#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j4e n SER 4 N 0.00 0.00 -0.53 0.00 2.88 -1.26 -5.04 113.62 109.67 2j4e n SER 4 Ca 0.00 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.55 2j4e n SER 4 Cb 0.00 0.00 0.04 0.00 -0.75 0.00 0.00 64.21 63.50 2j4e n SER 4 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2j4e n LEU 5 N -0.12 1.22 -4.59 2.46 4.32 -1.26 -4.88 117.00 114.16 2j4e n LEU 5 Ca 0.00 -0.62 -0.42 0.00 -0.02 0.00 0.00 56.01 54.96 2j4e n LEU 5 Cb 0.00 -0.42 -0.03 0.00 -1.62 0.00 0.00 43.42 41.35 2j4e n LEU 5 CO 0.00 0.25 1.77 -0.69 -1.22 0.00 0.00 177.39 177.49 2j4e s VAL 6 N -1.33 3.17 0.00 4.08 1.01 -1.26 -2.43 120.40 123.64 2j4e s VAL 6 Ca 0.05 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.19 2j4e s VAL 6 Cb 0.04 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 33.16 2j4e s VAL 6 CO 0.02 -0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.54 2j4e n GLY 7 N 5.69 3.12 3.77 4.51 0.00 -0.48 -5.05 105.19 116.75 2j4e n GLY 7 Ca 0.28 -1.04 -0.33 0.00 0.00 0.00 0.00 46.02 44.94 2j4e n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j4e s LYS 8 N 0.00 2.62 0.70 1.61 1.02 -1.02 -4.52 119.74 120.15 2j4e s LYS 8 Ca 0.00 1.35 -0.11 0.00 0.02 0.00 0.00 55.97 57.23 2j4e s LYS 8 Cb 0.00 -1.93 0.01 0.00 -0.52 0.00 0.00 37.83 35.39 2j4e s LYS 8 CO 0.00 -1.38 1.06 -1.59 -0.92 0.00 0.00 175.35 172.52 2j4e s LYS 9 N -4.29 2.89 -0.02 1.68 -2.85 -1.26 -3.19 119.74 112.71 2j4e s LYS 9 Ca 0.66 0.84 0.01 0.00 -1.00 0.00 0.00 55.97 56.48 2j4e s LYS 9 Cb -0.20 -1.99 0.01 0.00 -2.06 0.00 0.00 37.83 33.59 2j4e s LYS 9 CO 0.45 -1.10 -0.03 0.42 0.10 0.00 0.00 175.35 175.19 2j4e s ILE 10 N -3.10 0.29 -0.61 3.79 1.01 0.19 -4.77 121.20 118.01 2j4e s ILE 10 Ca 0.58 -0.09 -0.23 0.00 0.00 0.00 0.00 60.65 60.91 2j4e s ILE 10 Cb -0.13 -0.30 0.06 0.00 0.01 0.00 0.00 42.46 42.09 2j4e s ILE 10 CO 0.55 0.12 0.94 -0.69 0.00 0.00 0.00 174.94 175.86 2j4e s VAL 11 N 0.35 4.36 -0.46 2.92 1.01 -0.71 -0.80 120.40 127.07 2j4e s VAL 11 Ca -0.03 -0.09 -0.27 0.00 0.00 0.00 0.00 61.98 61.59 2j4e s VAL 11 Cb -0.07 -4.61 0.03 0.00 0.00 0.00 0.00 36.38 31.73 2j4e s VAL 11 CO -0.01 -1.29 1.01 0.12 0.00 0.00 0.00 175.10 174.93 2j4e s PHE 12 N 3.98 2.90 -0.30 5.22 5.36 -0.17 -1.04 117.98 133.93 2j4e s PHE 12 Ca 0.25 0.55 -0.11 0.00 -0.96 0.00 0.00 56.93 56.66 2j4e s PHE 12 Cb -0.15 -4.12 -0.04 0.00 -0.34 0.00 0.00 43.02 38.38 2j4e s PHE 12 CO 0.14 -1.14 0.20 0.54 -1.46 0.00 0.00 175.22 173.50 2j4e s VAL 13 N 3.99 5.23 -0.17 3.12 0.11 -0.23 -2.52 120.40 129.93 2j4e s VAL 13 Ca 0.41 -0.01 -0.29 0.00 -2.93 0.00 0.00 61.98 59.16 2j4e s VAL 13 Cb -0.09 -3.57 0.11 0.00 -1.53 0.00 0.00 36.38 31.29 2j4e s VAL 13 CO 0.28 0.15 0.90 0.28 -3.33 0.00 0.00 175.10 173.37 2j4e s THR 14 N 1.73 0.00 -0.19 5.04 -1.32 -1.19 -4.63 115.64 115.08 2j4e s THR 14 Ca 0.07 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.76 2j4e s THR 14 Cb -0.17 -1.00 -0.07 0.00 -1.51 0.00 0.00 72.50 69.75 2j4e s THR 14 CO 0.10 0.00 0.92 0.61 -2.21 0.00 0.00 174.62 174.05 2j4e n GLY 15 N 1.31 -1.36 3.54 6.08 0.00 -1.26 -4.18 105.19 109.32 2j4e n GLY 15 Ca -0.13 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.19 2j4e n GLY 15 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2j4e s ASN 16 N -5.25 6.29 0.24 1.61 3.84 -1.26 -4.91 114.94 115.50 2j4e s ASN 16 Ca -0.02 -0.31 -0.06 0.00 0.21 0.00 0.00 52.86 52.68 2j4e s ASN 16 Cb 0.10 -2.52 0.23 0.00 -0.55 0.00 0.00 41.25 38.51 2j4e s ASN 16 CO 0.81 -1.56 1.85 0.00 -2.79 0.00 0.00 177.10 175.41 2j4e h ALA 17 N 9.68 1.17 -0.71 1.71 0.00 -2.00 -2.24 119.26 126.87 2j4e h ALA 17 Ca -0.27 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 2j4e h ALA 17 Cb 1.06 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 2j4e h ALA 17 CO 1.20 0.66 0.32 0.87 0.00 0.00 0.00 179.25 182.30 2j4e h LYS 18 N 1.23 1.03 -0.38 0.00 1.79 -1.97 -0.60 116.57 117.67 2j4e h LYS 18 Ca 0.31 -0.16 -0.11 0.00 -2.18 0.00 0.00 60.65 58.52 2j4e h LYS 18 Cb 0.05 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 30.50 2j4e h LYS 18 CO -0.05 0.81 -0.19 -0.22 -1.08 0.00 0.00 179.45 178.73 2j4e h LYS 19 N 1.02 0.73 -0.26 3.15 3.64 -1.83 -1.56 116.57 121.46 2j4e h LYS 19 Ca 0.24 -0.28 -0.08 0.00 -1.27 0.00 0.00 60.65 59.27 2j4e h LYS 19 Cb 0.14 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 2j4e h LYS 19 CO -0.03 0.87 -0.14 1.25 -2.27 0.00 0.00 179.45 179.14 2j4e h LEU 20 N 0.65 0.57 -0.82 5.20 5.85 -1.20 -1.78 115.31 123.78 2j4e h LEU 20 Ca 0.10 -0.42 0.18 0.00 0.84 0.00 0.00 57.88 58.58 2j4e h LEU 20 Cb 0.68 -0.16 -0.11 0.00 0.37 0.00 0.00 40.66 41.44 2j4e h LEU 20 CO 0.05 0.86 0.31 -0.08 -0.34 0.00 0.00 178.44 179.25 2j4e h GLU 21 N 0.28 0.38 -0.11 1.25 4.81 -0.87 -1.08 114.58 119.24 2j4e h GLU 21 Ca 0.06 -0.02 -0.17 0.00 -0.13 0.00 0.00 59.36 59.09 2j4e h GLU 21 Cb 0.66 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.96 2j4e h GLU 21 CO 0.04 0.25 -0.61 0.93 -0.73 0.00 0.00 179.01 178.89 2j4e h GLU 22 N 0.39 0.61 -0.09 1.92 5.08 -1.16 -2.94 114.58 118.39 2j4e h GLU 22 Ca 0.48 -0.51 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2j4e h GLU 22 Cb 0.83 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 2j4e h GLU 22 CO -0.48 1.13 0.04 0.28 -1.00 0.00 0.00 179.01 178.98 2j4e h VAL 23 N 0.25 1.12 -0.76 3.13 2.07 -0.86 -1.22 116.25 119.98 2j4e h VAL 23 Ca -0.05 -0.34 0.11 0.00 0.82 0.00 0.00 66.70 67.24 2j4e h VAL 23 Cb 1.26 1.18 -0.08 0.00 -1.52 0.00 0.00 31.29 32.13 2j4e h VAL 23 CO 0.13 0.10 0.37 0.58 0.02 0.00 0.00 177.57 178.77 2j4e h VAL 24 N 0.02 0.79 -0.36 2.57 2.07 -1.30 -2.74 116.25 117.30 2j4e h VAL 24 Ca 0.03 -0.20 -0.11 0.00 0.82 0.00 0.00 66.70 67.23 2j4e h VAL 24 Cb 0.13 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 2j4e h VAL 24 CO -0.00 0.11 -0.22 1.56 0.02 0.00 0.00 177.57 179.03 2j4e h GLN 25 N 0.59 0.79 0.32 1.57 4.20 -1.31 -2.82 115.11 118.45 2j4e h GLN 25 Ca 0.39 -0.37 -0.02 0.00 0.06 0.00 0.00 58.65 58.72 2j4e h GLN 25 Cb 0.48 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.25 2j4e h GLN 25 CO -0.31 0.99 -0.15 0.82 -0.67 0.00 0.00 178.83 179.50 2j4e h ILE 26 N 0.57 0.00 0.00 2.54 2.04 -0.94 -3.26 117.51 118.46 2j4e h ILE 26 Ca 0.07 -0.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 2j4e h ILE 26 Cb 0.78 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 2j4e h ILE 26 CO 0.06 0.00 -0.08 0.17 0.00 0.00 0.00 178.15 178.31 2j4e h LEU 27 N -0.54 0.00 0.00 1.44 8.10 -1.67 -3.45 115.31 119.18 2j4e h LEU 27 Ca -0.04 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.95 2j4e h LEU 27 Cb 0.33 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.55 2j4e h LEU 27 CO 0.07 0.08 0.00 0.61 -4.11 0.00 0.00 178.44 175.09 2j4e n GLY 28 N -0.19 1.26 0.08 0.17 0.00 -1.06 -4.30 105.19 101.15 2j4e n GLY 28 Ca -0.00 0.45 -0.08 0.00 0.00 0.00 0.00 46.02 46.39 2j4e n GLY 28 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2j4e n ASP 29 N 10.80 1.81 -2.67 1.61 4.64 -1.26 -4.67 116.55 126.80 2j4e n ASP 29 Ca 0.00 0.39 -0.37 0.00 -1.38 0.00 0.00 54.79 53.43 2j4e n ASP 29 Cb 0.00 -0.76 0.05 0.00 -1.04 0.00 0.00 41.12 39.37 2j4e n ASP 29 CO 0.00 0.00 0.00 1.17 -0.82 0.00 0.00 177.20 177.55 2j4e n LYS 30 N -4.39 2.80 -2.63 -0.67 4.81 -1.26 -4.93 118.16 111.89 2j4e n LYS 30 Ca -0.12 -3.53 -0.43 0.00 -0.87 0.00 0.00 58.31 53.36 2j4e n LYS 30 Cb 0.43 -2.28 -0.02 0.00 0.02 0.00 0.00 35.03 33.19 2j4e n LYS 30 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 2j4e s PHE 31 N -3.95 3.26 -0.82 5.64 5.36 -1.26 -4.93 117.98 121.28 2j4e s PHE 31 Ca 0.56 1.38 0.00 0.00 -0.96 0.00 0.00 56.93 57.91 2j4e s PHE 31 Cb 0.46 -3.37 0.00 0.00 -0.34 0.00 0.00 43.02 39.77 2j4e s PHE 31 CO -0.26 -0.64 0.28 -2.30 -1.46 0.00 0.00 175.22 170.84 2j4e n PRO 32 N 6.45 0.47 -4.17 10.12 -0.02 -1.26 -4.65 135.00 141.94 2j4e n PRO 32 Ca 0.12 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.50 2j4e n PRO 32 Cb 0.46 -1.24 -0.10 0.00 -0.02 0.00 0.00 33.50 32.60 2j4e n PRO 32 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2j4e s THR 34 N -4.09 3.52 0.11 0.00 2.01 -1.19 -4.98 115.64 111.02 2j4e s THR 34 Ca 0.29 -1.09 -0.30 0.00 0.31 0.00 0.00 61.69 60.90 2j4e s THR 34 Cb 0.07 -2.94 -0.06 0.00 0.01 0.00 0.00 72.50 69.59 2j4e s THR 34 CO 0.05 -0.06 1.06 -0.76 -0.69 0.00 0.00 174.62 174.22 2j4e s LEU 35 N 1.38 4.46 -0.16 4.42 1.43 -1.26 -0.64 118.68 128.31 2j4e s LEU 35 Ca -0.01 1.93 0.00 0.00 -1.03 0.00 0.00 54.13 55.02 2j4e s LEU 35 Cb -0.19 -3.59 0.03 0.00 0.03 0.00 0.00 46.19 42.47 2j4e s LEU 35 CO 0.01 -0.22 -0.14 -0.69 0.23 0.00 0.00 176.35 175.54 2j4e s VAL 36 N 0.21 1.60 0.25 -1.59 1.01 0.02 -4.92 120.40 116.98 2j4e s VAL 36 Ca 0.51 -0.71 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 2j4e s VAL 36 Cb -0.26 -1.53 -0.09 0.00 0.00 0.00 0.00 36.38 34.49 2j4e s VAL 36 CO 0.31 0.41 0.93 0.00 0.00 0.00 0.00 175.10 176.75 2j4e s ALA 37 N 1.46 3.33 -0.17 5.51 0.00 -1.26 -1.00 121.76 129.64 2j4e s ALA 37 Ca 0.04 0.59 -0.04 0.00 0.00 0.00 0.00 51.96 52.55 2j4e s ALA 37 Cb -0.13 -3.19 0.08 0.00 0.00 0.00 0.00 23.12 19.88 2j4e s ALA 37 CO -0.10 0.21 0.25 -1.14 0.00 0.00 0.00 175.76 174.97 2j4e s GLN 38 N -1.30 0.18 -0.40 0.00 0.74 -1.05 -4.95 119.66 112.89 2j4e s GLN 38 Ca 0.42 0.46 -0.29 0.00 0.05 0.00 0.00 55.36 56.00 2j4e s GLN 38 Cb -0.25 -0.64 0.01 0.00 1.10 0.00 0.00 33.01 33.23 2j4e s GLN 38 CO 0.31 -0.49 1.38 -1.59 -0.55 0.00 0.00 175.29 174.34 2j4e s LYS 39 N 2.38 3.64 -0.16 1.67 -2.85 -1.26 -3.20 119.74 119.96 2j4e s LYS 39 Ca 0.05 0.96 -0.03 0.00 -1.00 0.00 0.00 55.97 55.95 2j4e s LYS 39 Cb -0.14 -3.99 0.05 0.00 -2.06 0.00 0.00 37.83 31.69 2j4e s LYS 39 CO -0.11 -1.48 0.05 0.42 0.10 0.00 0.00 175.35 174.33 2j4e s ILE 40 N 5.20 0.27 -0.49 3.79 1.01 -1.26 -4.97 121.20 124.75 2j4e s ILE 40 Ca 0.60 -0.28 -0.27 0.00 0.00 0.00 0.00 60.65 60.70 2j4e s ILE 40 Cb -0.14 -0.76 -0.01 0.00 0.01 0.00 0.00 42.46 41.56 2j4e s ILE 40 CO 0.31 -0.14 1.75 -0.62 0.00 0.00 0.00 174.94 176.24 2j4e s ASP 41 N 1.98 5.66 0.31 3.58 3.68 -1.26 -4.35 116.67 126.27 2j4e s ASP 41 Ca 0.01 0.70 -0.09 0.00 2.13 0.00 0.00 52.55 55.30 2j4e s ASP 41 Cb -0.16 -2.53 -0.06 0.00 -1.45 0.00 0.00 42.92 38.72 2j4e s ASP 41 CO -0.08 -2.00 0.63 -0.76 0.13 0.00 0.00 175.17 173.10 2j4e s LEU 42 N 7.70 4.03 0.36 -1.34 1.43 -1.26 -5.07 118.68 124.52 2j4e s LEU 42 Ca 0.69 0.94 -0.26 0.00 -1.03 0.00 0.00 54.13 54.47 2j4e s LEU 42 Cb -0.16 -3.76 -0.09 0.00 0.03 0.00 0.00 46.19 42.21 2j4e s LEU 42 CO 0.27 -0.22 1.12 -2.84 0.23 0.00 0.00 176.35 174.91 2j4e s PRO 43 N -3.37 4.28 -0.05 1.29 0.02 -1.26 -5.06 135.00 130.86 2j4e s PRO 43 Ca 0.48 1.75 0.06 0.00 0.02 0.00 0.00 61.00 63.31 2j4e s PRO 43 Cb -0.11 -2.82 -0.01 0.00 0.02 0.00 0.00 34.50 31.59 2j4e s PRO 43 CO 0.27 -0.09 -0.24 -1.21 -0.33 0.00 0.00 177.00 175.39 2j4e s GLU 44 N -2.06 2.38 0.71 5.54 2.02 -1.26 -4.74 118.70 121.29 2j4e s GLU 44 Ca 0.53 -0.88 -0.11 0.00 0.02 0.00 0.00 54.97 54.52 2j4e s GLU 44 Cb -0.29 -2.07 0.02 0.00 0.10 0.00 0.00 34.13 31.88 2j4e s GLU 44 CO 0.37 0.40 1.09 0.71 0.02 0.00 0.00 175.26 177.85 2j4e s TYR 45 N -0.24 3.27 0.18 1.61 2.02 -1.26 -5.06 117.35 117.88 2j4e s TYR 45 Ca -0.01 1.09 -0.26 0.00 -0.37 0.00 0.00 57.07 57.52 2j4e s TYR 45 Cb -0.13 -3.05 -0.08 0.00 -0.40 0.00 0.00 41.96 38.30 2j4e s TYR 45 CO 0.03 -1.23 0.81 -0.65 -1.57 0.00 0.00 175.55 172.94 2j4e s GLN 46 N -5.31 4.63 0.00 -0.62 -0.21 -1.26 -4.85 119.66 112.04 2j4e s GLN 46 Ca 0.58 1.23 0.00 0.00 0.02 0.00 0.00 55.36 57.19 2j4e s GLN 46 Cb -0.12 -3.26 0.00 0.00 1.00 0.00 0.00 33.01 30.64 2j4e s GLN 46 CO 0.52 0.56 0.00 0.41 -2.12 0.00 0.00 175.29 174.66 2j4e n GLY 47 N 1.55 0.13 3.88 3.09 0.00 -1.26 -4.94 105.19 107.63 2j4e n GLY 47 Ca -0.05 -0.87 -0.33 0.00 0.00 0.00 0.00 46.02 44.78 2j4e n GLY 47 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j4e s GLU 48 N -1.34 3.74 0.55 1.61 0.41 -1.26 -4.88 118.70 117.54 2j4e s GLU 48 Ca 0.00 0.14 0.23 0.00 -0.41 0.00 0.00 54.97 54.93 2j4e s GLU 48 Cb 0.00 -2.83 1.49 0.00 -1.78 0.00 0.00 34.13 31.01 2j4e s GLU 48 CO 0.00 0.45 2.15 -1.35 -0.49 0.00 0.00 175.26 176.02 2j4e h PRO 49 N 3.04 0.00 0.08 0.39 0.11 -1.98 0.22 132.00 133.86 2j4e h PRO 49 Ca -0.47 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 2j4e h PRO 49 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2j4e h PRO 49 CO 0.69 0.00 -0.04 -0.44 -0.21 0.00 0.00 178.00 178.00 2j4e h ASP 50 N 0.00 -0.09 -0.46 -2.05 3.32 -1.99 -2.06 116.42 113.09 2j4e h ASP 50 Ca 0.05 -0.51 0.07 0.00 0.02 0.00 0.00 57.03 56.66 2j4e h ASP 50 Cb 0.22 0.02 -0.06 0.00 0.22 0.00 0.00 39.33 39.73 2j4e h ASP 50 CO -0.00 0.52 0.12 -0.33 -1.72 0.00 0.00 179.24 177.83 2j4e h GLU 51 N -0.77 0.25 0.11 3.56 5.08 -1.86 -1.17 114.58 119.78 2j4e h GLU 51 Ca -0.01 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2j4e h GLU 51 Cb 0.59 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.75 2j4e h GLU 51 CO 0.02 0.17 -0.27 0.82 -1.00 0.00 0.00 179.01 178.74 2j4e h ILE 52 N 0.26 0.40 -0.74 3.13 2.04 -1.04 -1.29 117.51 120.28 2j4e h ILE 52 Ca 0.22 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.06 2j4e h ILE 52 Cb 0.27 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 2j4e h ILE 52 CO -0.27 0.00 0.37 0.28 0.00 0.00 0.00 178.15 178.53 2j4e h SER 53 N -0.48 0.95 0.46 1.72 0.02 -1.20 0.19 113.55 115.20 2j4e h SER 53 Ca 0.03 -0.12 -0.02 0.00 -0.84 0.00 0.00 61.79 60.85 2j4e h SER 53 Cb 0.51 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2j4e h SER 53 CO -0.17 0.80 -0.29 0.40 -1.14 0.00 0.00 176.83 176.44 2j4e h ILE 54 N 1.03 0.40 -0.43 3.27 2.04 -1.06 0.94 117.51 123.70 2j4e h ILE 54 Ca 0.25 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.09 2j4e h ILE 54 Cb 0.09 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 2j4e h ILE 54 CO -0.03 0.00 0.15 1.56 0.00 0.00 0.00 178.15 179.82 2j4e h GLN 55 N -0.72 0.62 -0.51 2.37 1.08 -1.09 -0.95 115.11 115.91 2j4e h GLN 55 Ca -0.05 -0.09 -0.06 0.00 -1.45 0.00 0.00 58.65 57.00 2j4e h GLN 55 Cb 0.59 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.89 2j4e h GLN 55 CO 0.05 0.54 0.09 -0.22 -0.95 0.00 0.00 178.83 178.33 2j4e h LYS 56 N 0.62 0.80 0.20 1.46 3.64 -0.37 -2.13 116.57 120.78 2j4e h LYS 56 Ca 0.15 -0.18 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2j4e h LYS 56 Cb 0.17 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2j4e h LYS 56 CO -0.01 0.75 -0.10 0.00 -2.27 0.00 0.00 179.45 177.82 2j4e h GLN 58 N -0.64 0.55 -0.36 0.00 4.20 -1.22 -0.99 115.11 116.64 2j4e h GLN 58 Ca -0.03 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 2j4e h GLN 58 Cb 0.46 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 2j4e h GLN 58 CO 0.04 0.36 0.18 1.49 -0.67 0.00 0.00 178.83 180.24 2j4e h GLU 59 N 0.57 0.52 -0.98 1.46 4.57 -1.27 -2.33 114.58 117.13 2j4e h GLU 59 Ca 0.58 -0.07 0.07 0.00 -1.18 0.00 0.00 59.36 58.76 2j4e h GLU 59 Cb 1.19 -0.10 -0.07 0.00 -0.16 0.00 0.00 28.75 29.61 2j4e h GLU 59 CO -0.34 0.46 0.63 0.00 -1.18 0.00 0.00 179.01 178.57 2j4e h ALA 60 N 1.03 1.36 -0.80 2.92 0.00 -0.81 -2.90 119.26 120.07 2j4e h ALA 60 Ca 0.13 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 2j4e h ALA 60 Cb 0.11 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 2j4e h ALA 60 CO -0.02 0.40 0.49 0.28 0.00 0.00 0.00 179.25 180.41 2j4e h VAL 61 N 1.13 1.22 0.00 0.00 2.07 -0.76 0.82 116.25 120.73 2j4e h VAL 61 Ca 0.43 -0.45 -0.03 0.00 0.82 0.00 0.00 66.70 67.46 2j4e h VAL 61 Cb 0.18 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.03 2j4e h VAL 61 CO -0.18 0.22 -0.16 0.03 0.02 0.00 0.00 177.57 177.50 2j4e h ARG 62 N 1.09 0.00 0.00 1.57 3.08 -1.28 -2.69 114.38 116.14 2j4e h ARG 62 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 2j4e h ARG 62 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.98 2j4e h ARG 62 CO -0.06 0.16 -1.31 1.04 -1.07 0.00 0.00 179.97 178.73 2j4e n GLN 63 N -3.28 1.10 -0.06 0.04 6.02 -0.73 -4.65 117.38 115.83 2j4e n GLN 63 Ca 0.01 -0.09 -0.06 0.00 -0.01 0.00 0.00 57.00 56.85 2j4e n GLN 63 Cb 0.42 -1.30 -0.09 0.00 1.02 0.00 0.00 30.24 30.30 2j4e n GLN 63 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2j4e n VAL 64 N -1.77 0.79 0.00 5.09 0.31 0.20 -5.04 118.33 117.92 2j4e n VAL 64 Ca -0.01 -0.46 0.00 0.00 -0.01 0.00 0.00 64.34 63.87 2j4e n VAL 64 Cb 0.33 -0.75 0.00 0.00 -0.91 0.00 0.00 33.84 32.51 2j4e n VAL 64 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2j4e n GLN 65 N -2.51 0.00 -0.92 5.55 -0.06 -1.02 -4.95 117.38 113.47 2j4e n GLN 65 Ca -0.20 0.00 -0.13 0.00 -2.00 0.00 0.00 57.00 54.67 2j4e n GLN 65 Cb 0.86 0.00 0.09 0.00 -4.06 0.00 0.00 30.24 27.12 2j4e n GLN 65 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2j4e n GLY 66 N 0.00 -1.10 3.67 1.69 0.00 -1.26 -4.99 105.19 103.20 2j4e n GLY 66 Ca 0.00 -1.72 -0.42 0.00 0.00 0.00 0.00 46.02 43.89 2j4e n GLY 66 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2j4e n PRO 67 N -2.23 1.80 -3.78 1.61 -0.02 -1.26 -4.89 135.00 126.23 2j4e n PRO 67 Ca 0.08 0.64 -0.13 0.00 -2.02 0.00 0.00 63.50 62.07 2j4e n PRO 67 Cb 0.26 -2.25 -0.12 0.00 -0.02 0.00 0.00 33.50 31.37 2j4e n PRO 67 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2j4e s VAL 68 N -1.18 -0.00 0.04 -1.45 1.01 -0.30 -1.75 120.40 116.77 2j4e s VAL 68 Ca 0.60 0.01 0.08 0.00 0.00 0.00 0.00 61.98 62.67 2j4e s VAL 68 Cb -0.55 -0.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.44 2j4e s VAL 68 CO 0.59 0.00 -0.23 -0.22 0.00 0.00 0.00 175.10 175.24 2j4e s LEU 69 N 0.23 2.16 0.24 3.92 2.96 -0.20 -1.60 118.68 126.39 2j4e s LEU 69 Ca -0.01 -0.55 -0.03 0.00 -0.22 0.00 0.00 54.13 53.32 2j4e s LEU 69 Cb -0.02 -1.13 -0.03 0.00 0.50 0.00 0.00 46.19 45.51 2j4e s LEU 69 CO -0.00 0.21 0.27 0.68 -1.32 0.00 0.00 176.35 176.19 2j4e s VAL 70 N -0.78 0.00 0.16 1.68 -7.23 -0.77 -1.07 120.40 112.39 2j4e s VAL 70 Ca 0.10 -1.80 -0.19 0.00 -1.81 0.00 0.00 61.98 58.28 2j4e s VAL 70 Cb -0.09 -2.44 0.04 0.00 0.56 0.00 0.00 36.38 34.45 2j4e s VAL 70 CO 0.02 0.00 0.50 -1.83 -0.31 0.00 0.00 175.10 173.48 2j4e s GLU 71 N -3.93 1.23 -0.11 4.82 -1.05 -1.26 -1.49 118.70 116.91 2j4e s GLU 71 Ca 0.34 -0.68 -0.03 0.00 -0.15 0.00 0.00 54.97 54.45 2j4e s GLU 71 Cb 0.04 0.52 0.04 0.00 -0.44 0.00 0.00 34.13 34.29 2j4e s GLU 71 CO 0.14 -0.52 0.06 -0.51 0.95 0.00 0.00 175.26 175.38 2j4e s ASP 72 N -2.81 1.83 -0.15 0.83 1.01 -0.74 -5.00 116.67 111.64 2j4e s ASP 72 Ca 0.04 -0.28 -0.15 0.00 0.71 0.00 0.00 52.55 52.87 2j4e s ASP 72 Cb 0.00 -0.28 -0.05 0.00 1.01 0.00 0.00 42.92 43.60 2j4e s ASP 72 CO -0.09 -0.28 0.34 -0.89 0.21 0.00 0.00 175.17 174.45 2j4e s THR 73 N 2.09 5.27 -0.02 -1.27 2.01 -1.26 -2.20 115.64 120.26 2j4e s THR 73 Ca 0.03 0.65 0.06 0.00 0.31 0.00 0.00 61.69 62.74 2j4e s THR 73 Cb -0.14 -3.68 -0.02 0.00 0.01 0.00 0.00 72.50 68.67 2j4e s THR 73 CO -0.06 0.38 -0.19 0.00 -0.69 0.00 0.00 174.62 174.06 2j4e s LEU 75 N -0.82 3.10 -0.16 0.00 2.96 -1.15 -0.24 118.68 122.37 2j4e s LEU 75 Ca 0.11 -0.24 0.01 0.00 -0.22 0.00 0.00 54.13 53.79 2j4e s LEU 75 Cb -0.10 -1.77 0.02 0.00 0.50 0.00 0.00 46.19 44.84 2j4e s LEU 75 CO 0.01 0.09 -0.16 0.00 -1.32 0.00 0.00 176.35 174.96 2j4e s PHE 77 N 1.40 3.31 0.27 0.00 0.40 0.42 -1.26 117.98 122.51 2j4e s PHE 77 Ca 0.04 0.69 -0.01 0.00 -0.60 0.00 0.00 56.93 57.06 2j4e s PHE 77 Cb -0.13 -2.70 0.39 0.00 0.51 0.00 0.00 43.02 41.09 2j4e s PHE 77 CO -0.11 -0.21 1.78 -0.91 0.70 0.00 0.00 175.22 176.47 2j4e h ASN 78 N 7.80 0.69 -0.69 1.36 -0.26 -1.64 0.85 115.58 123.69 2j4e h ASN 78 Ca -0.31 -0.16 0.12 0.00 -0.56 0.00 0.00 56.30 55.39 2j4e h ASN 78 Cb 1.15 -0.18 -0.04 0.00 -1.06 0.00 0.00 38.32 38.18 2j4e h ASN 78 CO 0.73 0.77 0.46 0.00 -1.06 0.00 0.00 177.43 178.33 2j4e h ALA 79 N 1.31 2.02 -0.81 -0.83 0.00 -1.74 -2.03 119.26 117.18 2j4e h ALA 79 Ca 0.13 -0.01 -0.45 0.00 0.00 0.00 0.00 54.91 54.59 2j4e h ALA 79 Cb 0.44 -0.09 -0.26 0.00 0.00 0.00 0.00 17.79 17.89 2j4e h ALA 79 CO 0.02 -0.19 0.43 1.28 0.00 0.00 0.00 179.25 180.79 2j4e n LEU 80 N -4.48 6.07 -3.81 0.00 4.77 -0.75 -4.95 117.00 113.85 2j4e n LEU 80 Ca 0.12 -3.78 -0.29 0.00 -0.03 0.00 0.00 56.01 52.03 2j4e n LEU 80 Cb 0.43 -0.78 0.03 0.00 -2.33 0.00 0.00 43.42 40.77 2j4e n LEU 80 CO 0.33 1.20 0.12 0.61 -1.33 0.00 0.00 177.39 178.33 2j4e n GLY 81 N -1.10 -0.51 1.66 -0.72 0.00 -0.76 -2.42 105.19 101.33 2j4e n GLY 81 Ca 0.52 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.74 2j4e n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j4e n GLY 82 N -1.72 0.99 3.92 -0.02 0.00 0.22 -4.99 105.19 103.59 2j4e n GLY 82 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 2j4e n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2j4e s LEU 83 N 0.00 3.54 0.33 0.99 1.43 -1.02 -3.05 118.68 120.90 2j4e s LEU 83 Ca 0.00 0.68 0.26 0.00 -1.03 0.00 0.00 54.13 54.04 2j4e s LEU 83 Cb 0.00 -3.57 1.09 0.00 0.03 0.00 0.00 46.19 43.74 2j4e s LEU 83 CO 0.00 -0.73 1.78 1.55 0.23 0.00 0.00 176.35 179.18 2j4e h PRO 84 N 0.18 0.00 0.00 1.29 0.13 -1.88 0.12 132.00 131.84 2j4e h PRO 84 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2j4e h PRO 84 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2j4e h PRO 84 CO 0.60 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.78 2j4e n GLY 85 N -0.05 2.73 0.12 1.56 0.00 0.72 -1.16 105.19 109.12 2j4e n GLY 85 Ca 0.02 0.32 0.11 0.00 0.00 0.00 0.00 46.02 46.47 2j4e n GLY 85 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2j4e n PRO 86 N 7.57 0.17 -0.24 1.61 -0.04 -1.26 -2.50 135.00 140.31 2j4e n PRO 86 Ca 0.00 0.42 0.10 0.00 -0.04 0.00 0.00 63.50 63.99 2j4e n PRO 86 Cb 0.00 -1.84 0.27 0.00 -0.04 0.00 0.00 33.50 31.89 2j4e n PRO 86 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2j4e n TYR 87 N -2.16 0.64 -0.25 0.54 4.01 -0.30 -4.54 117.16 115.09 2j4e n TYR 87 Ca 0.02 -0.32 0.13 0.00 -0.16 0.00 0.00 57.90 57.57 2j4e n TYR 87 Cb 0.21 0.00 0.41 0.00 -0.31 0.00 0.00 39.34 39.65 2j4e n TYR 87 CO 0.00 0.00 0.00 0.97 -0.46 0.00 0.00 176.86 177.37 2j4e h ILE 88 N 3.59 0.81 -0.83 -0.72 6.09 -1.61 -1.34 117.51 123.51 2j4e h ILE 88 Ca 0.00 -0.21 0.17 0.00 -1.37 0.00 0.00 64.86 63.45 2j4e h ILE 88 Cb 0.81 0.14 -0.10 0.00 0.47 0.00 0.00 36.82 38.13 2j4e h ILE 88 CO 0.00 0.11 0.37 0.50 -3.07 0.00 0.00 178.15 176.06 2j4e h LYS 89 N 0.61 0.47 0.02 2.19 3.64 -1.87 0.50 116.57 122.13 2j4e h LYS 89 Ca 0.44 -0.03 -0.25 0.00 -1.27 0.00 0.00 60.65 59.54 2j4e h LYS 89 Cb 0.80 -0.11 0.01 0.00 -0.41 0.00 0.00 32.23 32.52 2j4e h LYS 89 CO -0.19 0.31 -1.02 -1.49 -2.27 0.00 0.00 179.45 174.79 2j4e h TRP 90 N 0.48 0.79 -0.40 1.91 4.06 -1.61 -2.73 115.95 118.46 2j4e h TRP 90 Ca 0.47 -0.44 -0.12 0.00 2.06 0.00 0.00 58.89 60.86 2j4e h TRP 90 Cb 0.77 -0.09 -0.01 0.00 -1.00 0.00 0.00 29.16 28.83 2j4e h TRP 90 CO -0.14 1.27 -0.24 0.74 -3.56 0.00 0.00 178.44 176.51 2j4e h PHE 91 N 0.29 0.95 -0.26 0.49 0.04 -1.36 -2.45 116.94 114.63 2j4e h PHE 91 Ca -0.11 -0.23 -0.02 0.00 2.80 0.00 0.00 57.97 60.41 2j4e h PHE 91 Cb 1.67 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 39.58 2j4e h PHE 91 CO 0.08 0.98 0.06 1.25 -0.60 0.00 0.00 178.31 180.09 2j4e h LEU 92 N 0.71 0.34 -0.41 1.54 5.85 -0.90 -0.59 115.31 121.85 2j4e h LEU 92 Ca 0.09 -0.04 -0.15 0.00 0.84 0.00 0.00 57.88 58.63 2j4e h LEU 92 Cb 0.78 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 2j4e h LEU 92 CO 0.06 0.35 -0.33 -0.08 -0.34 0.00 0.00 178.44 178.11 2j4e h GLU 93 N 0.37 0.94 0.00 1.25 4.81 -1.13 -2.49 114.58 118.34 2j4e h GLU 93 Ca 0.09 -0.47 -0.26 0.00 -0.13 0.00 0.00 59.36 58.59 2j4e h GLU 93 Cb 0.15 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.48 2j4e h GLU 93 CO -0.00 1.13 -1.71 1.63 -0.73 0.00 0.00 179.01 179.33 2j4e n LYS 94 N -4.09 0.63 -0.06 1.92 4.76 -0.98 -4.62 118.16 115.73 2j4e n LYS 94 Ca -0.02 0.24 -0.06 0.00 -2.87 0.00 0.00 58.31 55.60 2j4e n LYS 94 Cb 0.51 -1.76 -0.09 0.00 -1.84 0.00 0.00 35.03 31.85 2j4e n LYS 94 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2j4e n LEU 95 N -2.96 0.43 -1.06 -0.35 4.77 -0.25 -5.04 117.00 112.53 2j4e n LEU 95 Ca -0.16 -0.01 0.14 0.00 -0.03 0.00 0.00 56.01 55.94 2j4e n LEU 95 Cb 1.00 0.17 -0.05 0.00 -2.33 0.00 0.00 43.42 42.21 2j4e n LEU 95 CO 0.44 0.35 -0.34 0.29 -1.33 0.00 0.00 177.39 176.80 2j4e n LYS 96 N -2.49 -2.31 -0.26 3.23 4.76 -0.94 -1.62 118.16 118.54 2j4e n LYS 96 Ca -0.19 1.73 0.14 0.00 -2.87 0.00 0.00 58.31 57.11 2j4e n LYS 96 Cb 0.85 -2.75 0.41 0.00 -1.84 0.00 0.00 35.03 31.71 2j4e n LYS 96 CO 0.00 0.00 0.00 -1.35 -1.37 0.00 0.00 177.40 174.68 2j4e h PRO 97 N -1.02 0.59 -0.06 1.97 0.11 -1.86 -1.72 132.00 130.02 2j4e h PRO 97 Ca -0.07 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 66.05 2j4e h PRO 97 Cb 1.00 -0.13 -0.06 0.00 0.11 0.00 0.00 31.00 31.92 2j4e h PRO 97 CO 0.04 0.39 -0.32 1.49 -0.21 0.00 0.00 178.00 179.39 2j4e h GLU 98 N 0.61 -0.42 0.00 1.05 4.22 -1.95 -2.43 114.58 115.66 2j4e h GLU 98 Ca 0.46 0.03 -0.01 0.00 0.08 0.00 0.00 59.36 59.92 2j4e h GLU 98 Cb 0.84 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 2j4e h GLU 98 CO -0.21 -0.28 -0.04 0.78 -2.18 0.00 0.00 179.01 177.09 2j4e h GLY 99 N -0.44 0.00 1.48 1.92 0.00 -0.45 -2.16 103.07 103.42 2j4e h GLY 99 Ca 0.08 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.19 2j4e h GLY 99 CO -0.30 0.00 -0.87 1.41 0.00 0.00 0.00 176.54 176.77 2j4e h LEU 100 N 0.00 0.61 -0.14 3.11 3.38 -0.91 -1.52 115.31 119.83 2j4e h LEU 100 Ca -0.00 -0.45 -0.03 0.00 0.09 0.00 0.00 57.88 57.49 2j4e h LEU 100 Cb 0.46 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 2j4e h LEU 100 CO 0.00 1.23 -0.03 -0.74 0.09 0.00 0.00 178.44 179.00 2j4e h HIS 101 N 0.30 0.30 -0.82 1.13 2.76 -1.06 -3.09 115.15 114.67 2j4e h HIS 101 Ca -0.07 -0.06 0.16 0.00 -2.20 0.00 0.00 60.37 58.20 2j4e h HIS 101 Cb 1.49 -0.08 -0.06 0.00 1.55 0.00 0.00 27.41 30.32 2j4e h HIS 101 CO 0.06 0.55 0.54 1.96 -1.30 0.00 0.00 177.93 179.74 2j4e h GLN 102 N -0.03 0.46 -0.44 5.26 4.20 -1.39 -1.75 115.11 121.43 2j4e h GLN 102 Ca 0.04 -0.03 0.12 0.00 0.06 0.00 0.00 58.65 58.84 2j4e h GLN 102 Cb 0.44 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 2j4e h GLN 102 CO 0.01 0.31 0.32 1.25 -0.67 0.00 0.00 178.83 180.05 2j4e h LEU 103 N 0.48 0.03 -2.33 1.46 5.85 -1.19 0.18 115.31 119.79 2j4e h LEU 103 Ca 0.41 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.13 2j4e h LEU 103 Cb 0.89 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.92 2j4e h LEU 103 CO -0.15 0.02 0.00 0.18 -0.34 0.00 0.00 178.44 178.14 2j4e n LEU 104 N -4.41 3.48 -0.15 2.25 4.77 -0.66 -4.57 117.00 117.71 2j4e n LEU 104 Ca 0.08 -1.75 0.11 0.00 -0.03 0.00 0.00 56.01 54.42 2j4e n LEU 104 Cb 0.50 -0.45 0.44 0.00 -2.33 0.00 0.00 43.42 41.58 2j4e n LEU 104 CO 0.36 0.70 1.20 0.00 -1.33 0.00 0.00 177.39 178.33 2j4e h ALA 105 N 3.91 1.92 -0.22 -1.18 0.00 -0.70 -0.78 119.26 122.21 2j4e h ALA 105 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2j4e h ALA 105 Cb 1.00 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2j4e h ALA 105 CO 0.10 -0.08 0.00 0.41 0.00 0.00 0.00 179.25 179.69 2j4e n GLY 106 N -1.49 0.57 3.28 0.00 0.00 -1.26 -4.88 105.19 101.42 2j4e n GLY 106 Ca 0.12 -0.47 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 2j4e n GLY 106 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2j4e s PHE 107 N -1.72 2.72 0.31 1.61 0.08 -0.30 -5.01 117.98 115.67 2j4e s PHE 107 Ca 0.33 -0.92 0.01 0.00 0.12 0.00 0.00 56.93 56.47 2j4e s PHE 107 Cb 0.18 -1.82 0.51 0.00 -0.57 0.00 0.00 43.02 41.32 2j4e s PHE 107 CO 0.26 -0.37 1.91 1.49 -0.10 0.00 0.00 175.22 178.41 2j4e h GLU 108 N 6.92 0.81 -6.11 0.44 4.81 -1.90 -3.41 114.58 116.15 2j4e h GLU 108 Ca -0.26 -0.11 -0.59 0.00 -0.13 0.00 0.00 59.36 58.26 2j4e h GLU 108 Cb 1.21 -0.15 -0.11 0.00 0.63 0.00 0.00 28.75 30.34 2j4e h GLU 108 CO 0.54 0.65 0.69 0.34 -0.73 0.00 0.00 179.01 180.50 2j4e s ASP 109 N -6.54 6.39 -0.07 1.04 2.15 -1.26 -4.90 116.67 113.48 2j4e s ASP 109 Ca -0.10 -0.16 0.13 0.00 0.43 0.00 0.00 52.55 52.86 2j4e s ASP 109 Cb 0.16 -2.47 0.50 0.00 -0.30 0.00 0.00 42.92 40.81 2j4e s ASP 109 CO 0.78 -1.28 1.37 0.29 -0.17 0.00 0.00 175.17 176.16 2j4e n LYS 110 N 7.72 2.80 -2.32 4.34 4.76 -1.26 -4.24 118.16 129.95 2j4e n LYS 110 Ca 0.04 -1.98 -0.31 0.00 -2.87 0.00 0.00 58.31 53.19 2j4e n LYS 110 Cb 0.48 -1.65 -0.02 0.00 -1.84 0.00 0.00 35.03 32.00 2j4e n LYS 110 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2j4e s SER 111 N -0.81 6.49 0.25 4.39 1.04 -1.26 -0.52 113.70 123.27 2j4e s SER 111 Ca 0.36 1.44 -0.21 0.00 0.48 0.00 0.00 55.95 58.02 2j4e s SER 111 Cb 0.22 -2.46 0.06 0.00 0.10 0.00 0.00 66.02 63.94 2j4e s SER 111 CO 0.18 -0.64 0.91 0.00 0.98 0.00 0.00 173.24 174.67 2j4e s ALA 112 N -2.75 -1.32 -0.07 5.32 0.00 -0.68 -1.85 121.76 120.41 2j4e s ALA 112 Ca 0.56 -0.34 -0.09 0.00 0.00 0.00 0.00 51.96 52.09 2j4e s ALA 112 Cb -0.10 0.72 0.02 0.00 0.00 0.00 0.00 23.12 23.75 2j4e s ALA 112 CO 0.38 -1.04 0.24 1.52 0.00 0.00 0.00 175.76 176.86 2j4e s TYR 113 N -2.69 -0.21 -0.16 0.00 -0.85 -0.39 -1.42 117.35 111.63 2j4e s TYR 113 Ca 0.16 0.49 -0.15 0.00 -0.52 0.00 0.00 57.07 57.06 2j4e s TYR 113 Cb -0.03 0.07 -0.05 0.00 0.38 0.00 0.00 41.96 42.33 2j4e s TYR 113 CO 0.06 -0.18 0.33 0.00 -1.52 0.00 0.00 175.55 174.24 2j4e s ALA 114 N -0.26 3.57 -0.12 9.51 0.00 0.09 -0.87 121.76 133.68 2j4e s ALA 114 Ca -0.04 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.51 2j4e s ALA 114 Cb -0.03 -2.45 -0.02 0.00 0.00 0.00 0.00 23.12 20.62 2j4e s ALA 114 CO 0.01 0.05 -0.13 -1.17 0.00 0.00 0.00 175.76 174.52 2j4e s LEU 115 N 0.55 2.77 -0.16 0.00 2.96 0.67 -1.23 118.68 124.24 2j4e s LEU 115 Ca 0.18 -0.28 0.00 0.00 -0.22 0.00 0.00 54.13 53.81 2j4e s LEU 115 Cb -0.13 -1.61 0.03 0.00 0.50 0.00 0.00 46.19 44.98 2j4e s LEU 115 CO 0.05 0.20 -0.09 0.00 -1.32 0.00 0.00 176.35 175.19 2j4e s THR 117 N 1.56 2.24 0.20 0.00 2.01 -0.94 -0.77 115.64 119.94 2j4e s THR 117 Ca 0.02 -1.18 -0.10 0.00 0.31 0.00 0.00 61.69 60.74 2j4e s THR 117 Cb -0.14 -2.10 -0.07 0.00 0.01 0.00 0.00 72.50 70.20 2j4e s THR 117 CO -0.09 0.30 0.53 -0.36 -0.69 0.00 0.00 174.62 174.31 2j4e s PHE 118 N 1.24 3.47 -0.05 4.92 0.08 0.37 -1.79 117.98 126.22 2j4e s PHE 118 Ca -0.00 0.89 0.01 0.00 0.12 0.00 0.00 56.93 57.94 2j4e s PHE 118 Cb -0.16 -2.26 0.02 0.00 -0.57 0.00 0.00 43.02 40.05 2j4e s PHE 118 CO -0.09 0.33 -0.04 0.00 -0.10 0.00 0.00 175.22 175.32 2j4e s ALA 119 N -1.71 0.74 -0.03 5.36 0.00 -0.56 -1.26 121.76 124.31 2j4e s ALA 119 Ca 0.44 -0.11 0.06 0.00 0.00 0.00 0.00 51.96 52.35 2j4e s ALA 119 Cb -0.12 -0.51 -0.01 0.00 0.00 0.00 0.00 23.12 22.47 2j4e s ALA 119 CO 0.21 -0.11 -0.21 -1.17 0.00 0.00 0.00 175.76 174.48 2j4e s LEU 120 N 1.13 2.01 0.03 0.00 2.96 -0.69 -1.85 118.68 122.27 2j4e s LEU 120 Ca -0.08 -0.40 -0.02 0.00 -0.22 0.00 0.00 54.13 53.41 2j4e s LEU 120 Cb -0.14 -1.12 -0.02 0.00 0.50 0.00 0.00 46.19 45.40 2j4e s LEU 120 CO -0.01 0.23 0.00 -0.55 -1.32 0.00 0.00 176.35 174.70 2j4e s SER 121 N -0.30 0.27 -0.06 3.68 0.15 -0.62 -2.46 113.70 114.36 2j4e s SER 121 Ca 0.03 -0.59 -0.06 0.00 0.70 0.00 0.00 55.95 56.02 2j4e s SER 121 Cb -0.10 0.15 -0.02 0.00 -1.71 0.00 0.00 66.02 64.34 2j4e s SER 121 CO 0.01 -0.40 -0.12 0.35 1.20 0.00 0.00 173.24 174.28 2j4e n THR 122 N 1.13 0.55 -1.64 6.45 -2.24 -1.26 -1.14 114.28 116.13 2j4e n THR 122 Ca -0.21 0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 2j4e n THR 122 Cb 0.57 -1.75 0.00 0.00 -2.10 0.00 0.00 70.33 67.05 2j4e n THR 122 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2j4e n GLN 127 N -3.19 -3.60 -0.81 -0.78 6.02 -1.26 -4.04 117.38 109.73 2j4e n GLN 127 Ca -0.05 2.65 -0.26 0.00 -0.01 0.00 0.00 57.00 59.33 2j4e n GLN 127 Cb 0.17 -3.11 0.01 0.00 1.02 0.00 0.00 30.24 28.34 2j4e n GLN 127 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 2j4e n PRO 128 N -0.33 0.00 -2.11 -1.09 -0.02 -1.26 -4.92 135.00 125.27 2j4e n PRO 128 Ca 0.00 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.12 2j4e n PRO 128 Cb 0.00 -0.69 0.02 0.00 -0.02 0.00 0.00 33.50 32.81 2j4e n PRO 128 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2j4e s VAL 129 N -1.39 2.86 -0.13 -1.45 1.01 -1.26 -4.95 120.40 115.09 2j4e s VAL 129 Ca 0.36 0.53 0.01 0.00 0.00 0.00 0.00 61.98 62.88 2j4e s VAL 129 Cb -0.27 -3.21 -0.01 0.00 0.00 0.00 0.00 36.38 32.89 2j4e s VAL 129 CO 0.50 -0.12 -0.17 -0.60 0.00 0.00 0.00 175.10 174.71 2j4e s ARG 130 N -3.33 3.25 -0.03 2.72 3.00 -1.03 -4.96 118.95 118.57 2j4e s ARG 130 Ca 0.75 -0.76 -0.01 0.00 -1.00 0.00 0.00 55.73 54.71 2j4e s ARG 130 Cb -0.27 -2.53 -0.04 0.00 0.00 0.00 0.00 34.95 32.11 2j4e s ARG 130 CO 0.31 0.16 0.07 -0.51 0.00 0.00 0.00 175.30 175.32 2j4e s LEU 131 N 0.45 3.86 -0.14 -0.88 1.43 -1.26 -1.70 118.68 120.44 2j4e s LEU 131 Ca -0.12 0.17 -0.01 0.00 -1.03 0.00 0.00 54.13 53.14 2j4e s LEU 131 Cb -0.16 -2.14 0.04 0.00 0.03 0.00 0.00 46.19 43.96 2j4e s LEU 131 CO 0.05 0.31 -0.01 -0.36 0.23 0.00 0.00 176.35 176.57 2j4e s PHE 132 N -1.10 1.20 0.02 0.29 0.08 -0.39 -4.97 117.98 113.11 2j4e s PHE 132 Ca 0.20 -0.73 0.04 0.00 0.12 0.00 0.00 56.93 56.55 2j4e s PHE 132 Cb -0.12 -1.08 -0.04 0.00 -0.57 0.00 0.00 43.02 41.22 2j4e s PHE 132 CO 0.10 -0.52 -0.06 1.03 -0.10 0.00 0.00 175.22 175.67 2j4e s ARG 133 N 1.80 2.53 -0.02 0.44 0.52 -1.26 -0.48 118.95 122.48 2j4e s ARG 133 Ca 0.02 -0.75 -0.00 0.00 -0.52 0.00 0.00 55.73 54.47 2j4e s ARG 133 Cb -0.15 -2.50 0.03 0.00 0.52 0.00 0.00 34.95 32.85 2j4e s ARG 133 CO -0.07 0.59 0.03 0.20 0.02 0.00 0.00 175.30 176.07 2j4e s GLY 134 N -1.62 0.09 -0.06 -3.53 0.00 0.05 -4.23 107.32 98.02 2j4e s GLY 134 Ca 0.19 0.31 -0.00 0.00 0.00 0.00 0.00 44.72 45.22 2j4e s GLY 134 CO 0.10 0.68 -0.02 1.09 0.00 0.00 0.00 173.10 174.94 2j4e s ARG 135 N 1.02 0.74 -0.09 2.90 1.70 -1.26 -0.50 118.95 123.47 2j4e s ARG 135 Ca -0.08 -0.01 -0.02 0.00 -0.47 0.00 0.00 55.73 55.14 2j4e s ARG 135 Cb -0.12 -0.91 -0.03 0.00 -0.57 0.00 0.00 34.95 33.31 2j4e s ARG 135 CO -0.03 -0.19 -0.01 0.99 -1.08 0.00 0.00 175.30 174.98 2j4e s THR 136 N 1.40 4.17 0.21 4.99 2.01 -0.36 -4.91 115.64 123.14 2j4e s THR 136 Ca -0.03 -0.30 -0.02 0.00 0.31 0.00 0.00 61.69 61.65 2j4e s THR 136 Cb -0.13 -2.75 -0.05 0.00 0.01 0.00 0.00 72.50 69.58 2j4e s THR 136 CO -0.03 0.59 0.42 -0.44 -0.69 0.00 0.00 174.62 174.47 2j4e s SER 137 N -0.69 6.42 0.00 3.53 0.01 -1.26 -0.73 113.70 120.97 2j4e s SER 137 Ca 0.11 0.50 0.00 0.00 1.31 0.00 0.00 55.95 57.87 2j4e s SER 137 Cb -0.12 -2.05 0.00 0.00 0.21 0.00 0.00 66.02 64.06 2j4e s SER 137 CO 0.02 -0.05 0.00 0.61 0.41 0.00 0.00 173.24 174.23 2j4e n GLY 138 N -0.56 1.53 3.32 3.44 0.00 -0.51 -1.58 105.19 110.84 2j4e n GLY 138 Ca -0.04 -0.42 -0.13 0.00 0.00 0.00 0.00 46.02 45.44 2j4e n GLY 138 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2j4e s ARG 139 N 1.67 0.87 -0.05 1.61 1.70 0.21 -1.69 118.95 123.27 2j4e s ARG 139 Ca 0.00 -0.27 -0.20 0.00 -0.47 0.00 0.00 55.73 54.79 2j4e s ARG 139 Cb 0.00 0.39 -0.05 0.00 -0.57 0.00 0.00 34.95 34.72 2j4e s ARG 139 CO 0.00 -0.28 0.55 0.42 -1.08 0.00 0.00 175.30 174.91 2j4e s ILE 140 N -2.10 5.04 0.12 4.99 -1.09 0.32 -1.82 121.20 126.66 2j4e s ILE 140 Ca -0.08 1.14 0.01 0.00 -2.23 0.00 0.00 60.65 59.49 2j4e s ILE 140 Cb -0.02 -3.89 -0.04 0.00 -1.58 0.00 0.00 42.46 36.93 2j4e s ILE 140 CO 0.00 0.37 -0.03 0.68 -1.23 0.00 0.00 174.94 174.74 2j4e s VAL 141 N 0.18 0.56 0.25 2.92 -7.23 -1.09 -4.92 120.40 111.07 2j4e s VAL 141 Ca 0.29 -1.93 -0.31 0.00 -1.81 0.00 0.00 61.98 58.23 2j4e s VAL 141 Cb -0.17 -1.82 -0.12 0.00 0.56 0.00 0.00 36.38 34.83 2j4e s VAL 141 CO 0.14 -0.73 1.59 0.00 -0.31 0.00 0.00 175.10 175.79 2j4e n ALA 142 N -0.08 2.26 -1.81 1.32 0.00 -1.26 -4.49 120.51 116.45 2j4e n ALA 142 Ca -0.10 0.39 -0.41 0.00 0.00 0.00 0.00 53.44 53.32 2j4e n ALA 142 Cb 0.62 -2.43 -0.02 0.00 0.00 0.00 0.00 19.45 17.61 2j4e n ALA 142 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2j4e s PRO 143 N 0.00 4.18 0.04 0.00 0.04 -1.26 -4.85 135.00 133.16 2j4e s PRO 143 Ca 0.68 2.46 0.02 0.00 0.04 0.00 0.00 61.00 64.21 2j4e s PRO 143 Cb -0.54 -3.06 -0.02 0.00 0.04 0.00 0.00 34.50 30.92 2j4e s PRO 143 CO 0.44 -0.54 -0.08 1.03 0.04 0.00 0.00 177.00 177.89 2j4e s ARG 144 N -0.45 0.53 0.00 4.56 0.52 -0.41 -4.97 118.95 118.73 2j4e s ARG 144 Ca 0.62 -0.71 0.00 0.00 -0.52 0.00 0.00 55.73 55.12 2j4e s ARG 144 Cb -0.45 -0.32 0.00 0.00 0.52 0.00 0.00 34.95 34.69 2j4e s ARG 144 CO 0.46 0.06 0.00 0.41 0.02 0.00 0.00 175.30 176.25 2j4e n GLY 145 N 1.61 -0.83 3.74 -3.53 0.00 -1.26 -4.10 105.19 100.82 2j4e n GLY 145 Ca -0.22 -1.66 -0.36 0.00 0.00 0.00 0.00 46.02 43.78 2j4e n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j4e n GLN 147 N -1.76 3.41 -0.09 0.00 6.02 -1.26 -4.61 117.38 119.08 2j4e n GLN 147 Ca 0.15 -3.07 -0.13 0.00 -0.01 0.00 0.00 57.00 53.94 2j4e n GLN 147 Cb 0.49 -3.03 -0.09 0.00 1.02 0.00 0.00 30.24 28.63 2j4e n GLN 147 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 2j4e n ASP 148 N 4.53 2.47 -3.62 1.08 9.92 -1.26 -4.91 116.55 124.75 2j4e n ASP 148 Ca 0.49 -0.09 -0.29 0.00 -0.53 0.00 0.00 54.79 54.36 2j4e n ASP 148 Cb 0.35 -0.22 -0.13 0.00 -0.64 0.00 0.00 41.12 40.48 2j4e n ASP 148 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 2j4e s PHE 149 N -2.37 1.40 0.00 1.24 5.99 -1.26 -5.05 117.98 117.93 2j4e s PHE 149 Ca -0.24 -1.92 0.00 0.00 0.00 0.00 0.00 56.93 54.77 2j4e s PHE 149 Cb 0.06 -1.47 0.00 0.00 0.00 0.00 0.00 43.02 41.61 2j4e s PHE 149 CO 0.44 -0.82 0.00 0.41 -0.00 0.00 0.00 175.22 175.25 2j4e n GLY 150 N 4.09 1.73 0.42 13.12 0.00 -1.26 -1.43 105.19 121.86 2j4e n GLY 150 Ca 0.06 0.29 0.07 0.00 0.00 0.00 0.00 46.02 46.45 2j4e n GLY 150 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2j4e n TRP 151 N 10.92 0.23 -0.24 1.61 4.27 -1.26 -4.36 117.44 128.61 2j4e n TRP 151 Ca 0.00 -0.11 0.04 0.00 -3.89 0.00 0.00 57.50 53.53 2j4e n TRP 151 Cb 0.00 0.00 0.16 0.00 -1.36 0.00 0.00 31.31 30.11 2j4e n TRP 151 CO 0.00 0.00 0.00 -0.44 -2.29 0.00 0.00 177.69 174.96 2j4e h ASP 152 N 1.49 0.18 0.19 -0.67 3.32 -1.62 -2.40 116.42 116.92 2j4e h ASP 152 Ca 0.00 0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 2j4e h ASP 152 Cb 0.33 0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.99 2j4e h ASP 152 CO 0.00 0.07 -0.05 -0.65 -1.72 0.00 0.00 179.24 176.89 2j4e h PRO 153 N 0.38 0.00 -0.44 3.56 0.11 -1.78 -2.63 132.00 131.20 2j4e h PRO 153 Ca 0.38 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.34 2j4e h PRO 153 Cb 0.57 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 31.59 2j4e h PRO 153 CO -0.40 0.05 0.07 0.00 -0.21 0.00 0.00 178.00 177.51 2j4e s PHE 155 N -3.05 2.13 -0.39 0.00 5.36 -1.00 -2.69 117.98 118.35 2j4e s PHE 155 Ca 0.47 -1.74 -0.19 0.00 -0.96 0.00 0.00 56.93 54.51 2j4e s PHE 155 Cb 0.39 -1.68 0.01 0.00 -0.34 0.00 0.00 43.02 41.40 2j4e s PHE 155 CO 0.07 -0.80 0.54 -1.14 -1.46 0.00 0.00 175.22 172.43 2j4e s GLN 156 N 1.48 3.43 0.47 10.12 0.74 -0.76 -2.14 119.66 133.01 2j4e s GLN 156 Ca 0.01 -0.33 -0.22 0.00 0.05 0.00 0.00 55.36 54.88 2j4e s GLN 156 Cb -0.18 -3.88 -0.08 0.00 1.10 0.00 0.00 33.01 29.98 2j4e s GLN 156 CO -0.12 -0.78 1.11 -1.25 -0.55 0.00 0.00 175.29 173.69 2j4e s PRO 157 N 2.47 3.75 0.35 1.67 0.04 -1.26 -0.62 135.00 141.39 2j4e s PRO 157 Ca 0.19 1.60 -0.28 0.00 0.04 0.00 0.00 61.00 62.55 2j4e s PRO 157 Cb -0.15 -2.28 -0.12 0.00 0.04 0.00 0.00 34.50 31.99 2j4e s PRO 157 CO 0.15 -0.52 1.30 -0.25 0.04 0.00 0.00 177.00 177.72 2j4e n ASP 158 N -0.69 2.82 0.00 6.66 10.43 -0.61 -2.68 116.55 132.47 2j4e n ASP 158 Ca 0.08 1.21 0.00 0.00 2.57 0.00 0.00 54.79 58.65 2j4e n ASP 158 Cb 0.50 -1.49 0.00 0.00 1.84 0.00 0.00 41.12 41.97 2j4e n ASP 158 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2j4e n GLY 159 N 0.75 2.81 3.58 0.44 0.00 -1.26 -4.99 105.19 106.52 2j4e n GLY 159 Ca 0.05 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 2j4e n GLY 159 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2j4e s TYR 160 N -2.79 2.63 -0.65 1.61 1.51 -1.09 -5.02 117.35 113.54 2j4e s TYR 160 Ca 0.00 -0.23 0.23 0.00 -1.01 0.00 0.00 57.07 56.07 2j4e s TYR 160 Cb 0.00 -1.26 0.13 0.00 -0.11 0.00 0.00 41.96 40.72 2j4e s TYR 160 CO 0.00 0.54 1.11 0.39 -1.11 0.00 0.00 175.55 176.47 2j4e n GLU 161 N -0.12 0.26 -3.82 -0.62 -0.58 -1.26 -4.71 120.64 109.79 2j4e n GLU 161 Ca -0.10 0.01 -0.35 0.00 -0.42 0.00 0.00 57.16 56.31 2j4e n GLU 161 Cb 0.56 -1.60 -0.05 0.00 -0.57 0.00 0.00 31.44 29.78 2j4e n GLU 161 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2j4e s GLN 162 N -3.17 3.52 0.82 3.49 -0.21 -1.26 -5.08 119.66 117.77 2j4e s GLN 162 Ca 0.05 -0.14 -0.12 0.00 0.02 0.00 0.00 55.36 55.16 2j4e s GLN 162 Cb 0.14 -3.11 0.08 0.00 1.00 0.00 0.00 33.01 31.12 2j4e s GLN 162 CO 0.78 0.69 1.13 0.95 -2.12 0.00 0.00 175.29 176.72 2j4e s THR 163 N -1.24 2.50 0.30 -0.19 -4.23 -1.26 -4.29 115.64 107.23 2j4e s THR 163 Ca 0.24 0.16 -0.01 0.00 -1.18 0.00 0.00 61.69 60.91 2j4e s THR 163 Cb -0.13 -3.03 0.27 0.00 1.34 0.00 0.00 72.50 70.96 2j4e s THR 163 CO 0.14 -0.21 1.93 1.88 -0.54 0.00 0.00 174.62 177.82 2j4e h TYR 164 N -1.13 1.06 -0.62 3.99 0.05 -1.42 -1.56 116.97 117.33 2j4e h TYR 164 Ca -0.47 0.03 -0.06 0.00 0.05 0.00 0.00 58.73 58.27 2j4e h TYR 164 Cb 1.30 -0.35 -0.03 0.00 1.01 0.00 0.00 36.73 38.66 2j4e h TYR 164 CO 0.37 0.60 0.13 0.00 -1.05 0.00 0.00 178.16 178.22 2j4e h ALA 165 N 1.49 1.07 -0.51 3.88 0.00 -1.80 -2.99 119.26 120.40 2j4e h ALA 165 Ca 0.36 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2j4e h ALA 165 Cb 0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2j4e h ALA 165 CO -0.11 0.61 -0.05 0.93 0.00 0.00 0.00 179.25 180.63 2j4e h GLU 166 N 0.94 0.89 -6.83 0.00 5.08 -1.47 -3.39 114.58 109.80 2j4e h GLU 166 Ca 0.20 -0.28 -0.53 0.00 -1.00 0.00 0.00 59.36 57.74 2j4e h GLU 166 Cb 0.36 -0.08 0.08 0.00 0.50 0.00 0.00 28.75 29.60 2j4e h GLU 166 CO 0.00 0.92 0.80 -1.64 -1.00 0.00 0.00 179.01 178.09 2j4e s MET 167 N -4.91 4.19 0.29 2.33 -1.94 -0.68 -4.95 119.30 113.63 2j4e s MET 167 Ca -0.10 2.45 -0.30 0.00 -1.71 0.00 0.00 55.69 56.03 2j4e s MET 167 Cb 0.14 -3.04 -0.12 0.00 2.01 0.00 0.00 34.83 33.81 2j4e s MET 167 CO 0.83 -0.49 1.42 -2.30 -0.01 0.00 0.00 175.02 174.47 2j4e n PRO 168 N 1.67 2.28 -0.03 2.03 -0.02 -1.26 -4.79 135.00 134.87 2j4e n PRO 168 Ca 0.05 0.81 0.12 0.00 -2.02 0.00 0.00 63.50 62.46 2j4e n PRO 168 Cb 0.39 -2.48 0.53 0.00 -0.02 0.00 0.00 33.50 31.93 2j4e n PRO 168 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2j4e h LYS 169 N 3.76 0.31 -0.84 -0.52 3.64 -1.94 0.44 116.57 121.42 2j4e h LYS 169 Ca -0.46 -0.02 0.17 0.00 -1.27 0.00 0.00 60.65 59.07 2j4e h LYS 169 Cb 1.26 -0.07 -0.10 0.00 -0.41 0.00 0.00 32.23 32.91 2j4e h LYS 169 CO 0.72 0.21 0.38 0.00 -2.27 0.00 0.00 179.45 178.48 2j4e h ALA 170 N 1.74 1.26 -0.25 5.00 0.00 -1.98 0.38 119.26 125.40 2j4e h ALA 170 Ca 0.23 0.12 -0.08 0.00 0.00 0.00 0.00 54.91 55.18 2j4e h ALA 170 Cb 0.49 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2j4e h ALA 170 CO -0.05 -0.21 -0.16 1.49 0.00 0.00 0.00 179.25 180.32 2j4e h GLU 171 N 0.50 0.55 -0.31 0.00 4.81 -0.49 -3.26 114.58 116.38 2j4e h GLU 171 Ca 0.48 -0.26 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 2j4e h GLU 171 Cb 0.77 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 2j4e h GLU 171 CO -0.43 0.83 0.19 -0.22 -0.73 0.00 0.00 179.01 178.65 2j4e h LYS 172 N 0.27 0.41 0.00 1.92 3.64 -0.95 -2.57 116.57 119.29 2j4e h LYS 172 Ca 0.05 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2j4e h LYS 172 Cb 0.68 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 2j4e h LYS 172 CO 0.04 0.29 0.00 0.09 -2.27 0.00 0.00 179.45 177.61 2j4e n ASN 173 N -4.86 0.00 -0.00 4.20 3.02 0.05 -1.17 115.26 116.50 2j4e n ASN 173 Ca -0.01 -0.71 0.06 0.00 -0.03 0.00 0.00 54.58 53.89 2j4e n ASN 173 Cb 0.04 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.13 2j4e n ASN 173 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2j4e n ALA 174 N -0.83 3.32 0.00 5.41 0.00 -0.97 -4.75 120.51 122.70 2j4e n ALA 174 Ca 0.08 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2j4e n ALA 174 Cb 0.04 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.04 2j4e n ALA 174 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2j4e n VAL 175 N -1.46 0.00 -2.37 0.00 0.24 -0.64 -4.97 118.33 109.13 2j4e n VAL 175 Ca 0.01 -0.19 -0.32 0.00 -2.04 0.00 0.00 64.34 61.80 2j4e n VAL 175 Cb 0.23 0.82 -0.03 0.00 -1.47 0.00 0.00 33.84 33.40 2j4e n VAL 175 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2j4e s SER 176 N -0.63 6.58 0.32 -1.34 1.04 -0.32 -4.84 113.70 114.51 2j4e s SER 176 Ca 0.00 1.53 0.15 0.00 0.48 0.00 0.00 55.95 58.11 2j4e s SER 176 Cb 0.00 -2.49 1.10 0.00 0.10 0.00 0.00 66.02 64.73 2j4e s SER 176 CO 0.00 -0.61 1.41 0.00 0.98 0.00 0.00 173.24 175.02 2j4e n HIS 177 N -1.69 0.95 0.01 5.02 -0.00 -1.26 -0.48 115.22 117.77 2j4e n HIS 177 Ca 0.06 1.06 -0.13 0.00 -0.00 0.00 0.00 57.72 58.71 2j4e n HIS 177 Cb 0.54 -1.41 -0.02 0.00 -0.00 0.00 0.00 29.99 29.11 2j4e n HIS 177 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.34 176.25 2j4e h ARG 178 N 0.00 0.62 -0.81 -1.40 2.43 -1.92 -1.61 114.38 111.69 2j4e h ARG 178 Ca 0.72 -0.49 0.01 0.00 -0.81 0.00 0.00 59.98 59.40 2j4e h ARG 178 Cb 1.83 0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 31.44 2j4e h ARG 178 CO -0.72 1.11 0.53 0.35 -1.51 0.00 0.00 179.97 179.73 2j4e h PHE 179 N 0.43 1.03 -0.31 2.20 3.57 -1.08 0.11 116.94 122.90 2j4e h PHE 179 Ca -0.04 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.39 2j4e h PHE 179 Cb 1.33 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 2j4e h PHE 179 CO 0.06 0.66 -0.20 0.00 -2.23 0.00 0.00 178.31 176.60 2j4e h ARG 180 N 1.10 0.57 -0.02 1.11 2.47 -1.06 -1.17 114.38 117.37 2j4e h ARG 180 Ca 0.30 -0.20 -0.02 0.00 -1.26 0.00 0.00 59.98 58.79 2j4e h ARG 180 Cb -0.11 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.17 2j4e h ARG 180 CO -0.06 0.74 -0.08 0.00 0.56 0.00 0.00 179.97 181.12 2j4e h ALA 181 N 1.28 0.04 0.00 0.04 0.00 -1.02 -3.01 119.26 116.59 2j4e h ALA 181 Ca 0.08 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 2j4e h ALA 181 Cb 0.63 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 2j4e h ALA 181 CO 0.04 -0.08 -0.01 -0.07 0.00 0.00 0.00 179.25 179.14 2j4e h LEU 182 N -0.50 0.00 -0.47 0.00 3.38 -0.97 -1.52 115.31 115.24 2j4e h LEU 182 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2j4e h LEU 182 Cb 0.72 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 2j4e h LEU 182 CO 0.02 0.01 0.24 0.25 0.09 0.00 0.00 178.44 179.04 2j4e h LEU 183 N 0.00 0.60 -1.38 1.67 5.85 -1.16 -0.85 115.31 120.04 2j4e h LEU 183 Ca -0.00 -0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.55 2j4e h LEU 183 Cb 0.01 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 2j4e h LEU 183 CO 0.00 0.55 -0.14 -0.33 -0.34 0.00 0.00 178.44 178.18 2j4e h GLU 184 N 0.61 0.24 -0.10 1.25 5.08 -1.16 -2.42 114.58 118.08 2j4e h GLU 184 Ca 0.16 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.32 2j4e h GLU 184 Cb 0.10 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2j4e h GLU 184 CO -0.02 0.39 -0.55 1.25 -1.00 0.00 0.00 179.01 179.08 2j4e h LEU 185 N 0.23 0.34 0.13 1.33 5.85 -0.89 -2.98 115.31 119.32 2j4e h LEU 185 Ca 0.05 -0.18 -0.30 0.00 0.84 0.00 0.00 57.88 58.28 2j4e h LEU 185 Cb 0.39 -0.10 0.03 0.00 0.37 0.00 0.00 40.66 41.35 2j4e h LEU 185 CO 0.02 0.82 -1.27 1.56 -0.34 0.00 0.00 178.44 179.24 2j4e h GLN 186 N 0.23 0.62 0.00 1.25 4.20 -1.01 -3.19 115.11 117.22 2j4e h GLN 186 Ca 0.00 -0.84 -0.01 0.00 0.06 0.00 0.00 58.65 57.86 2j4e h GLN 186 Cb 1.04 0.28 -0.00 0.00 0.30 0.00 0.00 27.48 29.10 2j4e h GLN 186 CO 0.09 1.39 -0.05 1.49 -0.67 0.00 0.00 178.83 181.07 2j4e h GLU 187 N 0.27 0.00 -0.58 1.46 4.22 -1.51 -2.26 114.58 116.18 2j4e h GLU 187 Ca -0.19 0.00 -0.06 0.00 0.08 0.00 0.00 59.36 59.19 2j4e h GLU 187 Cb 1.94 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 31.16 2j4e h GLU 187 CO 0.24 0.05 0.12 -0.92 -2.18 0.00 0.00 179.01 176.33 2j4e h TYR 188 N 0.00 0.95 -3.00 0.92 3.20 -1.50 -3.33 116.97 114.20 2j4e h TYR 188 Ca -0.00 -0.10 -0.77 0.00 3.14 0.00 0.00 58.73 61.00 2j4e h TYR 188 Cb 0.31 -0.27 -0.24 0.00 1.54 0.00 0.00 36.73 38.07 2j4e h TYR 188 CO 0.00 0.80 0.80 -0.06 -1.64 0.00 0.00 178.16 178.05 2j4e s PHE 189 N -5.20 3.92 0.00 -3.82 0.08 -0.85 -4.80 117.98 107.30 2j4e s PHE 189 Ca -0.10 -2.40 0.00 0.00 0.12 0.00 0.00 56.93 54.54 2j4e s PHE 189 Cb 0.15 -4.04 0.00 0.00 -0.57 0.00 0.00 43.02 38.56 2j4e s PHE 189 CO 0.82 -1.14 0.00 0.41 -0.10 0.00 0.00 175.22 175.20