#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j1e s ASP 2 N 0.00 6.21 0.00 3.17 3.68 -1.26 -4.85 116.67 123.62 1j1e s ASP 2 Ca 0.00 -1.01 0.30 0.00 2.13 0.00 0.00 52.55 53.97 1j1e s ASP 2 Cb 0.00 -2.27 1.56 0.00 -1.45 0.00 0.00 42.92 40.76 1j1e s ASP 2 CO 0.00 -0.86 2.05 0.47 0.13 0.00 0.00 175.17 176.96 1j1e n ASP 3 N 6.01 0.26 -0.01 -0.34 8.00 -1.26 -3.70 116.55 125.51 1j1e n ASP 3 Ca -0.08 -0.73 -0.17 0.00 0.71 0.00 0.00 54.79 54.53 1j1e n ASP 3 Cb 0.45 -0.09 -0.11 0.00 -0.02 0.00 0.00 41.12 41.35 1j1e n ASP 3 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 1j1e h ILE 4 N 0.37 1.45 -0.87 0.53 2.10 -1.92 -2.88 117.51 116.28 1j1e h ILE 4 Ca 0.00 -1.99 -0.01 0.00 1.08 0.00 0.00 64.86 63.94 1j1e h ILE 4 Cb 0.21 2.58 -0.04 0.00 -1.09 0.00 0.00 36.82 38.47 1j1e h ILE 4 CO 0.00 0.57 0.52 1.88 -1.08 0.00 0.00 178.15 180.04 1j1e h TYR 5 N -0.18 1.16 -0.79 2.19 0.05 -1.98 -0.85 116.97 116.58 1j1e h TYR 5 Ca -0.06 -0.01 0.02 0.00 0.05 0.00 0.00 58.73 58.74 1j1e h TYR 5 Cb 1.20 -0.38 -0.04 0.00 1.01 0.00 0.00 36.73 38.52 1j1e h TYR 5 CO 0.15 0.78 0.52 -0.22 -1.05 0.00 0.00 178.16 178.34 1j1e h LYS 6 N 1.21 0.98 0.00 4.88 1.63 -1.70 0.11 116.57 123.69 1j1e h LYS 6 Ca 0.31 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 60.05 1j1e h LYS 6 Cb -0.03 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.38 1j1e h LYS 6 CO -0.06 0.65 0.00 0.00 -3.45 0.00 0.00 179.45 176.59 1j1e n ALA 7 N -2.42 1.97 0.07 5.00 0.00 -0.40 -2.21 120.51 122.52 1j1e n ALA 7 Ca 0.10 -0.03 0.09 0.00 0.00 0.00 0.00 53.44 53.59 1j1e n ALA 7 Cb 0.08 -1.38 -0.04 0.00 0.00 0.00 0.00 19.45 18.11 1j1e n ALA 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j1e n ALA 8 N -1.62 2.40 -0.07 0.00 0.00 0.30 -3.84 120.51 117.69 1j1e n ALA 8 Ca 0.05 -0.35 -0.12 0.00 0.00 0.00 0.00 53.44 53.02 1j1e n ALA 8 Cb 0.28 -1.02 -0.05 0.00 0.00 0.00 0.00 19.45 18.65 1j1e n ALA 8 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1j1e h VAL 9 N 0.00 1.30 -0.16 0.00 2.07 -0.83 -2.65 116.25 115.97 1j1e h VAL 9 Ca -0.04 -1.10 0.05 0.00 0.82 0.00 0.00 66.70 66.43 1j1e h VAL 9 Cb 1.15 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 32.49 1j1e h VAL 9 CO 0.01 0.33 0.14 -0.33 0.02 0.00 0.00 177.57 177.75 1j1e h GLU 10 N 0.13 0.00 -0.38 1.57 5.08 -1.66 0.53 114.58 119.85 1j1e h GLU 10 Ca 0.05 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.31 1j1e h GLU 10 Cb 0.54 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1j1e h GLU 10 CO 0.03 0.00 -0.16 0.37 -1.00 0.00 0.00 179.01 178.24 1j1e h GLN 11 N 0.00 0.78 -4.28 2.33 -0.00 -1.58 -3.44 115.11 108.93 1j1e h GLN 11 Ca 0.08 -0.33 -0.58 0.00 -0.00 0.00 0.00 58.65 57.81 1j1e h GLN 11 Cb 0.36 -0.03 -0.01 0.00 0.00 0.00 0.00 27.48 27.80 1j1e h GLN 11 CO -0.00 0.95 0.74 1.28 0.00 0.00 0.00 178.83 181.80 1j1e n LEU 12 N -4.29 0.68 -4.73 -2.39 4.77 0.18 -4.80 117.00 106.42 1j1e n LEU 12 Ca -0.02 0.65 -0.36 0.00 -0.03 0.00 0.00 56.01 56.25 1j1e n LEU 12 Cb 0.40 -0.64 0.07 0.00 -2.33 0.00 0.00 43.42 40.93 1j1e n LEU 12 CO 0.44 -0.57 0.85 0.42 -1.33 0.00 0.00 177.39 177.20 1j1e s THR 13 N 3.32 2.23 -0.10 -5.08 -4.23 -1.26 -4.74 115.64 105.78 1j1e s THR 13 Ca 0.81 0.13 0.21 0.00 -1.18 0.00 0.00 61.69 61.66 1j1e s THR 13 Cb -1.07 -2.92 0.21 0.00 1.34 0.00 0.00 72.50 70.06 1j1e s THR 13 CO 0.52 -0.04 1.62 -0.33 -0.54 0.00 0.00 174.62 175.85 1j1e h GLU 14 N 0.29 0.00 0.00 3.99 4.39 -1.95 0.54 114.58 121.84 1j1e h GLU 14 Ca -0.50 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 58.96 1j1e h GLU 14 Cb 1.31 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.93 1j1e h GLU 14 CO 0.52 0.00 -1.29 1.49 -1.16 0.00 0.00 179.01 178.57 1j1e h GLU 15 N 0.00 0.00 0.01 2.33 4.81 -1.99 -2.97 114.58 116.78 1j1e h GLU 15 Ca 0.00 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1j1e h GLU 15 Cb 0.13 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.51 1j1e h GLU 15 CO 0.00 0.80 -0.00 1.96 -0.73 0.00 0.00 179.01 181.03 1j1e h GLN 16 N 0.00 -0.01 -0.42 1.92 1.08 -0.25 -2.43 115.11 115.00 1j1e h GLN 16 Ca -0.12 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.08 1j1e h GLN 16 Cb 1.87 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 29.28 1j1e h GLN 16 CO 0.11 0.37 0.28 0.87 -0.95 0.00 0.00 178.83 179.51 1j1e h LYS 17 N -0.39 0.55 -0.50 1.46 1.57 -1.52 -1.28 116.57 116.46 1j1e h LYS 17 Ca -0.00 -0.03 0.10 0.00 -1.87 0.00 0.00 60.65 58.84 1j1e h LYS 17 Cb 0.39 -0.12 -0.08 0.00 0.08 0.00 0.00 32.23 32.49 1j1e h LYS 17 CO 0.00 0.36 -0.00 -0.97 -0.57 0.00 0.00 179.45 178.27 1j1e h ASN 18 N 0.56 -0.22 -0.94 0.86 -0.00 -1.48 0.73 115.58 115.10 1j1e h ASN 18 Ca 0.16 0.12 -0.00 0.00 -0.00 0.00 0.00 56.30 56.57 1j1e h ASN 18 Cb -0.06 0.21 -0.05 0.00 -0.00 0.00 0.00 38.32 38.43 1j1e h ASN 18 CO -0.04 -0.07 0.57 -0.08 -0.00 0.00 0.00 177.43 177.81 1j1e h GLU 19 N 0.11 1.27 0.72 6.67 4.81 -0.92 -2.57 114.58 124.67 1j1e h GLU 19 Ca 0.25 -0.11 -0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1j1e h GLU 19 Cb 0.38 -0.27 0.01 0.00 0.63 0.00 0.00 28.75 29.49 1j1e h GLU 19 CO -0.42 0.88 -0.34 0.74 -0.73 0.00 0.00 179.01 179.14 1j1e h PHE 20 N 1.29 -0.89 -1.00 0.92 0.04 0.11 -2.50 116.94 114.92 1j1e h PHE 20 Ca 0.34 -0.02 0.34 0.00 2.80 0.00 0.00 57.97 61.43 1j1e h PHE 20 Cb -0.07 0.29 -0.18 0.00 2.20 0.00 0.00 35.95 38.20 1j1e h PHE 20 CO 0.00 -0.55 0.27 -0.22 -0.60 0.00 0.00 178.31 177.21 1j1e h LYS 21 N -1.12 0.01 0.49 1.51 1.63 0.24 1.09 116.57 120.42 1j1e h LYS 21 Ca -0.10 -0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.69 1j1e h LYS 21 Cb 0.74 -0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.34 1j1e h LYS 21 CO 0.16 0.01 -0.45 0.00 -3.45 0.00 0.00 179.45 175.72 1j1e h ALA 22 N 1.99 -1.02 -1.01 5.00 0.00 -1.32 0.40 119.26 123.30 1j1e h ALA 22 Ca 0.72 -0.17 0.16 0.00 0.00 0.00 0.00 54.91 55.61 1j1e h ALA 22 Cb 1.71 0.63 -0.10 0.00 0.00 0.00 0.00 17.79 20.03 1j1e h ALA 22 CO -0.85 -1.11 0.62 0.00 0.00 0.00 0.00 179.25 177.91 1j1e h ALA 23 N -0.69 1.61 -0.04 0.00 0.00 0.15 -1.91 119.26 118.38 1j1e h ALA 23 Ca -0.05 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1j1e h ALA 23 Cb 0.81 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1j1e h ALA 23 CO -0.04 0.07 -0.03 0.35 0.00 0.00 0.00 179.25 179.60 1j1e h PHE 24 N 0.87 0.10 -1.01 0.00 3.04 -0.13 -0.77 116.94 119.04 1j1e h PHE 24 Ca 0.54 -0.03 0.19 0.00 3.98 0.00 0.00 57.97 62.65 1j1e h PHE 24 Cb 0.72 -0.02 -0.11 0.00 2.56 0.00 0.00 35.95 39.10 1j1e h PHE 24 CO -0.00 0.54 0.61 -0.44 -2.02 0.00 0.00 178.31 177.00 1j1e h ASP 25 N -0.36 0.79 1.23 0.41 3.32 0.54 0.31 116.42 122.66 1j1e h ASP 25 Ca 0.01 0.10 -0.12 0.00 0.02 0.00 0.00 57.03 57.03 1j1e h ASP 25 Cb 0.52 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 1j1e h ASP 25 CO 0.01 0.28 -0.81 -0.29 -1.72 0.00 0.00 179.24 176.71 1j1e h ILE 26 N 0.77 0.74 0.34 0.35 2.10 -1.39 -1.48 117.51 118.94 1j1e h ILE 26 Ca 0.58 -2.13 -0.02 0.00 1.08 0.00 0.00 64.86 64.37 1j1e h ILE 26 Cb 0.89 2.28 0.00 0.00 -1.09 0.00 0.00 36.82 38.90 1j1e h ILE 26 CO -0.38 0.42 -0.16 0.15 -1.08 0.00 0.00 178.15 177.10 1j1e h PHE 27 N 0.00 -0.42 0.00 2.19 3.57 0.80 -2.95 116.94 120.12 1j1e h PHE 27 Ca -0.05 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.43 1j1e h PHE 27 Cb 1.44 0.14 -0.00 0.00 2.79 0.00 0.00 35.95 40.32 1j1e h PHE 27 CO 0.00 -0.15 -0.01 0.28 -2.23 0.00 0.00 178.31 176.19 1j1e h VAL 28 N -0.63 0.03 -1.79 1.41 2.07 -0.59 -3.45 116.25 113.29 1j1e h VAL 28 Ca -0.05 -0.56 -0.64 0.00 0.82 0.00 0.00 66.70 66.28 1j1e h VAL 28 Cb 0.46 1.54 0.01 0.00 -1.52 0.00 0.00 31.29 31.77 1j1e h VAL 28 CO 0.08 0.01 1.18 -0.11 0.02 0.00 0.00 177.57 178.75 1j1e n LEU 29 N -3.11 3.08 0.00 2.57 7.94 -0.56 -2.11 117.00 124.81 1j1e n LEU 29 Ca 0.01 0.80 0.00 0.00 -1.11 0.00 0.00 56.01 55.71 1j1e n LEU 29 Cb 0.32 -1.34 0.00 0.00 0.53 0.00 0.00 43.42 42.92 1j1e n LEU 29 CO 0.28 -0.28 0.00 0.61 -1.11 0.00 0.00 177.39 176.89 1j1e n GLY 30 N 4.93 1.83 3.45 -3.96 0.00 -1.26 -5.01 105.19 105.17 1j1e n GLY 30 Ca 0.27 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.95 1j1e n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j1e s ALA 31 N -1.41 3.00 0.41 4.61 0.00 -0.90 -4.99 121.76 122.47 1j1e s ALA 31 Ca 0.00 -0.96 0.10 0.00 0.00 0.00 0.00 51.96 51.11 1j1e s ALA 31 Cb 0.00 -1.70 0.92 0.00 0.00 0.00 0.00 23.12 22.34 1j1e s ALA 31 CO 0.00 -0.07 1.99 1.49 0.00 0.00 0.00 175.76 179.17 1j1e h GLU 32 N 7.32 0.51 -0.67 0.00 4.81 -1.96 0.51 114.58 125.10 1j1e h GLU 32 Ca -0.35 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 58.89 1j1e h GLU 32 Cb 1.18 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 30.41 1j1e h GLU 32 CO 0.61 0.34 0.44 0.22 -0.73 0.00 0.00 179.01 179.89 1j1e h ASP 33 N 0.53 0.67 -0.31 1.04 3.58 -1.96 -3.45 116.42 116.51 1j1e h ASP 33 Ca 0.26 -0.01 -0.13 0.00 0.42 0.00 0.00 57.03 57.57 1j1e h ASP 33 Cb 0.35 -0.15 -0.05 0.00 1.72 0.00 0.00 39.33 41.20 1j1e h ASP 33 CO -0.08 0.45 -0.12 0.61 -2.88 0.00 0.00 179.24 177.23 1j1e n GLY 34 N -1.45 0.88 3.20 -0.78 0.00 0.17 -5.01 105.19 102.20 1j1e n GLY 34 Ca 0.09 -0.64 -0.13 0.00 0.00 0.00 0.00 46.02 45.34 1j1e n GLY 34 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1j1e s SER 35 N -2.82 1.51 -0.24 1.61 0.01 -1.26 -4.97 113.70 107.54 1j1e s SER 35 Ca 0.00 -0.95 -0.29 0.00 1.31 0.00 0.00 55.95 56.02 1j1e s SER 35 Cb 0.00 0.02 -0.02 0.00 0.21 0.00 0.00 66.02 66.24 1j1e s SER 35 CO 0.00 -0.35 1.48 -0.63 0.41 0.00 0.00 173.24 174.15 1j1e s ILE 36 N -3.14 3.89 0.51 1.44 1.01 0.52 -4.72 121.20 120.70 1j1e s ILE 36 Ca 0.12 1.01 0.03 0.00 0.00 0.00 0.00 60.65 61.81 1j1e s ILE 36 Cb 0.02 -3.88 0.03 0.00 0.01 0.00 0.00 42.46 38.64 1j1e s ILE 36 CO -0.01 -0.34 0.25 -1.54 0.00 0.00 0.00 174.94 173.30 1j1e n SER 37 N 7.96 2.92 0.18 3.58 3.41 -1.26 0.52 113.62 130.93 1j1e n SER 37 Ca 0.17 -2.92 -0.14 0.00 -0.26 0.00 0.00 58.87 55.71 1j1e n SER 37 Cb 0.46 0.10 -0.08 0.00 -0.26 0.00 0.00 64.21 64.43 1j1e n SER 37 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1j1e h THR 38 N 0.88 0.72 -0.66 6.66 1.35 -1.94 0.16 112.91 120.08 1j1e h THR 38 Ca -0.36 -0.26 0.14 0.00 -0.55 0.00 0.00 66.41 65.38 1j1e h THR 38 Cb 1.22 0.87 -0.11 0.00 -1.73 0.00 0.00 68.15 68.39 1j1e h THR 38 CO 0.58 0.05 -0.02 0.50 -0.25 0.00 0.00 175.52 176.38 1j1e h LYS 39 N -0.55 0.09 0.69 4.72 3.64 -2.00 0.78 116.57 123.95 1j1e h LYS 39 Ca -0.04 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 1j1e h LYS 39 Cb 0.41 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1j1e h LYS 39 CO 0.07 0.06 -0.33 0.93 -2.27 0.00 0.00 179.45 177.91 1j1e h GLU 40 N 0.10 -0.90 -0.47 1.90 4.39 -1.93 -2.93 114.58 114.74 1j1e h GLU 40 Ca 0.35 0.06 0.14 0.00 0.34 0.00 0.00 59.36 60.24 1j1e h GLU 40 Cb 0.57 0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 29.41 1j1e h GLU 40 CO -0.59 -0.60 0.56 1.25 -1.16 0.00 0.00 179.01 178.48 1j1e h LEU 41 N -1.10 0.00 0.32 1.33 5.85 -0.58 -2.28 115.31 118.86 1j1e h LEU 41 Ca -0.10 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.61 1j1e h LEU 41 Cb 0.71 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.75 1j1e h LEU 41 CO 0.16 0.00 -0.16 1.23 -0.34 0.00 0.00 178.44 179.33 1j1e h GLY 42 N 0.00 -0.45 -0.99 3.75 0.00 -0.66 -1.38 103.07 103.33 1j1e h GLY 42 Ca 0.22 0.17 0.36 0.00 0.00 0.00 0.00 47.33 48.08 1j1e h GLY 42 CO -0.00 -0.16 0.32 1.70 0.00 0.00 0.00 176.54 178.39 1j1e h LYS 43 N -0.63 0.00 0.12 4.80 3.64 -1.33 0.54 116.57 123.71 1j1e h LYS 43 Ca -0.04 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1j1e h LYS 43 Cb 0.33 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1j1e h LYS 43 CO 0.07 0.00 -0.06 0.28 -2.27 0.00 0.00 179.45 177.48 1j1e h VAL 44 N 0.00 1.06 -0.60 2.00 2.07 -1.55 -1.39 116.25 117.83 1j1e h VAL 44 Ca 0.74 -1.19 0.12 0.00 0.82 0.00 0.00 66.70 67.19 1j1e h VAL 44 Cb 1.81 1.75 -0.10 0.00 -1.52 0.00 0.00 31.29 33.23 1j1e h VAL 44 CO -0.84 0.26 0.03 0.24 0.02 0.00 0.00 177.57 177.28 1j1e h MET 45 N -0.76 0.14 -0.79 1.57 2.86 0.03 0.29 114.93 118.27 1j1e h MET 45 Ca -0.02 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1j1e h MET 45 Cb 0.55 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.14 1j1e h MET 45 CO 0.03 0.09 0.50 0.00 1.06 0.00 0.00 176.91 178.59 1j1e h ARG 46 N 0.15 1.05 0.00 1.72 3.08 -0.98 -0.16 114.38 119.24 1j1e h ARG 46 Ca 0.31 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1j1e h ARG 46 Cb 0.50 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.32 1j1e h ARG 46 CO -0.49 0.72 0.14 -1.33 -1.07 0.00 0.00 179.97 177.94 1j1e n MET 47 N -4.40 0.06 -0.08 0.04 2.81 0.10 -5.00 117.12 110.65 1j1e n MET 47 Ca 0.09 0.50 -0.14 0.00 -1.81 0.00 0.00 57.70 56.33 1j1e n MET 47 Cb 0.04 -1.83 -0.05 0.00 -0.71 0.00 0.00 33.22 30.67 1j1e n MET 47 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1j1e n LEU 48 N -1.78 1.71 0.00 4.03 4.77 -0.07 -5.09 117.00 120.57 1j1e n LEU 48 Ca -0.01 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 1j1e n LEU 48 Cb 0.16 -0.67 0.00 0.00 -2.33 0.00 0.00 43.42 40.58 1j1e n LEU 48 CO 0.04 -0.04 0.00 -3.20 -1.33 0.00 0.00 177.39 172.86 1j1e n ASN 51 N -4.18 0.00 -3.18 -1.43 5.15 -1.26 -5.14 115.26 105.22 1j1e n ASN 51 Ca -0.24 0.00 -0.21 0.00 -0.60 0.00 0.00 54.58 53.53 1j1e n ASN 51 Cb 0.58 0.00 0.19 0.00 -0.53 0.00 0.00 39.78 40.02 1j1e n ASN 51 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1j1e n PRO 52 N 0.00 -3.45 -2.53 1.20 -0.04 -1.26 -5.04 135.00 123.88 1j1e n PRO 52 Ca 0.00 -1.09 -0.32 0.00 -0.04 0.00 0.00 63.50 62.05 1j1e n PRO 52 Cb 0.00 -1.25 -0.04 0.00 -0.04 0.00 0.00 33.50 32.17 1j1e n PRO 52 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1j1e s THR 53 N -2.00 4.50 0.36 0.52 -1.32 -1.26 -4.96 115.64 111.48 1j1e s THR 53 Ca 0.48 1.27 0.04 0.00 -1.21 0.00 0.00 61.69 62.27 1j1e s THR 53 Cb -0.07 -3.69 0.21 0.00 -1.51 0.00 0.00 72.50 67.44 1j1e s THR 53 CO 0.39 -0.58 1.95 1.55 -2.21 0.00 0.00 174.62 175.71 1j1e h PRO 54 N 1.21 0.61 0.82 7.08 0.13 -1.98 -1.70 132.00 138.17 1j1e h PRO 54 Ca -0.47 -0.08 -0.04 0.00 -0.87 0.00 0.00 66.00 64.53 1j1e h PRO 54 Cb 1.18 -0.11 0.01 0.00 0.13 0.00 0.00 31.00 32.21 1j1e h PRO 54 CO 0.61 0.51 -0.39 0.93 -0.23 0.00 0.00 178.00 179.43 1j1e h GLU 55 N 0.61 -1.06 -0.64 0.86 4.39 -1.96 0.99 114.58 117.77 1j1e h GLU 55 Ca 0.15 0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.90 1j1e h GLU 55 Cb 0.13 0.24 -0.03 0.00 -0.10 0.00 0.00 28.75 28.99 1j1e h GLU 55 CO -0.01 -0.71 0.33 1.05 -1.16 0.00 0.00 179.01 178.51 1j1e h GLU 56 N -1.20 0.89 -0.34 2.33 4.11 -1.92 6.51 114.58 124.95 1j1e h GLU 56 Ca -0.11 -0.10 -0.08 0.00 0.07 0.00 0.00 59.36 59.13 1j1e h GLU 56 Cb 0.84 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1j1e h GLU 56 CO 0.18 0.67 -0.11 -0.07 0.07 0.00 0.00 179.01 179.76 1j1e h LEU 57 N 0.90 0.69 0.24 3.06 3.38 -1.29 4.75 115.31 127.03 1j1e h LEU 57 Ca 0.23 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 1j1e h LEU 57 Cb 0.06 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1j1e h LEU 57 CO -0.03 0.91 -0.20 -0.61 0.09 0.00 0.00 178.44 178.59 1j1e h GLN 58 N 0.46 -0.44 0.00 1.13 5.75 0.29 0.95 115.11 123.24 1j1e h GLN 58 Ca 0.08 0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.61 1j1e h GLN 58 Cb 0.62 0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.27 1j1e h GLN 58 CO 0.04 -0.30 0.00 0.93 -2.65 0.00 0.00 178.83 176.85 1j1e h GLU 59 N -0.46 0.00 0.16 1.69 5.08 1.43 0.49 114.58 122.98 1j1e h GLU 59 Ca -0.01 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.09 1j1e h GLU 59 Cb 0.42 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.68 1j1e h GLU 59 CO -0.03 0.00 -1.22 1.98 -1.00 0.00 0.00 179.01 178.74 1j1e h MET 60 N 0.00 0.35 0.00 2.33 4.05 1.19 -2.53 114.93 120.32 1j1e h MET 60 Ca 0.00 -0.60 0.00 0.00 -0.28 0.00 0.00 59.70 58.82 1j1e h MET 60 Cb 0.07 0.22 0.00 0.00 -0.80 0.00 0.00 31.60 31.09 1j1e h MET 60 CO 0.00 1.28 0.00 -0.89 0.23 0.00 0.00 176.91 177.53 1j1e n ILE 61 N -3.93 0.53 -0.07 1.77 5.41 0.30 -2.95 119.36 120.43 1j1e n ILE 61 Ca -0.19 0.13 -0.12 0.00 1.00 0.00 0.00 62.75 63.58 1j1e n ILE 61 Cb 0.93 -0.93 -0.10 0.00 -0.71 0.00 0.00 39.64 38.83 1j1e n ILE 61 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 1j1e h ASP 62 N 0.00 0.00 -0.92 4.38 5.19 0.13 -3.18 116.42 122.01 1j1e h ASP 62 Ca 0.00 -0.73 0.21 0.00 -0.62 0.00 0.00 57.03 55.89 1j1e h ASP 62 Cb 0.09 0.00 -0.07 0.00 0.18 0.00 0.00 39.33 39.53 1j1e h ASP 62 CO 0.00 0.95 0.61 -0.08 -3.12 0.00 0.00 179.24 177.59 1j1e h GLU 63 N -1.00 0.40 0.00 3.56 4.81 -1.50 -3.12 114.58 117.74 1j1e h GLU 63 Ca -0.03 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.05 1j1e h GLU 63 Cb 0.83 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.10 1j1e h GLU 63 CO -0.02 0.27 -0.74 0.28 -0.73 0.00 0.00 179.01 178.07 1j1e h VAL 64 N 0.42 0.83 -1.28 0.32 2.07 -1.73 -3.47 116.25 113.40 1j1e h VAL 64 Ca 0.49 -1.87 -0.80 0.00 0.82 0.00 0.00 66.70 65.33 1j1e h VAL 64 Cb 1.20 1.82 0.02 0.00 -1.52 0.00 0.00 31.29 32.81 1j1e h VAL 64 CO -0.19 0.28 0.73 -0.67 0.02 0.00 0.00 177.57 177.74 1j1e n ASP 65 N -4.54 1.68 -0.06 0.57 4.64 -1.18 -4.85 116.55 112.82 1j1e n ASP 65 Ca -0.20 1.13 -0.12 0.00 -1.38 0.00 0.00 54.79 54.23 1j1e n ASP 65 Cb 0.50 -1.02 -0.04 0.00 -1.04 0.00 0.00 41.12 39.51 1j1e n ASP 65 CO 0.00 0.00 0.00 -1.84 -0.82 0.00 0.00 177.20 174.54 1j1e n GLU 66 N 4.37 0.25 0.00 -0.67 0.28 -1.26 -4.51 120.64 119.10 1j1e n GLU 66 Ca 0.28 0.10 0.02 0.00 -0.16 0.00 0.00 57.16 57.39 1j1e n GLU 66 Cb 0.05 -0.97 0.09 0.00 1.43 0.00 0.00 31.44 32.05 1j1e n GLU 66 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1j1e n ASP 67 N -3.42 0.00 -1.22 -1.84 3.85 -1.26 -4.81 116.55 107.85 1j1e n ASP 67 Ca -0.23 -1.12 -0.11 0.00 -0.71 0.00 0.00 54.79 52.62 1j1e n ASP 67 Cb 0.67 0.00 -0.05 0.00 -1.35 0.00 0.00 41.12 40.39 1j1e n ASP 67 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1j1e n GLY 68 N 0.13 1.07 0.00 6.12 0.00 -1.26 -4.74 105.19 106.51 1j1e n GLY 68 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1j1e n GLY 68 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1j1e n SER 69 N -0.32 0.00 0.00 1.61 3.41 -1.26 -4.62 113.62 112.43 1j1e n SER 69 Ca -0.11 0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.54 1j1e n SER 69 Cb 0.40 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.31 1j1e n SER 69 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1j1e n GLY 70 N -1.01 0.32 3.43 5.00 0.00 -1.26 -4.92 105.19 106.76 1j1e n GLY 70 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 1j1e n GLY 70 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1j1e s THR 71 N -1.85 0.67 -0.23 2.61 -4.23 -1.26 -4.74 115.64 106.61 1j1e s THR 71 Ca 0.00 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.46 1j1e s THR 71 Cb 0.00 -2.53 -0.02 0.00 1.34 0.00 0.00 72.50 71.30 1j1e s THR 71 CO 0.00 0.00 0.01 -0.69 -0.54 0.00 0.00 174.62 173.40 1j1e s VAL 72 N -3.38 3.83 0.45 2.29 1.01 0.19 -4.57 120.40 120.21 1j1e s VAL 72 Ca 0.31 -0.34 -0.01 0.00 0.00 0.00 0.00 61.98 61.94 1j1e s VAL 72 Cb 0.05 -2.76 -0.01 0.00 0.00 0.00 0.00 36.38 33.66 1j1e s VAL 72 CO 0.15 0.39 0.69 -1.81 0.00 0.00 0.00 175.10 174.52 1j1e s ASP 73 N 1.47 5.95 0.13 3.32 1.01 -1.26 -0.35 116.67 126.93 1j1e s ASP 73 Ca 0.05 0.44 -0.31 0.00 0.71 0.00 0.00 52.55 53.44 1j1e s ASP 73 Cb -0.15 -1.74 -0.09 0.00 1.01 0.00 0.00 42.92 41.96 1j1e s ASP 73 CO 0.00 -0.64 1.56 0.15 0.21 0.00 0.00 175.17 176.45 1j1e h PHE 74 N 0.38 -1.45 -1.00 4.23 3.57 -1.96 2.44 116.94 123.15 1j1e h PHE 74 Ca -0.47 0.06 0.26 0.00 3.53 0.00 0.00 57.97 61.35 1j1e h PHE 74 Cb 1.24 0.66 -0.07 0.00 2.79 0.00 0.00 35.95 40.56 1j1e h PHE 74 CO 0.48 -0.51 0.67 -0.44 -2.23 0.00 0.00 178.31 176.28 1j1e h ASP 75 N -0.51 0.33 0.06 0.41 3.32 -1.99 0.79 116.42 118.83 1j1e h ASP 75 Ca 0.06 0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 1j1e h ASP 75 Cb 0.65 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.20 1j1e h ASP 75 CO -0.46 0.09 -0.03 -0.33 -1.72 0.00 0.00 179.24 176.79 1j1e h GLU 76 N 0.30 -0.08 -0.49 3.56 5.08 -0.64 -3.13 114.58 119.18 1j1e h GLU 76 Ca 0.54 0.01 0.14 0.00 -1.00 0.00 0.00 59.36 59.04 1j1e h GLU 76 Cb 1.53 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.78 1j1e h GLU 76 CO -0.19 0.51 0.50 0.35 -1.00 0.00 0.00 179.01 179.18 1j1e h PHE 77 N -0.88 0.00 -0.16 4.33 3.57 0.65 0.36 116.94 124.81 1j1e h PHE 77 Ca -0.01 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 1j1e h PHE 77 Cb 0.62 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.36 1j1e h PHE 77 CO 0.15 0.00 -0.23 1.25 -2.23 0.00 0.00 178.31 177.24 1j1e h LEU 78 N 0.00 0.48 -0.05 0.59 5.85 0.48 -2.80 115.31 119.86 1j1e h LEU 78 Ca 0.23 -0.52 0.01 0.00 0.84 0.00 0.00 57.88 58.45 1j1e h LEU 78 Cb 1.24 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.12 1j1e h LEU 78 CO -0.00 0.91 -0.02 0.58 -0.34 0.00 0.00 178.44 179.56 1j1e h VAL 79 N 0.07 0.93 -0.96 1.05 2.07 -0.26 -1.54 116.25 117.62 1j1e h VAL 79 Ca 0.02 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.76 1j1e h VAL 79 Cb 0.80 0.93 -0.08 0.00 -1.52 0.00 0.00 31.29 31.42 1j1e h VAL 79 CO 0.05 0.00 0.63 -0.03 0.02 0.00 0.00 177.57 178.24 1j1e h MET 80 N -0.01 0.41 -0.02 1.57 1.85 -1.32 0.25 114.93 117.66 1j1e h MET 80 Ca 0.03 -0.02 -0.26 0.00 -0.61 0.00 0.00 59.70 58.83 1j1e h MET 80 Cb 0.05 -0.09 0.02 0.00 0.43 0.00 0.00 31.60 32.01 1j1e h MET 80 CO -0.06 0.27 -1.00 0.52 -0.40 0.00 0.00 176.91 176.25 1j1e h MET 81 N 0.43 0.70 -0.28 0.39 2.07 -1.13 -2.85 114.93 114.25 1j1e h MET 81 Ca 0.51 -0.72 0.08 0.00 -2.07 0.00 0.00 59.70 57.50 1j1e h MET 81 Cb 1.26 0.20 -0.01 0.00 -1.87 0.00 0.00 31.60 31.18 1j1e h MET 81 CO -0.22 1.30 0.26 0.28 1.07 0.00 0.00 176.91 179.60 1j1e h VAL 82 N 0.41 0.55 0.34 -2.22 2.07 0.45 -1.42 116.25 116.42 1j1e h VAL 82 Ca -0.11 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 1j1e h VAL 82 Cb 1.64 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 1j1e h VAL 82 CO 0.20 0.00 -0.16 -0.09 0.02 0.00 0.00 177.57 177.53 1j1e h ARG 83 N 0.00 -0.44 -0.01 1.57 1.12 -1.04 -3.07 114.38 112.51 1j1e h ARG 83 Ca 0.13 0.03 0.00 0.00 -1.11 0.00 0.00 59.98 59.03 1j1e h ARG 83 Cb 0.65 0.10 -0.00 0.00 -0.01 0.00 0.00 29.97 30.71 1j1e h ARG 83 CO -0.00 -0.15 0.08 1.03 -3.11 0.00 0.00 179.97 177.82 1j1e h SER 84 N -1.00 0.00 0.16 -3.80 0.87 -1.15 -2.53 113.55 106.11 1j1e h SER 84 Ca -0.05 0.00 -0.26 0.00 -1.23 0.00 0.00 61.79 60.25 1j1e h SER 84 Cb 0.50 0.00 0.03 0.00 -0.44 0.00 0.00 62.40 62.48 1j1e h SER 84 CO 0.08 0.00 -1.12 0.24 -0.53 0.00 0.00 176.83 175.50 1j1e h MET 85 N 0.00 0.47 -5.13 2.24 2.86 -1.28 -3.43 114.93 110.66 1j1e h MET 85 Ca 0.00 -0.72 -0.66 0.00 -2.06 0.00 0.00 59.70 56.26 1j1e h MET 85 Cb 0.17 0.26 -0.16 0.00 0.06 0.00 0.00 31.60 31.92 1j1e h MET 85 CO -0.00 1.33 -0.09 0.15 1.06 0.00 0.00 176.91 179.37 1j1e s LYS 86 N -2.68 3.37 -0.04 1.72 -0.14 -0.95 -4.86 119.74 116.15 1j1e s LYS 86 Ca -0.11 -0.42 0.06 0.00 -1.36 0.00 0.00 55.97 54.14 1j1e s LYS 86 Cb 0.03 -3.89 0.09 0.00 -1.68 0.00 0.00 37.83 32.39 1j1e s LYS 86 CO 0.89 -0.78 1.03 -0.25 -0.76 0.00 0.00 175.35 175.48 1j1e n ASP 87 N 5.78 1.97 -3.04 2.83 10.43 -1.26 -4.76 116.55 128.49 1j1e n ASP 87 Ca -0.05 -2.31 -0.23 0.00 2.57 0.00 0.00 54.79 54.77 1j1e n ASP 87 Cb 0.48 -0.14 -0.03 0.00 1.84 0.00 0.00 41.12 43.26 1j1e n ASP 87 CO 0.00 0.00 0.00 -0.90 -1.07 0.00 0.00 177.20 175.23 1j1e n ASP 88 N -0.77 2.75 -4.56 -2.24 5.75 -1.26 -5.01 116.55 111.21 1j1e n ASP 88 Ca 0.05 -3.36 -0.23 0.00 -0.01 0.00 0.00 54.79 51.24 1j1e n ASP 88 Cb 0.40 -0.59 -0.06 0.00 -1.03 0.00 0.00 41.12 39.85 1j1e n ASP 88 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1j1e s SER 89 N -2.99 4.64 -0.79 -1.12 1.04 -1.26 -4.75 113.70 108.47 1j1e s SER 89 Ca 0.44 -0.25 -0.26 0.00 0.48 0.00 0.00 55.95 56.36 1j1e s SER 89 Cb 0.32 -2.55 0.03 0.00 0.10 0.00 0.00 66.02 63.92 1j1e s SER 89 CO -0.11 -3.15 1.33 -0.54 0.98 0.00 0.00 173.24 171.74 1j1e s LYS 90 N 7.78 3.25 0.35 4.02 1.02 -1.26 -4.89 119.74 130.01 1j1e s LYS 90 Ca 0.80 -0.40 0.04 0.00 0.02 0.00 0.00 55.97 56.43 1j1e s LYS 90 Cb -0.10 -4.42 0.04 0.00 -0.52 0.00 0.00 37.83 32.84 1j1e s LYS 90 CO 0.05 -2.18 0.36 0.41 -0.92 0.00 0.00 175.35 173.07 1j1e n GLY 91 N 5.69 2.49 3.81 -3.33 0.00 -1.26 -4.24 105.19 108.36 1j1e n GLY 91 Ca 0.09 -2.23 -0.34 0.00 0.00 0.00 0.00 46.02 43.54 1j1e n GLY 91 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j1e s LYS 92 N -3.51 3.21 0.30 1.61 -0.14 -1.26 -5.03 119.74 114.92 1j1e s LYS 92 Ca 0.27 -0.36 -0.25 0.00 -1.36 0.00 0.00 55.97 54.27 1j1e s LYS 92 Cb -0.02 -2.97 -0.10 0.00 -1.68 0.00 0.00 37.83 33.06 1j1e s LYS 92 CO 0.17 0.69 0.91 -1.54 -0.76 0.00 0.00 175.35 174.83 1j1e s SER 93 N -1.47 7.32 0.61 2.83 1.04 -1.26 -4.89 113.70 117.88 1j1e s SER 93 Ca 0.20 1.79 0.30 0.00 0.48 0.00 0.00 55.95 58.72 1j1e s SER 93 Cb -0.12 -2.56 1.69 0.00 0.10 0.00 0.00 66.02 65.13 1j1e s SER 93 CO 0.11 -0.04 2.06 -0.08 0.98 0.00 0.00 173.24 176.27 1j1e h GLU 94 N 3.28 0.00 -0.07 4.02 4.81 -1.99 0.14 114.58 124.76 1j1e h GLU 94 Ca -0.47 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 58.57 1j1e h GLU 94 Cb 1.19 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.58 1j1e h GLU 94 CO 0.65 0.00 -0.70 1.49 -0.73 0.00 0.00 179.01 179.72 1j1e h GLU 95 N 0.00 0.60 0.20 1.92 4.81 -1.98 -1.09 114.58 119.03 1j1e h GLU 95 Ca 0.09 -0.55 -0.01 0.00 -0.13 0.00 0.00 59.36 58.76 1j1e h GLU 95 Cb 0.59 0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.10 1j1e h GLU 95 CO -0.00 1.17 -0.10 1.49 -0.73 0.00 0.00 179.01 180.84 1j1e h GLU 96 N 0.22 -0.26 -0.59 1.92 4.81 -1.14 -2.69 114.58 116.84 1j1e h GLU 96 Ca -0.07 0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.11 1j1e h GLU 96 Cb 1.36 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.77 1j1e h GLU 96 CO 0.14 -0.12 0.11 -0.07 -0.73 0.00 0.00 179.01 178.34 1j1e h LEU 97 N -0.34 0.90 -2.01 1.64 3.38 -1.34 -2.32 115.31 115.22 1j1e h LEU 97 Ca -0.03 -0.19 0.16 0.00 0.09 0.00 0.00 57.88 57.91 1j1e h LEU 97 Cb 0.26 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1j1e h LEU 97 CO 0.05 0.90 0.43 -1.28 0.09 0.00 0.00 178.44 178.62 1j1e h SER 98 N 0.90 0.00 1.11 -0.43 0.87 -0.90 0.75 113.55 115.85 1j1e h SER 98 Ca 0.19 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.59 1j1e h SER 98 Cb 0.38 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.31 1j1e h SER 98 CO 0.01 0.00 -0.93 0.44 -0.53 0.00 0.00 176.83 175.81 1j1e h ASP 99 N 0.00 0.00 0.91 6.23 3.32 -1.12 -3.27 116.42 122.49 1j1e h ASP 99 Ca 0.27 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 57.09 1j1e h ASP 99 Cb 1.11 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.64 1j1e h ASP 99 CO -0.00 0.63 -1.08 -0.07 -1.72 0.00 0.00 179.24 177.00 1j1e h LEU 100 N 0.00 0.08 -1.83 1.55 3.38 0.13 -3.23 115.31 115.40 1j1e h LEU 100 Ca -0.07 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 57.84 1j1e h LEU 100 Cb 1.54 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.25 1j1e h LEU 100 CO 0.07 1.07 0.19 0.15 0.09 0.00 0.00 178.44 180.01 1j1e h PHE 101 N 0.01 0.22 0.32 1.13 3.57 0.19 -2.03 116.94 120.36 1j1e h PHE 101 Ca -0.05 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.44 1j1e h PHE 101 Cb 1.82 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 40.49 1j1e h PHE 101 CO 0.01 0.13 -0.15 -0.09 -2.23 0.00 0.00 178.31 175.98 1j1e h ARG 102 N 0.22 -0.41 -0.92 1.11 2.43 -1.64 -2.26 114.38 112.91 1j1e h ARG 102 Ca 0.12 0.03 0.27 0.00 -0.81 0.00 0.00 59.98 59.58 1j1e h ARG 102 Cb 0.18 0.09 -0.15 0.00 -0.42 0.00 0.00 29.97 29.67 1j1e h ARG 102 CO -0.02 -0.08 0.24 0.52 -1.51 0.00 0.00 179.97 179.12 1j1e h MET 103 N -0.88 0.15 -0.14 0.20 2.86 -1.46 0.99 114.93 116.64 1j1e h MET 103 Ca -0.04 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.56 1j1e h MET 103 Cb 0.52 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.14 1j1e h MET 103 CO 0.07 0.10 -0.01 0.74 1.06 0.00 0.00 176.91 178.87 1j1e h PHE 104 N 0.15 0.28 -0.42 -0.22 0.05 -1.40 -3.38 116.94 112.01 1j1e h PHE 104 Ca 0.60 -0.05 -0.20 0.00 3.82 0.00 0.00 57.97 62.14 1j1e h PHE 104 Cb 1.28 -0.07 -0.03 0.00 2.00 0.00 0.00 35.95 39.13 1j1e h PHE 104 CO -0.28 0.51 0.59 0.34 -0.18 0.00 0.00 178.31 179.29 1j1e s ASP 105 N -5.79 4.49 0.15 2.17 3.68 0.34 -4.81 116.67 116.89 1j1e s ASP 105 Ca -0.14 -1.03 -0.15 0.00 2.13 0.00 0.00 52.55 53.36 1j1e s ASP 105 Cb 0.05 -2.58 0.02 0.00 -1.45 0.00 0.00 42.92 38.97 1j1e s ASP 105 CO 0.72 -3.55 1.74 0.11 0.13 0.00 0.00 175.17 174.32 1j1e h LYS 106 N 10.97 0.63 0.00 4.34 1.79 -1.76 -1.88 116.57 130.67 1j1e h LYS 106 Ca 0.11 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1j1e h LYS 106 Cb 0.98 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.51 1j1e h LYS 106 CO 1.14 0.52 0.00 0.27 -1.08 0.00 0.00 179.45 180.30 1j1e n ASN 107 N -4.67 0.00 -4.16 0.86 0.23 -1.26 -4.85 115.26 101.40 1j1e n ASN 107 Ca 0.01 -0.94 -0.35 0.00 -0.53 0.00 0.00 54.58 52.76 1j1e n ASN 107 Cb 0.10 0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 37.76 1j1e n ASN 107 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1j1e n ALA 108 N -0.96 -1.20 0.47 -2.53 0.00 -0.71 -4.79 120.51 110.79 1j1e n ALA 108 Ca 0.20 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.69 1j1e n ALA 108 Cb 0.09 -2.88 0.22 0.00 0.00 0.00 0.00 19.45 16.88 1j1e n ALA 108 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1j1e h ASP 109 N -1.11 0.00 0.00 0.00 2.03 -1.89 -3.47 116.42 111.98 1j1e h ASP 109 Ca -0.54 -0.08 0.00 0.00 -0.73 0.00 0.00 57.03 55.67 1j1e h ASP 109 Cb 1.35 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.85 1j1e h ASP 109 CO 0.76 0.04 0.00 0.61 -1.03 0.00 0.00 179.24 179.62 1j1e n GLY 110 N 1.27 1.94 3.64 7.15 0.00 -1.26 -5.10 105.19 112.83 1j1e n GLY 110 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 1j1e n GLY 110 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1j1e s TYR 111 N -2.00 -0.91 -0.45 1.61 2.02 -1.26 -4.84 117.35 111.51 1j1e s TYR 111 Ca 0.00 1.95 -0.20 0.00 -0.37 0.00 0.00 57.07 58.45 1j1e s TYR 111 Cb 0.00 0.48 0.03 0.00 -0.40 0.00 0.00 41.96 42.07 1j1e s TYR 111 CO 0.00 -0.45 0.65 -1.50 -1.57 0.00 0.00 175.55 172.68 1j1e s ILE 112 N 1.13 4.82 0.51 2.71 2.07 -0.81 -4.75 121.20 126.89 1j1e s ILE 112 Ca -0.06 0.00 0.07 0.00 -1.41 0.00 0.00 60.65 59.25 1j1e s ILE 112 Cb -0.05 -4.23 0.03 0.00 0.13 0.00 0.00 42.46 38.34 1j1e s ILE 112 CO -0.12 -0.65 0.46 1.51 -1.91 0.00 0.00 174.94 174.23 1j1e s ASP 113 N 2.15 4.84 0.16 4.50 3.84 -1.26 0.10 116.67 130.99 1j1e s ASP 113 Ca 0.21 -1.01 -0.30 0.00 -0.00 0.00 0.00 52.55 51.45 1j1e s ASP 113 Cb -0.15 0.07 -0.04 0.00 -1.38 0.00 0.00 42.92 41.42 1j1e s ASP 113 CO 0.18 -1.00 1.55 0.25 -0.00 0.00 0.00 175.17 176.15 1j1e h LEU 114 N 0.75 -1.90 -0.18 2.11 5.85 -1.96 0.78 115.31 120.76 1j1e h LEU 114 Ca -0.37 0.29 -0.09 0.00 0.84 0.00 0.00 57.88 58.54 1j1e h LEU 114 Cb 1.29 0.83 -0.00 0.00 0.37 0.00 0.00 40.66 43.15 1j1e h LEU 114 CO 0.54 -0.31 -0.25 -0.08 -0.34 0.00 0.00 178.44 178.01 1j1e h GLU 115 N -0.18 0.48 -0.82 1.25 4.81 -1.97 -2.09 114.58 116.05 1j1e h GLU 115 Ca 0.15 -0.28 0.08 0.00 -0.13 0.00 0.00 59.36 59.18 1j1e h GLU 115 Cb 0.51 0.02 -0.07 0.00 0.63 0.00 0.00 28.75 29.85 1j1e h GLU 115 CO -0.78 0.87 0.48 0.93 -0.73 0.00 0.00 179.01 179.78 1j1e h GLU 116 N 0.12 0.81 -0.77 1.92 5.08 -1.83 0.58 114.58 120.48 1j1e h GLU 116 Ca 0.02 -0.05 0.16 0.00 -1.00 0.00 0.00 59.36 58.49 1j1e h GLU 116 Cb 0.82 -0.18 -0.11 0.00 0.50 0.00 0.00 28.75 29.78 1j1e h GLU 116 CO 0.06 0.53 0.28 1.25 -1.00 0.00 0.00 179.01 180.13 1j1e h LEU 117 N 0.83 0.20 0.42 1.33 5.85 0.87 -1.56 115.31 123.24 1j1e h LEU 117 Ca 0.39 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 59.23 1j1e h LEU 117 Cb 0.31 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 1j1e h LEU 117 CO -0.22 0.04 -0.33 0.11 -0.34 0.00 0.00 178.44 177.70 1j1e h LYS 118 N 0.38 -0.71 -0.55 1.25 1.79 0.81 0.16 116.57 119.70 1j1e h LYS 118 Ca 0.44 0.05 0.07 0.00 -2.18 0.00 0.00 60.65 59.02 1j1e h LYS 118 Cb 0.73 0.16 -0.06 0.00 -1.58 0.00 0.00 32.23 31.49 1j1e h LYS 118 CO -0.46 -0.48 0.24 0.82 -1.08 0.00 0.00 179.45 178.49 1j1e h ILE 119 N -0.74 0.87 -0.38 1.86 2.04 -0.38 1.62 117.51 122.40 1j1e h ILE 119 Ca -0.04 -0.15 0.02 0.00 1.00 0.00 0.00 64.86 65.69 1j1e h ILE 119 Cb 0.64 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 1j1e h ILE 119 CO -0.01 0.08 0.21 0.24 0.00 0.00 0.00 178.15 178.67 1j1e h MET 120 N 0.45 0.41 0.14 2.37 2.86 -1.16 -0.48 114.93 119.53 1j1e h MET 120 Ca 0.26 -0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.88 1j1e h MET 120 Cb 0.24 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.79 1j1e h MET 120 CO -0.22 0.27 -0.16 -0.07 1.06 0.00 0.00 176.91 177.79 1j1e h LEU 121 N 0.43 -0.43 0.08 1.22 3.38 0.17 -3.05 115.31 117.11 1j1e h LEU 121 Ca 0.16 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1j1e h LEU 121 Cb 0.03 0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1j1e h LEU 121 CO -0.09 -0.24 -0.25 -0.61 0.09 0.00 0.00 178.44 177.34 1j1e h GLN 122 N -0.34 -0.36 0.00 1.13 5.75 0.29 -1.27 115.11 120.30 1j1e h GLN 122 Ca 0.01 0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1j1e h GLN 122 Cb 0.33 0.08 0.00 0.00 1.07 0.00 0.00 27.48 28.97 1j1e h GLN 122 CO -0.06 -0.24 0.27 0.00 -2.65 0.00 0.00 178.83 176.15 1j1e n ALA 123 N -2.66 0.49 -0.19 3.38 0.00 -0.24 -2.57 120.51 118.73 1j1e n ALA 123 Ca -0.04 0.02 -0.05 0.00 0.00 0.00 0.00 53.44 53.36 1j1e n ALA 123 Cb 0.20 -0.52 0.05 0.00 0.00 0.00 0.00 19.45 19.18 1j1e n ALA 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j1e h THR 124 N 0.00 1.06 0.00 0.00 1.03 -1.11 -3.48 112.91 110.41 1j1e h THR 124 Ca 0.00 -0.23 0.00 0.00 -0.01 0.00 0.00 66.41 66.17 1j1e h THR 124 Cb 0.55 0.34 0.00 0.00 -1.07 0.00 0.00 68.15 67.97 1j1e h THR 124 CO 0.00 0.12 0.00 0.61 -0.01 0.00 0.00 175.52 176.24 1j1e n GLY 125 N -1.25 3.71 3.52 2.99 0.00 -1.06 -5.12 105.19 107.97 1j1e n GLY 125 Ca 0.04 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.86 1j1e n GLY 125 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1j1e s GLU 126 N 0.00 -1.58 -0.28 1.61 0.41 -1.26 -4.98 118.70 112.63 1j1e s GLU 126 Ca 0.00 0.07 -0.22 0.00 -0.41 0.00 0.00 54.97 54.40 1j1e s GLU 126 Cb 0.00 -1.54 -0.01 0.00 -1.78 0.00 0.00 34.13 30.80 1j1e s GLU 126 CO 0.00 -3.97 0.74 0.99 -0.49 0.00 0.00 175.26 172.53 1j1e s THR 127 N -2.78 4.87 -0.80 3.63 2.01 -1.26 -4.99 115.64 116.32 1j1e s THR 127 Ca 0.70 1.23 -0.18 0.00 0.31 0.00 0.00 61.69 63.75 1j1e s THR 127 Cb -0.12 -4.06 0.14 0.00 0.01 0.00 0.00 72.50 68.46 1j1e s THR 127 CO 0.57 -0.12 0.94 -0.63 -0.69 0.00 0.00 174.62 174.70 1j1e s ILE 128 N 2.76 4.89 0.53 1.82 1.01 -1.26 -5.03 121.20 125.92 1j1e s ILE 128 Ca 0.30 -1.50 -0.20 0.00 0.00 0.00 0.00 60.65 59.25 1j1e s ILE 128 Cb -0.15 -4.64 -0.06 0.00 0.01 0.00 0.00 42.46 37.62 1j1e s ILE 128 CO 0.10 -1.32 1.15 0.42 0.00 0.00 0.00 174.94 175.29 1j1e s THR 129 N 2.31 3.06 -1.09 2.92 -4.23 -1.26 -4.88 115.64 112.48 1j1e s THR 129 Ca 0.24 0.69 0.02 0.00 -1.18 0.00 0.00 61.69 61.46 1j1e s THR 129 Cb -0.12 -3.29 0.02 0.00 1.34 0.00 0.00 72.50 70.45 1j1e s THR 129 CO -0.04 -0.11 1.04 -0.62 -0.54 0.00 0.00 174.62 174.35 1j1e n GLU 130 N -1.17 0.01 -0.04 3.99 1.02 -1.26 -1.98 120.64 121.21 1j1e n GLU 130 Ca 0.11 0.42 -0.20 0.00 -0.02 0.00 0.00 57.16 57.47 1j1e n GLU 130 Cb 0.50 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.29 1j1e n GLU 130 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1j1e h ASP 131 N 0.00 0.18 -0.42 1.62 3.32 -1.98 -3.06 116.42 116.08 1j1e h ASP 131 Ca 0.00 -0.77 0.09 0.00 0.02 0.00 0.00 57.03 56.36 1j1e h ASP 131 Cb 0.04 -0.06 -0.09 0.00 0.22 0.00 0.00 39.33 39.44 1j1e h ASP 131 CO 0.00 1.45 -0.26 0.44 -1.72 0.00 0.00 179.24 179.15 1j1e h ASP 132 N -0.67 -0.87 -0.08 6.45 5.19 -1.77 1.25 116.42 125.93 1j1e h ASP 132 Ca -0.25 0.18 0.01 0.00 -0.62 0.00 0.00 57.03 56.35 1j1e h ASP 132 Cb 1.46 0.44 -0.03 0.00 0.18 0.00 0.00 39.33 41.37 1j1e h ASP 132 CO -0.04 -0.28 -0.24 0.40 -3.12 0.00 0.00 179.24 175.96 1j1e h ILE 133 N -0.18 0.00 0.00 0.35 2.04 -1.67 0.50 117.51 118.55 1j1e h ILE 133 Ca 0.19 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.05 1j1e h ILE 133 Cb 0.49 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 1j1e h ILE 133 CO -0.52 0.00 0.00 -0.33 0.00 0.00 0.00 178.15 177.30 1j1e h GLU 134 N -0.24 0.00 0.00 2.37 5.08 -1.26 -2.29 114.58 118.24 1j1e h GLU 134 Ca 0.02 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 1j1e h GLU 134 Cb 0.29 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 1j1e h GLU 134 CO -0.21 0.00 -0.26 0.93 -1.00 0.00 0.00 179.01 178.48 1j1e h GLU 135 N 0.00 0.00 -0.27 2.33 4.39 0.32 -3.13 114.58 118.21 1j1e h GLU 135 Ca 0.00 0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.76 1j1e h GLU 135 Cb 0.15 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.74 1j1e h GLU 135 CO 0.00 0.29 -0.11 -0.07 -1.16 0.00 0.00 179.01 177.97 1j1e h LEU 136 N -1.00 -0.36 -0.67 1.33 3.38 -0.06 0.44 115.31 118.37 1j1e h LEU 136 Ca -0.04 0.10 0.13 0.00 0.09 0.00 0.00 57.88 58.16 1j1e h LEU 136 Cb 0.45 0.21 -0.13 0.00 0.09 0.00 0.00 40.66 41.29 1j1e h LEU 136 CO -0.02 -0.14 -0.22 -0.03 0.09 0.00 0.00 178.44 178.12 1j1e h MET 137 N -0.06 -0.04 0.00 1.13 4.05 -1.58 -0.44 114.93 117.99 1j1e h MET 137 Ca 0.14 0.00 -0.05 0.00 -0.28 0.00 0.00 59.70 59.52 1j1e h MET 137 Cb 0.27 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.07 1j1e h MET 137 CO -0.31 -0.03 -0.22 0.87 0.23 0.00 0.00 176.91 177.45 1j1e h LYS 138 N -0.05 0.00 0.00 0.39 1.79 -1.23 1.17 116.57 118.64 1j1e h LYS 138 Ca 0.31 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.78 1j1e h LYS 138 Cb 0.52 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.17 1j1e h LYS 138 CO -0.71 0.22 0.00 -3.47 -1.08 0.00 0.00 179.45 174.41 1j1e n ASP 139 N -3.32 0.07 -0.02 0.86 -0.08 0.05 -3.69 116.55 110.41 1j1e n ASP 139 Ca 0.01 0.51 -0.03 0.00 -1.51 0.00 0.00 54.79 53.77 1j1e n ASP 139 Cb 0.46 -0.53 -0.01 0.00 2.34 0.00 0.00 41.12 43.38 1j1e n ASP 139 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1j1e n GLY 140 N 0.74 -0.05 3.17 0.27 0.00 -0.91 -4.82 105.19 103.58 1j1e n GLY 140 Ca 0.05 -0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1j1e n GLY 140 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1j1e n ASP 141 N -2.79 1.99 0.12 1.61 4.64 0.40 -4.69 116.55 117.82 1j1e n ASP 141 Ca -0.06 -2.50 -0.14 0.00 -1.38 0.00 0.00 54.79 50.72 1j1e n ASP 141 Cb 0.56 -0.83 -0.08 0.00 -1.04 0.00 0.00 41.12 39.73 1j1e n ASP 141 CO 0.00 0.00 0.00 0.11 -0.82 0.00 0.00 177.20 176.49 1j1e h LYS 142 N 8.45 -0.26 0.00 -0.67 1.79 -1.85 -2.66 116.57 121.37 1j1e h LYS 142 Ca 0.33 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.81 1j1e h LYS 142 Cb 0.54 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 31.25 1j1e h LYS 142 CO 1.82 -0.04 0.00 0.27 -1.08 0.00 0.00 179.45 180.43 1j1e n ASN 143 N -5.13 0.32 -2.72 0.86 6.94 -1.26 -4.92 115.26 109.35 1j1e n ASN 143 Ca -0.09 0.57 -0.08 0.00 -0.02 0.00 0.00 54.58 54.96 1j1e n ASN 143 Cb 0.19 -0.64 0.04 0.00 -2.36 0.00 0.00 39.78 37.00 1j1e n ASN 143 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 1j1e n ASN 144 N -1.84 -5.58 -1.66 0.53 5.15 -1.00 -5.00 115.26 105.85 1j1e n ASN 144 Ca 0.04 -0.39 -0.09 0.00 -0.60 0.00 0.00 54.58 53.54 1j1e n ASN 144 Cb 0.24 -3.96 0.08 0.00 -0.53 0.00 0.00 39.78 35.61 1j1e n ASN 144 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 1j1e n ASP 145 N -2.42 3.16 -0.51 1.20 3.85 -1.26 -4.98 116.55 115.59 1j1e n ASP 145 Ca -0.04 -3.41 -0.06 0.00 -0.71 0.00 0.00 54.79 50.58 1j1e n ASP 145 Cb 0.56 -0.41 -0.02 0.00 -1.35 0.00 0.00 41.12 39.90 1j1e n ASP 145 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1j1e n GLY 146 N -0.71 0.55 3.58 6.12 0.00 -1.26 -4.90 105.19 108.56 1j1e n GLY 146 Ca 0.28 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.15 1j1e n GLY 146 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1j1e s ARG 147 N -2.26 0.92 -0.15 1.61 1.70 -1.26 -3.60 118.95 115.91 1j1e s ARG 147 Ca 0.00 0.69 -0.19 0.00 -0.47 0.00 0.00 55.73 55.76 1j1e s ARG 147 Cb 0.00 0.44 -0.04 0.00 -0.57 0.00 0.00 34.95 34.79 1j1e s ARG 147 CO 0.00 -0.19 0.53 0.42 -1.08 0.00 0.00 175.30 174.98 1j1e s ILE 148 N -0.26 5.13 0.00 4.99 1.01 0.11 -4.83 121.20 127.36 1j1e s ILE 148 Ca -0.04 1.03 0.00 0.00 0.00 0.00 0.00 60.65 61.64 1j1e s ILE 148 Cb -0.03 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.58 1j1e s ILE 148 CO 0.05 0.25 0.00 0.47 0.00 0.00 0.00 174.94 175.71 1j1e n ASP 149 N 4.17 -0.26 -0.07 3.58 8.00 -1.26 -1.91 116.55 128.79 1j1e n ASP 149 Ca -0.05 -0.26 -0.14 0.00 0.71 0.00 0.00 54.79 55.05 1j1e n ASP 149 Cb 0.51 0.00 -0.12 0.00 -0.02 0.00 0.00 41.12 41.49 1j1e n ASP 149 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1j1e h TYR 150 N -0.72 0.00 -0.41 1.24 3.20 -1.98 -2.06 116.97 116.24 1j1e h TYR 150 Ca 0.00 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1j1e h TYR 150 Cb 0.00 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 1j1e h TYR 150 CO 0.00 0.99 0.24 -0.44 -1.64 0.00 0.00 178.16 177.32 1j1e h ASP 151 N -1.00 0.49 -0.27 -2.11 3.32 -1.99 -1.10 116.42 113.76 1j1e h ASP 151 Ca -0.02 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 56.96 1j1e h ASP 151 Cb 0.98 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.39 1j1e h ASP 151 CO -0.01 0.41 0.15 -0.33 -1.72 0.00 0.00 179.24 177.73 1j1e h GLU 152 N 0.54 0.38 -0.90 3.56 5.08 -1.91 0.17 114.58 121.51 1j1e h GLU 152 Ca 0.15 -0.05 0.17 0.00 -1.00 0.00 0.00 59.36 58.63 1j1e h GLU 152 Cb 0.01 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.11 1j1e h GLU 152 CO -0.03 0.34 0.58 0.35 -1.00 0.00 0.00 179.01 179.26 1j1e h PHE 153 N 0.33 0.73 0.40 4.33 3.57 -0.89 0.53 116.94 125.93 1j1e h PHE 153 Ca 0.10 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.60 1j1e h PHE 153 Cb 0.07 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.59 1j1e h PHE 153 CO -0.03 0.23 -0.19 -0.07 -2.23 0.00 0.00 178.31 176.02 1j1e h LEU 154 N 0.58 -0.45 -0.72 0.59 3.38 -0.29 -2.73 115.31 115.67 1j1e h LEU 154 Ca 0.47 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.42 1j1e h LEU 154 Cb 0.91 0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1j1e h LEU 154 CO -0.21 -0.01 0.07 1.21 0.09 0.00 0.00 178.44 179.58 1j1e n GLU 155 N -5.13 0.07 0.12 1.13 4.07 0.52 0.34 120.64 121.76 1j1e n GLU 155 Ca -0.07 0.54 0.12 0.00 -0.06 0.00 0.00 57.16 57.69 1j1e n GLU 155 Cb 0.23 -1.80 0.05 0.00 -0.06 0.00 0.00 31.44 29.86 1j1e n GLU 155 CO 0.00 0.00 0.00 0.35 -0.06 0.00 0.00 177.13 177.42 1j1e h PHE 156 N 0.00 0.00 0.00 4.31 3.04 0.22 -3.37 116.94 121.14 1j1e h PHE 156 Ca 0.00 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.95 1j1e h PHE 156 Cb 0.14 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.65 1j1e h PHE 156 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 178.31 174.96 1j1e n MET 157 N -2.70 1.48 -1.50 1.11 2.81 0.15 -4.97 117.12 113.50 1j1e n MET 157 Ca 0.01 -1.11 -0.50 0.00 -1.81 0.00 0.00 57.70 54.29 1j1e n MET 157 Cb 0.53 -0.99 -0.06 0.00 -0.71 0.00 0.00 33.22 31.99 1j1e n MET 157 CO 0.00 0.00 0.00 0.36 1.51 0.00 0.00 175.97 177.84 1j1e n LYS 158 N -0.31 1.31 0.00 0.03 2.85 -0.84 -0.59 118.16 120.61 1j1e n LYS 158 Ca 0.00 0.38 0.00 0.00 -1.05 0.00 0.00 58.31 57.64 1j1e n LYS 158 Cb 0.16 -2.56 0.00 0.00 -0.65 0.00 0.00 35.03 31.98 1j1e n LYS 158 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1j1e n GLY 159 N 6.09 2.67 3.77 2.58 0.00 -1.26 -4.95 105.19 114.09 1j1e n GLY 159 Ca 0.37 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.99 1j1e n GLY 159 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j1e s VAL 160 N -2.62 2.25 -2.83 1.61 1.01 0.24 -4.80 120.40 115.26 1j1e s VAL 160 Ca 0.00 0.23 0.25 0.00 0.00 0.00 0.00 61.98 62.46 1j1e s VAL 160 Cb 0.00 -3.14 0.31 0.00 0.00 0.00 0.00 36.38 33.55 1j1e s VAL 160 CO 0.00 0.04 1.42 -0.62 0.00 0.00 0.00 175.10 175.94