#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ja7 s VAL 2 N 0.00 0.02 0.07 3.15 1.01 -1.26 -4.37 120.40 119.02 1ja7 s VAL 2 Ca 0.00 -0.08 0.01 0.00 0.00 0.00 0.00 61.98 61.91 1ja7 s VAL 2 Cb 0.00 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.79 1ja7 s VAL 2 CO 0.00 -0.14 0.20 -0.36 0.00 0.00 0.00 175.10 174.79 1ja7 s PHE 3 N 2.09 3.47 0.78 5.22 0.40 -1.16 -5.07 117.98 123.72 1ja7 s PHE 3 Ca 0.02 0.21 -0.07 0.00 -0.60 0.00 0.00 56.93 56.50 1ja7 s PHE 3 Cb -0.15 -1.73 0.13 0.00 0.51 0.00 0.00 43.02 41.78 1ja7 s PHE 3 CO -0.07 0.57 1.09 0.20 0.70 0.00 0.00 175.22 177.71 1ja7 s GLY 4 N -2.57 1.75 0.04 4.36 0.00 -1.26 -4.80 107.32 104.84 1ja7 s GLY 4 Ca 0.34 -1.32 -0.33 0.00 0.00 0.00 0.00 44.72 43.41 1ja7 s GLY 4 CO 0.27 -0.75 1.42 -0.09 0.00 0.00 0.00 173.10 173.95 1ja7 h ARG 5 N -0.85 -1.04 -0.00 2.90 2.43 -2.00 -1.62 114.38 114.20 1ja7 h ARG 5 Ca -0.41 0.07 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 1ja7 h ARG 5 Cb 1.27 0.24 0.00 0.00 -0.42 0.00 0.00 29.97 31.06 1ja7 h ARG 5 CO 0.46 -0.68 -0.05 0.00 -1.51 0.00 0.00 179.97 178.19 1ja7 n GLU 7 N -1.17 0.63 0.08 0.00 -0.58 -1.16 -4.35 120.64 114.09 1ja7 n GLU 7 Ca 0.14 -0.19 0.12 0.00 -0.42 0.00 0.00 57.16 56.82 1ja7 n GLU 7 Cb 0.26 -1.49 0.20 0.00 -0.57 0.00 0.00 31.44 29.84 1ja7 n GLU 7 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1ja7 h LEU 8 N 0.00 0.00 -2.17 -4.62 6.46 -1.40 -3.39 115.31 110.19 1ja7 h LEU 8 Ca -0.01 -0.15 0.00 0.00 -0.12 0.00 0.00 57.88 57.60 1ja7 h LEU 8 Cb 0.97 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.90 1ja7 h LEU 8 CO 0.00 0.07 0.00 0.00 -0.62 0.00 0.00 178.44 177.89 1ja7 n ALA 9 N -1.86 2.31 0.74 1.25 0.00 -1.26 -4.60 120.51 117.10 1ja7 n ALA 9 Ca 0.03 -0.86 0.12 0.00 0.00 0.00 0.00 53.44 52.74 1ja7 n ALA 9 Cb 0.45 -0.35 0.28 0.00 0.00 0.00 0.00 19.45 19.83 1ja7 n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ja7 n ALA 10 N 0.46 2.91 0.89 0.00 0.00 -1.26 -3.86 120.51 119.65 1ja7 n ALA 10 Ca 0.08 -0.22 0.13 0.00 0.00 0.00 0.00 53.44 53.43 1ja7 n ALA 10 Cb 0.33 -1.24 0.39 0.00 0.00 0.00 0.00 19.45 18.93 1ja7 n ALA 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ja7 n ALA 11 N -1.70 2.87 -0.02 0.00 0.00 -1.26 -3.76 120.51 116.64 1ja7 n ALA 11 Ca 0.05 -0.21 -0.08 0.00 0.00 0.00 0.00 53.44 53.19 1ja7 n ALA 11 Cb 0.40 -1.29 0.08 0.00 0.00 0.00 0.00 19.45 18.64 1ja7 n ALA 11 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1ja7 h MET 12 N 0.00 0.60 0.00 0.00 2.86 -1.88 -1.87 114.93 114.64 1ja7 h MET 12 Ca 0.00 -0.32 0.00 0.00 -2.06 0.00 0.00 59.70 57.32 1ja7 h MET 12 Cb 0.56 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.24 1ja7 h MET 12 CO 0.00 0.92 0.00 1.17 1.06 0.00 0.00 176.91 180.06 1ja7 n LYS 13 N -4.02 0.88 0.00 1.72 4.81 -1.25 -0.20 118.16 120.11 1ja7 n LYS 13 Ca -0.02 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.53 1ja7 n LYS 13 Cb 0.54 -1.46 -0.03 0.00 0.02 0.00 0.00 35.03 34.10 1ja7 n LYS 13 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 1ja7 n ARG 14 N -0.96 0.11 -1.93 1.64 0.63 -0.73 -4.42 116.66 111.00 1ja7 n ARG 14 Ca 0.19 -0.02 -0.12 0.00 -0.92 0.00 0.00 57.85 56.99 1ja7 n ARG 14 Cb 0.09 -1.52 0.06 0.00 0.45 0.00 0.00 32.46 31.54 1ja7 n ARG 14 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1ja7 n HIS 15 N -1.65 1.77 -1.24 -0.14 8.25 0.72 -5.00 115.22 117.93 1ja7 n HIS 15 Ca 0.03 -1.97 -0.08 0.00 -0.26 0.00 0.00 57.72 55.44 1ja7 n HIS 15 Cb 0.37 -0.29 -0.04 0.00 1.12 0.00 0.00 29.99 31.16 1ja7 n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ja7 n GLY 16 N -0.67 0.99 0.05 -1.41 0.00 -1.17 -4.91 105.19 98.06 1ja7 n GLY 16 Ca 0.29 -0.37 0.12 0.00 0.00 0.00 0.00 46.02 46.06 1ja7 n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ja7 n LEU 17 N -0.95 0.62 -4.63 0.99 4.77 -1.01 -4.40 117.00 112.39 1ja7 n LEU 17 Ca -0.08 0.19 -0.43 0.00 -0.03 0.00 0.00 56.01 55.66 1ja7 n LEU 17 Cb 0.35 -0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 1ja7 n LEU 17 CO 0.13 -0.01 1.48 -0.62 -1.33 0.00 0.00 177.39 177.04 1ja7 s ASP 18 N -3.89 6.22 -1.49 -1.43 -1.08 -1.26 -2.38 116.67 111.36 1ja7 s ASP 18 Ca 0.08 1.78 -0.13 0.00 -0.52 0.00 0.00 52.55 53.75 1ja7 s ASP 18 Cb 0.15 -2.53 0.10 0.00 -1.46 0.00 0.00 42.92 39.18 1ja7 s ASP 18 CO 0.71 -1.36 0.73 0.59 0.52 0.00 0.00 175.17 176.35 1ja7 n ASN 19 N 8.92 -4.00 -4.72 -0.34 5.03 -1.12 -4.89 115.26 114.14 1ja7 n ASN 19 Ca 0.21 -0.68 -0.41 0.00 0.87 0.00 0.00 54.58 54.57 1ja7 n ASN 19 Cb 0.45 -3.26 -0.04 0.00 -1.02 0.00 0.00 39.78 35.91 1ja7 n ASN 19 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1ja7 s TYR 20 N -3.14 3.67 -1.19 3.10 5.04 -0.78 -4.22 117.35 119.83 1ja7 s TYR 20 Ca 0.58 1.56 -0.26 0.00 -2.44 0.00 0.00 57.07 56.51 1ja7 s TYR 20 Cb -0.30 -2.97 0.01 0.00 0.35 0.00 0.00 41.96 39.04 1ja7 s TYR 20 CO 0.71 0.10 0.73 0.54 -1.34 0.00 0.00 175.55 176.29 1ja7 n ARG 21 N 3.51 -0.89 -0.56 4.97 5.12 -1.26 -1.41 116.66 126.13 1ja7 n ARG 21 Ca 0.02 0.29 0.00 0.00 -1.93 0.00 0.00 57.85 56.23 1ja7 n ARG 21 Cb 0.51 -3.48 0.00 0.00 -1.16 0.00 0.00 32.46 28.32 1ja7 n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ja7 n GLY 22 N -1.87 1.27 3.55 -0.13 0.00 -1.26 -4.98 105.19 101.76 1ja7 n GLY 22 Ca -0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 1ja7 n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ja7 s TYR 23 N -2.96 3.09 0.63 1.61 2.02 -0.50 -5.09 117.35 116.16 1ja7 s TYR 23 Ca 0.00 -0.16 -0.09 0.00 -0.37 0.00 0.00 57.07 56.45 1ja7 s TYR 23 Cb 0.00 -1.97 -0.00 0.00 -0.40 0.00 0.00 41.96 39.58 1ja7 s TYR 23 CO 0.00 0.06 0.99 0.45 -1.57 0.00 0.00 175.55 175.48 1ja7 s SER 24 N 0.25 5.75 0.47 2.29 0.15 -1.26 -1.88 113.70 119.48 1ja7 s SER 24 Ca -0.01 1.05 0.13 0.00 0.70 0.00 0.00 55.95 57.82 1ja7 s SER 24 Cb -0.13 -2.02 1.10 0.00 -1.71 0.00 0.00 66.02 63.26 1ja7 s SER 24 CO 0.02 -1.07 2.10 0.25 1.20 0.00 0.00 173.24 175.74 1ja7 h LEU 25 N -0.34 0.15 -0.41 3.45 5.85 -1.92 -2.52 115.31 119.56 1ja7 h LEU 25 Ca -0.45 -0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.20 1ja7 h LEU 25 Cb 1.24 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.22 1ja7 h LEU 25 CO 0.62 0.14 -0.31 1.23 -0.34 0.00 0.00 178.44 179.78 1ja7 h GLY 26 N 0.25 0.00 0.71 3.75 0.00 -1.94 -3.30 103.07 102.54 1ja7 h GLY 26 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1ja7 h GLY 26 CO -0.01 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.23 1ja7 n ASN 27 N -3.26 0.00 -0.04 0.19 3.02 -0.95 -4.44 115.26 109.78 1ja7 n ASN 27 Ca 0.02 -1.08 -0.06 0.00 -0.03 0.00 0.00 54.58 53.43 1ja7 n ASN 27 Cb 0.59 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.74 1ja7 n ASN 27 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 1ja7 n TRP 28 N -0.86 0.00 0.33 3.10 7.02 -1.24 -4.72 117.44 121.06 1ja7 n TRP 28 Ca 0.14 0.00 0.21 0.00 -1.02 0.00 0.00 57.50 56.83 1ja7 n TRP 28 Cb 0.07 -0.32 1.11 0.00 -2.42 0.00 0.00 31.31 29.74 1ja7 n TRP 28 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 1ja7 h VAL 29 N -0.64 0.08 0.27 -0.99 2.07 -1.82 -2.62 116.25 112.60 1ja7 h VAL 29 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1ja7 h VAL 29 Cb 0.64 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 1ja7 h VAL 29 CO 0.00 0.00 -0.31 0.00 0.02 0.00 0.00 177.57 177.28 1ja7 h ALA 31 N -0.04 1.48 -0.30 0.00 0.00 -1.77 -2.20 119.26 116.42 1ja7 h ALA 31 Ca -0.01 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1ja7 h ALA 31 Cb 0.58 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1ja7 h ALA 31 CO -0.09 0.07 0.05 0.00 0.00 0.00 0.00 179.25 179.28 1ja7 h ALA 32 N 1.95 1.52 0.00 0.00 0.00 -1.61 0.43 119.26 121.55 1ja7 h ALA 32 Ca -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1ja7 h ALA 32 Cb 0.14 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ja7 h ALA 32 CO 0.01 0.35 0.00 1.17 0.00 0.00 0.00 179.25 180.78 1ja7 n LYS 33 N -4.35 0.05 -0.07 0.00 3.00 -0.83 -2.69 118.16 113.27 1ja7 n LYS 33 Ca 0.01 0.09 0.06 0.00 -0.00 0.00 0.00 58.31 58.48 1ja7 n LYS 33 Cb 0.19 -1.56 0.10 0.00 0.00 0.00 0.00 35.03 33.75 1ja7 n LYS 33 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1ja7 n PHE 34 N -1.64 0.18 0.00 5.64 3.72 0.13 -4.12 117.46 121.38 1ja7 n PHE 34 Ca 0.06 -0.17 0.00 0.00 -0.05 0.00 0.00 57.45 57.29 1ja7 n PHE 34 Cb 0.32 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 38.85 1ja7 n PHE 34 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1ja7 n GLU 35 N 0.70 2.48 0.00 -1.08 -0.58 -0.16 -4.78 120.64 117.23 1ja7 n GLU 35 Ca 0.10 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 1ja7 n GLU 35 Cb 0.37 -0.85 0.00 0.00 -0.57 0.00 0.00 31.44 30.38 1ja7 n GLU 35 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1ja7 n SER 36 N -1.40 0.00 -3.48 1.62 7.64 -1.20 -4.70 113.62 112.10 1ja7 n SER 36 Ca 0.00 -1.00 -0.24 0.00 1.01 0.00 0.00 58.87 58.64 1ja7 n SER 36 Cb 0.24 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.49 1ja7 n SER 36 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1ja7 n ASN 37 N 0.00 -5.95 -1.69 6.43 5.15 -1.09 -2.23 115.26 115.87 1ja7 n ASN 37 Ca 0.00 -0.87 -0.20 0.00 -0.60 0.00 0.00 54.58 52.90 1ja7 n ASN 37 Cb 0.49 -4.21 -0.08 0.00 -0.53 0.00 0.00 39.78 35.45 1ja7 n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1ja7 n PHE 38 N -3.74 -0.15 -5.11 1.20 3.72 -1.18 -4.96 117.46 107.24 1ja7 n PHE 38 Ca -0.08 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.01 1ja7 n PHE 38 Cb 0.60 -3.47 -0.17 0.00 -0.94 0.00 0.00 39.48 35.50 1ja7 n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1ja7 s ASN 39 N -2.64 2.84 0.02 4.37 2.47 -0.95 -2.96 114.94 118.08 1ja7 s ASN 39 Ca 0.00 -0.50 -0.01 0.00 0.42 0.00 0.00 52.86 52.77 1ja7 s ASN 39 Cb 0.00 -1.23 -0.27 0.00 -1.45 0.00 0.00 41.25 38.30 1ja7 s ASN 39 CO 0.00 0.15 0.90 0.71 -3.72 0.00 0.00 177.10 175.14 1ja7 h THR 40 N 5.68 1.21 0.00 -5.21 1.35 -1.85 -3.31 112.91 110.78 1ja7 h THR 40 Ca -0.23 -2.87 0.00 0.00 -0.55 0.00 0.00 66.41 62.76 1ja7 h THR 40 Cb 1.22 2.75 0.00 0.00 -1.73 0.00 0.00 68.15 70.39 1ja7 h THR 40 CO 0.47 0.81 0.00 0.00 -0.25 0.00 0.00 175.52 176.55 1ja7 n GLN 41 N -3.41 0.82 -2.94 4.72 6.02 -1.26 -3.43 117.38 117.90 1ja7 n GLN 41 Ca -0.14 0.00 -0.44 0.00 -0.01 0.00 0.00 57.00 56.41 1ja7 n GLN 41 Cb 1.03 -1.22 -0.04 0.00 1.02 0.00 0.00 30.24 31.04 1ja7 n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ja7 s ALA 42 N -2.00 3.27 -0.01 -1.58 0.00 -1.25 -4.97 121.76 115.22 1ja7 s ALA 42 Ca 0.17 -2.24 0.06 0.00 0.00 0.00 0.00 51.96 49.96 1ja7 s ALA 42 Cb 0.08 -3.85 -0.02 0.00 0.00 0.00 0.00 23.12 19.33 1ja7 s ALA 42 CO 0.13 -2.75 -0.20 0.95 0.00 0.00 0.00 175.76 173.89 1ja7 s THR 43 N 3.28 2.56 -0.04 0.00 -4.23 -1.26 -4.15 115.64 111.80 1ja7 s THR 43 Ca 0.23 -1.00 -0.05 0.00 -1.18 0.00 0.00 61.69 59.68 1ja7 s THR 43 Cb -0.14 -1.97 0.01 0.00 1.34 0.00 0.00 72.50 71.73 1ja7 s THR 43 CO 0.03 0.52 0.14 0.20 -0.54 0.00 0.00 174.62 174.97 1ja7 s ASN 44 N -0.85 -0.10 0.38 3.99 -0.87 -1.20 -5.00 114.94 111.29 1ja7 s ASN 44 Ca 0.11 0.17 -0.12 0.00 -1.57 0.00 0.00 52.86 51.45 1ja7 s ASN 44 Cb -0.10 0.28 -0.07 0.00 -0.02 0.00 0.00 41.25 41.33 1ja7 s ASN 44 CO 0.01 -0.13 0.76 -0.60 -2.57 0.00 0.00 177.10 174.57 1ja7 s ARG 45 N -0.29 3.83 0.35 -0.60 3.52 -1.26 -0.21 118.95 124.29 1ja7 s ARG 45 Ca -0.04 0.52 0.07 0.00 -0.13 0.00 0.00 55.73 56.16 1ja7 s ARG 45 Cb -0.03 -2.40 -0.02 0.00 -1.56 0.00 0.00 34.95 30.94 1ja7 s ARG 45 CO 0.00 0.01 0.33 -0.80 -0.81 0.00 0.00 175.30 174.04 1ja7 s ASN 46 N -2.94 5.34 0.52 -2.12 0.01 -1.14 -4.87 114.94 109.75 1ja7 s ASN 46 Ca 0.52 -0.50 0.17 0.00 -0.71 0.00 0.00 52.86 52.35 1ja7 s ASN 46 Cb -0.10 -0.93 1.30 0.00 0.41 0.00 0.00 41.25 41.93 1ja7 s ASN 46 CO 0.28 -0.42 2.14 0.74 -1.51 0.00 0.00 177.10 178.33 1ja7 h THR 47 N 1.16 0.96 0.00 1.60 2.02 -1.98 0.36 112.91 117.02 1ja7 h THR 47 Ca -0.44 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.74 1ja7 h THR 47 Cb 1.26 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 68.65 1ja7 h THR 47 CO 0.57 0.00 0.00 -0.90 0.37 0.00 0.00 175.52 175.56 1ja7 n ASP 48 N -4.50 0.00 0.00 4.18 5.68 -1.26 -4.88 116.55 115.77 1ja7 n ASP 48 Ca -0.02 -0.53 0.00 0.00 -0.50 0.00 0.00 54.79 53.74 1ja7 n ASP 48 Cb 0.13 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.00 1ja7 n ASP 48 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ja7 n GLY 49 N 0.69 1.73 3.62 6.12 0.00 0.12 -4.95 105.19 112.52 1ja7 n GLY 49 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 1ja7 n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ja7 s SER 50 N -3.29 6.80 0.10 1.61 1.04 -1.26 -4.70 113.70 114.01 1ja7 s SER 50 Ca 0.00 0.82 -0.30 0.00 0.48 0.00 0.00 55.95 56.94 1ja7 s SER 50 Cb 0.00 -2.51 -0.06 0.00 0.10 0.00 0.00 66.02 63.54 1ja7 s SER 50 CO 0.00 -0.91 1.12 -0.89 0.98 0.00 0.00 173.24 173.54 1ja7 s THR 51 N 3.68 4.10 0.45 2.02 2.01 -1.26 -2.88 115.64 123.76 1ja7 s THR 51 Ca 0.43 1.63 -0.07 0.00 0.31 0.00 0.00 61.69 63.99 1ja7 s THR 51 Cb -0.11 -4.04 -0.04 0.00 0.01 0.00 0.00 72.50 68.31 1ja7 s THR 51 CO 0.18 0.19 0.77 -1.81 -0.69 0.00 0.00 174.62 173.26 1ja7 s ASP 52 N 0.54 6.35 -0.01 3.53 1.01 0.70 0.34 116.67 129.12 1ja7 s ASP 52 Ca 0.54 0.97 -0.01 0.00 0.71 0.00 0.00 52.55 54.76 1ja7 s ASP 52 Cb -0.28 -2.26 0.00 0.00 1.01 0.00 0.00 42.92 41.39 1ja7 s ASP 52 CO 0.31 -0.51 0.02 -0.31 0.21 0.00 0.00 175.17 174.90 1ja7 s TYR 53 N -2.60 0.00 0.04 4.23 1.51 0.20 -3.23 117.35 117.50 1ja7 s TYR 53 Ca 0.48 0.00 0.00 0.00 -1.01 0.00 0.00 57.07 56.55 1ja7 s TYR 53 Cb -0.10 -0.01 0.00 0.00 -0.11 0.00 0.00 41.96 41.73 1ja7 s TYR 53 CO 0.40 -0.04 0.00 0.41 -1.11 0.00 0.00 175.55 175.21 1ja7 n GLY 54 N 2.86 -2.10 0.26 0.71 0.00 -1.26 -2.06 105.19 103.60 1ja7 n GLY 54 Ca -0.14 -1.43 0.12 0.00 0.00 0.00 0.00 46.02 44.58 1ja7 n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ja7 h ILE 55 N -0.17 0.54 0.00 -0.61 6.09 -1.64 -2.07 117.51 119.66 1ja7 h ILE 55 Ca 0.00 -0.66 -0.06 0.00 -1.37 0.00 0.00 64.86 62.78 1ja7 h ILE 55 Cb 0.17 1.44 -0.01 0.00 0.47 0.00 0.00 36.82 38.88 1ja7 h ILE 55 CO 0.00 0.14 -0.29 -0.07 -3.07 0.00 0.00 178.15 174.86 1ja7 h LEU 56 N 0.00 0.00 -2.11 2.19 3.38 -1.89 -3.22 115.31 113.67 1ja7 h LEU 56 Ca -0.00 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.70 1ja7 h LEU 56 Cb 0.42 0.00 0.18 0.00 0.09 0.00 0.00 40.66 41.35 1ja7 h LEU 56 CO 0.02 0.29 -0.77 0.00 0.09 0.00 0.00 178.44 178.07 1ja7 n GLN 57 N -3.40 -4.03 -3.64 1.13 1.13 -0.78 -4.96 117.38 102.84 1ja7 n GLN 57 Ca 0.00 0.81 -0.36 0.00 -1.94 0.00 0.00 57.00 55.51 1ja7 n GLN 57 Cb 0.49 -5.63 -0.07 0.00 0.11 0.00 0.00 30.24 25.14 1ja7 n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1ja7 s ILE 58 N -3.35 5.35 0.20 5.09 1.01 -0.91 -4.61 121.20 123.98 1ja7 s ILE 58 Ca 0.23 0.41 -0.22 0.00 0.00 0.00 0.00 60.65 61.07 1ja7 s ILE 58 Cb -0.03 -3.56 -0.08 0.00 0.01 0.00 0.00 42.46 38.80 1ja7 s ILE 58 CO 0.69 0.44 0.76 0.54 0.00 0.00 0.00 174.94 177.37 1ja7 s ASN 59 N 0.19 7.21 0.14 3.58 2.20 -1.25 0.58 114.94 127.60 1ja7 s ASN 59 Ca 0.14 1.54 0.16 0.00 -0.94 0.00 0.00 52.86 53.76 1ja7 s ASN 59 Cb -0.12 -2.46 0.72 0.00 -2.00 0.00 0.00 41.25 37.39 1ja7 s ASN 59 CO 0.02 0.10 1.49 -1.54 -2.94 0.00 0.00 177.10 174.24 1ja7 n SER 60 N 1.08 0.32 0.31 3.54 3.41 0.15 -2.89 113.62 119.55 1ja7 n SER 60 Ca -0.03 0.60 -0.12 0.00 -0.26 0.00 0.00 58.87 59.05 1ja7 n SER 60 Cb 0.50 -0.66 -0.06 0.00 -0.26 0.00 0.00 64.21 63.73 1ja7 n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1ja7 h ARG 61 N 0.00 -0.78 0.05 4.33 2.43 -1.82 -3.37 114.38 115.22 1ja7 h ARG 61 Ca 0.00 0.05 -0.37 0.00 -0.81 0.00 0.00 59.98 58.86 1ja7 h ARG 61 Cb 0.19 0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 29.88 1ja7 h ARG 61 CO 0.00 -0.52 -2.10 0.91 -1.51 0.00 0.00 179.97 176.75 1ja7 n TRP 62 N -4.72 0.67 -0.09 2.20 7.02 -1.21 -3.12 117.44 118.20 1ja7 n TRP 62 Ca -0.10 0.18 -0.19 0.00 -1.02 0.00 0.00 57.50 56.37 1ja7 n TRP 62 Cb 0.32 -1.08 -0.13 0.00 -2.42 0.00 0.00 31.31 28.00 1ja7 n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 1ja7 n TRP 63 N -3.68 0.41 -4.36 -5.99 7.02 -1.14 -2.53 117.44 107.17 1ja7 n TRP 63 Ca -0.39 0.09 -0.17 0.00 -1.02 0.00 0.00 57.50 56.00 1ja7 n TRP 63 Cb 0.95 -1.05 -0.04 0.00 -2.42 0.00 0.00 31.31 28.74 1ja7 n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1ja7 s ASN 65 N -2.62 6.18 0.00 0.00 2.47 -1.25 -4.55 114.94 115.18 1ja7 s ASN 65 Ca 0.09 -0.84 0.00 0.00 0.42 0.00 0.00 52.86 52.53 1ja7 s ASN 65 Cb 0.00 -2.22 0.00 0.00 -1.45 0.00 0.00 41.25 37.58 1ja7 s ASN 65 CO 0.07 -0.63 0.00 -0.90 -3.72 0.00 0.00 177.10 171.92 1ja7 n ASP 66 N 5.58 1.16 0.00 -4.21 5.75 -1.26 -3.00 116.55 120.57 1ja7 n ASP 66 Ca -0.08 -0.05 0.00 0.00 -0.01 0.00 0.00 54.79 54.64 1ja7 n ASP 66 Cb 0.46 0.34 0.00 0.00 -1.03 0.00 0.00 41.12 40.89 1ja7 n ASP 66 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ja7 n GLY 67 N 0.69 2.75 0.14 6.12 0.00 -1.26 -4.79 105.19 108.83 1ja7 n GLY 67 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1ja7 n GLY 67 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1ja7 n ARG 68 N -2.00 0.41 -3.64 1.61 1.85 -1.26 -4.51 116.66 109.12 1ja7 n ARG 68 Ca 0.00 -0.27 -0.39 0.00 -1.00 0.00 0.00 57.85 56.19 1ja7 n ARG 68 Cb 0.00 -1.49 -0.08 0.00 -1.05 0.00 0.00 32.46 29.83 1ja7 n ARG 68 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1ja7 s THR 69 N -2.78 4.06 0.49 8.89 2.01 -1.26 -5.07 115.64 121.98 1ja7 s THR 69 Ca 0.16 -2.69 -0.19 0.00 0.31 0.00 0.00 61.69 59.28 1ja7 s THR 69 Cb 0.18 -3.62 -0.08 0.00 0.01 0.00 0.00 72.50 68.98 1ja7 s THR 69 CO 0.66 -0.88 1.02 -2.84 -0.69 0.00 0.00 174.62 171.89 1ja7 s PRO 70 N 0.22 3.81 0.00 4.92 0.02 -1.26 -3.07 135.00 139.63 1ja7 s PRO 70 Ca 0.15 1.27 0.00 0.00 0.02 0.00 0.00 61.00 62.45 1ja7 s PRO 70 Cb -0.19 -2.10 0.00 0.00 0.02 0.00 0.00 34.50 32.23 1ja7 s PRO 70 CO -0.04 -0.41 0.00 0.41 -0.33 0.00 0.00 177.00 176.62 1ja7 n GLY 71 N -0.51 0.57 3.76 0.52 0.00 -1.26 -4.96 105.19 103.32 1ja7 n GLY 71 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 1ja7 n GLY 71 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ja7 s SER 72 N -2.38 7.03 -0.02 1.61 0.15 -1.17 -4.94 113.70 113.97 1ja7 s SER 72 Ca 0.00 2.47 -0.26 0.00 0.70 0.00 0.00 55.95 58.86 1ja7 s SER 72 Cb 0.00 -2.64 -0.20 0.00 -1.71 0.00 0.00 66.02 61.47 1ja7 s SER 72 CO 0.00 -0.34 1.26 0.03 1.20 0.00 0.00 173.24 175.39 1ja7 h ARG 73 N 3.68 0.01 -5.47 5.44 3.08 -1.67 -3.48 114.38 115.98 1ja7 h ARG 73 Ca -0.48 -0.00 -0.27 0.00 0.07 0.00 0.00 59.98 59.30 1ja7 h ARG 73 Cb 1.22 0.00 0.19 0.00 0.08 0.00 0.00 29.97 31.46 1ja7 h ARG 73 CO 0.67 0.51 -0.82 -1.71 -1.07 0.00 0.00 179.97 177.55 1ja7 n ASN 74 N -4.84 -5.05 0.09 7.04 5.15 -1.05 -4.92 115.26 111.68 1ja7 n ASN 74 Ca -0.08 -0.67 -0.06 0.00 -0.60 0.00 0.00 54.58 53.17 1ja7 n ASN 74 Cb 0.26 -5.11 0.03 0.00 -0.53 0.00 0.00 39.78 34.43 1ja7 n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1ja7 h LEU 75 N -1.33 0.14 -1.66 1.20 3.38 -1.67 -3.18 115.31 112.19 1ja7 h LEU 75 Ca -0.59 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.23 1ja7 h LEU 75 Cb 1.31 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.02 1ja7 h LEU 75 CO 0.45 0.89 -0.19 0.00 0.09 0.00 0.00 178.44 179.68 1ja7 n ASN 77 N -4.15 -4.27 -3.80 0.00 3.02 -1.21 -4.98 115.26 99.87 1ja7 n ASN 77 Ca -0.02 -0.66 -0.13 0.00 -0.03 0.00 0.00 54.58 53.75 1ja7 n ASN 77 Cb 0.26 -4.65 -0.13 0.00 -0.61 0.00 0.00 39.78 34.66 1ja7 n ASN 77 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1ja7 s ILE 78 N -3.38 -0.01 0.31 2.41 1.01 -1.26 -5.11 121.20 115.17 1ja7 s ILE 78 Ca 0.39 0.04 -0.29 0.00 0.00 0.00 0.00 60.65 60.78 1ja7 s ILE 78 Cb -0.18 -0.24 -0.11 0.00 0.01 0.00 0.00 42.46 41.95 1ja7 s ILE 78 CO 0.77 0.02 1.47 -2.16 0.00 0.00 0.00 174.94 175.03 1ja7 s PRO 79 N 0.33 4.21 0.33 2.79 0.04 -1.26 -3.85 135.00 137.59 1ja7 s PRO 79 Ca -0.02 2.42 0.07 0.00 0.04 0.00 0.00 61.00 63.51 1ja7 s PRO 79 Cb -0.03 -3.05 0.77 0.00 0.04 0.00 0.00 34.50 32.23 1ja7 s PRO 79 CO -0.01 -0.46 1.84 0.00 0.04 0.00 0.00 177.00 178.41 1ja7 n SER 81 N -4.61 0.00 -0.02 0.00 3.41 -1.26 -2.49 113.62 108.65 1ja7 n SER 81 Ca 0.19 -0.48 0.16 0.00 -0.26 0.00 0.00 58.87 58.48 1ja7 n SER 81 Cb 0.49 -0.06 0.91 0.00 -0.26 0.00 0.00 64.21 65.29 1ja7 n SER 81 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ja7 n ALA 82 N -1.06 2.68 -0.07 7.33 0.00 0.18 -3.96 120.51 125.61 1ja7 n ALA 82 Ca 0.14 -0.21 -0.12 0.00 0.00 0.00 0.00 53.44 53.25 1ja7 n ALA 82 Cb 0.09 -1.49 -0.04 0.00 0.00 0.00 0.00 19.45 18.00 1ja7 n ALA 82 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ja7 n LEU 83 N -0.94 1.61 -0.27 0.00 4.77 -1.04 -4.73 117.00 116.39 1ja7 n LEU 83 Ca 0.23 0.27 0.33 0.00 -0.03 0.00 0.00 56.01 56.81 1ja7 n LEU 83 Cb 0.12 -0.62 0.68 0.00 -2.33 0.00 0.00 43.42 41.27 1ja7 n LEU 83 CO 0.18 -0.08 1.31 -0.07 -1.33 0.00 0.00 177.39 177.39 1ja7 h LEU 84 N -0.73 0.00-10.24 2.23 3.38 -1.75 -3.41 115.31 104.79 1ja7 h LEU 84 Ca -0.20 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.30 1ja7 h LEU 84 Cb 1.01 0.00 0.19 0.00 0.09 0.00 0.00 40.66 41.94 1ja7 h LEU 84 CO -0.12 0.00 0.14 -0.55 0.09 0.00 0.00 178.44 178.00 1ja7 s SER 85 N -4.47 2.25 0.44 -0.43 0.15 -1.26 -4.38 113.70 106.00 1ja7 s SER 85 Ca -0.04 1.65 0.17 0.00 0.70 0.00 0.00 55.95 58.43 1ja7 s SER 85 Cb 0.20 -2.31 1.09 0.00 -1.71 0.00 0.00 66.02 63.29 1ja7 s SER 85 CO 0.67 -3.43 1.92 0.77 1.20 0.00 0.00 173.24 174.37 1ja7 h SER 86 N -2.10 0.35 -3.78 5.45 4.64 -1.99 -3.37 113.55 112.75 1ja7 h SER 86 Ca -0.53 0.02 -0.63 0.00 -0.47 0.00 0.00 61.79 60.17 1ja7 h SER 86 Cb 1.30 -0.05 -0.16 0.00 -0.31 0.00 0.00 62.40 63.19 1ja7 h SER 86 CO 0.50 0.18 -0.33 -0.62 -0.87 0.00 0.00 176.83 175.68 1ja7 s ASP 87 N -5.96 6.17 -0.17 4.97 2.15 -1.26 -4.90 116.67 117.66 1ja7 s ASP 87 Ca -0.08 0.16 0.16 0.00 0.43 0.00 0.00 52.55 53.22 1ja7 s ASP 87 Cb 0.21 -2.18 0.59 0.00 -0.30 0.00 0.00 42.92 41.24 1ja7 s ASP 87 CO 0.76 -0.15 1.49 2.30 -0.17 0.00 0.00 175.17 179.41 1ja7 n ILE 88 N 5.10 2.24 -0.30 4.11 -6.64 -1.26 -4.74 119.36 117.88 1ja7 n ILE 88 Ca -0.10 -1.65 0.35 0.00 -1.77 0.00 0.00 62.75 59.57 1ja7 n ILE 88 Cb 0.51 -0.16 0.71 0.00 -1.44 0.00 0.00 39.64 39.26 1ja7 n ILE 88 CO 0.00 0.00 0.00 0.74 -1.77 0.00 0.00 176.55 175.52 1ja7 h THR 89 N 2.46 0.27 0.00 7.28 2.02 -1.94 -1.62 112.91 121.39 1ja7 h THR 89 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 1ja7 h THR 89 Cb 1.50 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 68.23 1ja7 h THR 89 CO 0.26 0.00 -0.91 0.00 0.37 0.00 0.00 175.52 175.24 1ja7 n ALA 90 N -2.64 2.68 -0.03 6.16 0.00 -1.26 -4.69 120.51 120.73 1ja7 n ALA 90 Ca 0.25 -0.22 0.24 0.00 0.00 0.00 0.00 53.44 53.71 1ja7 n ALA 90 Cb 1.31 -0.30 0.66 0.00 0.00 0.00 0.00 19.45 21.12 1ja7 n ALA 90 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1ja7 h SER 91 N 0.00 0.00 0.80 0.00 0.02 -1.58 -1.14 113.55 111.65 1ja7 h SER 91 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ja7 h SER 91 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 1ja7 h SER 91 CO 0.00 0.00 -0.58 0.52 -1.14 0.00 0.00 176.83 175.63 1ja7 n VAL 92 N -3.58 0.27 0.27 2.27 0.31 -1.26 -3.95 118.33 112.66 1ja7 n VAL 92 Ca 0.13 -0.21 0.16 0.00 -0.01 0.00 0.00 64.34 64.42 1ja7 n VAL 92 Cb 0.94 -0.07 0.90 0.00 -0.91 0.00 0.00 33.84 34.70 1ja7 n VAL 92 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 1ja7 h ASN 93 N 0.00 0.00 0.09 4.52 -0.26 -1.54 0.35 115.58 118.74 1ja7 h ASN 93 Ca 0.00 0.00 -0.18 0.00 -0.56 0.00 0.00 56.30 55.56 1ja7 h ASN 93 Cb 0.69 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.95 1ja7 h ASN 93 CO 0.00 0.00 -0.89 0.00 -1.06 0.00 0.00 177.43 175.48 1ja7 h ALA 95 N -0.03 1.29 0.00 0.00 0.00 -1.51 0.40 119.26 119.42 1ja7 h ALA 95 Ca -0.18 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1ja7 h ALA 95 Cb 1.53 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1ja7 h ALA 95 CO 0.06 0.20 0.00 0.87 0.00 0.00 0.00 179.25 180.39 1ja7 h LYS 96 N 0.00 0.00 0.00 0.00 1.57 -0.43 -3.10 116.57 114.61 1ja7 h LYS 96 Ca -0.00 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.52 1ja7 h LYS 96 Cb 0.42 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.68 1ja7 h LYS 96 CO 0.02 0.00 -1.97 1.63 -0.57 0.00 0.00 179.45 178.57 1ja7 n LYS 97 N -2.70 1.32 0.22 3.15 5.02 0.50 -4.55 118.16 121.12 1ja7 n LYS 97 Ca 0.01 0.03 0.11 0.00 -2.02 0.00 0.00 58.31 56.45 1ja7 n LYS 97 Cb 0.28 -1.35 0.60 0.00 -0.02 0.00 0.00 35.03 34.54 1ja7 n LYS 97 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1ja7 h ILE 98 N 0.00 0.00 0.08 -0.18 2.04 -0.28 0.71 117.51 119.89 1ja7 h ILE 98 Ca -0.38 0.00 -0.32 0.00 1.00 0.00 0.00 64.86 65.16 1ja7 h ILE 98 Cb 1.77 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 38.32 1ja7 h ILE 98 CO -0.01 0.00 -1.76 0.58 0.00 0.00 0.00 178.15 176.96 1ja7 h VAL 99 N 0.00 0.86 0.00 1.67 2.07 -1.80 -3.33 116.25 115.71 1ja7 h VAL 99 Ca 0.00 -2.60 0.00 0.00 0.82 0.00 0.00 66.70 64.92 1ja7 h VAL 99 Cb 0.38 2.56 0.00 0.00 -1.52 0.00 0.00 31.29 32.70 1ja7 h VAL 99 CO 0.00 0.75 0.00 -0.24 0.02 0.00 0.00 177.57 178.10 1ja7 n SER 100 N -3.34 0.17 0.25 0.57 2.88 0.24 -1.54 113.62 112.85 1ja7 n SER 100 Ca -0.22 0.56 0.17 0.00 -1.33 0.00 0.00 58.87 58.05 1ja7 n SER 100 Cb 1.05 -0.59 0.79 0.00 -0.75 0.00 0.00 64.21 64.70 1ja7 n SER 100 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 1ja7 h ASP 101 N 0.00 0.00 0.00 -3.46 3.58 -1.66 -3.44 116.42 111.44 1ja7 h ASP 101 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 1ja7 h ASP 101 Cb 0.11 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.16 1ja7 h ASP 101 CO 0.00 0.00 0.00 0.61 -2.88 0.00 0.00 179.24 176.97 1ja7 n GLY 102 N -1.32 0.75 0.06 -0.78 0.00 -0.59 -4.83 105.19 98.48 1ja7 n GLY 102 Ca 0.01 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.98 1ja7 n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ja7 n ASN 103 N 0.00 2.01 0.00 1.61 3.02 -1.24 -5.04 115.26 115.61 1ja7 n ASN 103 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1ja7 n ASN 103 Cb 0.00 0.85 0.00 0.00 -0.61 0.00 0.00 39.78 40.02 1ja7 n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ja7 n GLY 104 N 2.22 3.15 0.00 7.41 0.00 -0.94 -0.62 105.19 116.41 1ja7 n GLY 104 Ca -0.19 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1ja7 n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1ja7 n MET 105 N 14.00 0.00 0.24 1.61 2.81 -1.26 -2.55 117.12 131.97 1ja7 n MET 105 Ca 0.00 0.31 0.16 0.00 -1.81 0.00 0.00 57.70 56.37 1ja7 n MET 105 Cb 0.00 -1.57 0.73 0.00 -0.71 0.00 0.00 33.22 31.68 1ja7 n MET 105 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 1ja7 h ASN 106 N 0.00 0.00 0.06 7.83 2.35 -1.24 0.43 115.58 125.01 1ja7 h ASN 106 Ca 0.00 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.56 1ja7 h ASN 106 Cb 0.14 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.53 1ja7 h ASN 106 CO 0.00 0.00 -0.79 0.00 -1.65 0.00 0.00 177.43 174.99 1ja7 h ALA 107 N 1.29 0.01 -2.52 -0.83 0.00 -1.74 -3.44 119.26 112.03 1ja7 h ALA 107 Ca 0.08 -0.65 -0.53 0.00 0.00 0.00 0.00 54.91 53.82 1ja7 h ALA 107 Cb 0.95 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1ja7 h ALA 107 CO -0.00 0.43 0.39 -1.58 0.00 0.00 0.00 179.25 178.49 1ja7 s TRP 108 N -2.95 3.71 -0.18 0.00 0.51 0.15 -4.95 118.94 115.23 1ja7 s TRP 108 Ca -0.13 1.70 -0.12 0.00 -2.12 0.00 0.00 56.10 55.44 1ja7 s TRP 108 Cb 0.03 -3.13 -0.22 0.00 -0.81 0.00 0.00 33.47 29.34 1ja7 s TRP 108 CO 0.85 -0.08 0.20 1.55 -0.51 0.00 0.00 176.95 178.95 1ja7 n VAL 109 N 3.18 1.65 -0.01 4.03 3.14 -1.26 -4.34 118.33 124.71 1ja7 n VAL 109 Ca 0.04 -0.40 -0.09 0.00 -2.96 0.00 0.00 64.34 60.92 1ja7 n VAL 109 Cb 0.49 -1.83 -0.04 0.00 -1.06 0.00 0.00 33.84 31.41 1ja7 n VAL 109 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1ja7 h ALA 110 N -0.23 0.07 -0.22 1.55 0.00 -1.93 -2.97 119.26 115.54 1ja7 h ALA 110 Ca -0.44 0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.58 1ja7 h ALA 110 Cb 1.73 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 19.60 1ja7 h ALA 110 CO -0.08 -0.50 -0.15 2.35 0.00 0.00 0.00 179.25 180.88 1ja7 h TRP 111 N -0.03 -0.36 -0.38 0.00 7.01 -1.91 0.57 115.95 120.85 1ja7 h TRP 111 Ca 0.07 0.03 0.11 0.00 2.11 0.00 0.00 58.89 61.21 1ja7 h TRP 111 Cb 0.14 0.19 -0.02 0.00 -2.10 0.00 0.00 29.16 27.38 1ja7 h TRP 111 CO -0.19 -0.21 0.59 -0.09 -2.79 0.00 0.00 178.44 175.74 1ja7 h ARG 112 N -0.14 0.00 0.00 2.65 2.43 -1.71 0.67 114.38 118.28 1ja7 h ARG 112 Ca 0.13 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.21 1ja7 h ARG 112 Cb 0.33 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 1ja7 h ARG 112 CO -0.31 0.00 -1.32 0.09 -1.51 0.00 0.00 179.97 176.93 1ja7 n ASN 113 N -3.32 2.15 0.04 -3.80 3.02 -0.74 -4.33 115.26 108.27 1ja7 n ASN 113 Ca 0.07 0.02 -0.07 0.00 -0.03 0.00 0.00 54.58 54.57 1ja7 n ASN 113 Cb 0.74 -0.12 -0.12 0.00 -0.61 0.00 0.00 39.78 39.67 1ja7 n ASN 113 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1ja7 h ARG 114 N -0.09 0.00 -0.01 3.52 3.08 0.40 -3.35 114.38 117.92 1ja7 h ARG 114 Ca -0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.92 1ja7 h ARG 114 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.21 1ja7 h ARG 114 CO -0.05 0.79 -0.01 0.00 -1.07 0.00 0.00 179.97 179.63 1ja7 s LYS 116 N -0.77 4.26 -0.72 0.00 2.20 0.16 -3.70 119.74 121.18 1ja7 s LYS 116 Ca 0.10 0.53 0.00 0.00 -0.36 0.00 0.00 55.97 56.24 1ja7 s LYS 116 Cb 0.07 -3.37 0.00 0.00 -1.51 0.00 0.00 37.83 33.03 1ja7 s LYS 116 CO 0.12 0.32 0.00 0.41 -0.36 0.00 0.00 175.35 175.84 1ja7 n GLY 117 N 2.75 0.83 4.01 5.54 0.00 -1.26 -4.82 105.19 112.23 1ja7 n GLY 117 Ca -0.08 -0.72 -0.22 0.00 0.00 0.00 0.00 46.02 45.00 1ja7 n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ja7 s THR 118 N -2.26 1.90 -1.04 2.61 -4.23 -1.24 -5.03 115.64 106.34 1ja7 s THR 118 Ca 0.00 -1.12 -0.02 0.00 -1.18 0.00 0.00 61.69 59.37 1ja7 s THR 118 Cb 0.00 -2.02 0.32 0.00 1.34 0.00 0.00 72.50 72.14 1ja7 s THR 118 CO 0.00 0.00 1.66 -0.67 -0.54 0.00 0.00 174.62 175.07 1ja7 n ASP 119 N -2.18 6.88 -0.32 3.99 -0.08 -1.26 -4.90 116.55 118.68 1ja7 n ASP 119 Ca 0.12 -3.58 0.08 0.00 -1.51 0.00 0.00 54.79 49.91 1ja7 n ASP 119 Cb 0.63 -1.19 0.24 0.00 2.34 0.00 0.00 41.12 43.14 1ja7 n ASP 119 CO 0.00 0.00 0.00 -0.37 0.12 0.00 0.00 177.20 176.95 1ja7 h VAL 120 N 2.74 0.76 0.00 5.18 -1.51 -1.88 0.19 116.25 121.73 1ja7 h VAL 120 Ca 0.39 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 65.61 1ja7 h VAL 120 Cb 0.45 -0.01 0.00 0.00 -2.13 0.00 0.00 31.29 29.60 1ja7 h VAL 120 CO 1.23 0.13 0.00 0.00 -1.23 0.00 0.00 177.57 177.70 1ja7 n GLN 121 N -4.81 0.09 0.00 5.19 0.00 -1.26 -0.92 117.38 115.67 1ja7 n GLN 121 Ca 0.18 0.47 0.08 0.00 0.00 0.00 0.00 57.00 57.73 1ja7 n GLN 121 Cb 0.44 -1.74 0.37 0.00 0.00 0.00 0.00 30.24 29.31 1ja7 n GLN 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ja7 n ALA 122 N -1.66 1.80 -0.11 2.61 0.00 0.68 -1.26 120.51 122.58 1ja7 n ALA 122 Ca 0.01 -0.06 -0.18 0.00 0.00 0.00 0.00 53.44 53.20 1ja7 n ALA 122 Cb 0.10 -1.26 -0.12 0.00 0.00 0.00 0.00 19.45 18.17 1ja7 n ALA 122 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 1ja7 n TRP 123 N -1.39 0.17 1.27 0.00 7.02 -0.10 -4.36 117.44 120.05 1ja7 n TRP 123 Ca 0.06 0.04 0.14 0.00 -1.02 0.00 0.00 57.50 56.71 1ja7 n TRP 123 Cb 0.15 -1.02 0.60 0.00 -2.42 0.00 0.00 31.31 28.63 1ja7 n TRP 123 CO 0.00 0.00 0.00 0.44 -2.02 0.00 0.00 177.69 176.11 1ja7 n ILE 124 N -3.28 0.00 -2.49 -0.99 -5.35 -1.07 -4.89 119.36 101.28 1ja7 n ILE 124 Ca -0.44 -0.03 -0.33 0.00 -0.27 0.00 0.00 62.75 61.68 1ja7 n ILE 124 Cb 1.00 -0.24 -0.03 0.00 -1.74 0.00 0.00 39.64 38.63 1ja7 n ILE 124 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1ja7 s ARG 125 N -2.68 3.82 0.00 6.28 3.52 -0.39 -3.85 118.95 125.66 1ja7 s ARG 125 Ca 0.23 1.22 0.00 0.00 -0.13 0.00 0.00 55.73 57.06 1ja7 s ARG 125 Cb 0.20 -2.11 0.00 0.00 -1.56 0.00 0.00 34.95 31.48 1ja7 s ARG 125 CO 0.51 -0.39 0.00 0.41 -0.81 0.00 0.00 175.30 175.02 1ja7 n GLY 126 N -0.65 1.87 3.55 8.12 0.00 -1.26 -5.01 105.19 111.81 1ja7 n GLY 126 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 1ja7 n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ja7 s ARG 128 N -1.18 4.36 0.00 0.00 3.52 -1.26 -5.11 118.95 119.28 1ja7 s ARG 128 Ca 0.15 0.90 0.00 0.00 -0.13 0.00 0.00 55.73 56.65 1ja7 s ARG 128 Cb -0.11 -3.51 0.00 0.00 -1.56 0.00 0.00 34.95 29.77 1ja7 s ARG 128 CO 0.05 -0.12 0.00 1.28 -0.81 0.00 0.00 175.30 175.69