#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1je4 h PRO 2 N 0.00 -0.65 -6.62 0.00 0.11 -2.11 -3.41 132.00 119.33 1je4 h PRO 2 Ca 0.00 0.04 -0.53 0.00 0.11 0.00 0.00 66.00 65.63 1je4 h PRO 2 Cb 0.00 0.15 0.04 0.00 0.11 0.00 0.00 31.00 31.30 1je4 h PRO 2 CO 0.00 -0.43 0.80 -1.64 -0.21 0.00 0.00 178.00 176.52 1je4 s MET 3 N -5.17 4.26 0.11 1.05 -1.94 -1.26 -5.00 119.30 111.36 1je4 s MET 3 Ca -0.13 2.25 -0.02 0.00 -1.71 0.00 0.00 55.69 56.08 1je4 s MET 3 Cb 0.04 -3.17 0.03 0.00 2.01 0.00 0.00 34.83 33.73 1je4 s MET 3 CO 0.47 -0.51 0.06 0.41 -0.01 0.00 0.00 175.02 175.45 1je4 n GLY 4 N 3.31 -3.68 0.15 -0.03 0.00 -1.26 -4.94 105.19 98.74 1je4 n GLY 4 Ca 0.11 -1.21 -0.13 0.00 0.00 0.00 0.00 46.02 44.79 1je4 n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1je4 h SER 5 N -2.11 -0.24 -1.13 1.61 0.02 -1.95 -3.41 113.55 106.36 1je4 h SER 5 Ca -0.03 -0.26 -0.37 0.00 -0.84 0.00 0.00 61.79 60.29 1je4 h SER 5 Cb 0.10 0.06 -0.30 0.00 0.14 0.00 0.00 62.40 62.39 1je4 h SER 5 CO 0.02 0.17 -0.90 0.47 -1.14 0.00 0.00 176.83 175.44 1je4 n ASP 6 N -5.04 -0.28 -4.60 3.07 8.00 -1.26 -5.10 116.55 111.33 1je4 n ASP 6 Ca -0.09 -3.16 -0.43 0.00 0.71 0.00 0.00 54.79 51.82 1je4 n ASP 6 Cb 0.25 0.30 -0.02 0.00 -0.02 0.00 0.00 41.12 41.63 1je4 n ASP 6 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1je4 s PRO 7 N -1.48 3.45 0.67 -0.24 0.04 -1.26 -5.00 135.00 131.18 1je4 s PRO 7 Ca 0.32 1.31 -0.14 0.00 0.04 0.00 0.00 61.00 62.53 1je4 s PRO 7 Cb 0.35 -4.13 0.00 0.00 0.04 0.00 0.00 34.50 30.76 1je4 s PRO 7 CO -0.06 -1.72 1.08 -1.25 0.04 0.00 0.00 177.00 175.10 1je4 s PRO 8 N 5.35 2.85 -0.23 0.56 0.04 -1.26 -5.02 135.00 137.29 1je4 s PRO 8 Ca 0.74 1.23 -0.15 0.00 0.04 0.00 0.00 61.00 62.85 1je4 s PRO 8 Cb -0.20 -1.97 -0.09 0.00 0.04 0.00 0.00 34.50 32.28 1je4 s PRO 8 CO 0.33 -1.19 -0.35 0.25 0.04 0.00 0.00 177.00 176.08 1je4 n THR 9 N -2.65 1.49 -2.03 1.26 -2.24 -1.26 -4.92 114.28 103.93 1je4 n THR 9 Ca 0.09 -0.15 -0.04 0.00 -2.27 0.00 0.00 64.05 61.68 1je4 n THR 9 Cb 0.53 -2.07 -0.02 0.00 -2.10 0.00 0.00 70.33 66.67 1je4 n THR 9 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1je4 n ALA 10 N -4.31 2.13 -2.09 6.98 0.00 -1.26 -4.88 120.51 117.07 1je4 n ALA 10 Ca -0.36 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.53 1je4 n ALA 10 Cb 0.72 -0.40 0.00 0.00 0.00 0.00 0.00 19.45 19.77 1je4 n ALA 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1je4 n ALA 13 N 2.11 1.45 -3.16 0.00 0.00 -1.26 -4.98 120.51 114.67 1je4 n ALA 13 Ca -0.20 -1.02 -0.12 0.00 0.00 0.00 0.00 53.44 52.10 1je4 n ALA 13 Cb 0.57 -0.50 -0.10 0.00 0.00 0.00 0.00 19.45 19.41 1je4 n ALA 13 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1je4 s SER 14 N -5.92 -0.13 0.04 0.00 0.01 -1.26 -5.17 113.70 101.26 1je4 s SER 14 Ca -0.10 0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.26 1je4 s SER 14 Cb 0.07 0.33 0.00 0.00 0.21 0.00 0.00 66.02 66.63 1je4 s SER 14 CO 0.81 -0.32 0.03 -1.22 0.41 0.00 0.00 173.24 172.95 1je4 n TYR 15 N 1.78 -2.99 -3.78 2.43 4.01 -1.26 -4.66 117.16 112.69 1je4 n TYR 15 Ca -0.20 -0.08 -0.35 0.00 -0.16 0.00 0.00 57.90 57.11 1je4 n TYR 15 Cb 0.56 -0.02 -0.09 0.00 -0.31 0.00 0.00 39.34 39.48 1je4 n TYR 15 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 1je4 s THR 16 N 0.83 5.20 -0.53 -0.72 -1.32 0.42 -4.88 115.64 114.63 1je4 s THR 16 Ca 0.02 0.12 -0.01 0.00 -1.21 0.00 0.00 61.69 60.62 1je4 s THR 16 Cb -0.00 -3.38 0.43 0.00 -1.51 0.00 0.00 72.50 68.03 1je4 s THR 16 CO 0.02 0.41 1.98 0.00 -2.21 0.00 0.00 174.62 174.82 1je4 n ALA 17 N 3.82 5.83 -3.88 11.08 0.00 -1.26 -4.92 120.51 131.19 1je4 n ALA 17 Ca -0.16 -2.88 -0.10 0.00 0.00 0.00 0.00 53.44 50.30 1je4 n ALA 17 Cb 0.52 -1.61 -0.02 0.00 0.00 0.00 0.00 19.45 18.34 1je4 n ALA 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1je4 n ARG 18 N -0.65 0.66 -4.38 0.00 1.74 -1.26 -5.17 116.66 107.60 1je4 n ARG 18 Ca 0.53 -2.38 -0.33 0.00 -0.77 0.00 0.00 57.85 54.91 1je4 n ARG 18 Cb 0.82 2.36 -0.10 0.00 -1.02 0.00 0.00 32.46 34.52 1je4 n ARG 18 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1je4 s LYS 19 N -2.62 2.77 -0.28 5.56 2.20 -1.26 -5.10 119.74 121.01 1je4 s LYS 19 Ca 0.24 -0.59 -0.03 0.00 -0.36 0.00 0.00 55.97 55.23 1je4 s LYS 19 Cb -0.01 -2.65 0.09 0.00 -1.51 0.00 0.00 37.83 33.75 1je4 s LYS 19 CO 0.17 0.64 0.11 -0.51 -0.36 0.00 0.00 175.35 175.40 1je4 s LEU 20 N -1.32 0.95 0.44 5.43 1.43 -1.26 -5.13 118.68 119.22 1je4 s LEU 20 Ca 0.17 -1.28 -0.23 0.00 -1.03 0.00 0.00 54.13 51.76 1je4 s LEU 20 Cb -0.11 -0.47 -0.11 0.00 0.03 0.00 0.00 46.19 45.52 1je4 s LEU 20 CO 0.07 -0.42 0.76 -2.65 0.23 0.00 0.00 176.35 174.34 1je4 n PRO 21 N 5.15 0.88 -0.04 1.29 -0.02 -1.26 -4.86 135.00 136.14 1je4 n PRO 21 Ca -0.05 0.32 0.06 0.00 -2.02 0.00 0.00 63.50 61.81 1je4 n PRO 21 Cb 0.43 -1.77 0.43 0.00 -0.02 0.00 0.00 33.50 32.58 1je4 n PRO 21 CO 0.00 0.00 0.00 0.07 1.98 0.00 0.00 175.50 177.55 1je4 h ARG 22 N 1.03 0.53 0.00 -0.52 0.11 -1.98 -0.62 114.38 112.93 1je4 h ARG 22 Ca -0.43 -0.03 -0.01 0.00 0.10 0.00 0.00 59.98 59.61 1je4 h ARG 22 Cb 1.37 -0.12 -0.00 0.00 1.11 0.00 0.00 29.97 32.33 1je4 h ARG 22 CO 0.53 0.35 -0.05 -0.97 0.10 0.00 0.00 179.97 179.94 1je4 h ASN 23 N 0.55 0.00 -0.86 0.08 -0.73 -2.03 -1.43 115.58 111.16 1je4 h ASN 23 Ca 0.20 0.00 -0.46 0.00 1.87 0.00 0.00 56.30 57.91 1je4 h ASN 23 Cb 0.12 0.00 -0.27 0.00 0.27 0.00 0.00 38.32 38.44 1je4 h ASN 23 CO -0.05 0.05 0.58 0.49 -0.37 0.00 0.00 177.43 178.13 1je4 n PHE 24 N -3.97 2.67 -4.05 0.67 3.72 -0.24 -4.90 117.46 111.36 1je4 n PHE 24 Ca -0.03 -1.75 -0.14 0.00 -0.05 0.00 0.00 57.45 55.49 1je4 n PHE 24 Cb 0.14 -0.89 -0.14 0.00 -0.94 0.00 0.00 39.48 37.65 1je4 n PHE 24 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1je4 s VAL 25 N -2.95 0.29 -0.08 -4.37 1.01 -0.54 -4.23 120.40 109.53 1je4 s VAL 25 Ca 0.50 -0.33 -0.05 0.00 0.00 0.00 0.00 61.98 62.09 1je4 s VAL 25 Cb 0.42 -0.28 -0.02 0.00 0.00 0.00 0.00 36.38 36.50 1je4 s VAL 25 CO 0.09 -0.03 -0.10 0.52 0.00 0.00 0.00 175.10 175.57 1je4 n VAL 26 N 2.68 0.81 -4.16 2.92 0.31 -0.92 -4.92 118.33 115.05 1je4 n VAL 26 Ca -0.15 0.34 -0.17 0.00 -0.01 0.00 0.00 64.34 64.35 1je4 n VAL 26 Cb 0.58 -2.01 -0.05 0.00 -0.91 0.00 0.00 33.84 31.44 1je4 n VAL 26 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1je4 n ASP 27 N -3.61 -1.13 -4.56 4.52 9.92 -1.22 -5.05 116.55 115.43 1je4 n ASP 27 Ca -0.04 -3.06 -0.29 0.00 -0.53 0.00 0.00 54.79 50.87 1je4 n ASP 27 Cb 0.15 2.25 -0.09 0.00 -0.64 0.00 0.00 41.12 42.79 1je4 n ASP 27 CO 0.00 0.00 0.00 -0.72 0.13 0.00 0.00 177.20 176.61 1je4 s TYR 28 N -3.06 2.01 -0.13 1.24 1.13 -1.26 -0.91 117.35 116.37 1je4 s TYR 28 Ca 0.34 -0.96 -0.19 0.00 -1.41 0.00 0.00 57.07 54.86 1je4 s TYR 28 Cb 0.00 -1.51 0.05 0.00 -1.10 0.00 0.00 41.96 39.39 1je4 s TYR 28 CO 0.24 0.14 0.48 -0.47 -2.51 0.00 0.00 175.55 173.44 1je4 s TYR 29 N -2.96 -0.48 0.26 -3.49 5.04 -0.63 -4.83 117.35 110.25 1je4 s TYR 29 Ca 0.20 1.08 0.07 0.00 -2.44 0.00 0.00 57.07 55.98 1je4 s TYR 29 Cb 0.05 0.20 -0.03 0.00 0.35 0.00 0.00 41.96 42.52 1je4 s TYR 29 CO 0.10 -0.33 0.25 -1.21 -1.34 0.00 0.00 175.55 173.02 1je4 s GLU 30 N -0.26 3.02 0.38 4.97 8.01 -1.26 0.07 118.70 133.63 1je4 s GLU 30 Ca -0.04 -1.02 -0.02 0.00 0.01 0.00 0.00 54.97 53.90 1je4 s GLU 30 Cb -0.03 -2.63 -0.04 0.00 -4.31 0.00 0.00 34.13 27.12 1je4 s GLU 30 CO 0.03 0.37 0.62 0.95 0.01 0.00 0.00 175.26 177.24 1je4 s THR 31 N -2.12 5.04 0.01 3.63 -4.23 -1.23 -4.95 115.64 111.79 1je4 s THR 31 Ca 0.34 -0.20 -0.00 0.00 -1.18 0.00 0.00 61.69 60.65 1je4 s THR 31 Cb -0.08 -3.85 0.00 0.00 1.34 0.00 0.00 72.50 69.91 1je4 s THR 31 CO 0.26 -0.63 0.01 -0.24 -0.54 0.00 0.00 174.62 173.48 1je4 n SER 32 N -1.85 -1.99 -1.03 3.99 2.88 -1.23 -4.95 113.62 109.43 1je4 n SER 32 Ca -0.03 -0.02 -0.02 0.00 -1.33 0.00 0.00 58.87 57.46 1je4 n SER 32 Cb 0.56 -0.01 0.19 0.00 -0.75 0.00 0.00 64.21 64.19 1je4 n SER 32 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1je4 n SER 33 N -3.03 2.45 -0.08 -3.46 3.41 -1.26 -4.58 113.62 107.08 1je4 n SER 33 Ca 0.00 -3.84 -0.08 0.00 -0.26 0.00 0.00 58.87 54.69 1je4 n SER 33 Cb 0.01 -0.58 -0.11 0.00 -0.26 0.00 0.00 64.21 63.27 1je4 n SER 33 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1je4 n LEU 34 N -1.09 0.38 -4.81 1.04 4.77 -1.26 -4.98 117.00 111.05 1je4 n LEU 34 Ca 0.29 -0.01 -0.35 0.00 -0.03 0.00 0.00 56.01 55.90 1je4 n LEU 34 Cb 0.88 0.23 -0.06 0.00 -2.33 0.00 0.00 43.42 42.14 1je4 n LEU 34 CO 0.13 0.42 0.53 0.00 -1.33 0.00 0.00 177.39 177.14 1je4 n SER 36 N 0.29 3.48 -3.24 0.00 7.64 -1.26 -4.56 113.62 115.97 1je4 n SER 36 Ca 0.01 -2.65 -0.15 0.00 1.01 0.00 0.00 58.87 57.10 1je4 n SER 36 Cb 0.51 -0.63 -0.06 0.00 -1.01 0.00 0.00 64.21 63.02 1je4 n SER 36 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1je4 s GLN 37 N -1.86 0.80 0.86 1.43 -2.07 -1.26 -5.15 119.66 112.41 1je4 s GLN 37 Ca 0.30 -1.10 -0.14 0.00 -1.82 0.00 0.00 55.36 52.60 1je4 s GLN 37 Cb 0.24 -0.65 0.01 0.00 -1.09 0.00 0.00 33.01 31.51 1je4 s GLN 37 CO 0.07 -1.26 0.49 -2.30 -1.32 0.00 0.00 175.29 170.97 1je4 n PRO 38 N 3.72 -0.05 -3.66 9.60 -0.02 -1.26 -4.88 135.00 138.45 1je4 n PRO 38 Ca 0.16 0.04 -0.09 0.00 -2.02 0.00 0.00 63.50 61.58 1je4 n PRO 38 Cb 0.49 -1.88 -0.08 0.00 -0.02 0.00 0.00 33.50 32.01 1je4 n PRO 38 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1je4 s ALA 39 N -2.20 -1.60 -0.33 3.55 0.00 -1.26 -4.61 121.76 115.31 1je4 s ALA 39 Ca 0.61 2.06 -0.17 0.00 0.00 0.00 0.00 51.96 54.45 1je4 s ALA 39 Cb -0.26 -1.22 -0.01 0.00 0.00 0.00 0.00 23.12 21.63 1je4 s ALA 39 CO 0.63 -0.33 0.48 0.08 0.00 0.00 0.00 175.76 176.62 1je4 s VAL 40 N 1.29 5.06 0.35 0.00 1.01 -1.09 -3.53 120.40 123.49 1je4 s VAL 40 Ca -0.08 0.42 -0.06 0.00 0.00 0.00 0.00 61.98 62.26 1je4 s VAL 40 Cb -0.06 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.37 1je4 s VAL 40 CO -0.14 -0.12 0.65 -0.69 0.00 0.00 0.00 175.10 174.81 1je4 s VAL 41 N 2.31 4.95 -0.32 2.92 1.01 0.11 -1.09 120.40 130.29 1je4 s VAL 41 Ca 0.18 0.20 -0.01 0.00 0.00 0.00 0.00 61.98 62.34 1je4 s VAL 41 Cb -0.16 -3.76 0.13 0.00 0.00 0.00 0.00 36.38 32.59 1je4 s VAL 41 CO 0.12 -0.47 0.22 -0.36 0.00 0.00 0.00 175.10 174.62 1je4 s PHE 42 N -2.27 0.15 0.02 5.22 0.08 0.28 -1.61 117.98 119.85 1je4 s PHE 42 Ca 0.46 -0.90 -0.30 0.00 0.12 0.00 0.00 56.93 56.31 1je4 s PHE 42 Cb -0.10 -0.73 -0.07 0.00 -0.57 0.00 0.00 43.02 41.54 1je4 s PHE 42 CO 0.33 -0.87 1.70 -0.65 -0.10 0.00 0.00 175.22 175.63 1je4 s GLN 43 N 1.80 4.18 0.45 0.44 -0.21 -0.09 -1.21 119.66 125.04 1je4 s GLN 43 Ca 0.13 2.32 -0.03 0.00 0.02 0.00 0.00 55.36 57.80 1je4 s GLN 43 Cb -0.17 -3.83 -0.03 0.00 1.00 0.00 0.00 33.01 29.99 1je4 s GLN 43 CO -0.22 -0.81 0.72 0.95 -2.12 0.00 0.00 175.29 173.81 1je4 s THR 44 N 3.43 4.70 0.03 -0.19 -4.23 -1.11 -2.17 115.64 116.09 1je4 s THR 44 Ca 0.76 -0.10 -0.17 0.00 -1.18 0.00 0.00 61.69 61.00 1je4 s THR 44 Cb -0.38 -3.77 -0.09 0.00 1.34 0.00 0.00 72.50 69.60 1je4 s THR 44 CO 0.33 -0.66 1.26 0.11 -0.54 0.00 0.00 174.62 175.12 1je4 h LYS 45 N 0.35 -0.59 0.07 3.99 1.57 -1.91 -3.36 116.57 116.68 1je4 h LYS 45 Ca -0.47 0.04 -0.33 0.00 -1.87 0.00 0.00 60.65 58.01 1je4 h LYS 45 Cb 1.22 0.13 -0.03 0.00 0.08 0.00 0.00 32.23 33.64 1je4 h LYS 45 CO 0.61 -0.40 -1.86 0.00 -0.57 0.00 0.00 179.45 177.23 1je4 h ARG 46 N -0.62 0.16 -7.37 3.15 3.08 -1.96 -3.47 114.38 107.35 1je4 h ARG 46 Ca -0.06 -0.27 -0.48 0.00 0.07 0.00 0.00 59.98 59.24 1je4 h ARG 46 Cb 0.48 0.10 0.07 0.00 0.08 0.00 0.00 29.97 30.70 1je4 h ARG 46 CO 0.10 0.91 0.34 -1.12 -1.07 0.00 0.00 179.97 179.12 1je4 s SER 47 N -6.65 5.41 0.47 7.04 0.01 -1.26 -5.09 113.70 113.63 1je4 s SER 47 Ca -0.14 0.96 0.00 0.00 1.31 0.00 0.00 55.95 58.07 1je4 s SER 47 Cb 0.07 -1.79 0.00 0.00 0.21 0.00 0.00 66.02 64.51 1je4 s SER 47 CO 0.80 -1.30 0.00 0.29 0.41 0.00 0.00 173.24 173.44 1je4 n LYS 48 N -2.90 0.56 -1.67 12.44 5.02 -1.26 -3.29 118.16 127.06 1je4 n LYS 48 Ca 0.06 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.97 1je4 n LYS 48 Cb 0.58 0.00 0.05 0.00 -0.02 0.00 0.00 35.03 35.64 1je4 n LYS 48 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1je4 n GLN 49 N -0.48 1.16 -3.89 1.97 6.02 -1.26 -2.74 117.38 118.16 1je4 n GLN 49 Ca 0.00 0.44 -0.30 0.00 -0.01 0.00 0.00 57.00 57.14 1je4 n GLN 49 Cb 0.00 -2.34 -0.16 0.00 1.02 0.00 0.00 30.24 28.76 1je4 n GLN 49 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1je4 s VAL 50 N -1.41 1.33 0.19 5.09 1.01 -0.35 -4.87 120.40 121.39 1je4 s VAL 50 Ca 0.76 -1.14 -0.26 0.00 0.00 0.00 0.00 61.98 61.34 1je4 s VAL 50 Cb -0.42 -1.67 -0.08 0.00 0.00 0.00 0.00 36.38 34.21 1je4 s VAL 50 CO 0.47 -0.17 0.81 0.00 0.00 0.00 0.00 175.10 176.21 1je4 s ALA 52 N -1.21 -0.13 -0.28 0.00 0.00 -0.25 -0.43 121.76 119.45 1je4 s ALA 52 Ca 0.38 0.33 -0.29 0.00 0.00 0.00 0.00 51.96 52.38 1je4 s ALA 52 Cb -0.23 -0.22 -0.07 0.00 0.00 0.00 0.00 23.12 22.60 1je4 s ALA 52 CO 0.27 -0.08 2.24 -0.25 0.00 0.00 0.00 175.76 177.94 1je4 n ASP 53 N 3.57 2.90 0.28 0.00 8.00 -1.26 -2.69 116.55 127.34 1je4 n ASP 53 Ca -0.19 0.18 0.18 0.00 0.71 0.00 0.00 54.79 55.67 1je4 n ASP 53 Cb 0.56 -1.49 0.94 0.00 -0.02 0.00 0.00 41.12 41.10 1je4 n ASP 53 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 1je4 h PRO 54 N 14.89 0.00 -0.69 -0.24 0.11 -1.91 -1.48 132.00 142.68 1je4 h PRO 54 Ca -0.36 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.76 1je4 h PRO 54 Cb 1.26 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.34 1je4 h PRO 54 CO 0.99 0.00 0.45 0.77 -0.21 0.00 0.00 178.00 180.01 1je4 h SER 55 N 0.00 0.78 -3.80 -2.05 0.02 -1.93 -3.44 113.55 103.13 1je4 h SER 55 Ca 0.04 -0.02 -0.48 0.00 -0.84 0.00 0.00 61.79 60.49 1je4 h SER 55 Cb 0.39 -0.19 0.21 0.00 0.14 0.00 0.00 62.40 62.95 1je4 h SER 55 CO -0.00 0.56 0.12 -1.61 -1.14 0.00 0.00 176.83 174.76 1je4 s GLU 56 N -5.78 0.07 -0.13 3.45 2.02 -0.56 -4.98 118.70 112.80 1je4 s GLU 56 Ca -0.10 1.26 -0.08 0.00 0.02 0.00 0.00 54.97 56.06 1je4 s GLU 56 Cb 0.18 -1.64 -0.26 0.00 0.10 0.00 0.00 34.13 32.51 1je4 s GLU 56 CO 0.77 -3.18 0.36 0.43 0.02 0.00 0.00 175.26 173.66 1je4 n SER 57 N -4.59 2.11 -0.10 -0.19 7.64 -1.26 -4.11 113.62 113.13 1je4 n SER 57 Ca 0.08 0.23 0.26 0.00 1.01 0.00 0.00 58.87 60.44 1je4 n SER 57 Cb 0.53 -0.87 0.72 0.00 -1.01 0.00 0.00 64.21 63.57 1je4 n SER 57 CO 0.00 0.00 0.00 4.11 -3.01 0.00 0.00 175.04 176.14 1je4 h TRP 58 N -0.00 0.00 0.47 1.43 5.08 -1.95 -1.33 115.95 119.65 1je4 h TRP 58 Ca -0.42 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 59.53 1je4 h TRP 58 Cb 1.99 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 28.15 1je4 h TRP 58 CO 0.08 0.00 -0.23 0.28 -1.28 0.00 0.00 178.44 177.29 1je4 h VAL 59 N 0.00 0.49 -0.08 0.12 2.07 -1.88 -2.63 116.25 114.33 1je4 h VAL 59 Ca 0.36 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.56 1je4 h VAL 59 Cb 1.58 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1je4 h VAL 59 CO -0.00 0.05 0.05 -0.61 0.02 0.00 0.00 177.57 177.07 1je4 h GLN 60 N -0.83 0.11 0.38 1.57 4.15 -1.46 -1.96 115.11 117.06 1je4 h GLN 60 Ca -0.06 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.33 1je4 h GLN 60 Cb 0.57 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.24 1je4 h GLN 60 CO 0.11 0.08 -0.18 0.93 -1.93 0.00 0.00 178.83 177.83 1je4 h GLU 61 N 0.11 -0.49 -0.61 1.69 5.08 -1.22 -1.70 114.58 117.44 1je4 h GLU 61 Ca 0.03 0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.37 1je4 h GLU 61 Cb 0.00 0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 1je4 h GLU 61 CO -0.01 -0.32 0.15 1.88 -1.00 0.00 0.00 179.01 179.71 1je4 h TYR 62 N -0.52 0.99 -0.10 4.33 0.05 -1.14 -0.40 116.97 120.18 1je4 h TYR 62 Ca -0.05 -0.10 -0.00 0.00 0.05 0.00 0.00 58.73 58.62 1je4 h TYR 62 Cb 0.40 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 37.85 1je4 h TYR 62 CO -0.05 0.82 0.06 0.28 -1.05 0.00 0.00 178.16 178.22 1je4 h VAL 63 N 0.92 1.03 0.12 -2.88 2.07 -1.16 -0.40 116.25 115.96 1je4 h VAL 63 Ca 0.20 -0.08 -0.33 0.00 0.82 0.00 0.00 66.70 67.31 1je4 h VAL 63 Cb 0.33 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1je4 h VAL 63 CO -0.00 0.03 -1.68 0.22 0.02 0.00 0.00 177.57 176.16 1je4 h TYR 64 N 0.14 0.47 -0.22 1.57 5.03 -0.76 -3.34 116.97 119.85 1je4 h TYR 64 Ca 0.04 -0.34 -0.06 0.00 2.58 0.00 0.00 58.73 60.94 1je4 h TYR 64 Cb -0.00 -0.02 -0.01 0.00 1.55 0.00 0.00 36.73 38.25 1je4 h TYR 64 CO 0.00 1.48 -0.13 -0.44 -1.32 0.00 0.00 178.16 177.75 1je4 h ASP 65 N 0.07 0.35 -0.85 -2.11 5.19 -0.59 -2.54 116.42 115.94 1je4 h ASP 65 Ca -0.30 -0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.03 1je4 h ASP 65 Cb 2.04 -0.09 -0.04 0.00 0.18 0.00 0.00 39.33 41.41 1je4 h ASP 65 CO 0.14 0.51 0.55 -0.07 -3.12 0.00 0.00 179.24 177.25 1je4 h LEU 66 N 0.34 0.99 -0.72 1.55 3.38 -1.21 -2.19 115.31 117.45 1je4 h LEU 66 Ca 0.07 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.86 1je4 h LEU 66 Cb 0.44 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1je4 h LEU 66 CO 0.03 0.73 -0.60 -0.33 0.09 0.00 0.00 178.44 178.36 1je4 h GLU 67 N 1.15 0.13 -6.89 1.13 5.08 -1.61 -3.44 114.58 110.14 1je4 h GLU 67 Ca 0.31 -0.09 -0.47 0.00 -1.00 0.00 0.00 59.36 58.10 1je4 h GLU 67 Cb -0.11 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1je4 h GLU 67 CO -0.06 0.69 0.36 -0.51 -1.00 0.00 0.00 179.01 178.49 1je4 s LEU 68 N -7.81 4.34 0.00 1.33 1.43 -0.83 -5.15 118.68 112.00 1je4 s LEU 68 Ca -0.03 1.89 0.00 0.00 -1.03 0.00 0.00 54.13 54.96 1je4 s LEU 68 Cb 0.12 -4.00 0.00 0.00 0.03 0.00 0.00 46.19 42.34 1je4 s LEU 68 CO 0.78 -0.11 0.00 -3.20 0.23 0.00 0.00 176.35 174.05