#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3e1c n ARG 3 N 0.00 0.10 -4.28 5.56 0.63 -1.26 -4.84 116.66 112.56 3e1c n ARG 3 Ca 0.00 0.51 -0.33 0.00 -0.92 0.00 0.00 57.85 57.11 3e1c n ARG 3 Cb 0.00 -1.76 -0.09 0.00 0.45 0.00 0.00 32.46 31.06 3e1c n ARG 3 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 3e1c s ARG 4 N -3.29 2.78 0.17 -0.14 6.06 -1.26 -5.05 118.95 118.23 3e1c s ARG 4 Ca 0.01 -0.62 0.15 0.00 -2.50 0.00 0.00 55.73 52.77 3e1c s ARG 4 Cb 0.06 -2.66 0.73 0.00 0.06 0.00 0.00 34.95 33.14 3e1c s ARG 4 CO 0.19 0.62 1.46 1.33 -2.50 0.00 0.00 175.30 176.41 3e1c n VAL 5 N 1.38 1.25 -1.88 7.11 0.24 -1.26 -4.77 118.33 120.40 3e1c n VAL 5 Ca -0.14 0.50 -0.23 0.00 -2.04 0.00 0.00 64.34 62.42 3e1c n VAL 5 Cb 0.53 -1.45 -0.06 0.00 -1.47 0.00 0.00 33.84 31.39 3e1c n VAL 5 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3e1c s ILE 6 N -3.27 3.30 0.00 1.34 1.01 -1.26 -4.77 121.20 117.54 3e1c s ILE 6 Ca 0.01 -0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.43 3e1c s ILE 6 Cb 0.06 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.86 3e1c s ILE 6 CO 0.19 -0.63 0.04 0.61 0.00 0.00 0.00 174.94 175.16 3e1c n GLY 7 N 6.79 0.78 3.10 6.18 0.00 -1.26 -5.08 105.19 115.69 3e1c n GLY 7 Ca 0.42 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.31 3e1c n GLY 7 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3e1c s GLN 8 N -0.01 0.26 0.22 1.61 -0.21 -1.26 -5.15 119.66 115.12 3e1c s GLN 8 Ca 0.00 0.27 -0.32 0.00 0.02 0.00 0.00 55.36 55.33 3e1c s GLN 8 Cb 0.00 0.13 -0.12 0.00 1.00 0.00 0.00 33.01 34.02 3e1c s GLN 8 CO 0.00 -0.03 1.69 1.03 -2.12 0.00 0.00 175.29 175.85 3e1c s ARG 9 N 0.05 4.13 0.10 2.91 0.52 -1.26 -5.04 118.95 120.36 3e1c s ARG 9 Ca -0.01 2.58 -0.23 0.00 -0.52 0.00 0.00 55.73 57.56 3e1c s ARG 9 Cb -0.02 -3.07 -0.07 0.00 0.52 0.00 0.00 34.95 32.31 3e1c s ARG 9 CO 0.00 -0.72 0.70 0.21 0.02 0.00 0.00 175.30 175.51 3e1c s LYS 10 N 0.86 4.43 0.15 3.54 2.47 -1.26 -5.10 119.74 124.83 3e1c s LYS 10 Ca 0.72 0.98 0.07 0.00 -1.56 0.00 0.00 55.97 56.18 3e1c s LYS 10 Cb -0.49 -3.28 -0.04 0.00 -1.46 0.00 0.00 37.83 32.56 3e1c s LYS 10 CO 0.35 0.53 -0.14 0.96 0.16 0.00 0.00 175.35 177.21 3e1c s ILE 11 N -0.89 1.49 0.32 5.43 -4.36 -1.26 -5.18 121.20 116.75 3e1c s ILE 11 Ca 0.34 -1.92 0.00 0.00 -0.26 0.00 0.00 60.65 58.81 3e1c s ILE 11 Cb -0.21 -1.76 -0.04 0.00 1.25 0.00 0.00 42.46 41.71 3e1c s ILE 11 CO 0.23 -0.49 0.51 -1.48 0.24 0.00 0.00 174.94 173.95 3e1c s LEU 12 N -2.81 4.07 0.85 0.37 2.34 -1.26 -5.03 118.68 117.21 3e1c s LEU 12 Ca 0.15 0.43 -0.11 0.00 0.06 0.00 0.00 54.13 54.65 3e1c s LEU 12 Cb -0.03 -3.27 0.10 0.00 -0.56 0.00 0.00 46.19 42.43 3e1c s LEU 12 CO 0.04 -0.24 1.10 -2.16 -1.06 0.00 0.00 176.35 174.03 3e1c s PRO 13 N -4.11 1.68 0.45 1.48 0.04 -1.26 -4.79 135.00 128.50 3e1c s PRO 13 Ca 0.40 0.72 -0.24 0.00 0.04 0.00 0.00 61.00 61.91 3e1c s PRO 13 Cb -0.10 -1.87 -0.09 0.00 0.04 0.00 0.00 34.50 32.49 3e1c s PRO 13 CO 0.34 -1.92 1.26 -0.40 0.04 0.00 0.00 177.00 176.32 3e1c n ASP 14 N -3.65 2.44 0.00 6.66 5.75 -0.56 -4.84 116.55 122.35 3e1c n ASP 14 Ca 0.07 1.07 0.02 0.00 -0.01 0.00 0.00 54.79 55.94 3e1c n ASP 14 Cb 0.56 -1.50 0.13 0.00 -1.03 0.00 0.00 41.12 39.28 3e1c n ASP 14 CO 0.00 0.00 0.00 -0.81 -0.11 0.00 0.00 177.20 176.28 3e1c n PRO 15 N -0.18 0.11 0.07 0.11 -0.04 -1.26 -3.04 135.00 130.77 3e1c n PRO 15 Ca 0.08 0.14 0.00 0.00 -0.04 0.00 0.00 63.50 63.68 3e1c n PRO 15 Cb 0.41 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 3e1c n PRO 15 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3e1c n LYS 16 N -1.17 0.00 -0.25 0.54 4.76 -1.26 -4.88 118.16 115.90 3e1c n LYS 16 Ca 0.03 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.59 3e1c n LYS 16 Cb 0.03 -0.40 0.25 0.00 -1.84 0.00 0.00 35.03 33.07 3e1c n LYS 16 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 3e1c n PHE 17 N -3.48 0.66 -2.22 2.13 3.01 -1.26 -5.00 117.46 111.29 3e1c n PHE 17 Ca 0.00 -0.34 -0.19 0.00 1.01 0.00 0.00 57.45 57.93 3e1c n PHE 17 Cb 0.00 -0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.44 3e1c n PHE 17 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3e1c n GLY 18 N 1.52 0.00 3.30 1.37 0.00 -1.17 -4.95 105.19 105.26 3e1c n GLY 18 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 3e1c n GLY 18 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3e1c s SER 19 N -2.17 4.14 0.46 1.61 1.04 -1.26 -4.73 113.70 112.78 3e1c s SER 19 Ca 0.00 -0.41 0.31 0.00 0.48 0.00 0.00 55.95 56.33 3e1c s SER 19 Cb 0.00 -1.70 1.38 0.00 0.10 0.00 0.00 66.02 65.80 3e1c s SER 19 CO 0.00 0.00 1.93 -0.33 0.98 0.00 0.00 173.24 175.83 3e1c h GLU 20 N 7.92 0.00 0.00 4.02 5.08 -1.91 -1.49 114.58 128.20 3e1c h GLU 20 Ca -0.40 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 3e1c h GLU 20 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 3e1c h GLU 20 CO 0.60 0.00 0.00 -0.11 -1.00 0.00 0.00 179.01 178.50 3e1c n LEU 21 N -2.77 0.00 0.28 1.33 7.94 -1.26 -1.63 117.00 120.89 3e1c n LEU 21 Ca 0.00 0.60 0.10 0.00 -1.11 0.00 0.00 56.01 55.60 3e1c n LEU 21 Cb 0.23 -0.10 0.56 0.00 0.53 0.00 0.00 43.42 44.65 3e1c n LEU 21 CO 0.23 -0.10 1.00 -0.07 -1.11 0.00 0.00 177.39 177.35 3e1c h LEU 22 N 0.00 0.00 0.01 -1.96 4.07 -2.01 -2.40 115.31 113.02 3e1c h LEU 22 Ca 0.00 0.00 -0.17 0.00 0.08 0.00 0.00 57.88 57.79 3e1c h LEU 22 Cb 0.00 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.72 3e1c h LEU 22 CO 0.00 0.00 -0.93 0.00 -1.08 0.00 0.00 178.44 176.43 3e1c h ALA 23 N 1.09 0.19 -0.69 1.53 0.00 -1.58 -3.25 119.26 116.54 3e1c h ALA 23 Ca 0.00 -1.01 -0.04 0.00 0.00 0.00 0.00 54.91 53.86 3e1c h ALA 23 Cb 0.84 0.52 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 3e1c h ALA 23 CO 0.00 0.52 0.29 -0.22 0.00 0.00 0.00 179.25 179.84 3e1c h LYS 24 N -0.95 1.02 0.00 0.00 3.64 -0.96 -2.47 116.57 116.85 3e1c h LYS 24 Ca -0.25 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 3e1c h LYS 24 Cb 1.26 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.91 3e1c h LYS 24 CO -0.13 0.83 0.00 0.34 -2.27 0.00 0.00 179.45 178.22 3e1c n PHE 25 N -4.40 0.00 -0.24 1.91 7.35 -0.94 -0.91 117.46 120.24 3e1c n PHE 25 Ca 0.05 0.00 0.04 0.00 -0.76 0.00 0.00 57.45 56.78 3e1c n PHE 25 Cb 0.16 -0.09 0.15 0.00 0.35 0.00 0.00 39.48 40.05 3e1c n PHE 25 CO 0.00 0.00 0.00 -0.24 -0.76 0.00 0.00 176.76 175.76 3e1c h VAL 26 N 0.00 0.44 0.00 -2.13 3.04 -1.58 -1.71 116.25 114.31 3e1c h VAL 26 Ca 0.00 -0.05 0.00 0.00 -1.01 0.00 0.00 66.70 65.64 3e1c h VAL 26 Cb 0.00 0.27 0.00 0.00 -2.01 0.00 0.00 31.29 29.55 3e1c h VAL 26 CO 0.00 0.03 0.00 0.59 -1.01 0.00 0.00 177.57 177.18 3e1c n ASN 27 N -5.27 0.00 -0.01 3.17 3.02 -0.94 -1.33 115.26 113.90 3e1c n ASN 27 Ca 0.12 0.38 -0.15 0.00 -0.03 0.00 0.00 54.58 54.90 3e1c n ASN 27 Cb 0.43 -0.41 -0.14 0.00 -0.61 0.00 0.00 39.78 39.05 3e1c n ASN 27 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3e1c n ILE 28 N -1.41 1.70 0.27 2.41 2.08 -0.08 -4.44 119.36 119.88 3e1c n ILE 28 Ca 0.02 -0.72 0.13 0.00 0.56 0.00 0.00 62.75 62.74 3e1c n ILE 28 Cb 0.06 -1.39 0.31 0.00 -0.75 0.00 0.00 39.64 37.87 3e1c n ILE 28 CO 0.00 0.00 0.00 0.25 0.56 0.00 0.00 176.55 177.36 3e1c h LEU 29 N 0.04 0.00 -0.41 1.39 5.85 -0.78 -3.39 115.31 118.01 3e1c h LEU 29 Ca -0.36 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.27 3e1c h LEU 29 Cb 2.03 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 43.04 3e1c h LEU 29 CO 0.08 0.00 -0.09 0.00 -0.34 0.00 0.00 178.44 178.09 3e1c h MET 30 N 0.00 0.79 0.00 1.25 -0.00 -1.60 -3.47 114.93 111.90 3e1c h MET 30 Ca 0.00 -0.30 0.00 0.00 -0.00 0.00 0.00 59.70 59.40 3e1c h MET 30 Cb 0.86 -0.05 0.00 0.00 -0.00 0.00 0.00 31.60 32.41 3e1c h MET 30 CO 0.00 0.91 0.00 1.33 -0.00 0.00 0.00 176.91 179.15 3e1c n VAL 31 N -4.33 0.00 -0.62 -0.10 0.24 -1.26 -3.31 118.33 108.95 3e1c n VAL 31 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.29 3e1c n VAL 31 Cb 0.36 -0.09 0.00 0.00 -1.47 0.00 0.00 33.84 32.64 3e1c n VAL 31 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 3e1c n ASP 32 N 0.00 0.00 0.00 -1.34 4.64 -1.26 -5.15 116.55 113.44 3e1c n ASP 32 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 3e1c n ASP 32 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.08 3e1c n ASP 32 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3e1c n GLY 33 N 0.00 1.73 0.05 0.27 0.00 -1.21 -5.03 105.19 101.00 3e1c n GLY 33 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 3e1c n GLY 33 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3e1c n LYS 34 N 0.00 -0.10 0.00 1.61 2.85 -1.26 -4.88 118.16 116.38 3e1c n LYS 34 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 3e1c n LYS 34 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 3e1c n LYS 34 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 3e1c n LYS 35 N 0.00 0.00 -0.23 -1.58 4.81 -1.26 -3.71 118.16 116.20 3e1c n LYS 35 Ca 0.00 0.00 0.13 0.00 -0.87 0.00 0.00 58.31 57.57 3e1c n LYS 35 Cb 0.00 0.00 0.42 0.00 0.02 0.00 0.00 35.03 35.47 3e1c n LYS 35 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3e1c h SER 36 N 0.00 0.56 0.15 3.14 4.64 -1.99 0.32 113.55 120.38 3e1c h SER 36 Ca 0.00 0.03 -0.29 0.00 -0.47 0.00 0.00 61.79 61.06 3e1c h SER 36 Cb 0.00 -0.08 0.02 0.00 -0.31 0.00 0.00 62.40 62.04 3e1c h SER 36 CO 0.00 0.29 -1.19 0.00 -0.87 0.00 0.00 176.83 175.06 3e1c h THR 37 N 0.60 1.30 -0.90 2.95 1.03 -1.99 -1.48 112.91 114.42 3e1c h THR 37 Ca 0.41 -2.46 0.12 0.00 -0.01 0.00 0.00 66.41 64.47 3e1c h THR 37 Cb 0.74 2.64 -0.08 0.00 -1.07 0.00 0.00 68.15 70.37 3e1c h THR 37 CO -0.17 0.75 0.52 0.00 -0.01 0.00 0.00 175.52 176.61 3e1c h ALA 38 N 0.36 1.33 -0.66 0.00 0.00 -1.01 -1.85 119.26 117.43 3e1c h ALA 38 Ca -0.17 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 3e1c h ALA 38 Cb 1.86 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.49 3e1c h ALA 38 CO 0.23 0.10 0.12 0.93 0.00 0.00 0.00 179.25 180.62 3e1c h GLU 39 N 0.82 1.08 -0.48 0.00 5.08 -0.20 -2.65 114.58 118.23 3e1c h GLU 39 Ca 0.45 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 3e1c h GLU 39 Cb 0.49 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 3e1c h GLU 39 CO -0.28 0.99 0.26 1.03 -1.00 0.00 0.00 179.01 180.00 3e1c h SER 40 N 1.00 0.58 0.14 1.42 0.87 -1.04 -1.62 113.55 114.90 3e1c h SER 40 Ca 0.20 -0.04 -0.17 0.00 -1.23 0.00 0.00 61.79 60.56 3e1c h SER 40 Cb 0.42 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 3e1c h SER 40 CO 0.01 0.48 -0.61 0.40 -0.53 0.00 0.00 176.83 176.58 3e1c h ILE 41 N 0.67 1.35 -0.78 2.23 2.04 -1.31 -2.11 117.51 119.59 3e1c h ILE 41 Ca 0.17 -1.92 -0.03 0.00 1.00 0.00 0.00 64.86 64.08 3e1c h ILE 41 Cb 0.03 1.91 -0.04 0.00 -0.74 0.00 0.00 36.82 37.98 3e1c h ILE 41 CO -0.03 0.59 0.37 0.58 0.00 0.00 0.00 178.15 179.66 3e1c h VAL 42 N 0.34 1.25 -0.24 1.67 2.07 -1.47 -0.58 116.25 119.29 3e1c h VAL 42 Ca -0.01 -0.71 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 3e1c h VAL 42 Cb 1.16 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 3e1c h VAL 42 CO 0.11 0.30 0.11 0.22 0.02 0.00 0.00 177.57 178.33 3e1c h TYR 43 N 1.11 0.31 -0.00 1.57 -0.00 -1.26 -2.51 116.97 116.19 3e1c h TYR 43 Ca 0.27 -0.00 -0.14 0.00 -0.00 0.00 0.00 58.73 58.85 3e1c h TYR 43 Cb 0.13 -0.10 -0.02 0.00 -0.00 0.00 0.00 36.73 36.74 3e1c h TYR 43 CO 0.01 0.24 -0.68 1.03 -0.00 0.00 0.00 178.16 178.76 3e1c h SER 44 N 0.33 0.02 -0.14 -2.11 0.87 -0.84 -3.29 113.55 108.40 3e1c h SER 44 Ca 0.09 -0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.65 3e1c h SER 44 Cb 0.04 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 61.97 3e1c h SER 44 CO -0.01 0.69 0.01 0.00 -0.53 0.00 0.00 176.83 176.99 3e1c h ALA 45 N 1.31 0.12 0.00 6.23 0.00 -0.67 -2.49 119.26 123.76 3e1c h ALA 45 Ca -0.01 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3e1c h ALA 45 Cb 1.20 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3e1c h ALA 45 CO 0.09 -0.44 0.00 -0.07 0.00 0.00 0.00 179.25 178.83 3e1c h LEU 46 N 0.05 0.00 0.03 0.00 3.38 -1.63 0.93 115.31 118.08 3e1c h LEU 46 Ca 0.06 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.74 3e1c h LEU 46 Cb 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 3e1c h LEU 46 CO -0.10 0.00 -1.62 -0.62 0.09 0.00 0.00 178.44 176.19 3e1c n GLU 47 N -3.03 0.62 -0.02 1.13 -0.58 -1.19 -3.96 120.64 113.61 3e1c n GLU 47 Ca -0.03 0.45 0.12 0.00 -0.42 0.00 0.00 57.16 57.28 3e1c n GLU 47 Cb 0.08 -1.71 0.53 0.00 -0.57 0.00 0.00 31.44 29.78 3e1c n GLU 47 CO 0.00 0.00 0.00 1.79 -0.48 0.00 0.00 177.13 178.44 3e1c h THR 48 N -0.68 0.91 0.18 2.62 1.35 -1.25 -2.28 112.91 113.76 3e1c h THR 48 Ca -0.41 -0.11 0.01 0.00 -0.55 0.00 0.00 66.41 65.34 3e1c h THR 48 Cb 1.55 0.56 -0.04 0.00 -1.73 0.00 0.00 68.15 68.50 3e1c h THR 48 CO -0.15 0.06 -0.44 0.25 -0.25 0.00 0.00 175.52 174.99 3e1c h LEU 49 N 0.32 -1.31 -1.01 3.87 5.85 -1.00 -3.30 115.31 118.73 3e1c h LEU 49 Ca 0.22 0.13 0.00 0.00 0.84 0.00 0.00 57.88 59.07 3e1c h LEU 49 Cb 0.46 0.47 0.00 0.00 0.37 0.00 0.00 40.66 41.97 3e1c h LEU 49 CO -0.05 -0.50 0.00 0.00 -0.34 0.00 0.00 178.44 177.55 3e1c h ALA 50 N -0.78 1.00 0.00 1.25 0.00 -1.55 -2.77 119.26 116.42 3e1c h ALA 50 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3e1c h ALA 50 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3e1c h ALA 50 CO -0.20 0.00 0.50 0.37 0.00 0.00 0.00 179.25 179.92 3e1c h GLN 51 N 0.00 0.00 0.00 0.00 5.75 -1.56 0.56 115.11 119.86 3e1c h GLN 51 Ca 0.00 0.00 -0.13 0.00 -0.15 0.00 0.00 58.65 58.37 3e1c h GLN 51 Cb 0.56 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.09 3e1c h GLN 51 CO 0.00 0.00 -0.93 0.00 -2.65 0.00 0.00 178.83 175.25 3e1c h ARG 52 N 0.00 0.00 0.00 1.69 3.08 -1.70 -3.43 114.38 114.02 3e1c h ARG 52 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3e1c h ARG 52 Cb 0.99 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.04 3e1c h ARG 52 CO 0.00 0.42 0.00 -1.13 -1.07 0.00 0.00 179.97 178.19 3e1c n SER 53 N -3.07 0.00 -0.77 7.04 3.41 -0.83 -5.09 113.62 114.31 3e1c n SER 53 Ca -0.03 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.51 3e1c n SER 53 Cb 0.78 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.73 3e1c n SER 53 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3e1c n GLY 54 N 0.00 0.10 0.00 5.00 0.00 0.13 -4.99 105.19 105.43 3e1c n GLY 54 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.42 3e1c n GLY 54 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3e1c n LYS 55 N -1.68 0.00 -1.83 1.61 -0.00 -1.26 -5.05 118.16 109.95 3e1c n LYS 55 Ca -0.08 0.00 -0.40 0.00 -0.00 0.00 0.00 58.31 57.83 3e1c n LYS 55 Cb 0.56 0.00 -0.03 0.00 -0.00 0.00 0.00 35.03 35.56 3e1c n LYS 55 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 3e1c n SER 56 N -0.91 3.60 0.18 -5.58 2.88 -1.26 -4.73 113.62 107.80 3e1c n SER 56 Ca 0.00 -2.79 0.14 0.00 -1.33 0.00 0.00 58.87 54.89 3e1c n SER 56 Cb 0.00 -1.54 0.58 0.00 -0.75 0.00 0.00 64.21 62.50 3e1c n SER 56 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 3e1c h GLU 57 N 7.56 0.00 0.00 -1.46 4.57 -1.95 -2.17 114.58 121.13 3e1c h GLU 57 Ca 0.44 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.62 3e1c h GLU 57 Cb 0.76 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.35 3e1c h GLU 57 CO 1.69 0.00 0.00 1.37 -1.18 0.00 0.00 179.01 180.89 3e1c h LEU 58 N 0.00 0.00 -0.03 1.64 8.10 -1.89 -1.08 115.31 122.05 3e1c h LEU 58 Ca 0.00 0.00 -0.26 0.00 0.11 0.00 0.00 57.88 57.73 3e1c h LEU 58 Cb 0.36 0.00 0.02 0.00 -0.44 0.00 0.00 40.66 40.59 3e1c h LEU 58 CO 0.00 0.00 -1.07 -0.33 -4.11 0.00 0.00 178.44 172.93 3e1c h GLU 59 N 0.00 0.55 0.00 0.17 5.08 -1.80 -3.14 114.58 115.44 3e1c h GLU 59 Ca 0.00 -0.64 0.00 0.00 -1.00 0.00 0.00 59.36 57.72 3e1c h GLU 59 Cb 0.01 0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.45 3e1c h GLU 59 CO 0.00 1.25 0.00 0.00 -1.00 0.00 0.00 179.01 179.26 3e1c n ALA 60 N -2.61 1.78 -0.34 3.43 0.00 -0.45 -3.30 120.51 119.02 3e1c n ALA 60 Ca -0.10 -0.06 0.10 0.00 0.00 0.00 0.00 53.44 53.38 3e1c n ALA 60 Cb 0.90 -1.26 0.29 0.00 0.00 0.00 0.00 19.45 19.38 3e1c n ALA 60 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 3e1c h PHE 61 N 0.00 1.05 0.42 0.00 3.57 -1.38 0.23 116.94 120.84 3e1c h PHE 61 Ca 0.00 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 3e1c h PHE 61 Cb 0.24 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.64 3e1c h PHE 61 CO 0.00 0.36 -0.33 1.49 -2.23 0.00 0.00 178.31 177.61 3e1c h GLU 62 N 0.87 -0.72 0.00 1.11 4.57 -1.78 -1.24 114.58 117.39 3e1c h GLU 62 Ca 0.51 0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.74 3e1c h GLU 62 Cb 0.65 0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.41 3e1c h GLU 62 CO -0.28 -0.48 0.00 0.28 -1.18 0.00 0.00 179.01 177.35 3e1c n VAL 63 N -5.45 0.92 -0.12 0.32 0.31 -0.00 -0.38 118.33 113.93 3e1c n VAL 63 Ca -0.11 0.23 -0.25 0.00 -0.01 0.00 0.00 64.34 64.21 3e1c n VAL 63 Cb 0.35 -1.09 -0.09 0.00 -0.91 0.00 0.00 33.84 32.10 3e1c n VAL 63 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3e1c n ALA 64 N -1.32 1.02 0.08 3.52 0.00 -0.76 -4.29 120.51 118.76 3e1c n ALA 64 Ca 0.04 -0.88 0.21 0.00 0.00 0.00 0.00 53.44 52.80 3e1c n ALA 64 Cb 0.07 -0.07 0.71 0.00 0.00 0.00 0.00 19.45 20.16 3e1c n ALA 64 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3e1c h LEU 65 N -1.00 0.00 -1.18 0.00 4.07 0.16 -2.29 115.31 115.07 3e1c h LEU 65 Ca -0.51 0.00 0.09 0.00 0.08 0.00 0.00 57.88 57.54 3e1c h LEU 65 Cb 1.42 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 43.10 3e1c h LEU 65 CO -0.31 0.00 0.58 -0.33 -1.08 0.00 0.00 178.44 177.30 3e1c h GLU 66 N 0.00 0.89 0.00 1.13 5.08 -0.95 -2.01 114.58 118.72 3e1c h GLU 66 Ca 0.21 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 3e1c h GLU 66 Cb 1.29 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 3e1c h GLU 66 CO -0.00 0.59 -0.69 -0.91 -1.00 0.00 0.00 179.01 177.00 3e1c h ASN 67 N 0.92 0.00 0.27 1.42 2.35 -1.67 -3.39 115.58 115.48 3e1c h ASN 67 Ca 0.41 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.82 3e1c h ASN 67 Cb 0.37 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 3e1c h ASN 67 CO -0.17 0.16 -1.86 0.58 -1.65 0.00 0.00 177.43 174.48 3e1c h VAL 68 N 0.00 0.75 -2.25 2.81 2.07 -1.46 -3.43 116.25 114.73 3e1c h VAL 68 Ca -0.03 -2.50 -0.57 0.00 0.82 0.00 0.00 66.70 64.43 3e1c h VAL 68 Cb 1.14 2.52 0.03 0.00 -1.52 0.00 0.00 31.29 33.46 3e1c h VAL 68 CO 0.02 0.77 1.09 -2.11 0.02 0.00 0.00 177.57 177.36 3e1c n ARG 69 N -3.36 2.49 -2.19 1.57 1.85 -0.77 -4.57 116.66 111.69 3e1c n ARG 69 Ca -0.26 0.91 -0.28 0.00 -1.00 0.00 0.00 57.85 57.23 3e1c n ARG 69 Cb 1.05 -2.78 0.17 0.00 -1.05 0.00 0.00 32.46 29.85 3e1c n ARG 69 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 3e1c s PRO 70 N 3.38 0.90 -0.03 2.89 0.04 -1.26 -4.99 135.00 135.92 3e1c s PRO 70 Ca 0.87 -0.74 0.14 0.00 0.04 0.00 0.00 61.00 61.30 3e1c s PRO 70 Cb -0.58 -2.02 -0.21 0.00 0.04 0.00 0.00 34.50 31.73 3e1c s PRO 70 CO 0.44 -2.14 0.28 -2.37 0.04 0.00 0.00 177.00 173.24 3e1c n THR 71 N -3.46 0.09 -4.20 1.26 5.66 -1.26 -4.86 114.28 107.50 3e1c n THR 71 Ca 0.16 -0.34 -0.18 0.00 -3.05 0.00 0.00 64.05 60.64 3e1c n THR 71 Cb 0.60 0.10 -0.12 0.00 -1.55 0.00 0.00 70.33 69.36 3e1c n THR 71 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 3e1c s VAL 72 N -2.89 1.18 -0.01 1.08 -7.23 -1.26 -0.33 120.40 110.93 3e1c s VAL 72 Ca -0.05 -1.48 -0.02 0.00 -1.81 0.00 0.00 61.98 58.62 3e1c s VAL 72 Cb 0.08 -1.26 0.00 0.00 0.56 0.00 0.00 36.38 35.77 3e1c s VAL 72 CO 0.57 -0.32 0.04 -0.70 -0.31 0.00 0.00 175.10 174.38 3e1c s GLU 73 N -2.15 0.07 -0.25 4.82 2.12 -1.21 -4.81 118.70 117.29 3e1c s GLU 73 Ca 0.02 0.02 -0.10 0.00 0.36 0.00 0.00 54.97 55.27 3e1c s GLU 73 Cb -0.08 0.03 -0.05 0.00 0.26 0.00 0.00 34.13 34.30 3e1c s GLU 73 CO 0.02 -0.01 0.16 0.14 -0.54 0.00 0.00 175.26 175.03 3e1c s VAL 74 N -0.07 5.27 0.34 3.70 -7.23 -1.26 -4.46 120.40 116.69 3e1c s VAL 74 Ca -0.01 0.15 0.04 0.00 -1.81 0.00 0.00 61.98 60.35 3e1c s VAL 74 Cb -0.01 -3.47 -0.06 0.00 0.56 0.00 0.00 36.38 33.40 3e1c s VAL 74 CO 0.00 0.33 0.06 -0.54 -0.31 0.00 0.00 175.10 174.64 3e1c s LYS 75 N 1.21 1.72 -0.82 4.82 3.01 -1.26 -5.08 119.74 123.33 3e1c s LYS 75 Ca 0.07 -1.97 -0.25 0.00 -1.01 0.00 0.00 55.97 52.81 3e1c s LYS 75 Cb -0.14 -0.93 -0.19 0.00 -1.01 0.00 0.00 37.83 35.56 3e1c s LYS 75 CO 0.06 -0.20 2.49 0.45 0.51 0.00 0.00 175.35 178.65 3e1c n SER 76 N -0.78 0.79 -3.22 2.83 2.88 -1.26 -4.91 113.62 109.95 3e1c n SER 76 Ca -0.03 -0.35 -0.24 0.00 -1.33 0.00 0.00 58.87 56.91 3e1c n SER 76 Cb 0.67 -1.15 -0.07 0.00 -0.75 0.00 0.00 64.21 62.91 3e1c n SER 76 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3e1c n ARG 77 N 8.19 0.61 -0.02 -1.46 1.74 -1.26 -4.96 116.66 119.50 3e1c n ARG 77 Ca 0.55 -3.20 0.04 0.00 -0.77 0.00 0.00 57.85 54.48 3e1c n ARG 77 Cb 0.25 -1.30 0.21 0.00 -1.02 0.00 0.00 32.46 30.60 3e1c n ARG 77 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 3e1c n ARG 78 N 1.68 1.12 -0.33 5.56 1.85 -1.26 -0.93 116.66 124.35 3e1c n ARG 78 Ca 0.23 -0.18 -0.08 0.00 -1.00 0.00 0.00 57.85 56.81 3e1c n ARG 78 Cb 0.52 -1.14 -0.07 0.00 -1.05 0.00 0.00 32.46 30.73 3e1c n ARG 78 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 3e1c n VAL 79 N -0.44 -0.52 0.12 8.89 0.31 -1.26 -2.98 118.33 122.44 3e1c n VAL 79 Ca 0.06 1.90 0.00 0.00 -0.01 0.00 0.00 64.34 66.29 3e1c n VAL 79 Cb 0.07 -2.36 0.00 0.00 -0.91 0.00 0.00 33.84 30.64 3e1c n VAL 79 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3e1c n GLY 80 N -1.21 1.84 3.25 2.92 0.00 -1.26 -4.78 105.19 105.94 3e1c n GLY 80 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3e1c n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3e1c n GLY 81 N 1.17 2.32 3.42 -0.02 0.00 -1.16 -4.93 105.19 105.99 3e1c n GLY 81 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3e1c n GLY 81 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3e1c s SER 82 N -3.59 -0.55 -0.36 1.61 1.04 -1.20 -5.12 113.70 105.53 3e1c s SER 82 Ca 0.00 0.04 -0.05 0.00 0.48 0.00 0.00 55.95 56.42 3e1c s SER 82 Cb 0.00 0.58 -0.11 0.00 0.10 0.00 0.00 66.02 66.59 3e1c s SER 82 CO 0.00 -0.92 0.81 0.41 0.98 0.00 0.00 173.24 174.51 3e1c n THR 83 N -0.24 0.00 -3.82 2.02 -1.04 -1.26 -4.44 114.28 105.50 3e1c n THR 83 Ca -0.17 -0.15 -0.31 0.00 -2.04 0.00 0.00 64.05 61.38 3e1c n THR 83 Cb 0.64 -0.03 -0.10 0.00 -1.82 0.00 0.00 70.33 69.02 3e1c n THR 83 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 3e1c s TYR 84 N 0.58 3.65 -0.28 -1.42 6.14 -0.11 -4.98 117.35 120.93 3e1c s TYR 84 Ca 0.48 -3.22 -0.02 0.00 0.64 0.00 0.00 57.07 54.95 3e1c s TYR 84 Cb -0.33 -2.90 0.04 0.00 0.42 0.00 0.00 41.96 39.19 3e1c s TYR 84 CO 0.20 -0.63 -0.03 -0.65 0.64 0.00 0.00 175.55 175.09 3e1c s GLN 85 N -1.31 2.60 -0.07 4.97 -0.21 -1.26 -4.79 119.66 119.59 3e1c s GLN 85 Ca 0.25 -1.14 -0.06 0.00 0.02 0.00 0.00 55.36 54.43 3e1c s GLN 85 Cb -0.07 -3.10 0.01 0.00 1.00 0.00 0.00 33.01 30.85 3e1c s GLN 85 CO -0.14 -0.53 0.10 0.28 -2.12 0.00 0.00 175.29 172.88 3e1c n VAL 86 N 4.64 -1.83 0.06 1.09 0.31 -1.26 -4.66 118.33 116.69 3e1c n VAL 86 Ca -0.15 0.33 -0.20 0.00 -0.01 0.00 0.00 64.34 64.31 3e1c n VAL 86 Cb 0.45 -2.41 -0.11 0.00 -0.91 0.00 0.00 33.84 30.86 3e1c n VAL 86 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 3e1c h PRO 87 N 2.76 0.65 -3.61 5.55 0.13 -1.84 -3.45 132.00 132.18 3e1c h PRO 87 Ca -0.09 -0.76 0.00 0.00 -0.87 0.00 0.00 66.00 64.29 3e1c h PRO 87 Cb 0.84 0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.20 3e1c h PRO 87 CO 0.03 1.33 -0.67 0.28 -0.23 0.00 0.00 178.00 178.74 3e1c n VAL 88 N -3.82 -3.95 -0.93 1.56 0.31 -1.26 -4.57 118.33 105.67 3e1c n VAL 88 Ca -0.12 1.82 -0.33 0.00 -0.01 0.00 0.00 64.34 65.70 3e1c n VAL 88 Cb 0.92 -2.43 0.12 0.00 -0.91 0.00 0.00 33.84 31.53 3e1c n VAL 88 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 3e1c n GLU 89 N -0.26 -0.10 -3.34 5.55 0.28 -1.26 -3.34 120.64 118.17 3e1c n GLU 89 Ca 0.00 0.03 -0.38 0.00 -0.16 0.00 0.00 57.16 56.65 3e1c n GLU 89 Cb 0.00 -2.02 -0.06 0.00 1.43 0.00 0.00 31.44 30.79 3e1c n GLU 89 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 3e1c s VAL 90 N -2.27 5.12 0.48 3.84 -7.23 0.55 -4.85 120.40 116.05 3e1c s VAL 90 Ca 0.63 0.95 -0.23 0.00 -1.81 0.00 0.00 61.98 61.53 3e1c s VAL 90 Cb -0.26 -3.80 -0.08 0.00 0.56 0.00 0.00 36.38 32.80 3e1c s VAL 90 CO 0.61 0.39 1.11 0.54 -0.31 0.00 0.00 175.10 177.45 3e1c n ARG 91 N 3.19 1.44 -0.34 4.82 3.00 -1.26 -4.81 116.66 122.69 3e1c n ARG 91 Ca -0.09 0.52 0.20 0.00 -0.01 0.00 0.00 57.85 58.48 3e1c n ARG 91 Cb 0.52 -2.24 0.39 0.00 0.00 0.00 0.00 32.46 31.13 3e1c n ARG 91 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 3e1c h PRO 92 N 1.40 0.01 0.00 5.56 0.11 -1.99 0.16 132.00 137.24 3e1c h PRO 92 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3e1c h PRO 92 Cb 1.33 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 3e1c h PRO 92 CO 0.56 0.00 0.02 1.33 -0.21 0.00 0.00 178.00 179.71 3e1c n VAL 93 N -5.42 0.33 0.05 3.15 0.24 -1.26 -3.20 118.33 112.23 3e1c n VAL 93 Ca 0.28 0.11 0.04 0.00 -2.04 0.00 0.00 64.34 62.72 3e1c n VAL 93 Cb 0.93 -1.11 -0.05 0.00 -1.47 0.00 0.00 33.84 32.14 3e1c n VAL 93 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3e1c n ARG 94 N -0.99 0.92 -0.31 7.34 5.12 0.55 -4.76 116.66 124.52 3e1c n ARG 94 Ca 0.00 -0.06 -0.05 0.00 -1.93 0.00 0.00 57.85 55.82 3e1c n ARG 94 Cb 0.02 -1.12 0.08 0.00 -1.16 0.00 0.00 32.46 30.28 3e1c n ARG 94 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3e1c h ARG 95 N 0.00 1.20 0.00 5.56 -0.00 -1.72 -2.36 114.38 117.05 3e1c h ARG 95 Ca 0.00 -0.15 -0.13 0.00 -0.50 0.00 0.00 59.98 59.19 3e1c h ARG 95 Cb 0.31 -0.23 -0.02 0.00 0.00 0.00 0.00 29.97 30.03 3e1c h ARG 95 CO 0.00 0.90 -1.77 0.09 0.00 0.00 0.00 179.97 179.18 3e1c n ASN 96 N -4.35 0.38 -0.12 7.04 3.02 -1.26 -3.66 115.26 116.30 3e1c n ASN 96 Ca 0.09 0.16 -0.12 0.00 -0.03 0.00 0.00 54.58 54.67 3e1c n ASN 96 Cb 0.11 1.01 -0.00 0.00 -0.61 0.00 0.00 39.78 40.29 3e1c n ASN 96 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3e1c h ALA 97 N 1.61 0.64 0.00 5.41 0.00 -1.83 -2.25 119.26 122.83 3e1c h ALA 97 Ca -0.17 -0.43 -0.08 0.00 0.00 0.00 0.00 54.91 54.22 3e1c h ALA 97 Cb 1.45 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 3e1c h ALA 97 CO 0.02 0.68 -0.40 1.25 0.00 0.00 0.00 179.25 180.80 3e1c h LEU 98 N 0.77 0.00 -0.62 0.00 6.46 -1.59 -2.91 115.31 117.43 3e1c h LEU 98 Ca 0.08 0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.78 3e1c h LEU 98 Cb 0.92 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.82 3e1c h LEU 98 CO 0.09 0.40 0.18 0.00 -0.62 0.00 0.00 178.44 178.48 3e1c h ALA 99 N 1.60 0.81 -0.79 1.25 0.00 -1.62 -2.45 119.26 118.07 3e1c h ALA 99 Ca -0.00 -0.21 0.10 0.00 0.00 0.00 0.00 54.91 54.79 3e1c h ALA 99 Cb 0.82 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 3e1c h ALA 99 CO 0.05 0.50 0.51 0.52 0.00 0.00 0.00 179.25 180.83 3e1c h MET 100 N 0.89 0.70 -0.85 0.00 2.86 -1.41 -0.92 114.93 116.20 3e1c h MET 100 Ca 0.20 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.79 3e1c h MET 100 Cb 0.31 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 31.77 3e1c h MET 100 CO -0.00 0.46 0.52 0.00 1.06 0.00 0.00 176.91 178.95 3e1c h ARG 101 N 0.72 1.14 0.00 1.72 2.47 -1.23 -1.76 114.38 117.44 3e1c h ARG 101 Ca 0.36 -0.10 -0.14 0.00 -1.26 0.00 0.00 59.98 58.84 3e1c h ARG 101 Cb 0.45 -0.24 -0.02 0.00 -1.65 0.00 0.00 29.97 28.51 3e1c h ARG 101 CO -0.14 0.80 -0.89 -1.49 0.56 0.00 0.00 179.97 178.81 3e1c h TRP 102 N 1.16 0.00 -0.72 3.04 6.55 -1.30 -1.99 115.95 122.68 3e1c h TRP 102 Ca 0.30 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.14 3e1c h TRP 102 Cb -0.06 0.00 -0.04 0.00 -0.86 0.00 0.00 29.16 28.21 3e1c h TRP 102 CO -0.00 0.60 0.45 0.82 -1.05 0.00 0.00 178.44 179.26 3e1c h ILE 103 N 0.00 1.20 0.18 1.49 2.04 -1.04 -2.54 117.51 118.84 3e1c h ILE 103 Ca -0.06 -0.41 -0.34 0.00 1.00 0.00 0.00 64.86 65.05 3e1c h ILE 103 Cb 1.51 0.16 0.01 0.00 -0.74 0.00 0.00 36.82 37.76 3e1c h ILE 103 CO 0.07 0.20 -1.64 0.58 0.00 0.00 0.00 178.15 177.35 3e1c h VAL 104 N 0.99 1.06 -0.05 1.67 2.07 -1.16 -2.63 116.25 118.20 3e1c h VAL 104 Ca 0.26 -2.63 -0.05 0.00 0.82 0.00 0.00 66.70 65.11 3e1c h VAL 104 Cb -0.07 2.81 -0.01 0.00 -1.52 0.00 0.00 31.29 32.51 3e1c h VAL 104 CO -0.05 0.84 -0.18 1.05 0.02 0.00 0.00 177.57 179.25 3e1c h GLU 105 N 0.10 0.08 -0.27 1.57 4.11 -1.47 -2.88 114.58 115.83 3e1c h GLU 105 Ca -0.30 -0.02 -0.09 0.00 0.07 0.00 0.00 59.36 59.02 3e1c h GLU 105 Cb 2.09 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 31.31 3e1c h GLU 105 CO 0.19 0.27 -0.21 0.00 0.07 0.00 0.00 179.01 179.33 3e1c h ALA 106 N 1.74 1.15 0.00 1.06 0.00 -1.37 -3.26 119.26 118.58 3e1c h ALA 106 Ca 0.02 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 3e1c h ALA 106 Cb 0.37 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3e1c h ALA 106 CO 0.03 0.54 -0.28 0.00 0.00 0.00 0.00 179.25 179.54 3e1c h ALA 107 N 1.34 1.37 0.32 0.00 0.00 -1.30 -3.19 119.26 117.80 3e1c h ALA 107 Ca 0.07 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 3e1c h ALA 107 Cb 0.61 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3e1c h ALA 107 CO 0.04 0.35 -0.22 -0.09 0.00 0.00 0.00 179.25 179.32 3e1c h ARG 108 N 0.00 -0.52 -0.33 0.00 9.65 -1.55 -3.05 114.38 118.58 3e1c h ARG 108 Ca -0.00 0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.91 3e1c h ARG 108 Cb 0.55 0.12 0.00 0.00 -1.39 0.00 0.00 29.97 29.24 3e1c h ARG 108 CO 0.04 -0.34 0.00 1.63 2.80 0.00 0.00 179.97 184.09 3e1c n LYS 109 N -5.35 2.39 -0.29 0.20 4.76 -1.26 -4.88 118.16 113.72 3e1c n LYS 109 Ca -0.09 -2.09 0.11 0.00 -2.87 0.00 0.00 58.31 53.37 3e1c n LYS 109 Cb 0.26 -1.49 0.23 0.00 -1.84 0.00 0.00 35.03 32.18 3e1c n LYS 109 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 3e1c n ARG 110 N 1.31 -0.07 0.00 1.97 0.63 -1.15 -4.88 116.66 114.47 3e1c n ARG 110 Ca 0.19 1.26 0.00 0.00 -0.92 0.00 0.00 57.85 58.37 3e1c n ARG 110 Cb 0.57 -1.98 0.00 0.00 0.45 0.00 0.00 32.46 31.50 3e1c n ARG 110 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3e1c n GLY 111 N -1.43 2.77 3.69 5.14 0.00 -1.26 -5.09 105.19 109.00 3e1c n GLY 111 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 3e1c n GLY 111 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3e1c n ASP 112 N 0.00 1.94 -0.14 1.61 8.00 -1.26 -4.92 116.55 121.77 3e1c n ASP 112 Ca 0.00 0.94 -0.04 0.00 0.71 0.00 0.00 54.79 56.40 3e1c n ASP 112 Cb 0.00 -1.49 -0.03 0.00 -0.02 0.00 0.00 41.12 39.57 3e1c n ASP 112 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3e1c n LYS 113 N -0.83 -0.15 -4.22 -1.24 5.02 -1.26 -4.64 118.16 110.83 3e1c n LYS 113 Ca 0.11 0.80 -0.24 0.00 -2.02 0.00 0.00 58.31 56.95 3e1c n LYS 113 Cb 0.44 -1.18 -0.08 0.00 -0.02 0.00 0.00 35.03 34.20 3e1c n LYS 113 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3e1c s SER 114 N -4.27 4.36 0.24 4.39 1.04 -1.26 -5.06 113.70 113.15 3e1c s SER 114 Ca -0.04 -1.00 0.11 0.00 0.48 0.00 0.00 55.95 55.50 3e1c s SER 114 Cb 0.04 -0.55 0.21 0.00 0.10 0.00 0.00 66.02 65.82 3e1c s SER 114 CO 0.21 -0.37 1.52 -0.03 0.98 0.00 0.00 173.24 175.55 3e1c h MET 115 N 1.61 0.00 -0.72 4.02 4.05 -1.98 -1.40 114.93 120.51 3e1c h MET 115 Ca -0.43 0.00 0.12 0.00 -0.28 0.00 0.00 59.70 59.11 3e1c h MET 115 Cb 1.25 0.00 -0.09 0.00 -0.80 0.00 0.00 31.60 31.96 3e1c h MET 115 CO 0.68 0.69 0.29 0.00 0.23 0.00 0.00 176.91 178.80 3e1c h ALA 116 N 1.31 0.99 0.00 0.39 0.00 -1.96 -2.45 119.26 117.55 3e1c h ALA 116 Ca -0.01 0.10 -0.19 0.00 0.00 0.00 0.00 54.91 54.81 3e1c h ALA 116 Cb 1.29 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 3e1c h ALA 116 CO 0.09 -0.18 -0.89 -0.07 0.00 0.00 0.00 179.25 178.20 3e1c h LEU 117 N 0.46 0.04 -1.00 0.00 3.38 -1.88 -1.18 115.31 115.13 3e1c h LEU 117 Ca 0.38 -0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.33 3e1c h LEU 117 Cb 0.53 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.22 3e1c h LEU 117 CO -0.36 0.91 0.66 0.03 0.09 0.00 0.00 178.44 179.77 3e1c h ARG 118 N 0.01 1.31 -0.01 1.13 3.08 -1.06 -0.61 114.38 118.23 3e1c h ARG 118 Ca -0.02 -0.08 -0.11 0.00 0.07 0.00 0.00 59.98 59.85 3e1c h ARG 118 Cb 1.56 -0.30 0.01 0.00 0.08 0.00 0.00 29.97 31.32 3e1c h ARG 118 CO 0.12 0.87 -0.42 -0.07 -1.07 0.00 0.00 179.97 179.40 3e1c h LEU 119 N 1.35 0.38 -0.69 3.04 -0.00 -1.47 -3.16 115.31 114.77 3e1c h LEU 119 Ca 0.37 -0.75 -0.14 0.00 -0.00 0.00 0.00 57.88 57.35 3e1c h LEU 119 Cb -0.15 -0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 40.38 3e1c h LEU 119 CO -0.08 1.09 -0.61 0.00 -0.00 0.00 0.00 178.44 178.83 3e1c h ALA 120 N 0.31 0.89 -0.02 1.53 0.00 -0.91 -0.69 119.26 120.37 3e1c h ALA 120 Ca -0.05 -0.55 -0.00 0.00 0.00 0.00 0.00 54.91 54.31 3e1c h ALA 120 Cb 1.14 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 3e1c h ALA 120 CO 0.08 0.74 0.00 -0.91 0.00 0.00 0.00 179.25 179.17 3e1c h ASN 121 N 0.12 0.04 -0.21 0.00 2.35 -1.31 -2.61 115.58 113.96 3e1c h ASN 121 Ca -0.01 -0.30 -0.05 0.00 -0.55 0.00 0.00 56.30 55.39 3e1c h ASN 121 Cb 1.11 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 39.45 3e1c h ASN 121 CO 0.09 0.32 -0.02 -0.08 -1.65 0.00 0.00 177.43 176.09 3e1c h GLU 122 N -0.25 0.51 -0.52 0.81 4.57 -1.48 -0.64 114.58 117.58 3e1c h GLU 122 Ca 0.01 -0.11 0.02 0.00 -1.18 0.00 0.00 59.36 58.09 3e1c h GLU 122 Cb 0.30 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.79 3e1c h GLU 122 CO 0.00 0.56 0.31 1.25 -1.18 0.00 0.00 179.01 179.95 3e1c h LEU 123 N 0.49 0.51 -0.30 1.64 5.85 -1.18 -0.63 115.31 121.68 3e1c h LEU 123 Ca 0.10 0.00 0.07 0.00 0.84 0.00 0.00 57.88 58.89 3e1c h LEU 123 Cb 0.36 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.21 3e1c h LEU 123 CO 0.01 0.36 -0.16 -1.28 -0.34 0.00 0.00 178.44 177.03 3e1c h SER 124 N 0.62 -0.53 -0.95 1.25 0.87 -1.04 -2.26 113.55 111.51 3e1c h SER 124 Ca 0.21 0.12 0.11 0.00 -1.23 0.00 0.00 61.79 61.00 3e1c h SER 124 Cb 0.01 0.29 -0.08 0.00 -0.44 0.00 0.00 62.40 62.18 3e1c h SER 124 CO -0.09 -0.20 0.59 0.44 -0.53 0.00 0.00 176.83 177.04 3e1c h ASP 125 N -0.12 0.87 -0.76 6.23 3.32 -1.07 -2.70 116.42 122.18 3e1c h ASP 125 Ca 0.16 0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.20 3e1c h ASP 125 Cb 0.36 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 3e1c h ASP 125 CO -0.37 0.48 0.26 0.00 -1.72 0.00 0.00 179.24 177.89 3e1c h ALA 126 N 1.51 0.99 -0.54 3.45 0.00 -0.55 -1.58 119.26 122.53 3e1c h ALA 126 Ca 0.46 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 3e1c h ALA 126 Cb 0.42 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3e1c h ALA 126 CO -0.25 0.65 0.13 0.00 0.00 0.00 0.00 179.25 179.78 3e1c h ALA 127 N 1.14 1.21 0.00 0.00 0.00 -1.39 -2.68 119.26 117.53 3e1c h ALA 127 Ca 0.25 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3e1c h ALA 127 Cb 0.27 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3e1c h ALA 127 CO -0.01 0.54 0.00 0.39 0.00 0.00 0.00 179.25 180.17 3e1c n GLU 128 N -4.27 0.56 -0.01 0.00 1.02 -0.89 -4.86 120.64 112.18 3e1c n GLU 128 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 3e1c n GLU 128 Cb 0.23 -1.45 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 3e1c n GLU 128 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3e1c n ASN 129 N -0.95 0.00 -0.14 1.62 3.02 -0.74 -4.77 115.26 113.30 3e1c n ASN 129 Ca 0.12 0.00 0.17 0.00 -0.03 0.00 0.00 54.58 54.85 3e1c n ASN 129 Cb 0.06 -1.04 0.55 0.00 -0.61 0.00 0.00 39.78 38.74 3e1c n ASN 129 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 3e1c h LYS 130 N 0.00 0.30 -6.20 3.52 3.64 -1.67 -3.44 116.57 112.73 3e1c h LYS 130 Ca 0.00 -0.02 -0.61 0.00 -1.27 0.00 0.00 60.65 58.75 3e1c h LYS 130 Cb 0.00 -0.07 0.16 0.00 -0.41 0.00 0.00 32.23 31.91 3e1c h LYS 130 CO 0.00 0.20 -0.68 0.41 -2.27 0.00 0.00 179.45 177.11 3e1c n GLY 131 N -1.56 -2.12 0.10 5.01 0.00 -0.67 -4.83 105.19 101.12 3e1c n GLY 131 Ca 0.14 -0.02 -0.04 0.00 0.00 0.00 0.00 46.02 46.10 3e1c n GLY 131 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3e1c h THR 132 N 0.47 1.58 -0.14 2.61 2.02 -1.91 0.15 112.91 117.69 3e1c h THR 132 Ca -0.40 -2.76 -0.03 0.00 0.77 0.00 0.00 66.41 64.00 3e1c h THR 132 Cb 1.42 2.49 -0.00 0.00 -1.74 0.00 0.00 68.15 70.32 3e1c h THR 132 CO 0.48 0.79 -0.01 0.00 0.37 0.00 0.00 175.52 177.15 3e1c h ALA 133 N 1.20 0.19 -0.72 6.16 0.00 -1.92 -2.94 119.26 121.23 3e1c h ALA 133 Ca -0.01 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 3e1c h ALA 133 Cb 1.42 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.13 3e1c h ALA 133 CO 0.10 -0.09 0.26 0.28 0.00 0.00 0.00 179.25 179.81 3e1c h VAL 134 N -0.02 1.25 -0.30 0.00 2.07 -1.81 -3.01 116.25 114.43 3e1c h VAL 134 Ca 0.04 -0.81 0.05 0.00 0.82 0.00 0.00 66.70 66.80 3e1c h VAL 134 Cb 0.41 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 3e1c h VAL 134 CO 0.01 0.32 0.00 0.50 0.02 0.00 0.00 177.57 178.42 3e1c h LYS 135 N 1.05 0.09 -0.90 1.57 3.64 -0.73 -1.93 116.57 119.34 3e1c h LYS 135 Ca 0.24 -0.01 0.21 0.00 -1.27 0.00 0.00 60.65 59.82 3e1c h LYS 135 Cb 0.23 -0.02 -0.12 0.00 -0.41 0.00 0.00 32.23 31.92 3e1c h LYS 135 CO -0.02 0.06 0.44 0.87 -2.27 0.00 0.00 179.45 178.53 3e1c h LYS 136 N 0.09 0.47 0.39 1.90 1.57 -1.38 0.25 116.57 119.86 3e1c h LYS 136 Ca 0.14 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 3e1c h LYS 136 Cb 0.19 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.40 3e1c h LYS 136 CO -0.24 0.31 -0.19 -0.09 -0.57 0.00 0.00 179.45 178.67 3e1c h ARG 137 N 0.48 -0.51 -0.94 3.15 1.12 -1.40 -2.63 114.38 113.66 3e1c h ARG 137 Ca 0.55 0.03 0.12 0.00 -1.11 0.00 0.00 59.98 59.58 3e1c h ARG 137 Cb 0.99 0.11 -0.07 0.00 -0.01 0.00 0.00 29.97 30.99 3e1c h ARG 137 CO -0.48 -0.23 0.60 0.93 -3.11 0.00 0.00 179.97 177.68 3e1c h GLU 138 N -0.73 0.84 -0.76 0.20 4.39 -1.33 0.18 114.58 117.37 3e1c h GLU 138 Ca -0.05 -0.05 0.15 0.00 0.34 0.00 0.00 59.36 59.74 3e1c h GLU 138 Cb 0.51 -0.19 -0.10 0.00 -0.10 0.00 0.00 28.75 28.87 3e1c h GLU 138 CO 0.09 0.56 0.30 -0.44 -1.16 0.00 0.00 179.01 178.35 3e1c h ASP 139 N 0.87 0.26 0.64 1.42 3.45 -0.84 -0.10 116.42 122.12 3e1c h ASP 139 Ca 0.46 0.11 -0.08 0.00 0.43 0.00 0.00 57.03 57.95 3e1c h ASP 139 Cb 0.54 0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 39.40 3e1c h ASP 139 CO -0.22 0.09 -0.40 0.58 -1.57 0.00 0.00 179.24 177.72 3e1c h VAL 140 N 0.43 1.05 0.01 -1.35 2.07 -0.32 0.10 116.25 118.24 3e1c h VAL 140 Ca 0.42 -1.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.44 3e1c h VAL 140 Cb 0.65 1.86 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 3e1c h VAL 140 CO -0.42 0.39 -0.06 0.45 0.02 0.00 0.00 177.57 177.96 3e1c h HIS 141 N 0.00 0.05 -1.42 1.57 3.86 -0.37 0.28 115.15 119.12 3e1c h HIS 141 Ca -0.00 -0.03 0.48 0.00 -1.16 0.00 0.00 60.37 59.66 3e1c h HIS 141 Cb 0.82 -0.00 -0.14 0.00 1.06 0.00 0.00 27.41 29.15 3e1c h HIS 141 CO 0.00 0.92 0.92 0.54 0.86 0.00 0.00 177.93 181.17 3e1c n ARG 142 N -4.62 -0.03 0.00 2.45 1.74 -0.14 -2.31 116.66 113.75 3e1c n ARG 142 Ca -0.10 1.24 0.00 0.00 -0.77 0.00 0.00 57.85 58.22 3e1c n ARG 142 Cb 0.46 -2.47 0.00 0.00 -1.02 0.00 0.00 32.46 29.42 3e1c n ARG 142 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 3e1c n MET 143 N -4.66 0.00 -0.00 5.56 1.56 0.35 -4.66 117.12 115.27 3e1c n MET 143 Ca 0.41 0.00 -0.03 0.00 -0.27 0.00 0.00 57.70 57.80 3e1c n MET 143 Cb 1.60 -0.30 -0.11 0.00 2.15 0.00 0.00 33.22 36.56 3e1c n MET 143 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 3e1c n ALA 144 N -1.17 1.79 -0.05 -5.12 0.00 0.96 -2.12 120.51 114.81 3e1c n ALA 144 Ca 0.00 -0.70 -0.07 0.00 0.00 0.00 0.00 53.44 52.67 3e1c n ALA 144 Cb 0.00 -0.83 0.10 0.00 0.00 0.00 0.00 19.45 18.72 3e1c n ALA 144 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3e1c h GLU 145 N 0.00 0.67 -0.17 0.00 4.57 -1.60 -2.13 114.58 115.93 3e1c h GLU 145 Ca -0.24 -0.30 0.04 0.00 -1.18 0.00 0.00 59.36 57.69 3e1c h GLU 145 Cb 1.76 -0.02 -0.07 0.00 -0.16 0.00 0.00 28.75 30.27 3e1c h GLU 145 CO 0.05 0.89 -0.49 0.00 -1.18 0.00 0.00 179.01 178.28 3e1c h ALA 146 N 1.09 -0.74 0.00 2.92 0.00 -1.58 -3.22 119.26 117.74 3e1c h ALA 146 Ca 0.07 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3e1c h ALA 146 Cb 0.80 0.93 0.00 0.00 0.00 0.00 0.00 17.79 19.51 3e1c h ALA 146 CO 0.07 -1.01 0.00 0.09 0.00 0.00 0.00 179.25 178.39 3e1c n ASN 147 N -5.43 0.00 -0.46 0.00 3.02 -0.82 -2.17 115.26 109.40 3e1c n ASN 147 Ca -0.05 -0.60 0.38 0.00 -0.03 0.00 0.00 54.58 54.28 3e1c n ASN 147 Cb 0.37 0.00 0.66 0.00 -0.61 0.00 0.00 39.78 40.20 3e1c n ASN 147 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 3e1c h LYS 148 N 0.00 0.07 -0.01 3.52 3.64 -1.52 0.04 116.57 122.30 3e1c h LYS 148 Ca 0.00 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3e1c h LYS 148 Cb 0.00 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 3e1c h LYS 148 CO 0.00 0.05 -0.15 0.00 -2.27 0.00 0.00 179.45 177.08 3e1c n ALA 149 N -2.55 2.87 -0.01 5.00 0.00 -0.92 -4.25 120.51 120.64 3e1c n ALA 149 Ca 0.38 -0.43 -0.01 0.00 0.00 0.00 0.00 53.44 53.38 3e1c n ALA 149 Cb 1.47 -1.13 -0.03 0.00 0.00 0.00 0.00 19.45 19.76 3e1c n ALA 149 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3e1c n PHE 150 N -0.25 0.00 0.00 0.00 7.35 -0.06 -5.22 117.46 119.28 3e1c n PHE 150 Ca 0.15 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.84 3e1c n PHE 150 Cb 0.36 -0.14 0.00 0.00 0.35 0.00 0.00 39.48 40.05 3e1c n PHE 150 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00