#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j1e n ASP 2 N 0.00 0.77 -3.57 7.83 8.00 -1.26 -5.10 116.55 123.21 1j1e n ASP 2 Ca 0.00 -2.41 -0.06 0.00 0.71 0.00 0.00 54.79 53.03 1j1e n ASP 2 Cb 0.00 0.76 -0.02 0.00 -0.02 0.00 0.00 41.12 41.84 1j1e n ASP 2 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1j1e s ASP 3 N -2.60 -0.20 0.22 -2.24 3.68 -1.26 -4.97 116.67 109.29 1j1e s ASP 3 Ca 0.16 0.01 0.25 0.00 2.13 0.00 0.00 52.55 55.10 1j1e s ASP 3 Cb 0.01 0.21 0.87 0.00 -1.45 0.00 0.00 42.92 42.56 1j1e s ASP 3 CO 0.11 -0.34 1.76 0.00 0.13 0.00 0.00 175.17 176.83 1j1e n ILE 4 N -0.11 0.66 -0.05 4.11 3.06 -1.26 -3.24 119.36 122.52 1j1e n ILE 4 Ca -0.02 -0.12 -0.22 0.00 -2.50 0.00 0.00 62.75 59.88 1j1e n ILE 4 Cb 0.59 -0.76 -0.13 0.00 0.54 0.00 0.00 39.64 39.88 1j1e n ILE 4 CO 0.00 0.00 0.00 -1.22 -2.50 0.00 0.00 176.55 172.83 1j1e n TYR 5 N -2.24 1.09 -0.27 9.51 4.01 -1.26 -3.25 117.16 124.75 1j1e n TYR 5 Ca 0.05 0.33 0.07 0.00 -0.16 0.00 0.00 57.90 58.18 1j1e n TYR 5 Cb 0.37 -1.13 0.21 0.00 -0.31 0.00 0.00 39.34 38.48 1j1e n TYR 5 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1j1e h LYS 6 N -0.44 0.40 -0.46 -0.72 1.79 -1.93 0.58 116.57 115.80 1j1e h LYS 6 Ca -0.40 -0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 57.98 1j1e h LYS 6 Cb 1.70 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 32.24 1j1e h LYS 6 CO -0.06 0.26 0.05 0.00 -1.08 0.00 0.00 179.45 178.62 1j1e h ALA 7 N 1.59 0.61 -0.60 3.86 0.00 -1.71 -2.16 119.26 120.84 1j1e h ALA 7 Ca 0.44 -0.24 0.08 0.00 0.00 0.00 0.00 54.91 55.19 1j1e h ALA 7 Cb 0.71 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 1j1e h ALA 7 CO -0.44 0.36 0.40 0.00 0.00 0.00 0.00 179.25 179.57 1j1e h ALA 8 N 0.94 1.92 0.13 0.00 0.00 -0.04 -0.44 119.26 121.76 1j1e h ALA 8 Ca 0.14 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1j1e h ALA 8 Cb 0.43 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1j1e h ALA 8 CO 0.01 -0.03 -0.06 0.28 0.00 0.00 0.00 179.25 179.45 1j1e h VAL 9 N 0.49 1.02 -0.01 0.00 2.07 0.27 -2.19 116.25 117.91 1j1e h VAL 9 Ca 0.27 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 67.12 1j1e h VAL 9 Cb 0.42 1.44 -0.00 0.00 -1.52 0.00 0.00 31.29 31.63 1j1e h VAL 9 CO -0.08 0.16 0.01 -0.33 0.02 0.00 0.00 177.57 177.35 1j1e h GLU 10 N -0.49 0.00 0.00 1.57 5.08 -0.82 -1.57 114.58 118.35 1j1e h GLU 10 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1j1e h GLU 10 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1j1e h GLU 10 CO 0.03 0.00 0.00 1.96 -1.00 0.00 0.00 179.01 180.00 1j1e h GLN 11 N 0.00 0.00 -6.73 2.33 1.08 -0.49 -3.46 115.11 107.84 1j1e h GLN 11 Ca 0.00 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 56.68 1j1e h GLN 11 Cb 0.02 0.00 0.05 0.00 -0.05 0.00 0.00 27.48 27.51 1j1e h GLN 11 CO -0.00 0.00 0.75 -0.51 -0.95 0.00 0.00 178.83 178.12 1j1e s LEU 12 N -5.09 4.39 0.90 1.46 1.43 -0.59 -4.98 118.68 116.19 1j1e s LEU 12 Ca 0.09 2.63 -0.10 0.00 -1.03 0.00 0.00 54.13 55.71 1j1e s LEU 12 Cb 0.10 -3.62 0.14 0.00 0.03 0.00 0.00 46.19 42.84 1j1e s LEU 12 CO 0.60 -0.68 1.12 0.42 0.23 0.00 0.00 176.35 178.05 1j1e s THR 13 N 0.06 2.34 0.44 5.49 -4.23 -1.26 -4.69 115.64 113.78 1j1e s THR 13 Ca 0.59 0.11 0.25 0.00 -1.18 0.00 0.00 61.69 61.47 1j1e s THR 13 Cb -0.41 -2.25 0.28 0.00 1.34 0.00 0.00 72.50 71.46 1j1e s THR 13 CO 0.42 -0.14 2.07 -0.08 -0.54 0.00 0.00 174.62 176.35 1j1e h GLU 14 N -1.77 0.00 0.00 3.99 4.57 -1.99 0.15 114.58 119.54 1j1e h GLU 14 Ca -0.45 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 57.59 1j1e h GLU 14 Cb 1.27 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.84 1j1e h GLU 14 CO 0.45 0.12 -0.67 1.49 -1.18 0.00 0.00 179.01 179.22 1j1e h GLU 15 N 0.00 0.00 0.08 1.92 4.81 -2.01 -3.21 114.58 116.16 1j1e h GLU 15 Ca -0.00 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1j1e h GLU 15 Cb 0.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.68 1j1e h GLU 15 CO 0.02 0.67 -0.04 1.96 -0.73 0.00 0.00 179.01 180.89 1j1e h GLN 16 N 0.00 -0.10 -1.06 1.92 1.08 -1.11 -3.25 115.11 112.59 1j1e h GLN 16 Ca -0.01 0.01 0.29 0.00 -1.45 0.00 0.00 58.65 57.49 1j1e h GLN 16 Cb 1.40 0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 28.79 1j1e h GLN 16 CO 0.09 0.45 0.73 -0.22 -0.95 0.00 0.00 178.83 178.93 1j1e h LYS 17 N -0.86 0.15 0.36 1.46 3.64 -1.13 -2.64 116.57 117.55 1j1e h LYS 17 Ca -0.01 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 1j1e h LYS 17 Cb 0.60 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1j1e h LYS 17 CO 0.02 0.10 -0.17 -0.97 -2.27 0.00 0.00 179.45 176.16 1j1e h ASN 18 N 0.16 -0.40 -0.81 4.20 -1.24 -1.58 -2.60 115.58 113.30 1j1e h ASN 18 Ca 0.54 -0.15 0.07 0.00 0.71 0.00 0.00 56.30 57.48 1j1e h ASN 18 Cb 1.82 0.10 -0.05 0.00 0.73 0.00 0.00 38.32 40.92 1j1e h ASN 18 CO -0.12 -0.03 0.53 -0.33 -1.29 0.00 0.00 177.43 176.19 1j1e h GLU 19 N -0.83 0.82 0.00 6.67 5.08 -1.53 0.40 114.58 125.19 1j1e h GLU 19 Ca -0.05 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.21 1j1e h GLU 19 Cb 0.53 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1j1e h GLU 19 CO 0.08 0.54 -0.26 0.74 -1.00 0.00 0.00 179.01 179.12 1j1e h PHE 20 N 0.85 0.00 0.48 4.33 0.05 -1.55 0.65 116.94 121.74 1j1e h PHE 20 Ca 0.36 0.00 -0.02 0.00 3.82 0.00 0.00 57.97 62.13 1j1e h PHE 20 Cb 0.30 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.25 1j1e h PHE 20 CO -0.00 0.26 -0.23 -0.22 -0.18 0.00 0.00 178.31 177.94 1j1e h LYS 21 N 0.00 -0.62 0.14 1.51 1.63 0.18 0.35 116.57 119.75 1j1e h LYS 21 Ca -0.00 0.04 0.01 0.00 -0.85 0.00 0.00 60.65 59.85 1j1e h LYS 21 Cb 0.52 0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 32.26 1j1e h LYS 21 CO 0.03 -0.33 -0.42 0.00 -3.45 0.00 0.00 179.45 175.29 1j1e h ALA 22 N -0.38 -0.93 -0.97 5.00 0.00 -0.82 1.38 119.26 122.52 1j1e h ALA 22 Ca -0.07 -0.10 0.32 0.00 0.00 0.00 0.00 54.91 55.07 1j1e h ALA 22 Cb 0.57 0.78 -0.16 0.00 0.00 0.00 0.00 17.79 18.98 1j1e h ALA 22 CO 0.11 -1.02 0.42 0.00 0.00 0.00 0.00 179.25 178.76 1j1e h ALA 23 N -0.81 1.77 -0.07 0.00 0.00 -0.84 0.26 119.26 119.59 1j1e h ALA 23 Ca -0.01 0.24 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 1j1e h ALA 23 Cb 0.61 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1j1e h ALA 23 CO -0.20 -0.66 -0.26 0.35 0.00 0.00 0.00 179.25 178.48 1j1e h PHE 24 N 0.17 0.39 0.00 0.00 3.57 0.27 -1.91 116.94 119.43 1j1e h PHE 24 Ca 0.71 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 62.05 1j1e h PHE 24 Cb 1.66 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 40.34 1j1e h PHE 24 CO -0.13 0.88 0.00 -0.44 -2.23 0.00 0.00 178.31 176.40 1j1e h ASP 25 N -0.21 0.00 0.04 0.41 5.19 0.51 -2.17 116.42 120.20 1j1e h ASP 25 Ca -0.01 0.00 -0.30 0.00 -0.62 0.00 0.00 57.03 56.10 1j1e h ASP 25 Cb 0.90 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.38 1j1e h ASP 25 CO 0.06 0.00 -1.65 -0.38 -3.12 0.00 0.00 179.24 174.15 1j1e n ILE 26 N -2.64 1.61 0.28 0.35 5.41 -0.41 -4.05 119.36 119.90 1j1e n ILE 26 Ca -0.02 -0.28 0.16 0.00 1.00 0.00 0.00 62.75 63.61 1j1e n ILE 26 Cb 0.06 -1.91 0.78 0.00 -0.71 0.00 0.00 39.64 37.87 1j1e n ILE 26 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 176.55 176.70 1j1e h PHE 27 N -0.62 0.00 -0.01 1.39 -0.00 -0.71 -1.47 116.94 115.52 1j1e h PHE 27 Ca -0.41 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.56 1j1e h PHE 27 Cb 1.59 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.54 1j1e h PHE 27 CO 0.07 0.00 -0.63 0.28 -0.00 0.00 0.00 178.31 178.04 1j1e n VAL 28 N -3.08 0.00 -1.56 1.41 0.31 -0.98 -4.89 118.33 109.54 1j1e n VAL 28 Ca 0.00 -0.17 -0.49 0.00 -0.01 0.00 0.00 64.34 63.67 1j1e n VAL 28 Cb 0.45 1.13 -0.04 0.00 -0.91 0.00 0.00 33.84 34.47 1j1e n VAL 28 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1j1e n LEU 29 N -0.51 1.30 -0.10 7.52 4.77 -0.55 -0.70 117.00 128.72 1j1e n LEU 29 Ca 0.08 1.15 -0.01 0.00 -0.03 0.00 0.00 56.01 57.19 1j1e n LEU 29 Cb 0.42 -1.19 -0.01 0.00 -2.33 0.00 0.00 43.42 40.31 1j1e n LEU 29 CO 0.33 -1.44 -0.01 0.61 -1.33 0.00 0.00 177.39 175.54 1j1e n GLY 30 N 1.92 0.51 3.47 -0.72 0.00 -1.26 -5.00 105.19 104.10 1j1e n GLY 30 Ca 0.15 -0.38 -0.35 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.96 3.11 0.00 4.61 0.00 0.12 -5.04 121.76 122.60 1j1e s ALA 31 Ca 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 50.98 1j1e s ALA 31 Cb 0.00 -1.85 0.00 0.00 0.00 0.00 0.00 23.12 21.27 1j1e s ALA 31 CO 0.00 -0.17 0.93 -1.91 0.00 0.00 0.00 175.76 174.61 1j1e n GLU 32 N 4.28 0.00 0.03 0.00 4.07 -1.26 -2.92 120.64 124.84 1j1e n GLU 32 Ca -0.17 0.63 0.06 0.00 -0.06 0.00 0.00 57.16 57.63 1j1e n GLU 32 Cb 0.52 -1.43 0.28 0.00 -0.06 0.00 0.00 31.44 30.75 1j1e n GLU 32 CO 0.00 0.00 0.00 -0.40 -0.06 0.00 0.00 177.13 176.67 1j1e n ASP 33 N -2.17 0.15 0.00 4.31 3.85 -1.26 -4.86 116.55 116.57 1j1e n ASP 33 Ca 0.00 0.55 0.00 0.00 -0.71 0.00 0.00 54.79 54.63 1j1e n ASP 33 Cb 0.00 -0.57 0.00 0.00 -1.35 0.00 0.00 41.12 39.20 1j1e n ASP 33 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1j1e n GLY 34 N -0.47 0.53 3.44 6.12 0.00 -1.15 -5.06 105.19 108.61 1j1e n GLY 34 Ca 0.02 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.83 3.14 -0.47 1.61 0.01 -1.26 -4.89 113.70 109.01 1j1e s SER 35 Ca 0.00 -1.11 -0.23 0.00 1.31 0.00 0.00 55.95 55.92 1j1e s SER 35 Cb 0.00 -0.23 0.03 0.00 0.21 0.00 0.00 66.02 66.03 1j1e s SER 35 CO 0.00 -0.17 0.81 -0.63 0.41 0.00 0.00 173.24 173.66 1j1e s ILE 36 N -2.79 4.61 0.09 1.44 1.01 0.05 -4.85 121.20 120.76 1j1e s ILE 36 Ca 0.29 0.41 0.01 0.00 0.00 0.00 0.00 60.65 61.36 1j1e s ILE 36 Cb 0.00 -4.36 0.01 0.00 0.01 0.00 0.00 42.46 38.12 1j1e s ILE 36 CO 0.12 -0.78 0.10 -1.54 0.00 0.00 0.00 174.94 172.84 1j1e n SER 37 N 6.84 0.72 -0.03 3.58 3.41 -1.26 0.82 113.62 127.70 1j1e n SER 37 Ca 0.02 -1.27 -0.11 0.00 -0.26 0.00 0.00 58.87 57.26 1j1e n SER 37 Cb 0.48 -0.04 -0.05 0.00 -0.26 0.00 0.00 64.21 64.34 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 0.23 1.14 -0.90 6.66 1.35 -1.94 -2.59 112.91 116.85 1j1e h THR 38 Ca -0.05 -0.40 0.26 0.00 -0.55 0.00 0.00 66.41 65.67 1j1e h THR 38 Cb 0.20 1.14 -0.04 0.00 -1.73 0.00 0.00 68.15 67.72 1j1e h THR 38 CO 0.07 0.12 0.86 0.50 -0.25 0.00 0.00 175.52 176.83 1j1e h LYS 39 N 0.09 0.00 0.07 4.72 3.64 -1.98 0.86 116.57 123.96 1j1e h LYS 39 Ca 0.05 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.10 1j1e h LYS 39 Cb 0.14 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.93 1j1e h LYS 39 CO -0.01 0.00 -1.80 0.39 -2.27 0.00 0.00 179.45 175.77 1j1e n GLU 40 N -3.66 0.67 0.22 1.90 4.71 -1.03 -3.12 120.64 120.34 1j1e n GLU 40 Ca 0.19 0.37 0.07 0.00 -0.01 0.00 0.00 57.16 57.78 1j1e n GLU 40 Cb 1.16 -1.70 0.53 0.00 -1.01 0.00 0.00 31.44 30.42 1j1e n GLU 40 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 1j1e h LEU 41 N -0.38 0.00 0.27 -4.62 5.85 -0.77 -2.09 115.31 113.57 1j1e h LEU 41 Ca -0.42 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.28 1j1e h LEU 41 Cb 1.74 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.77 1j1e h LEU 41 CO -0.06 0.22 -0.13 1.23 -0.34 0.00 0.00 178.44 179.35 1j1e h GLY 42 N 0.83 -0.38 -0.48 3.75 0.00 0.55 -1.59 103.07 105.74 1j1e h GLY 42 Ca -0.00 0.14 0.18 0.00 0.00 0.00 0.00 47.33 47.65 1j1e h GLY 42 CO 0.03 -0.14 -0.03 1.70 0.00 0.00 0.00 176.54 178.10 1j1e h LYS 43 N -0.63 0.07 -0.05 4.80 3.64 -1.32 -1.04 116.57 122.04 1j1e h LYS 43 Ca -0.04 -0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.25 1j1e h LYS 43 Cb 0.45 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 32.26 1j1e h LYS 43 CO 0.06 0.05 -0.33 0.28 -2.27 0.00 0.00 179.45 177.24 1j1e h VAL 44 N 0.07 1.45 -0.51 2.00 2.07 -1.48 -3.17 116.25 116.68 1j1e h VAL 44 Ca 0.43 -1.79 0.10 0.00 0.82 0.00 0.00 66.70 66.26 1j1e h VAL 44 Cb 0.76 2.44 -0.10 0.00 -1.52 0.00 0.00 31.29 32.86 1j1e h VAL 44 CO -0.73 0.51 -0.23 0.24 0.02 0.00 0.00 177.57 177.38 1j1e h MET 45 N -0.22 -0.11 -0.12 1.57 2.86 -0.68 0.62 114.93 118.85 1j1e h MET 45 Ca -0.03 0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.65 1j1e h MET 45 Cb 1.00 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.68 1j1e h MET 45 CO 0.07 -0.07 0.43 0.00 1.06 0.00 0.00 176.91 178.40 1j1e h ARG 46 N -0.11 0.00 0.00 1.72 3.08 -1.03 1.35 114.38 119.39 1j1e h ARG 46 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1j1e h ARG 46 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.53 1j1e h ARG 46 CO -0.59 0.00 -0.24 -1.33 -1.07 0.00 0.00 179.97 176.75 1j1e n MET 47 N -3.06 0.13 -0.67 0.04 2.81 0.21 -3.48 117.12 113.11 1j1e n MET 47 Ca 0.01 0.08 0.02 0.00 -1.81 0.00 0.00 57.70 56.00 1j1e n MET 47 Cb 0.51 -1.62 0.26 0.00 -0.71 0.00 0.00 33.22 31.65 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 -1.84 4.46 0.00 4.03 4.77 0.46 -4.94 117.00 123.94 1j1e n LEU 48 Ca 0.05 -3.26 0.00 0.00 -0.03 0.00 0.00 56.01 52.78 1j1e n LEU 48 Cb 0.39 -0.62 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 1j1e n LEU 48 CO 0.32 0.85 0.00 0.61 -1.33 0.00 0.00 177.39 177.84 1j1e n GLY 49 N -0.59 2.15 3.95 -0.72 0.00 -1.17 -5.00 105.19 103.81 1j1e n GLY 49 Ca 0.29 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.08 1j1e n GLY 49 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1j1e s GLN 50 N -0.03 3.24 -0.45 1.61 -1.52 -1.15 -4.98 119.66 116.39 1j1e s GLN 50 Ca 0.00 -0.49 0.07 0.00 -1.95 0.00 0.00 55.36 52.99 1j1e s GLN 50 Cb 0.00 -2.63 0.33 0.00 -0.22 0.00 0.00 33.01 30.48 1j1e s GLN 50 CO 0.00 -0.05 1.08 -1.71 -0.25 0.00 0.00 175.29 174.35 1j1e n ASN 51 N -1.90 -1.90 -4.60 5.90 5.15 -1.26 -2.78 115.26 113.87 1j1e n ASN 51 Ca -0.01 -3.57 -0.35 0.00 -0.60 0.00 0.00 54.58 50.05 1j1e n ASN 51 Cb 0.57 1.56 0.10 0.00 -0.53 0.00 0.00 39.78 41.49 1j1e n ASN 51 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 1j1e n PRO 52 N 0.31 0.25 -1.69 1.20 -0.02 -1.26 -4.99 135.00 128.80 1j1e n PRO 52 Ca 0.08 0.15 -0.30 0.00 -2.02 0.00 0.00 63.50 61.40 1j1e n PRO 52 Cb 0.70 -2.20 0.06 0.00 -0.02 0.00 0.00 33.50 32.04 1j1e n PRO 52 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1j1e s THR 53 N -2.02 3.61 0.20 3.45 -4.23 -1.26 -4.79 115.64 110.60 1j1e s THR 53 Ca 0.70 0.52 -0.16 0.00 -1.18 0.00 0.00 61.69 61.57 1j1e s THR 53 Cb -0.31 -3.37 0.18 0.00 1.34 0.00 0.00 72.50 70.35 1j1e s THR 53 CO 0.54 -0.69 1.62 -0.65 -0.54 0.00 0.00 174.62 174.90 1j1e h PRO 54 N -0.78 -0.06 -0.02 3.99 0.11 -1.98 0.59 132.00 133.83 1j1e h PRO 54 Ca -0.45 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.69 1j1e h PRO 54 Cb 1.24 0.01 -0.06 0.00 0.11 0.00 0.00 31.00 32.31 1j1e h PRO 54 CO 0.60 -0.04 -0.45 0.93 -0.21 0.00 0.00 178.00 178.83 1j1e h GLU 55 N -0.06 -0.57 -0.43 1.05 3.07 -1.98 1.23 114.58 116.89 1j1e h GLU 55 Ca 0.27 0.04 0.12 0.00 -0.50 0.00 0.00 59.36 59.29 1j1e h GLU 55 Cb 0.48 0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 28.50 1j1e h GLU 55 CO -0.62 -0.38 0.33 0.93 -1.40 0.00 0.00 179.01 177.87 1j1e h GLU 56 N -0.59 0.00 0.01 2.33 5.08 -1.68 0.29 114.58 120.01 1j1e h GLU 56 Ca 0.04 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1j1e h GLU 56 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1j1e h GLU 56 CO -0.34 0.00 -0.00 -0.07 -1.00 0.00 0.00 179.01 177.59 1j1e h LEU 57 N 0.00 -0.01 -1.19 1.33 3.38 0.16 -2.59 115.31 116.40 1j1e h LEU 57 Ca 0.20 -0.38 0.24 0.00 0.09 0.00 0.00 57.88 58.04 1j1e h LEU 57 Cb 0.86 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.50 1j1e h LEU 57 CO -0.00 0.68 0.63 -0.61 0.09 0.00 0.00 178.44 179.23 1j1e h GLN 58 N -1.00 0.51 -0.53 1.13 5.75 0.17 0.74 115.11 121.87 1j1e h GLN 58 Ca -0.00 -0.03 -0.10 0.00 -0.15 0.00 0.00 58.65 58.36 1j1e h GLN 58 Cb 0.39 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 28.80 1j1e h GLN 58 CO 0.00 0.33 -0.08 1.05 -2.65 0.00 0.00 178.83 177.48 1j1e h GLU 59 N 0.52 0.98 -0.42 1.69 4.11 -1.03 -0.05 114.58 120.38 1j1e h GLU 59 Ca 0.60 -0.34 0.04 0.00 0.07 0.00 0.00 59.36 59.74 1j1e h GLU 59 Cb 1.30 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.45 1j1e h GLU 59 CO -0.37 1.01 0.28 0.52 0.07 0.00 0.00 179.01 180.52 1j1e h MET 60 N 0.88 0.37 0.01 1.06 2.86 0.86 -2.85 114.93 118.13 1j1e h MET 60 Ca 0.14 -0.02 -0.06 0.00 -2.06 0.00 0.00 59.70 57.71 1j1e h MET 60 Cb 0.63 -0.08 0.01 0.00 0.06 0.00 0.00 31.60 32.21 1j1e h MET 60 CO 0.04 0.25 -0.23 0.82 1.06 0.00 0.00 176.91 178.85 1j1e h ILE 61 N 0.39 1.60 -0.23 -1.22 2.04 -0.38 -3.31 117.51 116.39 1j1e h ILE 61 Ca 0.18 -2.06 0.07 0.00 1.00 0.00 0.00 64.86 64.04 1j1e h ILE 61 Cb 0.22 2.94 -0.01 0.00 -0.74 0.00 0.00 36.82 39.22 1j1e h ILE 61 CO -0.04 0.56 0.26 0.44 0.00 0.00 0.00 178.15 179.37 1j1e h ASP 62 N -0.61 0.00 0.59 1.72 3.32 -0.81 0.66 116.42 121.29 1j1e h ASP 62 Ca -0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.02 1j1e h ASP 62 Cb 1.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.59 1j1e h ASP 62 CO 0.04 0.00 0.00 1.21 -1.72 0.00 0.00 179.24 178.77 1j1e n GLU 63 N -3.77 0.19 0.00 3.56 2.13 -1.14 -2.96 120.64 118.66 1j1e n GLU 63 Ca 0.03 0.47 0.00 0.00 0.66 0.00 0.00 57.16 58.32 1j1e n GLU 63 Cb 0.40 -1.91 0.00 0.00 0.27 0.00 0.00 31.44 30.20 1j1e n GLU 63 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1j1e n VAL 64 N -2.27 0.00 -1.88 6.31 0.31 0.19 -5.01 118.33 115.97 1j1e n VAL 64 Ca 0.01 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.92 1j1e n VAL 64 Cb 0.19 0.36 -0.03 0.00 -0.91 0.00 0.00 33.84 33.46 1j1e n VAL 64 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1j1e s ASP 65 N -1.86 6.42 -0.01 4.52 3.68 0.11 -4.82 116.67 124.70 1j1e s ASP 65 Ca 0.00 2.22 0.14 0.00 2.13 0.00 0.00 52.55 57.04 1j1e s ASP 65 Cb 0.00 -2.53 -0.19 0.00 -1.45 0.00 0.00 42.92 38.75 1j1e s ASP 65 CO 0.00 -1.14 0.45 -0.62 0.13 0.00 0.00 175.17 174.00 1j1e n GLU 66 N 7.53 1.42 -0.33 4.34 1.02 -1.26 -4.52 120.64 128.85 1j1e n GLU 66 Ca 0.20 -0.07 0.09 0.00 -0.02 0.00 0.00 57.16 57.36 1j1e n GLU 66 Cb 0.43 -1.25 0.22 0.00 -0.02 0.00 0.00 31.44 30.82 1j1e n GLU 66 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1j1e n ASP 67 N -1.66 3.34 -1.56 1.62 3.85 -1.26 -4.94 116.55 115.93 1j1e n ASP 67 Ca 0.00 -3.06 -0.17 0.00 -0.71 0.00 0.00 54.79 50.85 1j1e n ASP 67 Cb 0.30 -0.51 -0.07 0.00 -1.35 0.00 0.00 41.12 39.49 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 -0.84 1.40 0.24 6.12 0.00 -1.26 -4.80 105.19 106.05 1j1e n GLY 68 Ca 0.20 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.23 1j1e n GLY 68 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1j1e h SER 69 N 0.00 0.27 0.00 1.61 4.64 -1.92 -3.46 113.55 114.70 1j1e h SER 69 Ca -0.34 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1j1e h SER 69 Cb 1.10 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1j1e h SER 69 CO 0.49 0.46 0.00 0.61 -0.87 0.00 0.00 176.83 177.52 1j1e n GLY 70 N -0.75 0.77 3.06 -0.77 0.00 -1.26 -5.01 105.19 101.23 1j1e n GLY 70 Ca -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.78 0.19 -0.24 2.61 -4.23 -1.26 -4.79 115.64 105.14 1j1e s THR 71 Ca 0.00 -1.59 -0.17 0.00 -1.18 0.00 0.00 61.69 58.74 1j1e s THR 71 Cb 0.00 -1.22 -0.03 0.00 1.34 0.00 0.00 72.50 72.59 1j1e s THR 71 CO 0.00 -0.88 0.48 -0.69 -0.54 0.00 0.00 174.62 172.99 1j1e s VAL 72 N -3.33 5.11 0.48 2.29 1.01 0.24 -4.81 120.40 121.39 1j1e s VAL 72 Ca 0.01 0.83 0.03 0.00 0.00 0.00 0.00 61.98 62.86 1j1e s VAL 72 Cb 0.04 -3.80 0.02 0.00 0.00 0.00 0.00 36.38 32.63 1j1e s VAL 72 CO -0.08 0.13 0.68 1.51 0.00 0.00 0.00 175.10 177.34 1j1e s ASP 73 N 1.42 5.52 0.13 3.32 1.47 -1.26 -0.77 116.67 126.51 1j1e s ASP 73 Ca 0.21 -0.10 -0.32 0.00 1.18 0.00 0.00 52.55 53.52 1j1e s ASP 73 Cb -0.15 -0.94 -0.10 0.00 -0.34 0.00 0.00 42.92 41.38 1j1e s ASP 73 CO 0.09 -0.91 1.55 0.15 0.68 0.00 0.00 175.17 176.73 1j1e h PHE 74 N 0.35 -1.69 -0.27 2.11 3.04 -1.96 1.46 116.94 119.98 1j1e h PHE 74 Ca -0.42 0.08 0.06 0.00 3.98 0.00 0.00 57.97 61.67 1j1e h PHE 74 Cb 1.28 0.79 -0.07 0.00 2.56 0.00 0.00 35.95 40.51 1j1e h PHE 74 CO 0.40 -0.49 -0.25 -0.44 -2.02 0.00 0.00 178.31 175.51 1j1e h ASP 75 N -0.38 -0.80 0.10 0.41 3.32 -1.97 2.93 116.42 120.03 1j1e h ASP 75 Ca 0.08 0.14 0.02 0.00 0.02 0.00 0.00 57.03 57.29 1j1e h ASP 75 Cb 0.59 0.38 -0.03 0.00 0.22 0.00 0.00 39.33 40.49 1j1e h ASP 75 CO -0.61 -0.28 -0.23 -0.33 -1.72 0.00 0.00 179.24 176.07 1j1e h GLU 76 N -0.24 -0.41 -0.65 3.56 5.08 -1.54 0.73 114.58 121.11 1j1e h GLU 76 Ca 0.14 0.03 0.17 0.00 -1.00 0.00 0.00 59.36 58.70 1j1e h GLU 76 Cb 0.47 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.78 1j1e h GLU 76 CO -0.41 -0.27 0.46 0.35 -1.00 0.00 0.00 179.01 178.14 1j1e h PHE 77 N -0.42 0.14 0.19 4.33 3.57 0.34 0.26 116.94 125.35 1j1e h PHE 77 Ca 0.03 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 1j1e h PHE 77 Cb 0.45 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.15 1j1e h PHE 77 CO -0.22 0.05 -0.09 1.25 -2.23 0.00 0.00 178.31 177.07 1j1e h LEU 78 N 0.12 -0.22 0.07 0.59 5.85 1.12 -2.32 115.31 120.52 1j1e h LEU 78 Ca 0.31 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.98 1j1e h LEU 78 Cb 1.07 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 1j1e h LEU 78 CO -0.04 -0.09 -0.07 0.58 -0.34 0.00 0.00 178.44 178.49 1j1e h VAL 79 N -0.33 0.84 -1.00 1.05 2.07 0.24 -2.67 116.25 116.45 1j1e h VAL 79 Ca -0.03 0.00 0.31 0.00 0.82 0.00 0.00 66.70 67.80 1j1e h VAL 79 Cb 0.26 0.84 -0.14 0.00 -1.52 0.00 0.00 31.29 30.73 1j1e h VAL 79 CO 0.04 0.00 0.57 -0.03 0.02 0.00 0.00 177.57 178.17 1j1e h MET 80 N -0.15 0.36 -0.02 1.57 1.85 -0.49 0.34 114.93 118.39 1j1e h MET 80 Ca 0.01 -0.02 -0.19 0.00 -0.61 0.00 0.00 59.70 58.88 1j1e h MET 80 Cb 0.15 -0.08 -0.01 0.00 0.43 0.00 0.00 31.60 32.09 1j1e h MET 80 CO -0.02 0.24 -0.81 0.52 -0.40 0.00 0.00 176.91 176.44 1j1e h MET 81 N 0.37 0.27 0.14 0.39 2.07 -1.08 -1.53 114.93 115.56 1j1e h MET 81 Ca 0.71 -0.26 -0.01 0.00 -2.07 0.00 0.00 59.70 58.08 1j1e h MET 81 Cb 1.58 0.07 0.00 0.00 -1.87 0.00 0.00 31.60 31.37 1j1e h MET 81 CO -0.58 0.94 -0.07 0.28 1.07 0.00 0.00 176.91 178.55 1j1e h VAL 82 N 0.17 0.96 -0.08 -2.22 2.07 -0.30 0.49 116.25 117.33 1j1e h VAL 82 Ca -0.04 -0.39 0.03 0.00 0.82 0.00 0.00 66.70 67.11 1j1e h VAL 82 Cb 1.41 1.20 -0.06 0.00 -1.52 0.00 0.00 31.29 32.32 1j1e h VAL 82 CO 0.13 0.09 -0.54 0.03 0.02 0.00 0.00 177.57 177.30 1j1e h ARG 83 N -0.37 -0.60 0.00 1.57 3.08 -0.70 0.90 114.38 118.27 1j1e h ARG 83 Ca -0.02 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1j1e h ARG 83 Cb 0.30 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.48 1j1e h ARG 83 CO 0.03 -0.40 0.00 0.45 -1.07 0.00 0.00 179.97 178.98 1j1e n SER 84 N -5.43 0.00 0.00 7.04 2.88 -0.58 -4.22 113.62 113.31 1j1e n SER 84 Ca -0.07 -0.48 0.00 0.00 -1.33 0.00 0.00 58.87 56.99 1j1e n SER 84 Cb 0.38 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.84 1j1e n SER 84 CO 0.00 0.00 0.00 0.80 -1.23 0.00 0.00 175.04 174.61 1j1e n MET 85 N -0.86 0.00 -3.53 -1.46 0.00 0.31 -4.93 117.12 106.66 1j1e n MET 85 Ca 0.06 0.29 -0.08 0.00 0.00 0.00 0.00 57.70 57.98 1j1e n MET 85 Cb 0.03 -0.89 -0.02 0.00 0.00 0.00 0.00 33.22 32.34 1j1e n MET 85 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 1j1e s LYS 86 N -0.78 0.83 0.09 2.12 1.02 -1.26 -5.06 119.74 116.71 1j1e s LYS 86 Ca 0.00 -0.33 0.05 0.00 0.02 0.00 0.00 55.97 55.72 1j1e s LYS 86 Cb 0.00 0.37 -0.04 0.00 -0.52 0.00 0.00 37.83 37.64 1j1e s LYS 86 CO 0.00 -0.37 -0.04 -0.51 -0.92 0.00 0.00 175.35 173.52 1j1e s ASP 87 N -2.52 4.80 0.00 2.83 1.01 -1.26 -5.08 116.67 116.46 1j1e s ASP 87 Ca 0.06 -0.24 0.00 0.00 0.71 0.00 0.00 52.55 53.08 1j1e s ASP 87 Cb -0.01 -1.08 0.00 0.00 1.01 0.00 0.00 42.92 42.84 1j1e s ASP 87 CO -0.08 0.18 0.00 -0.67 0.21 0.00 0.00 175.17 174.81 1j1e n ASP 88 N 0.66 0.00 -4.77 0.27 2.03 -1.26 -5.30 116.55 108.18 1j1e n ASP 88 Ca -0.12 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.78 1j1e n ASP 88 Cb 0.52 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.90 1j1e n ASP 88 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1j1e s LYS 92 N -0.59 4.31 0.40 -0.67 -0.14 -1.26 -5.21 119.74 116.57 1j1e s LYS 92 Ca 0.00 2.28 -0.11 0.00 -1.36 0.00 0.00 55.97 56.78 1j1e s LYS 92 Cb 0.00 -3.05 -0.07 0.00 -1.68 0.00 0.00 37.83 33.03 1j1e s LYS 92 CO 0.00 -0.25 0.78 -1.54 -0.76 0.00 0.00 175.35 173.58 1j1e s SER 93 N -0.41 6.55 0.12 2.83 1.04 -1.26 -4.92 113.70 117.65 1j1e s SER 93 Ca 0.50 1.17 -0.27 0.00 0.48 0.00 0.00 55.95 57.83 1j1e s SER 93 Cb -0.41 -2.34 -0.06 0.00 0.10 0.00 0.00 66.02 63.32 1j1e s SER 93 CO 0.55 -0.39 1.63 -0.08 0.98 0.00 0.00 173.24 175.92 1j1e h GLU 94 N 1.33 -0.43 -0.97 4.02 4.81 -2.03 -1.42 114.58 119.90 1j1e h GLU 94 Ca -0.47 0.03 0.29 0.00 -0.13 0.00 0.00 59.36 59.07 1j1e h GLU 94 Cb 1.19 0.10 -0.14 0.00 0.63 0.00 0.00 28.75 30.52 1j1e h GLU 94 CO 0.64 -0.28 0.47 1.49 -0.73 0.00 0.00 179.01 180.59 1j1e h GLU 95 N -0.44 0.31 0.42 1.92 4.81 -1.99 0.18 114.58 119.79 1j1e h GLU 95 Ca 0.06 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1j1e h GLU 95 Cb 0.52 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.84 1j1e h GLU 95 CO -0.24 0.20 -0.20 0.93 -0.73 0.00 0.00 179.01 178.97 1j1e h GLU 96 N 0.32 -0.55 -0.64 1.92 5.08 -1.68 -3.06 114.58 115.97 1j1e h GLU 96 Ca 0.67 0.04 0.04 0.00 -1.00 0.00 0.00 59.36 59.11 1j1e h GLU 96 Cb 1.46 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.79 1j1e h GLU 96 CO -0.61 -0.24 0.42 -0.07 -1.00 0.00 0.00 179.01 177.51 1j1e h LEU 97 N -0.89 0.62 -2.07 1.33 3.38 -0.26 0.31 115.31 117.74 1j1e h LEU 97 Ca -0.06 -0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.01 1j1e h LEU 97 Cb 0.56 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1j1e h LEU 97 CO 0.10 0.42 0.29 -1.28 0.09 0.00 0.00 178.44 178.06 1j1e h SER 98 N 0.72 0.00 0.58 -0.43 0.87 -0.59 0.35 113.55 115.04 1j1e h SER 98 Ca 0.26 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.54 1j1e h SER 98 Cb 0.15 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.10 1j1e h SER 98 CO -0.08 0.00 -1.34 0.44 -0.53 0.00 0.00 176.83 175.32 1j1e h ASP 99 N 0.00 0.39 0.05 6.23 3.45 -0.32 -3.18 116.42 123.05 1j1e h ASP 99 Ca 0.17 -0.46 -0.25 0.00 0.43 0.00 0.00 57.03 56.92 1j1e h ASP 99 Cb 0.75 -0.13 0.01 0.00 -0.56 0.00 0.00 39.33 39.41 1j1e h ASP 99 CO -0.00 1.37 -0.96 -0.07 -1.57 0.00 0.00 179.24 178.01 1j1e h LEU 100 N 0.07 0.83 -1.28 1.55 3.38 -0.63 -2.54 115.31 116.69 1j1e h LEU 100 Ca -0.17 -0.63 0.13 0.00 0.09 0.00 0.00 57.88 57.30 1j1e h LEU 100 Cb 1.98 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 42.41 1j1e h LEU 100 CO 0.19 1.43 0.57 0.15 0.09 0.00 0.00 178.44 180.86 1j1e h PHE 101 N 0.39 0.83 -0.64 1.13 3.57 -1.10 0.51 116.94 121.64 1j1e h PHE 101 Ca -0.10 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.36 1j1e h PHE 101 Cb 1.60 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 40.05 1j1e h PHE 101 CO 0.09 0.32 0.14 -0.09 -2.23 0.00 0.00 178.31 176.55 1j1e h ARG 102 N 0.72 1.01 0.00 1.11 2.43 -1.48 -1.57 114.38 116.60 1j1e h ARG 102 Ca 0.43 -0.23 -0.02 0.00 -0.81 0.00 0.00 59.98 59.36 1j1e h ARG 102 Cb 0.65 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.06 1j1e h ARG 102 CO -0.20 0.90 -0.07 0.52 -1.51 0.00 0.00 179.97 179.61 1j1e h MET 103 N 0.96 0.00 0.00 0.20 2.86 0.41 -3.02 114.93 116.34 1j1e h MET 103 Ca 0.20 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.80 1j1e h MET 103 Cb 0.36 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 1j1e h MET 103 CO 0.00 0.07 -0.26 0.74 1.06 0.00 0.00 176.91 178.52 1j1e h PHE 104 N 0.00 0.00 -0.25 -0.22 -1.00 -0.71 -3.41 116.94 111.34 1j1e h PHE 104 Ca -0.00 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.78 1j1e h PHE 104 Cb 0.37 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.93 1j1e h PHE 104 CO 0.00 0.80 0.03 -3.47 -1.61 0.00 0.00 178.31 174.05 1j1e n ASP 105 N -4.62 1.61 0.20 2.17 2.03 -0.65 -4.73 116.55 112.57 1j1e n ASP 105 Ca -0.12 -1.81 0.09 0.00 0.52 0.00 0.00 54.79 53.48 1j1e n ASP 105 Cb 0.39 -1.68 0.26 0.00 -0.72 0.00 0.00 41.12 39.38 1j1e n ASP 105 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1j1e h LYS 106 N 12.35 0.00 -0.67 -0.67 1.79 -1.81 -3.11 116.57 124.44 1j1e h LYS 106 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1j1e h LYS 106 Cb 1.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.65 1j1e h LYS 106 CO 1.01 0.20 0.00 0.27 -1.08 0.00 0.00 179.45 179.84 1j1e n ASN 107 N -3.20 3.57 -2.85 0.86 6.94 -1.26 -4.94 115.26 114.38 1j1e n ASN 107 Ca 0.02 -2.00 -0.15 0.00 -0.02 0.00 0.00 54.58 52.42 1j1e n ASN 107 Cb 0.54 -0.45 -0.01 0.00 -2.36 0.00 0.00 39.78 37.50 1j1e n ASN 107 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1j1e n ALA 108 N 1.45 -0.93 1.53 -2.53 0.00 -1.18 -4.80 120.51 114.06 1j1e n ALA 108 Ca 0.22 0.08 0.14 0.00 0.00 0.00 0.00 53.44 53.88 1j1e n ALA 108 Cb 0.56 -1.89 0.56 0.00 0.00 0.00 0.00 19.45 18.68 1j1e n ALA 108 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1j1e n ASP 109 N -1.97 1.28 -0.85 0.00 3.85 -1.26 -4.91 116.55 112.69 1j1e n ASP 109 Ca -0.07 -1.37 -0.08 0.00 -0.71 0.00 0.00 54.79 52.56 1j1e n ASP 109 Cb 0.57 0.01 -0.01 0.00 -1.35 0.00 0.00 41.12 40.34 1j1e n ASP 109 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1j1e n GLY 110 N 1.17 0.14 3.21 6.12 0.00 -1.26 -5.02 105.19 109.55 1j1e n GLY 110 Ca 0.19 -0.58 -0.12 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.37 -0.45 -0.25 1.61 2.02 -1.26 -4.46 117.35 112.19 1j1e s TYR 111 Ca 0.00 1.03 -0.17 0.00 -0.37 0.00 0.00 57.07 57.56 1j1e s TYR 111 Cb 0.00 0.16 -0.03 0.00 -0.40 0.00 0.00 41.96 41.69 1j1e s TYR 111 CO 0.00 -0.25 0.47 0.42 -1.57 0.00 0.00 175.55 174.62 1j1e s ILE 112 N 0.84 5.11 0.45 2.71 1.01 -0.13 -4.67 121.20 126.52 1j1e s ILE 112 Ca -0.05 0.80 0.07 0.00 0.00 0.00 0.00 60.65 61.47 1j1e s ILE 112 Cb -0.06 -3.79 -0.01 0.00 0.01 0.00 0.00 42.46 38.61 1j1e s ILE 112 CO -0.06 0.13 0.38 1.51 0.00 0.00 0.00 174.94 176.90 1j1e s ASP 113 N 1.48 4.90 0.22 3.58 3.84 -1.26 0.82 116.67 130.25 1j1e s ASP 113 Ca 0.20 -0.89 -0.10 0.00 -0.00 0.00 0.00 52.55 51.76 1j1e s ASP 113 Cb -0.16 -0.32 0.32 0.00 -1.38 0.00 0.00 42.92 41.39 1j1e s ASP 113 CO 0.09 -0.77 1.64 0.25 -0.00 0.00 0.00 175.17 176.39 1j1e h LEU 114 N 0.97 -0.40 -0.11 2.11 6.46 -1.98 0.30 115.31 122.67 1j1e h LEU 114 Ca -0.40 0.18 0.03 0.00 -0.12 0.00 0.00 57.88 57.56 1j1e h LEU 114 Cb 1.27 0.33 -0.03 0.00 -0.73 0.00 0.00 40.66 41.51 1j1e h LEU 114 CO 0.58 -0.16 -0.05 -0.08 -0.62 0.00 0.00 178.44 178.10 1j1e h GLU 115 N 0.08 -0.04 -0.59 1.25 4.81 -1.95 0.18 114.58 118.30 1j1e h GLU 115 Ca 0.34 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.53 1j1e h GLU 115 Cb 0.56 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.93 1j1e h GLU 115 CO -0.61 -0.03 0.20 0.93 -0.73 0.00 0.00 179.01 178.77 1j1e h GLU 116 N -0.04 0.92 -0.26 1.92 5.08 -1.54 0.15 114.58 120.80 1j1e h GLU 116 Ca 0.06 -0.19 0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1j1e h GLU 116 Cb 0.14 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1j1e h GLU 116 CO -0.14 0.81 0.15 1.25 -1.00 0.00 0.00 179.01 180.08 1j1e h LEU 117 N 0.84 0.23 0.58 1.33 5.85 0.07 0.28 115.31 124.48 1j1e h LEU 117 Ca 0.19 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 1j1e h LEU 117 Cb 0.27 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.26 1j1e h LEU 117 CO -0.01 0.17 -0.28 0.50 -0.34 0.00 0.00 178.44 178.49 1j1e h LYS 118 N 0.30 -0.74 -0.79 1.25 3.64 -0.38 1.17 116.57 121.02 1j1e h LYS 118 Ca 0.10 0.05 0.17 0.00 -1.27 0.00 0.00 60.65 59.70 1j1e h LYS 118 Cb 0.01 0.17 -0.15 0.00 -0.41 0.00 0.00 32.23 31.85 1j1e h LYS 118 CO -0.06 -0.46 -0.14 0.82 -2.27 0.00 0.00 179.45 177.35 1j1e h ILE 119 N -0.88 0.23 -0.17 2.00 2.04 -0.49 0.64 117.51 120.87 1j1e h ILE 119 Ca -0.08 -0.01 -0.04 0.00 1.00 0.00 0.00 64.86 65.74 1j1e h ILE 119 Cb 0.63 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1j1e h ILE 119 CO 0.13 0.00 -0.04 -0.03 0.00 0.00 0.00 178.15 178.22 1j1e h MET 120 N 0.02 0.33 -0.33 2.37 4.05 -0.78 -2.67 114.93 117.92 1j1e h MET 120 Ca 0.40 -0.12 0.10 0.00 -0.28 0.00 0.00 59.70 59.79 1j1e h MET 120 Cb 0.64 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.41 1j1e h MET 120 CO -0.78 0.59 0.26 1.25 0.23 0.00 0.00 176.91 178.46 1j1e h LEU 121 N 0.04 0.00 0.00 3.39 5.85 0.55 0.14 115.31 125.29 1j1e h LEU 121 Ca 0.04 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.62 1j1e h LEU 121 Cb 0.47 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 1j1e h LEU 121 CO 0.02 0.00 -0.78 -0.61 -0.34 0.00 0.00 178.44 176.72 1j1e h GLN 122 N 0.00 0.00 -0.42 1.25 5.75 0.33 -3.28 115.11 118.75 1j1e h GLN 122 Ca 0.16 0.00 0.12 0.00 -0.15 0.00 0.00 58.65 58.78 1j1e h GLN 122 Cb 0.68 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.21 1j1e h GLN 122 CO -0.00 0.61 0.31 0.00 -2.65 0.00 0.00 178.83 177.10 1j1e h ALA 123 N 1.34 2.34 -2.22 3.38 0.00 -0.38 -3.41 119.26 120.31 1j1e h ALA 123 Ca -0.03 -0.01 -0.46 0.00 0.00 0.00 0.00 54.91 54.40 1j1e h ALA 123 Cb 1.53 0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.36 1j1e h ALA 123 CO 0.08 -0.53 0.37 -0.08 0.00 0.00 0.00 179.25 179.09 1j1e s THR 124 N -4.96 4.04 0.19 0.00 -1.32 -1.23 -4.96 115.64 107.39 1j1e s THR 124 Ca -0.05 1.26 -0.12 0.00 -1.21 0.00 0.00 61.69 61.57 1j1e s THR 124 Cb 0.19 -3.51 0.11 0.00 -1.51 0.00 0.00 72.50 67.77 1j1e s THR 124 CO 0.69 -0.29 1.81 1.23 -2.21 0.00 0.00 174.62 175.86 1j1e h GLY 125 N 1.65 0.95 -4.82 6.08 0.00 -1.91 -3.45 103.07 101.58 1j1e h GLY 125 Ca -0.49 -0.42 -0.63 0.00 0.00 0.00 0.00 47.33 45.79 1j1e h GLY 125 CO 0.60 0.40 0.18 -2.21 0.00 0.00 0.00 176.54 175.51 1j1e n GLU 126 N -4.56 1.19 -1.84 4.80 4.07 -1.26 -4.83 120.64 118.22 1j1e n GLU 126 Ca 0.05 0.42 -0.25 0.00 -0.06 0.00 0.00 57.16 57.32 1j1e n GLU 126 Cb 0.07 -1.85 -0.05 0.00 -0.06 0.00 0.00 31.44 29.55 1j1e n GLU 126 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 1j1e s THR 127 N -0.56 3.25 -0.16 6.31 2.01 -1.26 -4.91 115.64 120.31 1j1e s THR 127 Ca 0.67 -0.13 -0.29 0.00 0.31 0.00 0.00 61.69 62.25 1j1e s THR 127 Cb -0.79 -3.57 -0.05 0.00 0.01 0.00 0.00 72.50 68.09 1j1e s THR 127 CO 0.55 -0.54 1.92 -0.51 -0.69 0.00 0.00 174.62 175.35 1j1e s ILE 128 N 11.69 3.28 0.87 1.82 2.07 -1.26 -4.98 121.20 134.69 1j1e s ILE 128 Ca 0.80 0.32 -0.10 0.00 -1.41 0.00 0.00 60.65 60.25 1j1e s ILE 128 Cb -0.11 -3.30 0.17 0.00 0.13 0.00 0.00 42.46 39.35 1j1e s ILE 128 CO 0.08 -0.13 1.20 0.42 -1.91 0.00 0.00 174.94 174.60 1j1e s THR 129 N 6.15 2.05 0.18 4.00 -4.23 -1.26 -4.97 115.64 117.56 1j1e s THR 129 Ca 0.86 -0.21 0.11 0.00 -1.18 0.00 0.00 61.69 61.27 1j1e s THR 129 Cb -0.32 -2.84 -0.04 0.00 1.34 0.00 0.00 72.50 70.65 1j1e s THR 129 CO 0.35 0.00 1.54 -0.08 -0.54 0.00 0.00 174.62 175.88 1j1e h GLU 130 N -1.22 0.00 -0.01 3.99 4.22 -2.01 -3.12 114.58 116.42 1j1e h GLU 130 Ca -0.42 0.00 -0.11 0.00 0.08 0.00 0.00 59.36 58.91 1j1e h GLU 130 Cb 1.25 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.51 1j1e h GLU 130 CO 0.40 0.66 -0.43 -0.44 -2.18 0.00 0.00 179.01 177.02 1j1e h ASP 131 N 0.00 0.40 -0.61 1.04 3.32 -2.00 -3.05 116.42 115.52 1j1e h ASP 131 Ca -0.01 -0.75 0.09 0.00 0.02 0.00 0.00 57.03 56.39 1j1e h ASP 131 Cb 1.25 -0.12 -0.11 0.00 0.22 0.00 0.00 39.33 40.57 1j1e h ASP 131 CO 0.09 1.09 -0.43 0.44 -1.72 0.00 0.00 179.24 178.71 1j1e h ASP 132 N -0.25 -1.48 0.29 6.45 3.32 -1.93 -1.05 116.42 121.76 1j1e h ASP 132 Ca -0.05 0.25 -0.00 0.00 0.02 0.00 0.00 57.03 57.25 1j1e h ASP 132 Cb 1.15 0.68 -0.03 0.00 0.22 0.00 0.00 39.33 41.35 1j1e h ASP 132 CO 0.09 -0.33 -0.47 0.40 -1.72 0.00 0.00 179.24 177.20 1j1e h ILE 133 N -0.20 0.00 -0.82 0.35 2.04 -1.62 -2.11 117.51 115.15 1j1e h ILE 133 Ca 0.19 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.25 1j1e h ILE 133 Cb 0.56 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.59 1j1e h ILE 133 CO -0.71 0.00 0.56 -0.08 0.00 0.00 0.00 178.15 177.92 1j1e h GLU 134 N -0.81 0.28 0.08 2.37 4.81 -1.31 -2.21 114.58 117.78 1j1e h GLU 134 Ca -0.03 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1j1e h GLU 134 Cb 0.75 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.07 1j1e h GLU 134 CO -0.16 0.19 -0.04 0.93 -0.73 0.00 0.00 179.01 179.20 1j1e h GLU 135 N 0.29 -0.10 0.25 1.92 4.39 -0.92 -2.84 114.58 117.57 1j1e h GLU 135 Ca 0.41 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 60.11 1j1e h GLU 135 Cb 1.17 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.83 1j1e h GLU 135 CO -0.11 0.46 -0.17 -0.07 -1.16 0.00 0.00 179.01 177.96 1j1e h LEU 136 N -0.86 -0.43 -2.21 1.33 3.38 -1.22 0.23 115.31 115.54 1j1e h LEU 136 Ca -0.01 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1j1e h LEU 136 Cb 0.60 0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.49 1j1e h LEU 136 CO 0.02 -0.27 0.27 -0.03 0.09 0.00 0.00 178.44 178.52 1j1e h MET 137 N -0.41 0.00 0.24 1.13 4.05 -1.55 0.39 114.93 118.78 1j1e h MET 137 Ca -0.02 0.00 -0.32 0.00 -0.28 0.00 0.00 59.70 59.08 1j1e h MET 137 Cb 0.35 0.00 0.03 0.00 -0.80 0.00 0.00 31.60 31.19 1j1e h MET 137 CO 0.01 0.00 -1.45 -0.22 0.23 0.00 0.00 176.91 175.48 1j1e h LYS 138 N 0.00 0.50 0.06 0.39 3.64 -0.40 -2.49 116.57 118.27 1j1e h LYS 138 Ca 0.02 -0.86 -0.24 0.00 -1.27 0.00 0.00 60.65 58.30 1j1e h LYS 138 Cb 0.55 0.32 -0.00 0.00 -0.41 0.00 0.00 32.23 32.68 1j1e h LYS 138 CO -0.00 1.41 -1.07 0.22 -2.27 0.00 0.00 179.45 177.74 1j1e h ASP 139 N 0.08 0.34 0.68 4.20 -0.00 0.13 -3.36 116.42 118.50 1j1e h ASP 139 Ca -0.26 -0.32 -0.03 0.00 -0.00 0.00 0.00 57.03 56.41 1j1e h ASP 139 Cb 2.11 -0.11 0.01 0.00 -0.00 0.00 0.00 39.33 41.34 1j1e h ASP 139 CO 0.25 1.20 -0.33 1.23 -0.00 0.00 0.00 179.24 181.59 1j1e h GLY 140 N 1.80 -0.96 -6.09 -0.78 0.00 -0.46 -3.33 103.07 93.25 1j1e h GLY 140 Ca -0.09 0.35 -0.59 0.00 0.00 0.00 0.00 47.33 47.01 1j1e h GLY 140 CO 0.17 -0.35 2.54 1.34 0.00 0.00 0.00 176.54 180.24 1j1e n ASP 141 N -5.39 3.53 0.20 0.19 4.64 -0.94 -4.66 116.55 114.13 1j1e n ASP 141 Ca -0.12 -2.60 0.14 0.00 -1.38 0.00 0.00 54.79 50.84 1j1e n ASP 141 Cb 0.37 -1.19 0.70 0.00 -1.04 0.00 0.00 41.12 39.96 1j1e n ASP 141 CO 0.00 0.00 0.00 0.50 -0.82 0.00 0.00 177.20 176.88 1j1e h LYS 142 N 7.15 0.00 0.00 -0.67 3.64 -1.78 -1.16 116.57 123.75 1j1e h LYS 142 Ca 0.48 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.68 1j1e h LYS 142 Cb 0.52 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 1j1e h LYS 142 CO 1.81 0.00 -2.06 0.27 -2.27 0.00 0.00 179.45 177.21 1j1e n ASN 143 N -2.51 0.14 -2.50 4.20 0.23 -1.26 -5.03 115.26 108.53 1j1e n ASN 143 Ca -0.01 0.06 -0.09 0.00 -0.53 0.00 0.00 54.58 54.01 1j1e n ASN 143 Cb 0.12 1.30 0.05 0.00 -2.08 0.00 0.00 39.78 39.17 1j1e n ASN 143 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1j1e n ASN 144 N -2.56 -3.62 -0.68 0.53 5.15 -0.44 -4.98 115.26 108.65 1j1e n ASN 144 Ca -0.17 -0.40 0.07 0.00 -0.60 0.00 0.00 54.58 53.49 1j1e n ASN 144 Cb 0.85 -3.28 0.12 0.00 -0.53 0.00 0.00 39.78 36.94 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 2.66 0.00 1.20 5.68 -1.26 -4.97 116.55 117.44 1j1e n ASP 145 Ca -0.10 -1.79 0.00 0.00 -0.50 0.00 0.00 54.79 52.41 1j1e n ASP 145 Cb 0.58 -0.14 0.00 0.00 -1.14 0.00 0.00 41.12 40.42 1j1e n ASP 145 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1j1e n GLY 146 N 0.79 2.95 3.10 6.12 0.00 -1.26 -5.03 105.19 111.86 1j1e n GLY 146 Ca 0.11 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.31 0.77 -0.27 1.61 3.03 -1.26 -4.08 118.95 118.44 1j1e s ARG 147 Ca 0.00 -0.71 -0.26 0.00 2.03 0.00 0.00 55.73 56.79 1j1e s ARG 147 Cb 0.00 -0.72 0.00 0.00 -1.03 0.00 0.00 34.95 33.21 1j1e s ARG 147 CO 0.00 0.17 0.90 0.42 -1.13 0.00 0.00 175.30 175.67 1j1e s ILE 148 N -0.92 4.74 0.51 4.99 1.01 0.24 -4.86 121.20 126.91 1j1e s ILE 148 Ca -0.01 1.60 -0.06 0.00 0.00 0.00 0.00 60.65 62.18 1j1e s ILE 148 Cb -0.08 -4.21 -0.04 0.00 0.01 0.00 0.00 42.46 38.14 1j1e s ILE 148 CO 0.01 -0.21 0.83 1.51 0.00 0.00 0.00 174.94 177.08 1j1e s ASP 149 N 1.43 6.24 0.25 3.58 1.47 -1.26 -0.95 116.67 127.42 1j1e s ASP 149 Ca 0.38 1.00 -0.12 0.00 1.18 0.00 0.00 52.55 54.99 1j1e s ASP 149 Cb -0.14 -2.27 0.35 0.00 -0.34 0.00 0.00 42.92 40.51 1j1e s ASP 149 CO 0.10 -0.64 1.58 0.22 0.68 0.00 0.00 175.17 177.10 1j1e h TYR 150 N 0.12 -0.61 -0.82 2.11 3.20 -1.96 0.37 116.97 119.38 1j1e h TYR 150 Ca -0.46 0.08 -0.04 0.00 3.14 0.00 0.00 58.73 61.45 1j1e h TYR 150 Cb 1.20 0.40 -0.04 0.00 1.54 0.00 0.00 36.73 39.84 1j1e h TYR 150 CO 0.59 -0.39 0.37 -0.44 -1.64 0.00 0.00 178.16 176.66 1j1e h ASP 151 N -0.01 1.09 -0.38 -2.11 5.19 -1.97 -0.86 116.42 117.36 1j1e h ASP 151 Ca 0.40 -0.14 -0.15 0.00 -0.62 0.00 0.00 57.03 56.51 1j1e h ASP 151 Cb 0.64 -0.28 -0.01 0.00 0.18 0.00 0.00 39.33 39.86 1j1e h ASP 151 CO -0.91 0.93 -0.35 -0.33 -3.12 0.00 0.00 179.24 175.46 1j1e h GLU 152 N 1.18 0.93 -0.02 3.56 5.08 -1.26 -1.31 114.58 122.73 1j1e h GLU 152 Ca 0.28 -0.47 0.01 0.00 -1.00 0.00 0.00 59.36 58.17 1j1e h GLU 152 Cb 0.15 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 1j1e h GLU 152 CO -0.03 1.13 0.02 0.35 -1.00 0.00 0.00 179.01 179.48 1j1e h PHE 153 N 0.77 0.00 0.14 4.33 3.57 0.26 0.94 116.94 126.96 1j1e h PHE 153 Ca 0.07 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 1j1e h PHE 153 Cb 0.94 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.68 1j1e h PHE 153 CO 0.06 0.00 -0.07 1.25 -2.23 0.00 0.00 178.31 177.32 1j1e h LEU 154 N 0.00 -0.16 -1.78 0.59 5.85 -0.10 -2.30 115.31 117.39 1j1e h LEU 154 Ca 0.01 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.50 1j1e h LEU 154 Cb 0.06 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.12 1j1e h LEU 154 CO -0.00 0.39 -0.14 -0.08 -0.34 0.00 0.00 178.44 178.27 1j1e h GLU 155 N -1.00 0.00 -0.10 1.25 4.57 -0.87 0.15 114.58 118.58 1j1e h GLU 155 Ca -0.02 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.13 1j1e h GLU 155 Cb 0.35 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.94 1j1e h GLU 155 CO 0.03 0.14 -0.05 0.35 -1.18 0.00 0.00 179.01 178.30 1j1e h PHE 156 N 0.00 0.23 -0.01 0.92 3.57 0.85 -3.02 116.94 119.49 1j1e h PHE 156 Ca -0.00 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.44 1j1e h PHE 156 Cb 0.26 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.95 1j1e h PHE 156 CO 0.00 0.56 -0.04 -1.33 -2.23 0.00 0.00 178.31 175.27 1j1e n MET 157 N -4.73 1.23 -1.57 1.11 2.81 -0.87 -4.91 117.12 110.20 1j1e n MET 157 Ca -0.07 -0.53 -0.52 0.00 -1.81 0.00 0.00 57.70 54.77 1j1e n MET 157 Cb 0.27 -1.49 -0.06 0.00 -0.71 0.00 0.00 33.22 31.23 1j1e n MET 157 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1j1e n LYS 158 N -0.42 0.96 0.00 0.03 4.81 0.01 -0.92 118.16 122.63 1j1e n LYS 158 Ca 0.19 0.34 0.00 0.00 -0.87 0.00 0.00 58.31 57.97 1j1e n LYS 158 Cb 0.27 -1.92 0.00 0.00 0.02 0.00 0.00 35.03 33.40 1j1e n LYS 158 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1j1e n GLY 159 N 2.25 2.66 3.61 3.14 0.00 -1.26 -4.80 105.19 110.79 1j1e n GLY 159 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.57 3.17 -0.81 1.61 1.01 -0.09 -4.88 120.40 118.84 1j1e s VAL 160 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.16 1j1e s VAL 160 Cb 0.00 -3.20 0.00 0.00 0.00 0.00 0.00 36.38 33.18 1j1e s VAL 160 CO 0.00 -0.11 0.20 1.21 0.00 0.00 0.00 175.10 176.40