#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jx7 s LYS 3 N 0.00 3.49 -0.15 3.69 1.02 -1.26 -3.06 119.74 123.46 1jx7 s LYS 3 Ca 0.00 -0.58 0.02 0.00 0.02 0.00 0.00 55.97 55.42 1jx7 s LYS 3 Cb 0.00 -3.30 0.02 0.00 -0.52 0.00 0.00 37.83 34.02 1jx7 s LYS 3 CO 0.00 -0.25 -0.20 0.42 -0.92 0.00 0.00 175.35 174.40 1jx7 s ILE 4 N 1.57 1.95 -0.11 2.17 1.01 -0.58 -1.78 121.20 125.44 1jx7 s ILE 4 Ca 0.05 -0.89 -0.03 0.00 0.00 0.00 0.00 60.65 59.78 1jx7 s ILE 4 Cb -0.15 -1.75 -0.03 0.00 0.01 0.00 0.00 42.46 40.53 1jx7 s ILE 4 CO 0.03 0.53 0.01 -0.69 0.00 0.00 0.00 174.94 174.81 1jx7 s VAL 5 N 1.06 4.34 -0.11 2.92 1.01 -0.39 -1.52 120.40 127.70 1jx7 s VAL 5 Ca -0.02 -0.23 0.03 0.00 0.00 0.00 0.00 61.98 61.76 1jx7 s VAL 5 Cb -0.14 -2.85 0.01 0.00 0.00 0.00 0.00 36.38 33.39 1jx7 s VAL 5 CO -0.06 0.58 -0.21 -0.63 0.00 0.00 0.00 175.10 174.77 1jx7 s ILE 6 N -0.58 1.86 0.19 2.22 1.01 0.31 -0.47 121.20 125.74 1jx7 s ILE 6 Ca 0.10 -0.88 0.08 0.00 0.00 0.00 0.00 60.65 59.95 1jx7 s ILE 6 Cb -0.12 -1.64 -0.04 0.00 0.01 0.00 0.00 42.46 40.67 1jx7 s ILE 6 CO 0.02 0.51 -0.04 -0.69 0.00 0.00 0.00 174.94 174.74 1jx7 s VAL 7 N 0.63 3.44 -0.10 2.92 1.01 0.60 -0.28 120.40 128.62 1jx7 s VAL 7 Ca -0.13 -1.62 -0.07 0.00 0.00 0.00 0.00 61.98 60.16 1jx7 s VAL 7 Cb -0.16 -2.74 0.03 0.00 0.00 0.00 0.00 36.38 33.51 1jx7 s VAL 7 CO 0.03 -0.16 0.25 0.00 0.00 0.00 0.00 175.10 175.23 1jx7 s ALA 8 N -1.83 -0.61 -0.03 5.51 0.00 -0.81 -1.54 121.76 122.46 1jx7 s ALA 8 Ca 0.27 0.83 0.07 0.00 0.00 0.00 0.00 51.96 53.13 1jx7 s ALA 8 Cb -0.09 -0.50 -0.11 0.00 0.00 0.00 0.00 23.12 22.43 1jx7 s ALA 8 CO 0.17 -0.15 0.11 0.09 0.00 0.00 0.00 175.76 175.99 1jx7 n ASN 9 N 3.43 3.29 -4.77 0.00 4.13 -1.26 -4.49 115.26 115.58 1jx7 n ASN 9 Ca -0.17 0.00 -0.41 0.00 1.68 0.00 0.00 54.58 55.68 1jx7 n ASN 9 Cb 0.56 1.10 -0.01 0.00 -1.54 0.00 0.00 39.78 39.89 1jx7 n ASN 9 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1jx7 s GLY 10 N -3.22 2.98 0.24 7.41 0.00 -1.26 -2.34 107.32 111.12 1jx7 s GLY 10 Ca -0.03 1.33 -0.30 0.00 0.00 0.00 0.00 44.72 45.73 1jx7 s GLY 10 CO 0.30 1.98 1.15 0.00 0.00 0.00 0.00 173.10 176.54 1jx7 s ALA 11 N -1.15 3.42 0.49 3.20 0.00 -1.26 -2.17 121.76 124.29 1jx7 s ALA 11 Ca 0.51 0.94 -0.23 0.00 0.00 0.00 0.00 51.96 53.18 1jx7 s ALA 11 Cb -0.41 -3.38 -0.08 0.00 0.00 0.00 0.00 23.12 19.26 1jx7 s ALA 11 CO 0.55 -0.29 1.18 -2.30 0.00 0.00 0.00 175.76 174.90 1jx7 n PRO 12 N 1.77 1.55 0.00 0.00 -0.02 -1.26 -2.79 135.00 134.25 1jx7 n PRO 12 Ca 0.01 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1jx7 n PRO 12 Cb 0.45 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 1jx7 n PRO 12 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1jx7 n TYR 13 N -0.78 0.00 0.11 6.00 4.01 -1.26 -4.37 117.16 120.87 1jx7 n TYR 13 Ca 0.09 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.64 1jx7 n TYR 13 Cb 0.42 -0.04 -0.13 0.00 -0.31 0.00 0.00 39.34 39.29 1jx7 n TYR 13 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1jx7 h GLY 14 N 0.00 0.53 -0.56 2.72 0.00 -1.98 -3.46 103.07 100.33 1jx7 h GLY 14 Ca 0.00 -1.20 -0.17 0.00 0.00 0.00 0.00 47.33 45.96 1jx7 h GLY 14 CO 0.00 1.06 -0.03 -1.14 0.00 0.00 0.00 176.54 176.43 1jx7 n SER 15 N -3.69 0.76 0.00 0.19 3.41 -1.12 -5.05 113.62 108.13 1jx7 n SER 15 Ca -0.12 -1.54 0.00 0.00 -0.26 0.00 0.00 58.87 56.95 1jx7 n SER 15 Cb 1.01 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.81 1jx7 n SER 15 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1jx7 n GLU 16 N -1.43 3.07 -0.22 4.33 4.07 -1.26 -4.76 120.64 124.44 1jx7 n GLU 16 Ca 0.06 0.00 0.02 0.00 -0.06 0.00 0.00 57.16 57.18 1jx7 n GLU 16 Cb 0.21 -0.94 0.13 0.00 -0.06 0.00 0.00 31.44 30.78 1jx7 n GLU 16 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 1jx7 h SER 17 N 0.00 0.11 -0.16 4.31 4.64 -1.96 0.71 113.55 121.20 1jx7 h SER 17 Ca 0.00 0.11 -0.01 0.00 -0.47 0.00 0.00 61.79 61.42 1jx7 h SER 17 Cb 0.74 0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.94 1jx7 h SER 17 CO 0.00 0.05 0.07 0.25 -0.87 0.00 0.00 176.83 176.33 1jx7 h LEU 18 N 0.33 0.22 -0.64 5.97 6.46 -1.86 -1.13 115.31 124.65 1jx7 h LEU 18 Ca 0.35 -0.14 0.07 0.00 -0.12 0.00 0.00 57.88 58.03 1jx7 h LEU 18 Cb 0.51 -0.06 -0.06 0.00 -0.73 0.00 0.00 40.66 40.32 1jx7 h LEU 18 CO -0.39 0.30 0.33 0.15 -0.62 0.00 0.00 178.44 178.21 1jx7 h PHE 19 N 0.12 0.61 -0.50 1.25 3.57 -1.65 -1.77 116.94 118.58 1jx7 h PHE 19 Ca 0.06 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 1jx7 h PHE 19 Cb 0.15 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 1jx7 h PHE 19 CO -0.02 0.27 0.06 -0.91 -2.23 0.00 0.00 178.31 175.47 1jx7 h ASN 20 N 0.61 0.75 -0.32 0.41 2.35 -0.57 -1.56 115.58 117.25 1jx7 h ASN 20 Ca 0.30 -0.16 0.02 0.00 -0.55 0.00 0.00 56.30 55.91 1jx7 h ASN 20 Cb 0.24 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 1jx7 h ASN 20 CO -0.21 0.78 0.18 0.28 -1.65 0.00 0.00 177.43 176.81 1jx7 h SER 21 N 0.75 0.28 -0.28 5.81 0.02 -0.35 -0.41 113.55 119.37 1jx7 h SER 21 Ca 0.16 0.01 -0.13 0.00 -0.84 0.00 0.00 61.79 60.99 1jx7 h SER 21 Cb 0.37 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 1jx7 h SER 21 CO 0.01 0.21 -0.28 -0.07 -1.14 0.00 0.00 176.83 175.55 1jx7 h LEU 22 N 0.36 0.81 -0.67 5.07 3.38 -1.27 -0.38 115.31 122.62 1jx7 h LEU 22 Ca 0.13 -0.32 -0.08 0.00 0.09 0.00 0.00 57.88 57.70 1jx7 h LEU 22 Cb 0.02 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 1jx7 h LEU 22 CO -0.07 1.04 0.12 -0.09 0.09 0.00 0.00 178.44 179.53 1jx7 h ARG 23 N 0.67 1.11 -0.25 1.13 2.43 -0.97 -0.53 114.38 117.98 1jx7 h ARG 23 Ca 0.08 -0.29 -0.16 0.00 -0.81 0.00 0.00 59.98 58.80 1jx7 h ARG 23 Cb 0.81 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.22 1jx7 h ARG 23 CO 0.07 1.01 -0.49 1.25 -1.51 0.00 0.00 179.97 180.30 1jx7 h LEU 24 N 1.03 0.73 -0.17 3.80 6.46 -0.92 -2.45 115.31 123.78 1jx7 h LEU 24 Ca 0.21 -0.37 -0.01 0.00 -0.12 0.00 0.00 57.88 57.59 1jx7 h LEU 24 Cb 0.43 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 40.15 1jx7 h LEU 24 CO 0.01 1.10 0.08 0.00 -0.62 0.00 0.00 178.44 179.00 1jx7 h ALA 25 N 0.92 0.22 -0.18 1.25 0.00 -0.67 0.13 119.26 120.93 1jx7 h ALA 25 Ca 0.02 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 1jx7 h ALA 25 Cb 1.04 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1jx7 h ALA 25 CO 0.10 -0.21 -0.09 0.82 0.00 0.00 0.00 179.25 179.86 1jx7 h ILE 26 N 0.13 1.17 -0.23 0.00 2.04 -1.11 -2.59 117.51 116.93 1jx7 h ILE 26 Ca 0.06 -0.75 -0.20 0.00 1.00 0.00 0.00 64.86 64.97 1jx7 h ILE 26 Cb 0.14 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 1jx7 h ILE 26 CO -0.01 0.24 -0.65 0.00 0.00 0.00 0.00 178.15 177.73 1jx7 h ALA 27 N 1.63 0.41 -0.71 1.87 0.00 -0.92 -2.08 119.26 119.46 1jx7 h ALA 27 Ca 0.06 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1jx7 h ALA 27 Cb 0.35 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1jx7 h ALA 27 CO 0.02 0.68 0.39 -0.07 0.00 0.00 0.00 179.25 180.27 1jx7 h LEU 28 N 0.61 0.89 -0.43 0.00 3.38 -0.39 -2.26 115.31 117.10 1jx7 h LEU 28 Ca -0.01 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 1jx7 h LEU 28 Cb 1.26 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.77 1jx7 h LEU 28 CO 0.14 0.73 0.08 0.03 0.09 0.00 0.00 178.44 179.51 1jx7 h ARG 29 N 0.98 0.70 0.00 1.13 2.47 -1.44 -1.66 114.38 116.56 1jx7 h ARG 29 Ca 0.25 -0.18 -0.00 0.00 -1.26 0.00 0.00 59.98 58.79 1jx7 h ARG 29 Cb 0.03 -0.09 -0.00 0.00 -1.65 0.00 0.00 29.97 28.27 1jx7 h ARG 29 CO -0.04 0.73 -0.01 0.93 0.56 0.00 0.00 179.97 182.14 1jx7 h GLU 30 N 0.56 0.00 0.19 0.04 5.08 -1.01 -1.27 114.58 118.17 1jx7 h GLU 30 Ca 0.13 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.21 1jx7 h GLU 30 Cb 0.36 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.63 1jx7 h GLU 30 CO 0.01 0.01 -1.27 1.96 -1.00 0.00 0.00 179.01 178.71 1jx7 h GLN 31 N 0.00 0.40 -2.77 2.33 1.08 -0.89 -3.42 115.11 111.84 1jx7 h GLN 31 Ca -0.00 -0.68 -0.60 0.00 -1.45 0.00 0.00 58.65 55.92 1jx7 h GLN 31 Cb 0.04 0.25 -0.40 0.00 -0.05 0.00 0.00 27.48 27.33 1jx7 h GLN 31 CO 0.00 1.33 -0.80 -1.21 -0.95 0.00 0.00 178.83 177.20 1jx7 s GLU 32 N -2.52 1.07 0.53 1.46 2.02 -0.57 -4.99 118.70 115.69 1jx7 s GLU 32 Ca -0.13 -1.89 0.47 0.00 0.02 0.00 0.00 54.97 53.44 1jx7 s GLU 32 Cb 0.03 -1.93 1.62 0.00 0.10 0.00 0.00 34.13 33.95 1jx7 s GLU 32 CO 0.87 -1.22 1.47 0.45 0.02 0.00 0.00 175.26 176.85 1jx7 n SER 33 N 3.49 0.00 -0.90 -0.19 2.88 -0.65 0.16 113.62 118.41 1jx7 n SER 33 Ca 0.14 0.94 0.11 0.00 -1.33 0.00 0.00 58.87 58.72 1jx7 n SER 33 Cb 0.37 -0.46 0.10 0.00 -0.75 0.00 0.00 64.21 63.47 1jx7 n SER 33 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1jx7 n ASN 34 N -3.80 2.88 -4.64 -3.46 2.85 -1.26 -4.99 115.26 102.85 1jx7 n ASN 34 Ca 0.42 -1.94 -0.51 0.00 -0.11 0.00 0.00 54.58 52.44 1jx7 n ASN 34 Cb 1.91 -0.01 -0.06 0.00 1.24 0.00 0.00 39.78 42.86 1jx7 n ASN 34 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 1jx7 n LEU 35 N 1.27 2.86 -4.55 1.20 -0.00 0.41 -4.84 117.00 113.34 1jx7 n LEU 35 Ca 0.13 0.86 -0.36 0.00 -0.00 0.00 0.00 56.01 56.64 1jx7 n LEU 35 Cb 0.56 -1.29 -0.03 0.00 -0.00 0.00 0.00 43.42 42.66 1jx7 n LEU 35 CO 0.14 -0.32 1.50 -0.62 -0.00 0.00 0.00 177.39 178.08 1jx7 s ASP 36 N 4.78 5.38 -0.11 1.96 -1.08 -1.17 -4.94 116.67 121.49 1jx7 s ASP 36 Ca 0.98 -0.05 0.02 0.00 -0.52 0.00 0.00 52.55 52.98 1jx7 s ASP 36 Cb -0.83 -2.54 -0.01 0.00 -1.46 0.00 0.00 42.92 38.08 1jx7 s ASP 36 CO 0.55 -2.37 -0.16 -0.22 0.52 0.00 0.00 175.17 173.48 1jx7 s LEU 37 N 8.80 2.57 -0.03 -1.34 0.20 -1.26 -1.52 118.68 126.10 1jx7 s LEU 37 Ca 0.64 -0.36 0.04 0.00 0.69 0.00 0.00 54.13 55.14 1jx7 s LEU 37 Cb -0.10 -1.55 -0.01 0.00 -0.43 0.00 0.00 46.19 44.10 1jx7 s LEU 37 CO 0.14 0.20 -0.16 -0.13 -0.29 0.00 0.00 176.35 176.11 1jx7 s ARG 38 N 0.12 1.57 -0.16 1.98 0.52 -0.58 -3.72 118.95 118.68 1jx7 s ARG 38 Ca -0.08 -0.58 0.01 0.00 -0.52 0.00 0.00 55.73 54.56 1jx7 s ARG 38 Cb -0.15 -1.42 0.01 0.00 0.52 0.00 0.00 34.95 33.91 1jx7 s ARG 38 CO 0.05 0.27 -0.18 -1.17 0.02 0.00 0.00 175.30 174.29 1jx7 s LEU 39 N -0.09 2.27 -0.04 2.53 1.98 0.13 -0.53 118.68 124.92 1jx7 s LEU 39 Ca -0.00 -0.57 0.05 0.00 -2.89 0.00 0.00 54.13 50.71 1jx7 s LEU 39 Cb -0.10 -1.51 -0.02 0.00 0.66 0.00 0.00 46.19 45.22 1jx7 s LEU 39 CO 0.01 0.05 -0.18 0.12 -1.89 0.00 0.00 176.35 174.46 1jx7 s PHE 40 N 1.02 2.60 0.21 5.38 2.19 0.62 -0.52 117.98 129.47 1jx7 s PHE 40 Ca -0.02 -0.24 0.09 0.00 0.33 0.00 0.00 56.93 57.10 1jx7 s PHE 40 Cb -0.15 -1.59 -0.05 0.00 -1.31 0.00 0.00 43.02 39.93 1jx7 s PHE 40 CO -0.05 0.13 -0.17 -0.51 1.83 0.00 0.00 175.22 176.44 1jx7 s LEU 41 N -0.70 2.53 0.00 6.12 1.43 0.20 -1.92 118.68 126.33 1jx7 s LEU 41 Ca 0.11 -0.97 0.00 0.00 -1.03 0.00 0.00 54.13 52.24 1jx7 s LEU 41 Cb -0.10 -0.81 0.00 0.00 0.03 0.00 0.00 46.19 45.30 1jx7 s LEU 41 CO 0.00 -0.08 0.00 -1.54 0.23 0.00 0.00 176.35 174.96 1jx7 n SER 43 N -0.21 0.00 -0.35 2.29 3.41 -1.26 -1.86 113.62 115.64 1jx7 n SER 43 Ca -0.09 0.00 0.23 0.00 -0.26 0.00 0.00 58.87 58.75 1jx7 n SER 43 Cb 0.59 0.00 0.47 0.00 -0.26 0.00 0.00 64.21 65.01 1jx7 n SER 43 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1jx7 h ASP 44 N 0.00 0.54 0.07 4.04 3.45 -1.87 -2.77 116.42 119.88 1jx7 h ASP 44 Ca 0.00 0.15 0.00 0.00 0.43 0.00 0.00 57.03 57.61 1jx7 h ASP 44 Cb 0.00 0.08 0.00 0.00 -0.56 0.00 0.00 39.33 38.85 1jx7 h ASP 44 CO 0.00 -0.02 0.00 0.00 -1.57 0.00 0.00 179.24 177.65 1jx7 n ALA 45 N -2.35 1.58 0.15 3.45 0.00 -0.92 -2.73 120.51 119.68 1jx7 n ALA 45 Ca 0.29 -0.03 0.02 0.00 0.00 0.00 0.00 53.44 53.72 1jx7 n ALA 45 Cb 0.92 -1.10 0.16 0.00 0.00 0.00 0.00 19.45 19.43 1jx7 n ALA 45 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1jx7 h VAL 46 N 0.00 1.11 0.00 0.00 2.07 -1.75 -2.95 116.25 114.73 1jx7 h VAL 46 Ca 0.00 -2.10 0.00 0.00 0.82 0.00 0.00 66.70 65.42 1jx7 h VAL 46 Cb 0.03 2.23 0.00 0.00 -1.52 0.00 0.00 31.29 32.04 1jx7 h VAL 46 CO 0.00 0.54 0.00 0.71 0.02 0.00 0.00 177.57 178.84 1jx7 h THR 47 N 0.00 0.00 0.00 2.57 1.35 -1.77 -2.79 112.91 112.27 1jx7 h THR 47 Ca -0.01 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1jx7 h THR 47 Cb 1.19 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 1jx7 h THR 47 CO 0.07 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.34 1jx7 n ALA 48 N -1.87 1.07 1.47 6.62 0.00 -1.12 -1.63 120.51 125.05 1jx7 n ALA 48 Ca 0.02 0.20 0.14 0.00 0.00 0.00 0.00 53.44 53.81 1jx7 n ALA 48 Cb 0.29 -1.33 0.62 0.00 0.00 0.00 0.00 19.45 19.04 1jx7 n ALA 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jx7 n GLY 49 N -1.24 -0.83 3.77 0.00 0.00 -1.05 -4.73 105.19 101.10 1jx7 n GLY 49 Ca -0.01 -0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1jx7 n GLY 49 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1jx7 s LEU 50 N -2.38 3.67 0.39 0.99 1.43 -0.65 -1.18 118.68 120.96 1jx7 s LEU 50 Ca 0.31 2.18 0.00 0.00 -1.03 0.00 0.00 54.13 55.59 1jx7 s LEU 50 Cb 0.20 -4.58 -0.02 0.00 0.03 0.00 0.00 46.19 41.82 1jx7 s LEU 50 CO 0.45 -1.36 0.61 -0.60 0.23 0.00 0.00 176.35 175.68 1jx7 s ARG 51 N -3.44 3.34 0.00 1.70 3.52 -1.11 -4.49 118.95 118.47 1jx7 s ARG 51 Ca 0.72 -0.36 0.00 0.00 -0.13 0.00 0.00 55.73 55.97 1jx7 s ARG 51 Cb -0.24 -2.61 0.00 0.00 -1.56 0.00 0.00 34.95 30.54 1jx7 s ARG 51 CO 0.31 -0.02 0.00 0.41 -0.81 0.00 0.00 175.30 175.18 1jx7 n GLY 52 N -1.92 0.58 3.69 8.12 0.00 -1.26 -5.01 105.19 109.39 1jx7 n GLY 52 Ca -0.02 -0.34 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 1jx7 n GLY 52 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1jx7 s GLN 53 N -0.76 4.22 -0.44 1.61 -0.21 -1.26 -4.94 119.66 117.88 1jx7 s GLN 53 Ca 0.00 2.26 0.06 0.00 0.02 0.00 0.00 55.36 57.69 1jx7 s GLN 53 Cb 0.00 -3.54 0.20 0.00 1.00 0.00 0.00 33.01 30.66 1jx7 s GLN 53 CO 0.00 -0.68 0.53 0.36 -2.12 0.00 0.00 175.29 173.38 1jx7 n LYS 54 N 5.35 0.42 -2.86 2.91 -0.00 -1.26 -4.91 118.16 117.81 1jx7 n LYS 54 Ca 0.15 -2.73 -0.40 0.00 -0.00 0.00 0.00 58.31 55.33 1jx7 n LYS 54 Cb 0.41 -1.52 -0.05 0.00 -0.00 0.00 0.00 35.03 33.86 1jx7 n LYS 54 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 1jx7 s PRO 55 N 0.14 4.66 0.00 -1.58 0.04 -1.26 -4.93 135.00 132.06 1jx7 s PRO 55 Ca 0.32 1.29 0.28 0.00 0.04 0.00 0.00 61.00 62.94 1jx7 s PRO 55 Cb 0.07 -3.31 1.13 0.00 0.04 0.00 0.00 34.50 32.42 1jx7 s PRO 55 CO -0.15 0.41 1.83 0.41 0.04 0.00 0.00 177.00 179.55 1jx7 n GLY 56 N 1.89 -1.32 0.00 0.56 0.00 -1.26 -4.79 105.19 100.26 1jx7 n GLY 56 Ca -0.02 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1jx7 n GLY 56 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1jx7 n GLU 57 N -1.38 0.13 0.00 1.61 2.13 -1.26 -5.10 120.64 116.78 1jx7 n GLU 57 Ca 0.09 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.91 1jx7 n GLU 57 Cb 0.31 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.02 1jx7 n GLU 57 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1jx7 n GLY 58 N 5.00 0.39 3.79 8.31 0.00 -1.26 -5.00 105.19 116.42 1jx7 n GLY 58 Ca 0.00 -0.02 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 1jx7 n GLY 58 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1jx7 s TYR 59 N 0.00 2.83 -0.33 1.61 -0.85 -1.26 -5.04 117.35 114.30 1jx7 s TYR 59 Ca 0.00 1.39 0.01 0.00 -0.52 0.00 0.00 57.07 57.95 1jx7 s TYR 59 Cb 0.00 -3.00 0.10 0.00 0.38 0.00 0.00 41.96 39.44 1jx7 s TYR 59 CO 0.00 -1.62 0.09 1.21 -1.52 0.00 0.00 175.55 173.72 1jx7 s ASN 60 N -3.67 4.27 0.46 -0.18 2.47 -1.26 -4.87 114.94 112.16 1jx7 s ASN 60 Ca 0.60 -1.92 0.18 0.00 0.42 0.00 0.00 52.86 52.14 1jx7 s ASN 60 Cb -0.15 -1.16 1.15 0.00 -1.45 0.00 0.00 41.25 39.63 1jx7 s ASN 60 CO 0.55 -0.39 1.94 0.40 -3.72 0.00 0.00 177.10 175.89 1jx7 h ILE 61 N 6.42 0.78 -0.11 -5.21 2.04 -1.96 -1.55 117.51 117.93 1jx7 h ILE 61 Ca -0.09 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1jx7 h ILE 61 Cb 1.01 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1jx7 h ILE 61 CO 0.49 0.05 0.07 -0.61 0.00 0.00 0.00 178.15 178.16 1jx7 h GLN 62 N 0.29 0.14 -1.98 2.37 4.15 -1.91 -2.26 115.11 115.92 1jx7 h GLN 62 Ca 0.33 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.74 1jx7 h GLN 62 Cb 0.89 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.54 1jx7 h GLN 62 CO -0.08 0.12 0.00 0.94 -1.93 0.00 0.00 178.83 177.88 1jx7 n GLN 63 N -5.00 0.02 0.00 1.69 7.27 -0.59 -1.87 117.38 118.90 1jx7 n GLN 63 Ca -0.05 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.02 1jx7 n GLN 63 Cb 0.04 -1.49 0.00 0.00 2.41 0.00 0.00 30.24 31.20 1jx7 n GLN 63 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1jx7 n LEU 65 N 1.09 0.00 0.04 1.69 4.77 -0.85 -1.14 117.00 122.60 1jx7 n LEU 65 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 1jx7 n LEU 65 Cb 0.01 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.15 1jx7 n LEU 65 CO 0.00 0.00 0.42 -0.33 -1.33 0.00 0.00 177.39 176.15 1jx7 h GLU 66 N 0.00 0.45 -0.91 3.23 5.08 -1.65 0.22 114.58 121.00 1jx7 h GLU 66 Ca 0.00 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.02 1jx7 h GLU 66 Cb 0.00 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.26 1jx7 h GLU 66 CO 0.00 0.95 0.54 0.82 -1.00 0.00 0.00 179.01 180.32 1jx7 h ILE 67 N 0.33 1.25 0.12 3.13 2.04 -1.41 0.73 117.51 123.70 1jx7 h ILE 67 Ca -0.01 -0.58 -0.29 0.00 1.00 0.00 0.00 64.86 64.98 1jx7 h ILE 67 Cb 1.20 -0.02 0.03 0.00 -0.74 0.00 0.00 36.82 37.28 1jx7 h ILE 67 CO 0.11 0.27 -1.23 -0.07 0.00 0.00 0.00 178.15 177.23 1jx7 h LEU 68 N 1.26 0.81 -0.64 1.44 3.38 -1.76 -3.31 115.31 116.50 1jx7 h LEU 68 Ca 0.33 -0.76 -0.09 0.00 0.09 0.00 0.00 57.88 57.45 1jx7 h LEU 68 Cb -0.03 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 1jx7 h LEU 68 CO -0.06 1.56 -0.42 0.71 0.09 0.00 0.00 178.44 180.32 1jx7 h THR 69 N 0.25 0.88 0.00 0.22 1.35 -0.38 -2.11 112.91 113.12 1jx7 h THR 69 Ca -0.18 -1.77 -0.04 0.00 -0.55 0.00 0.00 66.41 63.88 1jx7 h THR 69 Cb 1.90 2.10 -0.01 0.00 -1.73 0.00 0.00 68.15 70.42 1jx7 h THR 69 CO 0.23 0.41 -0.17 0.00 -0.25 0.00 0.00 175.52 175.75 1jx7 h ALA 70 N 1.58 1.45 -0.05 6.62 0.00 -0.94 -0.02 119.26 127.90 1jx7 h ALA 70 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1jx7 h ALA 70 Cb 1.06 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1jx7 h ALA 70 CO 0.06 0.21 0.00 1.04 0.00 0.00 0.00 179.25 180.56 1jx7 n GLN 71 N -3.95 1.49 -1.64 0.00 6.02 -1.12 -4.92 117.38 113.27 1jx7 n GLN 71 Ca -0.02 -0.72 -0.08 0.00 -0.01 0.00 0.00 57.00 56.16 1jx7 n GLN 71 Cb 0.26 -1.44 -0.02 0.00 1.02 0.00 0.00 30.24 30.06 1jx7 n GLN 71 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1jx7 n ASN 72 N -0.10 -3.53 -4.65 1.08 3.02 -0.02 -4.97 115.26 106.08 1jx7 n ASN 72 Ca 0.19 0.11 -0.43 0.00 -0.03 0.00 0.00 54.58 54.42 1jx7 n ASN 72 Cb 0.27 -2.23 -0.02 0.00 -0.61 0.00 0.00 39.78 37.19 1jx7 n ASN 72 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1jx7 s VAL 73 N -2.35 4.58 0.25 2.41 1.01 -0.81 -4.98 120.40 120.52 1jx7 s VAL 73 Ca 0.00 1.87 -0.30 0.00 0.00 0.00 0.00 61.98 63.55 1jx7 s VAL 73 Cb 0.00 -4.37 -0.10 0.00 0.00 0.00 0.00 36.38 31.91 1jx7 s VAL 73 CO 0.00 -0.35 1.50 -2.84 0.00 0.00 0.00 175.10 173.41 1jx7 s PRO 74 N 3.46 4.22 -0.24 2.72 0.02 -1.24 -4.30 135.00 139.64 1jx7 s PRO 74 Ca 0.45 2.39 0.00 0.00 0.02 0.00 0.00 61.00 63.86 1jx7 s PRO 74 Cb -0.13 -3.09 0.06 0.00 0.02 0.00 0.00 34.50 31.36 1jx7 s PRO 74 CO 0.11 -0.50 -0.02 0.08 -0.33 0.00 0.00 177.00 176.34 1jx7 s VAL 75 N 0.10 1.32 -0.11 3.83 1.01 -1.26 -0.70 120.40 124.60 1jx7 s VAL 75 Ca 0.61 -1.16 -0.02 0.00 0.00 0.00 0.00 61.98 61.42 1jx7 s VAL 75 Cb -0.44 -1.68 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 1jx7 s VAL 75 CO 0.43 -0.19 -0.04 -0.54 0.00 0.00 0.00 175.10 174.77 1jx7 s LYS 76 N 1.48 3.21 -0.16 2.72 -0.14 0.32 -1.03 119.74 126.13 1jx7 s LYS 76 Ca -0.03 -0.50 -0.06 0.00 -1.36 0.00 0.00 55.97 54.01 1jx7 s LYS 76 Cb -0.18 -2.78 -0.04 0.00 -1.68 0.00 0.00 37.83 33.15 1jx7 s LYS 76 CO -0.08 0.49 0.06 -0.51 -0.76 0.00 0.00 175.35 174.55 1jx7 s LEU 77 N -0.32 3.84 0.08 3.17 1.43 0.73 -0.62 118.68 126.98 1jx7 s LEU 77 Ca 0.05 0.14 -0.31 0.00 -1.03 0.00 0.00 54.13 52.98 1jx7 s LEU 77 Cb -0.12 -1.95 -0.08 0.00 0.03 0.00 0.00 46.19 44.06 1jx7 s LEU 77 CO 0.02 0.24 1.67 0.00 0.23 0.00 0.00 176.35 178.51 1jx7 h LYS 79 N 8.33 -0.50 -0.69 0.00 1.63 -0.45 -0.67 116.57 124.22 1jx7 h LYS 79 Ca -0.43 0.03 0.01 0.00 -0.85 0.00 0.00 60.65 59.42 1jx7 h LYS 79 Cb 1.20 0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 32.91 1jx7 h LYS 79 CO 0.93 -0.33 0.46 1.79 -3.45 0.00 0.00 179.45 178.85 1jx7 h THR 80 N -0.52 1.16 0.12 1.00 1.35 -1.92 -1.51 112.91 112.59 1jx7 h THR 80 Ca 0.06 -0.31 -0.01 0.00 -0.55 0.00 0.00 66.41 65.60 1jx7 h THR 80 Cb 0.62 0.16 0.00 0.00 -1.73 0.00 0.00 68.15 67.20 1jx7 h THR 80 CO -0.32 0.17 -0.06 0.00 -0.25 0.00 0.00 175.52 175.06 1jx7 h THR 82 N -0.50 1.21 -0.57 0.00 1.35 -0.93 -2.43 112.91 111.04 1jx7 h THR 82 Ca -0.02 -0.47 -0.02 0.00 -0.55 0.00 0.00 66.41 65.36 1jx7 h THR 82 Cb 0.40 0.15 -0.03 0.00 -1.73 0.00 0.00 68.15 66.94 1jx7 h THR 82 CO 0.03 0.22 0.29 0.44 -0.25 0.00 0.00 175.52 176.25 1jx7 h ASP 83 N 1.04 0.73 0.21 5.36 3.32 -1.28 -0.27 116.42 125.53 1jx7 h ASP 83 Ca 0.27 -0.11 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 1jx7 h ASP 83 Cb -0.04 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.32 1jx7 h ASP 83 CO -0.05 0.64 -0.16 1.23 -1.72 0.00 0.00 179.24 179.18 1jx7 h GLY 84 N 0.77 0.00 -2.34 2.75 0.00 -1.12 -2.41 103.07 100.71 1jx7 h GLY 84 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 1jx7 h GLY 84 CO -0.03 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.05 1jx7 n ARG 85 N -4.15 2.53 -2.85 4.80 1.74 -0.96 -4.95 116.66 112.82 1jx7 n ARG 85 Ca -0.02 -2.31 -0.19 0.00 -0.77 0.00 0.00 57.85 54.55 1jx7 n ARG 85 Cb 0.23 -1.52 0.03 0.00 -1.02 0.00 0.00 32.46 30.18 1jx7 n ARG 85 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jx7 n GLY 86 N 1.52 -0.34 0.00 -0.13 0.00 -0.56 -4.89 105.19 100.80 1jx7 n GLY 86 Ca 0.20 -0.02 0.08 0.00 0.00 0.00 0.00 46.02 46.27 1jx7 n GLY 86 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1jx7 n ILE 87 N -4.30 0.00 -0.24 -0.61 5.41 -0.22 -4.57 119.36 114.83 1jx7 n ILE 87 Ca -0.11 -0.23 0.04 0.00 1.00 0.00 0.00 62.75 63.45 1jx7 n ILE 87 Cb 0.61 0.65 0.16 0.00 -0.71 0.00 0.00 39.64 40.35 1jx7 n ILE 87 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1jx7 h SER 88 N 0.00 0.23 -0.04 4.38 0.02 -1.86 -2.26 113.55 114.02 1jx7 h SER 88 Ca 0.00 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1jx7 h SER 88 Cb 0.52 0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.15 1jx7 h SER 88 CO 0.00 0.10 0.00 0.35 -1.14 0.00 0.00 176.83 176.14 1jx7 n THR 89 N -5.02 0.03 -2.07 -2.27 -2.24 -1.26 -4.95 114.28 96.50 1jx7 n THR 89 Ca 0.13 -0.32 -0.29 0.00 -2.27 0.00 0.00 64.05 61.30 1jx7 n THR 89 Cb 0.38 0.71 0.04 0.00 -2.10 0.00 0.00 70.33 69.36 1jx7 n THR 89 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1jx7 s LEU 90 N -1.96 3.00 -0.16 3.22 1.43 -0.85 -5.00 118.68 118.36 1jx7 s LEU 90 Ca 0.35 0.96 -0.29 0.00 -1.03 0.00 0.00 54.13 54.12 1jx7 s LEU 90 Cb 0.21 -3.75 -0.02 0.00 0.03 0.00 0.00 46.19 42.66 1jx7 s LEU 90 CO 0.32 -1.27 1.31 -2.84 0.23 0.00 0.00 176.35 174.10 1jx7 s PRO 91 N -5.24 4.21 0.24 1.29 0.02 -1.26 -5.02 135.00 129.25 1jx7 s PRO 91 Ca 0.57 1.71 0.02 0.00 0.02 0.00 0.00 61.00 63.32 1jx7 s PRO 91 Cb -0.11 -3.80 -0.04 0.00 0.02 0.00 0.00 34.50 30.58 1jx7 s PRO 91 CO 0.49 -0.74 0.41 -0.51 -0.33 0.00 0.00 177.00 176.32 1jx7 s LEU 92 N 3.61 4.22 0.65 -5.54 2.01 -1.26 -2.74 118.68 119.63 1jx7 s LEU 92 Ca 0.57 0.28 -0.18 0.00 0.01 0.00 0.00 54.13 54.81 1jx7 s LEU 92 Cb -0.23 -3.08 -0.02 0.00 0.01 0.00 0.00 46.19 42.88 1jx7 s LEU 92 CO 0.17 -0.10 1.19 -0.38 1.01 0.00 0.00 176.35 178.24 1jx7 n ILE 93 N -1.16 4.51 0.00 -0.59 5.41 -0.32 -4.78 119.36 122.43 1jx7 n ILE 93 Ca -0.06 -0.49 0.00 0.00 1.00 0.00 0.00 62.75 63.20 1jx7 n ILE 93 Cb 0.55 -1.38 0.00 0.00 -0.71 0.00 0.00 39.64 38.10 1jx7 n ILE 93 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1jx7 n ASP 94 N -1.66 0.00 0.16 4.38 8.00 -1.26 -1.96 116.55 124.21 1jx7 n ASP 94 Ca 0.15 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.69 1jx7 n ASP 94 Cb 0.48 0.00 0.22 0.00 -0.02 0.00 0.00 41.12 41.80 1jx7 n ASP 94 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1jx7 n GLY 95 N 0.00 -0.47 3.75 0.44 0.00 -1.26 -4.65 105.19 103.00 1jx7 n GLY 95 Ca 0.00 0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1jx7 n GLY 95 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1jx7 s VAL 96 N -3.19 2.55 0.14 1.61 1.01 -0.83 -4.37 120.40 117.32 1jx7 s VAL 96 Ca -0.01 0.47 -0.03 0.00 0.00 0.00 0.00 61.98 62.40 1jx7 s VAL 96 Cb 0.02 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.07 1jx7 s VAL 96 CO 0.07 0.08 0.12 -1.61 0.00 0.00 0.00 175.10 173.76 1jx7 s GLU 97 N -0.44 0.98 -0.43 2.72 2.02 -0.20 -4.77 118.70 118.58 1jx7 s GLU 97 Ca 0.60 -1.35 -0.19 0.00 0.02 0.00 0.00 54.97 54.04 1jx7 s GLU 97 Cb -0.43 0.28 0.02 0.00 0.10 0.00 0.00 34.13 34.11 1jx7 s GLU 97 CO 0.44 -0.30 0.57 0.42 0.02 0.00 0.00 175.26 176.41 1jx7 s ILE 98 N -4.02 4.92 0.04 -1.63 1.01 -1.26 0.26 121.20 120.52 1jx7 s ILE 98 Ca 0.21 -0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.80 1jx7 s ILE 98 Cb 0.06 -4.15 0.00 0.00 0.01 0.00 0.00 42.46 38.39 1jx7 s ILE 98 CO 0.01 -0.54 0.04 0.61 0.00 0.00 0.00 174.94 175.05 1jx7 n GLY 99 N 5.07 2.83 3.19 6.18 0.00 0.49 -4.81 105.19 118.13 1jx7 n GLY 99 Ca -0.04 -2.17 -0.16 0.00 0.00 0.00 0.00 46.02 43.65 1jx7 n GLY 99 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1jx7 s THR 100 N -0.02 1.05 0.30 2.61 -4.23 -1.26 0.33 115.64 114.42 1jx7 s THR 100 Ca 0.03 -1.57 0.05 0.00 -1.18 0.00 0.00 61.69 59.02 1jx7 s THR 100 Cb -0.00 -1.31 0.30 0.00 1.34 0.00 0.00 72.50 72.82 1jx7 s THR 100 CO 0.02 -0.45 1.70 0.25 -0.54 0.00 0.00 174.62 175.59 1jx7 h LEU 101 N 3.73 0.40 -1.29 4.79 5.85 -1.97 0.80 115.31 127.61 1jx7 h LEU 101 Ca -0.38 0.15 0.17 0.00 0.84 0.00 0.00 57.88 58.65 1jx7 h LEU 101 Cb 1.19 0.12 -0.08 0.00 0.37 0.00 0.00 40.66 42.26 1jx7 h LEU 101 CO 0.49 0.01 0.59 0.58 -0.34 0.00 0.00 178.44 179.77 1jx7 h VAL 102 N 0.42 0.78 -0.07 1.05 2.07 -1.96 0.38 116.25 118.93 1jx7 h VAL 102 Ca 0.59 -0.22 -0.06 0.00 0.82 0.00 0.00 66.70 67.83 1jx7 h VAL 102 Cb 1.13 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1jx7 h VAL 102 CO -0.53 0.12 -0.18 -0.08 0.02 0.00 0.00 177.57 176.92 1jx7 h GLU 103 N 0.64 0.25 -0.47 1.57 4.81 0.19 -3.14 114.58 118.43 1jx7 h GLU 103 Ca 0.48 -0.17 0.05 0.00 -0.13 0.00 0.00 59.36 59.58 1jx7 h GLU 103 Cb 0.85 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.21 1jx7 h GLU 103 CO -0.23 0.78 0.20 1.25 -0.73 0.00 0.00 179.01 180.29 1jx7 h LEU 104 N -0.25 0.26 -7.33 1.64 6.46 -0.61 -0.46 115.31 115.03 1jx7 h LEU 104 Ca -0.00 0.04 -0.69 0.00 -0.12 0.00 0.00 57.88 57.10 1jx7 h LEU 104 Cb 0.79 -0.00 -0.08 0.00 -0.73 0.00 0.00 40.66 40.64 1jx7 h LEU 104 CO 0.04 0.19 2.40 0.00 -0.62 0.00 0.00 178.44 180.45 1jx7 n ALA 105 N -2.35 4.14 0.00 1.25 0.00 0.12 -1.50 120.51 122.18 1jx7 n ALA 105 Ca 0.04 -3.89 0.00 0.00 0.00 0.00 0.00 53.44 49.58 1jx7 n ALA 105 Cb 0.15 -3.54 0.00 0.00 0.00 0.00 0.00 19.45 16.06 1jx7 n ALA 105 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1jx7 n GLN 106 N 7.51 0.00 -0.37 0.00 7.27 -1.03 -4.74 117.38 126.03 1jx7 n GLN 106 Ca 0.49 0.00 -0.01 0.00 0.07 0.00 0.00 57.00 57.55 1jx7 n GLN 106 Cb 0.44 0.00 0.13 0.00 2.41 0.00 0.00 30.24 33.22 1jx7 n GLN 106 CO 0.00 0.00 0.00 -1.49 0.07 0.00 0.00 177.06 175.64 1jx7 h TRP 107 N 0.00 1.24 -0.30 3.69 4.06 -0.68 -0.96 115.95 122.99 1jx7 h TRP 107 Ca 0.00 0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.97 1jx7 h TRP 107 Cb 0.00 -0.42 -0.01 0.00 -1.00 0.00 0.00 29.16 27.73 1jx7 h TRP 107 CO 0.00 0.75 0.15 1.15 -3.56 0.00 0.00 178.44 176.93 1jx7 h THR 108 N 1.31 1.15 -0.03 1.49 2.02 -1.51 -2.66 112.91 114.68 1jx7 h THR 108 Ca 0.38 -0.42 -0.08 0.00 0.77 0.00 0.00 66.41 67.06 1jx7 h THR 108 Cb -0.09 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 1jx7 h THR 108 CO -0.10 0.15 -0.34 -0.07 0.37 0.00 0.00 175.52 175.54 1jx7 h LEU 109 N 0.36 0.06 -3.71 2.58 3.38 -1.67 -3.15 115.31 113.16 1jx7 h LEU 109 Ca 0.10 -0.02 -0.42 0.00 0.09 0.00 0.00 57.88 57.64 1jx7 h LEU 109 Cb 0.11 -0.02 -0.24 0.00 0.09 0.00 0.00 40.66 40.60 1jx7 h LEU 109 CO -0.01 0.40 0.23 -1.54 0.09 0.00 0.00 178.44 177.61 1jx7 n SER 110 N -4.12 4.10 -4.22 -0.43 3.41 -0.42 -4.97 113.62 106.97 1jx7 n SER 110 Ca -0.02 -3.74 -0.24 0.00 -0.26 0.00 0.00 58.87 54.61 1jx7 n SER 110 Cb 0.39 -0.73 -0.14 0.00 -0.26 0.00 0.00 64.21 63.47 1jx7 n SER 110 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jx7 s ALA 111 N -3.42 1.61 0.10 7.33 0.00 -1.02 -4.90 121.76 121.47 1jx7 s ALA 111 Ca 0.53 -0.98 -0.13 0.00 0.00 0.00 0.00 51.96 51.38 1jx7 s ALA 111 Cb 0.45 -0.32 -0.17 0.00 0.00 0.00 0.00 23.12 23.08 1jx7 s ALA 111 CO 0.03 0.36 1.28 -0.44 0.00 0.00 0.00 175.76 176.99 1jx7 h ASP 112 N 4.98 0.94 -4.57 0.00 3.32 -1.68 -3.46 116.42 115.95 1jx7 h ASP 112 Ca -0.41 -0.65 -0.32 0.00 0.02 0.00 0.00 57.03 55.67 1jx7 h ASP 112 Cb 1.16 -0.28 -0.22 0.00 0.22 0.00 0.00 39.33 40.21 1jx7 h ASP 112 CO 0.44 1.44 -0.75 -0.54 -1.72 0.00 0.00 179.24 178.12 1jx7 s LYS 113 N -3.68 0.61 -0.21 3.56 1.02 -1.04 -5.07 119.74 114.94 1jx7 s LYS 113 Ca -0.10 -0.73 -0.04 0.00 0.02 0.00 0.00 55.97 55.12 1jx7 s LYS 113 Cb 0.08 -0.47 0.07 0.00 -0.52 0.00 0.00 37.83 36.99 1jx7 s LYS 113 CO 0.91 0.10 0.08 0.08 -0.92 0.00 0.00 175.35 175.59 1jx7 s VAL 114 N -1.16 0.21 -0.19 3.17 1.01 -1.26 -1.26 120.40 120.92 1jx7 s VAL 114 Ca -0.06 -0.48 -0.18 0.00 0.00 0.00 0.00 61.98 61.26 1jx7 s VAL 114 Cb -0.09 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.38 1jx7 s VAL 114 CO 0.01 -0.34 0.50 -0.76 0.00 0.00 0.00 175.10 174.51 1jx7 s LEU 115 N 1.99 4.17 -0.38 3.92 1.02 0.38 -4.99 118.68 124.79 1jx7 s LEU 115 Ca 0.02 0.68 0.02 0.00 0.02 0.00 0.00 54.13 54.88 1jx7 s LEU 115 Cb -0.16 -2.69 0.11 0.00 0.02 0.00 0.00 46.19 43.46 1jx7 s LEU 115 CO -0.14 -0.14 0.11 0.42 0.02 0.00 0.00 176.35 176.63 1jx7 s THR 116 N 1.45 2.61 -2.70 5.49 -4.23 -1.26 -0.29 115.64 116.71 1jx7 s THR 116 Ca 0.24 -2.35 0.26 0.00 -1.18 0.00 0.00 61.69 58.67 1jx7 s THR 116 Cb -0.15 -2.87 0.41 0.00 1.34 0.00 0.00 72.50 71.23 1jx7 s THR 116 CO 0.10 -0.64 1.55 0.49 -0.54 0.00 0.00 174.62 175.57