64 0.00 1.64 2.15 -1.26 -1.69 116.67 121.26 1b1c s ASP 147 Ca 0.45 -1.86 0.15 0.00 0.43 0.00 0.00 52.55 51.72 1b1c s ASP 147 Cb -0.32 -1.59 0.71 0.00 -0.30 0.00 0.00 42.92 41.42 1b1c s ASP 147 CO 0.41 -0.31 1.43 -0.67 -0.17 0.00 0.00 175.17 175.87 1b1c n ASP 148 N 4.32 0.00 0.14 -0.34 2.03 0.82 -1.88 116.55 121.65 1b1c n ASP 148 Ca -0.03 0.22 0.05 0.00 0.52 0.00 0.00 54.79 55.55 1b1c n ASP 148 Cb 0.42 -0.36 0.05 0.00 -0.72 0.00 0.00 41.12 40.51 1b1c n ASP 148 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 1b1c h ASP 149 N 0.00 0.00 0.00 1.67 3.58 -1.93 -3.45 116.42 116.30 1b1c h ASP 149 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1b1c h ASP 149 Cb 0.18 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.23 1b1c h ASP 149 CO 0.00 0.33 0.00 0.61 -2.88 0.00 0.00 179.24 177.30 1b1c n GLY 150 N 1.21 0.55 2.78 -0.78 0.00 -0.79 -5.04 105.19 103.13 1b1c n GLY 150 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 1b1c n GLY 150 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1b1c s ASN 151 N -0.58 3.88 0.22 1.61 3.84 -1.21 -4.97 114.94 117.73 1b1c s ASN 151 Ca 0.00 -2.65 -0.09 0.00 0.21 0.00 0.00 52.86 50.34 1b1c s ASN 151 Cb 0.00 -1.20 0.25 0.00 -0.55 0.00 0.00 41.25 39.75 1b1c s ASN 151 CO 0.00 -0.27 1.82 0.25 -2.79 0.00 0.00 177.10 176.11 1b1c h LEU 152 N 6.79 0.63 -0.59 3.21 5.85 -1.84 -1.96 115.31 127.38 1b1c h LEU 152 Ca -0.04 0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.81 1b1c h LEU 152 Cb 0.93 -0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.77 1b1c h LEU 152 CO 0.53 0.41 0.16 -0.08 -0.34 0.00 0.00 178.44 179.13 1b1c h GLU 153 N 0.76 0.30 -0.30 1.25 4.57 -1.93 0.28 114.58 119.52 1b1c h GLU 153 Ca 0.31 -0.02 -0.13 0.00 -1.18 0.00 0.00 59.36 58.34 1b1c h GLU 153 Cb 0.17 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.68 1b1c h GLU 153 CO -0.17 0.20 -0.36 1.49 -1.18 0.00 0.00 179.01 178.98 1b1c h GLU 154 N 0.31 0.68 -0.72 1.92 4.81 -1.86 -1.58 114.58 118.13 1b1c h GLU 154 Ca 0.31 -0.33 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 1b1c h GLU 154 Cb 0.43 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.77 1b1c h GLU 154 CO -0.36 0.93 0.39 -0.44 -0.73 0.00 0.00 179.01 178.80 1b1c h ASP 155 N 0.56 0.91 -0.07 1.04 3.32 -0.56 -1.31 116.42 120.31 1b1c h ASP 155 Ca 0.05 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 1b1c h ASP 155 Cb 0.88 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 40.20 1b1c h ASP 155 CO 0.08 0.75 0.03 0.15 -1.72 0.00 0.00 179.24 178.53 1b1c h PHE 156 N 1.00 0.11 -0.68 4.55 3.57 -0.74 -2.19 116.94 122.56 1b1c h PHE 156 Ca 0.25 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.77 1b1c h PHE 156 Cb 0.05 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.72 1b1c h PHE 156 CO -0.00 0.23 0.43 0.82 -2.23 0.00 0.00 178.31 177.56 1b1c h ILE 157 N -0.04 1.11 -0.81 1.41 2.04 -1.11 0.73 117.51 120.84 1b1c h ILE 157 Ca 0.02 -0.29 -0.02 0.00 1.00 0.00 0.00 64.86 65.57 1b1c h ILE 157 Cb 0.16 0.18 -0.04 0.00 -0.74 0.00 0.00 36.82 36.39 1b1c h ILE 157 CO -0.00 0.16 0.42 0.74 0.00 0.00 0.00 178.15 179.47 1b1c h THR 158 N 0.85 1.25 0.17 -0.27 2.02 -1.14 0.42 112.91 116.21 1b1c h THR 158 Ca 0.27 -0.64 -0.01 0.00 0.77 0.00 0.00 66.41 66.80 1b1c h THR 158 Cb -0.01 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.59 1b1c h THR 158 CO -0.09 0.28 -0.08 -0.25 0.37 0.00 0.00 175.52 175.75 1b1c h TRP 159 N 1.13 -0.21 -0.99 3.16 7.01 -0.95 -3.12 115.95 121.98 1b1c h TRP 159 Ca 0.28 -0.00 0.08 0.00 2.11 0.00 0.00 58.89 61.36 1b1c h TRP 159 Cb 0.07 0.07 -0.07 0.00 -2.10 0.00 0.00 29.16 27.12 1b1c h TRP 159 CO 0.01 0.14 0.63 -0.09 -2.79 0.00 0.00 178.44 176.34 1b1c h ARG 160 N -0.60 1.07 -0.78 2.65 2.43 -0.66 0.16 114.38 118.65 1b1c h ARG 160 Ca -0.02 -0.06 0.03 0.00 -0.81 0.00 0.00 59.98 59.12 1b1c h ARG 160 Cb 0.45 -0.24 -0.04 0.00 -0.42 0.00 0.00 29.97 29.71 1b1c h ARG 160 CO 0.04 0.71 0.51 1.49 -1.51 0.00 0.00 179.97 181.21 1b1c h GLU 161 N 1.10 0.93 0.00 0.20 4.81 -0.92 -2.47 114.58 118.23 1b1c h GLU 161 Ca 0.45 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.61 1b1c h GLU 161 Cb 0.27 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.44 1b1c h GLU 161 CO -0.20 0.61 -1.35 1.04 -0.73 0.00 0.00 179.01 178.38 1b1c n GLN 162 N -4.45 0.62 0.19 1.92 6.02 -0.71 -4.46 117.38 116.51 1b1c n GLN 162 Ca 0.10 0.02 -0.14 0.00 -0.01 0.00 0.00 57.00 56.97 1b1c n GLN 162 Cb 0.12 -1.73 -0.08 0.00 1.02 0.00 0.00 30.24 29.57 1b1c n GLN 162 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 1b1c h PHE 163 N 0.00 -0.44 -0.56 1.08 3.57 -0.24 -3.08 116.94 117.27 1b1c h PHE 163 Ca -0.01 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.53 1b1c h PHE 163 Cb 1.04 0.15 -0.05 0.00 2.79 0.00 0.00 35.95 39.87 1b1c h PHE 163 CO 0.00 -0.15 0.28 -1.49 -2.23 0.00 0.00 178.31 174.72 1b1c h TRP 164 N -0.70 0.52 -0.66 0.41 4.06 -1.75 -0.59 115.95 117.23 1b1c h TRP 164 Ca -0.05 0.02 0.01 0.00 2.06 0.00 0.00 58.89 60.94 1b1c h TRP 164 Cb 0.49 -0.15 -0.03 0.00 -1.00 0.00 0.00 29.16 28.47 1b1c h TRP 164 CO 0.00 0.24 0.44 -1.35 -3.56 0.00 0.00 178.44 174.21 1b1c h PRO 165 N 0.54 0.84 -0.38 0.49 0.11 -1.78 0.89 132.00 132.71 1b1c h PRO 165 Ca 0.25 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 66.18 1b1c h PRO 165 Cb 0.17 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 1b1c h PRO 165 CO -0.18 0.56 -0.27 0.00 -0.21 0.00 0.00 178.00 177.90 1b1c h ALA 166 N 1.59 0.54 -0.37 -0.75 0.00 -1.29 -0.07 119.26 118.92 1b1c h ALA 166 Ca 0.25 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1b1c h ALA 166 Cb -0.06 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1b1c h ALA 166 CO -0.06 0.56 0.19 0.28 0.00 0.00 0.00 179.25 180.22 1b1c h VAL 167 N 0.66 1.16 -0.75 0.00 2.07 -0.30 0.15 116.25 119.24 1b1c h VAL 167 Ca 0.07 -0.44 -0.06 0.00 0.82 0.00 0.00 66.70 67.10 1b1c h VAL 167 Cb 0.84 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 1b1c h VAL 167 CO 0.07 0.17 0.23 0.00 0.02 0.00 0.00 177.57 178.06 1b1c h GLU 169 N 1.11 0.99 -0.09 0.00 4.57 -0.57 0.19 114.58 120.78 1b1c h GLU 169 Ca 0.24 -0.16 -0.03 0.00 -1.18 0.00 0.00 59.36 58.23 1b1c h GLU 169 Cb 0.31 -0.17 -0.00 0.00 -0.16 0.00 0.00 28.75 28.73 1b1c h GLU 169 CO -0.01 0.80 -0.07 1.25 -1.18 0.00 0.00 179.01 179.81 1b1c h HIS 170 N 0.95 0.25 -0.00 0.92 2.76 -0.60 -3.24 115.15 116.19 1b1c h HIS 170 Ca 0.23 -0.07 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 1b1c h HIS 170 Cb 0.16 -0.06 0.00 0.00 1.55 0.00 0.00 27.41 29.06 1b1c h HIS 170 CO 0.01 0.61 -0.16 1.19 -1.30 0.00 0.00 177.93 178.28 1b1c n PHE 171 N -4.70 0.00 -0.84 5.26 3.72 -0.58 -5.11 117.46 115.21 1b1c n PHE 171 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 1b1c n PHE 171 Cb 0.30 -0.28 0.00 0.00 -0.94 0.00 0.00 39.48 38.56 1b1c n PHE 171 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12