#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mx7 s VAL 2 N 0.00 4.94 -0.16 -1.45 0.11 -1.26 -5.04 120.40 117.54 1mx7 s VAL 2 Ca 0.00 1.48 -0.01 0.00 -2.93 0.00 0.00 61.98 60.52 1mx7 s VAL 2 Cb 0.00 -4.07 0.04 0.00 -1.53 0.00 0.00 36.38 30.82 1mx7 s VAL 2 CO 0.00 0.07 -0.02 -1.81 -3.33 0.00 0.00 175.10 170.01 1mx7 s ASP 3 N 1.14 2.67 0.32 3.54 1.01 -1.26 -5.02 116.67 119.08 1mx7 s ASP 3 Ca 0.35 -0.62 0.21 0.00 0.71 0.00 0.00 52.55 53.20 1mx7 s ASP 3 Cb -0.16 -0.77 1.13 0.00 1.01 0.00 0.00 42.92 44.12 1mx7 s ASP 3 CO 0.12 -0.21 1.62 0.49 0.21 0.00 0.00 175.17 177.40 1mx7 n PHE 4 N 4.95 0.70 -1.69 4.23 3.72 -1.26 -4.73 117.46 123.39 1mx7 n PHE 4 Ca -0.10 0.37 -0.43 0.00 -0.05 0.00 0.00 57.45 57.24 1mx7 n PHE 4 Cb 0.48 -1.06 -0.03 0.00 -0.94 0.00 0.00 39.48 37.92 1mx7 n PHE 4 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1mx7 n ASN 5 N -2.24 4.02 0.00 4.37 5.15 -1.26 -4.78 115.26 120.52 1mx7 n ASN 5 Ca -0.01 0.98 0.00 0.00 -0.60 0.00 0.00 54.58 54.95 1mx7 n ASN 5 Cb 0.07 -1.54 0.00 0.00 -0.53 0.00 0.00 39.78 37.78 1mx7 n ASN 5 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1mx7 n GLY 6 N 4.24 0.93 3.67 8.20 0.00 -1.24 -5.01 105.19 115.98 1mx7 n GLY 6 Ca 0.18 0.25 -0.06 0.00 0.00 0.00 0.00 46.02 46.39 1mx7 n GLY 6 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mx7 s TYR 7 N 1.54 -0.22 0.13 1.61 2.02 -1.26 -4.85 117.35 116.32 1mx7 s TYR 7 Ca 0.00 -0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.67 1mx7 s TYR 7 Cb 0.00 0.61 -0.00 0.00 -0.40 0.00 0.00 41.96 42.16 1mx7 s TYR 7 CO 0.00 -0.76 0.15 -2.67 -1.57 0.00 0.00 175.55 170.70 1mx7 n TRP 8 N -0.40 -0.56 0.00 2.71 2.14 -1.26 -3.43 117.44 116.64 1mx7 n TRP 8 Ca -0.07 -0.99 0.00 0.00 2.07 0.00 0.00 57.50 58.51 1mx7 n TRP 8 Cb 0.61 0.16 0.00 0.00 -0.81 0.00 0.00 31.31 31.27 1mx7 n TRP 8 CO 0.00 0.00 0.00 0.36 2.07 0.00 0.00 177.69 180.12 1mx7 n LYS 9 N -0.23 0.00 0.00 -2.67 2.85 -1.22 -4.62 118.16 112.27 1mx7 n LYS 9 Ca 0.02 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.28 1mx7 n LYS 9 Cb 0.23 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.61 1mx7 n LYS 9 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1mx7 n MET 10 N 0.00 0.00 0.00 -1.58 -0.00 -1.26 -4.03 117.12 110.25 1mx7 n MET 10 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 1mx7 n MET 10 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 33.22 33.22 1mx7 n MET 10 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 1mx7 n LEU 11 N 0.00 0.00 -3.47 3.17 0.00 -1.26 -2.47 117.00 112.97 1mx7 n LEU 11 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 56.01 55.91 1mx7 n LEU 11 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 43.42 43.40 1mx7 n LEU 11 CO 0.00 0.00 0.55 -0.44 0.00 0.00 0.00 177.39 177.50 1mx7 s SER 12 N 0.00 -0.47 0.20 1.96 0.01 -1.26 -5.01 113.70 109.13 1mx7 s SER 12 Ca 0.00 0.04 -0.20 0.00 1.31 0.00 0.00 55.95 57.11 1mx7 s SER 12 Cb 0.00 0.49 0.04 0.00 0.21 0.00 0.00 66.02 66.75 1mx7 s SER 12 CO 0.00 -0.77 0.58 0.54 0.41 0.00 0.00 173.24 174.00 1mx7 s ASN 13 N -2.51 -0.35 0.31 2.44 4.22 -1.26 -0.50 114.94 117.30 1mx7 s ASN 13 Ca 0.02 -0.36 0.03 0.00 -2.14 0.00 0.00 52.86 50.41 1mx7 s ASN 13 Cb -0.01 0.61 -0.01 0.00 1.28 0.00 0.00 41.25 43.12 1mx7 s ASN 13 CO -0.10 -1.08 0.36 -0.62 -2.04 0.00 0.00 177.10 173.62 1mx7 n GLU 14 N -0.37 0.51 -2.94 3.55 1.02 -0.90 -4.96 120.64 116.56 1mx7 n GLU 14 Ca -0.11 -2.82 -0.15 0.00 -0.02 0.00 0.00 57.16 54.05 1mx7 n GLU 14 Cb 0.63 2.51 -0.04 0.00 -0.02 0.00 0.00 31.44 34.52 1mx7 n GLU 14 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1mx7 n ASN 15 N -1.73 -0.27 -0.04 1.62 3.02 -1.26 -4.16 115.26 112.43 1mx7 n ASN 15 Ca 0.04 -0.51 -0.14 0.00 -0.03 0.00 0.00 54.58 53.93 1mx7 n ASN 15 Cb 0.55 -0.65 -0.08 0.00 -0.61 0.00 0.00 39.78 38.99 1mx7 n ASN 15 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1mx7 h PHE 16 N -0.26 0.47 0.00 3.10 3.57 -1.93 -1.76 116.94 120.12 1mx7 h PHE 16 Ca -0.25 -0.18 -0.05 0.00 3.53 0.00 0.00 57.97 61.02 1mx7 h PHE 16 Cb 0.56 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 1mx7 h PHE 16 CO 0.26 0.88 -0.23 1.05 -2.23 0.00 0.00 178.31 178.04 1mx7 h GLU 17 N -0.09 0.00 0.00 1.11 4.11 -1.90 -2.81 114.58 115.00 1mx7 h GLU 17 Ca -0.01 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.30 1mx7 h GLU 17 Cb 0.88 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 1mx7 h GLU 17 CO 0.06 0.23 -0.58 1.49 0.07 0.00 0.00 179.01 180.27 1mx7 h GLU 18 N 0.00 0.00 0.03 1.06 4.81 -1.93 -2.40 114.58 116.16 1mx7 h GLU 18 Ca -0.00 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.01 1mx7 h GLU 18 Cb 1.10 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.47 1mx7 h GLU 18 CO 0.03 0.58 -0.98 -0.92 -0.73 0.00 0.00 179.01 176.99 1mx7 h TYR 19 N 0.00 0.38 -0.04 0.92 3.20 -1.09 -3.06 116.97 117.27 1mx7 h TYR 19 Ca -0.01 -0.23 -0.12 0.00 3.14 0.00 0.00 58.73 61.52 1mx7 h TYR 19 Cb 1.28 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.50 1mx7 h TYR 19 CO 0.00 1.08 -0.52 -0.07 -1.64 0.00 0.00 178.16 177.01 1mx7 h LEU 20 N 0.12 0.13 -0.74 2.82 3.38 -1.39 -2.89 115.31 116.74 1mx7 h LEU 20 Ca -0.07 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 1mx7 h LEU 20 Cb 1.65 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.35 1mx7 h LEU 20 CO 0.16 0.63 -0.20 -0.09 0.09 0.00 0.00 178.44 179.02 1mx7 h ARG 21 N 0.09 0.00 -0.04 1.13 1.12 -1.44 -2.57 114.38 112.66 1mx7 h ARG 21 Ca 0.00 0.00 -0.12 0.00 -1.11 0.00 0.00 59.98 58.75 1mx7 h ARG 21 Cb 0.95 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.90 1mx7 h ARG 21 CO 0.07 0.20 -0.54 0.00 -3.11 0.00 0.00 179.97 176.59 1mx7 h ALA 22 N 1.80 1.02 0.00 2.80 0.00 -1.40 -3.01 119.26 120.46 1mx7 h ALA 22 Ca -0.00 -0.50 -0.04 0.00 0.00 0.00 0.00 54.91 54.37 1mx7 h ALA 22 Cb 0.88 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 1mx7 h ALA 22 CO 0.03 0.68 -1.31 1.28 0.00 0.00 0.00 179.25 179.93 1mx7 n LEU 23 N -3.91 0.67 -1.34 0.00 4.77 -1.20 -4.77 117.00 111.22 1mx7 n LEU 23 Ca -0.02 0.27 -0.03 0.00 -0.03 0.00 0.00 56.01 56.20 1mx7 n LEU 23 Cb 0.56 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 41.66 1mx7 n LEU 23 CO 0.42 -0.07 0.02 -0.67 -1.33 0.00 0.00 177.39 175.76 1mx7 n ASP 24 N -2.64 -2.05 -3.79 -1.43 2.03 -0.98 -5.08 116.55 102.61 1mx7 n ASP 24 Ca -0.04 -0.09 -0.28 0.00 0.52 0.00 0.00 54.79 54.91 1mx7 n ASP 24 Cb 0.63 -1.20 0.19 0.00 -0.72 0.00 0.00 41.12 40.02 1mx7 n ASP 24 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1mx7 n VAL 25 N -1.56 0.00 -1.18 5.18 0.24 -1.17 -5.01 118.33 114.84 1mx7 n VAL 25 Ca -0.04 -0.93 -0.34 0.00 -2.04 0.00 0.00 64.34 61.00 1mx7 n VAL 25 Cb 0.52 -1.53 0.12 0.00 -1.47 0.00 0.00 33.84 31.48 1mx7 n VAL 25 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1mx7 s ASN 26 N -5.56 3.70 0.31 -1.34 -0.87 -1.26 -4.94 114.94 104.98 1mx7 s ASN 26 Ca 0.71 2.38 0.16 0.00 -1.57 0.00 0.00 52.86 54.54 1mx7 s ASN 26 Cb -0.02 -2.59 0.36 0.00 -0.02 0.00 0.00 41.25 38.98 1mx7 s ASN 26 CO 0.50 -2.60 1.58 -0.37 -2.57 0.00 0.00 177.10 173.64 1mx7 h VAL 27 N -0.77 0.96 0.00 1.60 -1.51 -2.00 -3.18 116.25 111.35 1mx7 h VAL 27 Ca -0.47 -1.97 -0.10 0.00 -1.23 0.00 0.00 66.70 62.93 1mx7 h VAL 27 Cb 1.30 2.21 -0.01 0.00 -2.13 0.00 0.00 31.29 32.65 1mx7 h VAL 27 CO 0.47 0.47 -0.46 0.00 -1.23 0.00 0.00 177.57 176.82 1mx7 h ALA 28 N 1.52 0.77 -0.03 5.19 0.00 -2.01 -3.19 119.26 121.51 1mx7 h ALA 28 Ca -0.00 -0.42 -0.14 0.00 0.00 0.00 0.00 54.91 54.35 1mx7 h ALA 28 Cb 1.17 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1mx7 h ALA 28 CO 0.06 0.58 -0.62 1.25 0.00 0.00 0.00 179.25 180.51 1mx7 h LEU 29 N 0.00 0.11 -0.94 0.00 6.46 -1.93 -2.78 115.31 116.23 1mx7 h LEU 29 Ca -0.00 -0.07 -0.10 0.00 -0.12 0.00 0.00 57.88 57.58 1mx7 h LEU 29 Cb 1.23 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 41.12 1mx7 h LEU 29 CO 0.06 0.71 -0.36 -0.09 -0.62 0.00 0.00 178.44 178.14 1mx7 h ARG 30 N 0.07 0.33 -0.09 1.25 2.43 -1.63 -1.74 114.38 114.99 1mx7 h ARG 30 Ca -0.01 -0.15 -0.23 0.00 -0.81 0.00 0.00 59.98 58.78 1mx7 h ARG 30 Cb 1.12 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.67 1mx7 h ARG 30 CO 0.09 0.65 -0.86 -0.22 -1.51 0.00 0.00 179.97 178.12 1mx7 h LYS 31 N 0.28 0.75 0.08 0.20 3.64 -1.54 -2.88 116.57 117.10 1mx7 h LYS 31 Ca 0.03 -0.68 -0.00 0.00 -1.27 0.00 0.00 60.65 58.73 1mx7 h LYS 31 Cb 0.77 0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.75 1mx7 h LYS 31 CO 0.06 1.27 -0.04 0.82 -2.27 0.00 0.00 179.45 179.29 1mx7 h ILE 32 N 0.46 1.15 -0.07 2.00 2.04 -1.42 -3.26 117.51 118.39 1mx7 h ILE 32 Ca -0.08 -1.36 0.02 0.00 1.00 0.00 0.00 64.86 64.44 1mx7 h ILE 32 Cb 1.50 1.95 -0.00 0.00 -0.74 0.00 0.00 36.82 39.53 1mx7 h ILE 32 CO 0.17 0.31 0.21 0.00 0.00 0.00 0.00 178.15 178.84 1mx7 h ALA 33 N -0.05 1.41 -0.13 1.87 0.00 -1.45 -2.48 119.26 118.43 1mx7 h ALA 33 Ca -0.01 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1mx7 h ALA 33 Cb 0.59 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1mx7 h ALA 33 CO 0.02 -0.25 -0.02 -0.97 0.00 0.00 0.00 179.25 178.03 1mx7 h ASN 34 N 0.00 0.25 0.16 0.00 -0.73 -1.55 -2.97 115.58 110.75 1mx7 h ASN 34 Ca 0.03 -0.34 0.00 0.00 1.87 0.00 0.00 56.30 57.86 1mx7 h ASN 34 Cb 0.46 -0.07 0.00 0.00 0.27 0.00 0.00 38.32 38.98 1mx7 h ASN 34 CO -0.00 0.53 0.00 0.00 -0.37 0.00 0.00 177.43 177.59 1mx7 n LEU 35 N -4.74 0.00 -4.86 0.34 -0.00 -0.93 -4.79 117.00 102.01 1mx7 n LEU 35 Ca -0.06 0.13 -0.25 0.00 -0.00 0.00 0.00 56.01 55.83 1mx7 n LEU 35 Cb 0.23 -0.13 -0.04 0.00 -0.00 0.00 0.00 43.42 43.48 1mx7 n LEU 35 CO 0.36 -0.04 -0.16 -0.76 -0.00 0.00 0.00 177.39 176.78 1mx7 s LEU 36 N -2.25 4.00 -0.03 1.47 2.01 -1.12 -5.12 118.68 117.63 1mx7 s LEU 36 Ca 0.26 -0.05 -0.01 0.00 0.01 0.00 0.00 54.13 54.34 1mx7 s LEU 36 Cb 0.14 -2.58 0.03 0.00 0.01 0.00 0.00 46.19 43.79 1mx7 s LEU 36 CO 0.27 0.04 0.05 -0.54 1.01 0.00 0.00 176.35 177.17 1mx7 s LYS 37 N -3.31 -0.04 0.37 1.70 1.02 -1.26 -4.99 119.74 113.23 1mx7 s LYS 37 Ca 0.32 0.26 -0.12 0.00 0.02 0.00 0.00 55.97 56.46 1mx7 s LYS 37 Cb -0.10 -0.32 -0.07 0.00 -0.52 0.00 0.00 37.83 36.82 1mx7 s LYS 37 CO 0.25 -0.22 0.75 -2.14 -0.92 0.00 0.00 175.35 173.08 1mx7 s PRO 38 N 1.42 3.85 0.37 -1.68 0.02 -1.26 -4.84 135.00 132.88 1mx7 s PRO 38 Ca -0.05 0.52 0.08 0.00 0.02 0.00 0.00 61.00 61.57 1mx7 s PRO 38 Cb -0.13 -2.41 -0.05 0.00 0.02 0.00 0.00 34.50 31.93 1mx7 s PRO 38 CO -0.03 0.04 0.09 0.16 -0.33 0.00 0.00 177.00 176.93 1mx7 s ASP 39 N -2.86 4.35 -0.30 2.53 1.47 -1.26 -4.32 116.67 116.28 1mx7 s ASP 39 Ca 0.52 -0.99 0.01 0.00 1.18 0.00 0.00 52.55 53.27 1mx7 s ASP 39 Cb -0.10 -0.55 0.19 0.00 -0.34 0.00 0.00 42.92 42.12 1mx7 s ASP 39 CO 0.27 -0.36 0.64 -0.75 0.68 0.00 0.00 175.17 175.65 1mx7 s LYS 40 N -3.80 0.53 -0.08 2.11 2.20 -1.26 -3.50 119.74 115.94 1mx7 s LYS 40 Ca 0.37 0.72 -0.14 0.00 -0.36 0.00 0.00 55.97 56.57 1mx7 s LYS 40 Cb 0.01 0.38 -0.05 0.00 -1.51 0.00 0.00 37.83 36.66 1mx7 s LYS 40 CO 0.21 -0.78 0.35 -2.00 -0.36 0.00 0.00 175.35 172.77 1mx7 s GLU 41 N 2.86 4.02 0.14 4.03 2.12 -1.16 -4.38 118.70 126.33 1mx7 s GLU 41 Ca 0.15 0.26 0.11 0.00 0.36 0.00 0.00 54.97 55.84 1mx7 s GLU 41 Cb -0.12 -3.31 -0.04 0.00 0.26 0.00 0.00 34.13 30.92 1mx7 s GLU 41 CO -0.23 0.49 -0.26 0.42 -0.54 0.00 0.00 175.26 175.15 1mx7 s ILE 42 N -0.37 2.21 -0.05 -3.70 1.01 -1.26 -3.49 121.20 115.55 1mx7 s ILE 42 Ca 0.21 -1.78 -0.02 0.00 0.00 0.00 0.00 60.65 59.05 1mx7 s ILE 42 Cb -0.15 -1.97 0.04 0.00 0.01 0.00 0.00 42.46 40.39 1mx7 s ILE 42 CO 0.09 0.03 0.10 -0.69 0.00 0.00 0.00 174.94 174.47 1mx7 s VAL 43 N -1.19 -0.09 -0.27 2.92 1.01 -1.21 -3.65 120.40 117.91 1mx7 s VAL 43 Ca 0.14 0.25 -0.01 0.00 0.00 0.00 0.00 61.98 62.36 1mx7 s VAL 43 Cb -0.10 -0.18 0.09 0.00 0.00 0.00 0.00 36.38 36.19 1mx7 s VAL 43 CO 0.06 0.10 0.07 -1.58 0.00 0.00 0.00 175.10 173.76 1mx7 s GLN 44 N 1.44 0.74 -0.01 2.72 0.74 -1.26 -2.70 119.66 121.33 1mx7 s GLN 44 Ca -0.05 -0.86 -0.14 0.00 0.05 0.00 0.00 55.36 54.36 1mx7 s GLN 44 Cb -0.12 -2.02 -0.08 0.00 1.10 0.00 0.00 33.01 31.89 1mx7 s GLN 44 CO -0.05 -0.86 0.74 0.22 -0.55 0.00 0.00 175.29 174.79 1mx7 h ASP 45 N 8.14 -0.43 0.00 6.67 3.58 -2.01 -3.47 116.42 128.91 1mx7 h ASP 45 Ca -0.15 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.32 1mx7 h ASP 45 Cb 1.05 0.11 0.00 0.00 1.72 0.00 0.00 39.33 42.21 1mx7 h ASP 45 CO 0.43 -0.14 0.00 0.61 -2.88 0.00 0.00 179.24 177.26 1mx7 n GLY 46 N 0.10 -1.96 2.76 -0.78 0.00 -1.26 -4.98 105.19 99.06 1mx7 n GLY 46 Ca -0.06 0.58 -0.36 0.00 0.00 0.00 0.00 46.02 46.19 1mx7 n GLY 46 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1mx7 n ASP 47 N -1.08 6.45 -3.76 1.61 5.68 -1.26 -4.93 116.55 119.26 1mx7 n ASP 47 Ca 0.00 -3.76 -0.06 0.00 -0.50 0.00 0.00 54.79 50.47 1mx7 n ASP 47 Cb 0.00 -0.89 -0.02 0.00 -1.14 0.00 0.00 41.12 39.08 1mx7 n ASP 47 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 1mx7 s HIS 48 N -3.94 -0.20 -0.29 2.11 3.76 -1.26 -4.52 115.29 110.94 1mx7 s HIS 48 Ca 0.48 -0.15 0.01 0.00 -0.15 0.00 0.00 55.06 55.24 1mx7 s HIS 48 Cb 0.35 0.66 0.19 0.00 1.11 0.00 0.00 32.58 34.89 1mx7 s HIS 48 CO -0.26 -0.98 0.70 1.41 -0.85 0.00 0.00 174.74 174.76 1mx7 s MET 49 N -3.57 0.47 -0.59 1.40 1.75 -0.33 -4.30 119.30 114.13 1mx7 s MET 49 Ca 0.10 0.55 -0.19 0.00 -1.25 0.00 0.00 55.69 54.90 1mx7 s MET 49 Cb -0.03 0.27 0.10 0.00 2.84 0.00 0.00 34.83 38.01 1mx7 s MET 49 CO 0.02 -0.78 0.72 0.42 -0.65 0.00 0.00 175.02 174.76 1mx7 s ILE 50 N 2.87 4.77 -0.35 10.11 1.09 -1.10 -0.30 121.20 138.29 1mx7 s ILE 50 Ca 0.14 -0.88 -0.17 0.00 -1.10 0.00 0.00 60.65 58.65 1mx7 s ILE 50 Cb -0.10 -4.49 -0.01 0.00 -1.06 0.00 0.00 42.46 36.81 1mx7 s ILE 50 CO -0.24 -1.13 0.43 -0.63 -0.10 0.00 0.00 174.94 173.28 1mx7 s ILE 51 N 2.83 5.10 -0.16 2.92 -1.09 -1.06 -3.36 121.20 126.38 1mx7 s ILE 51 Ca 0.13 0.15 -0.00 0.00 -2.23 0.00 0.00 60.65 58.70 1mx7 s ILE 51 Cb -0.23 -3.90 -0.01 0.00 -1.58 0.00 0.00 42.46 36.75 1mx7 s ILE 51 CO 0.07 -0.17 -0.13 0.00 -1.23 0.00 0.00 174.94 173.49 1mx7 s ARG 52 N 2.19 3.29 -0.20 2.79 1.70 -1.23 -2.01 118.95 125.48 1mx7 s ARG 52 Ca 0.15 -0.71 -0.03 0.00 -0.47 0.00 0.00 55.73 54.67 1mx7 s ARG 52 Cb -0.16 -2.68 -0.01 0.00 -0.57 0.00 0.00 34.95 31.53 1mx7 s ARG 52 CO 0.12 0.04 -0.06 0.99 -1.08 0.00 0.00 175.30 175.32 1mx7 s THR 53 N 0.77 3.31 -1.56 4.99 2.01 -1.14 -2.97 115.64 121.06 1mx7 s THR 53 Ca -0.05 -0.52 0.15 0.00 0.31 0.00 0.00 61.69 61.58 1mx7 s THR 53 Cb -0.15 -2.49 0.52 0.00 0.01 0.00 0.00 72.50 70.39 1mx7 s THR 53 CO 0.01 0.44 1.41 0.18 -0.69 0.00 0.00 174.62 175.97 1mx7 n LEU 54 N 4.57 3.37 -4.71 4.42 4.77 -1.23 -3.53 117.00 124.66 1mx7 n LEU 54 Ca -0.18 -1.70 -0.42 0.00 -0.03 0.00 0.00 56.01 53.68 1mx7 n LEU 54 Cb 0.51 -0.44 -0.03 0.00 -2.33 0.00 0.00 43.42 41.13 1mx7 n LEU 54 CO 0.29 0.67 1.11 -0.94 -1.33 0.00 0.00 177.39 177.20 1mx7 s SER 55 N -0.88 6.77 0.49 -1.43 1.04 -1.26 -4.85 113.70 113.58 1mx7 s SER 55 Ca 0.38 2.36 -0.12 0.00 0.48 0.00 0.00 55.95 59.05 1mx7 s SER 55 Cb 0.22 -2.58 -0.06 0.00 0.10 0.00 0.00 66.02 63.70 1mx7 s SER 55 CO 0.21 -0.70 0.89 0.42 0.98 0.00 0.00 173.24 175.03 1mx7 s THR 56 N 1.37 4.72 0.00 2.02 -4.23 -1.26 0.77 115.64 119.02 1mx7 s THR 56 Ca 0.66 0.78 0.00 0.00 -1.18 0.00 0.00 61.69 61.95 1mx7 s THR 56 Cb -0.38 -3.78 0.00 0.00 1.34 0.00 0.00 72.50 69.69 1mx7 s THR 56 CO 0.30 -0.75 0.00 0.33 -0.54 0.00 0.00 174.62 173.96 1mx7 n PHE 57 N -1.82 0.00 0.02 3.99 -0.00 -1.26 -4.67 117.46 113.73 1mx7 n PHE 57 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.49 1mx7 n PHE 57 Cb 0.54 -0.03 0.00 0.00 -0.00 0.00 0.00 39.48 39.99 1mx7 n PHE 57 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 1mx7 n ARG 58 N -2.81 0.00 -1.15 -4.13 1.74 -1.23 -5.07 116.66 104.00 1mx7 n ARG 58 Ca 0.00 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 57.07 1mx7 n ARG 58 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1mx7 n ARG 58 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1mx7 n ASN 59 N -2.60 -1.45 -4.34 0.55 6.94 0.23 -4.98 115.26 109.62 1mx7 n ASN 59 Ca 0.00 0.08 -0.27 0.00 -0.02 0.00 0.00 54.58 54.36 1mx7 n ASN 59 Cb 0.00 -0.35 -0.13 0.00 -2.36 0.00 0.00 39.78 36.94 1mx7 n ASN 59 CO 0.00 0.00 0.00 -0.72 -1.03 0.00 0.00 177.26 175.51 1mx7 s TYR 60 N -0.24 2.13 0.12 -2.53 -0.85 -1.23 -5.03 117.35 109.72 1mx7 s TYR 60 Ca 0.01 -0.39 0.03 0.00 -0.52 0.00 0.00 57.07 56.20 1mx7 s TYR 60 Cb -0.00 -1.18 -0.04 0.00 0.38 0.00 0.00 41.96 41.12 1mx7 s TYR 60 CO 0.02 0.25 -0.09 0.42 -1.52 0.00 0.00 175.55 174.64 1mx7 s ILE 61 N -1.03 0.96 0.05 -3.49 1.09 -1.26 -2.86 121.20 114.66 1mx7 s ILE 61 Ca 0.11 -1.92 -0.03 0.00 -1.10 0.00 0.00 60.65 57.71 1mx7 s ILE 61 Cb -0.10 -1.68 -0.03 0.00 -1.06 0.00 0.00 42.46 39.60 1mx7 s ILE 61 CO 0.05 -0.74 0.03 -0.04 -0.10 0.00 0.00 174.94 174.13 1mx7 s MET 62 N -3.54 0.62 -0.61 2.79 -1.94 -0.85 -5.05 119.30 110.72 1mx7 s MET 62 Ca 0.12 -1.05 0.05 0.00 -1.71 0.00 0.00 55.69 53.11 1mx7 s MET 62 Cb 0.02 0.23 0.19 0.00 2.01 0.00 0.00 34.83 37.28 1mx7 s MET 62 CO -0.01 -0.14 0.51 -3.47 -0.01 0.00 0.00 175.02 171.90 1mx7 n ASP 63 N 0.31 2.21 -4.12 3.03 2.03 -1.26 -2.55 116.55 116.20 1mx7 n ASP 63 Ca -0.16 -3.04 -0.30 0.00 0.52 0.00 0.00 54.79 51.82 1mx7 n ASP 63 Cb 0.60 -0.69 0.19 0.00 -0.72 0.00 0.00 41.12 40.50 1mx7 n ASP 63 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1mx7 s PHE 64 N -1.30 1.41 -0.18 -0.67 0.08 0.59 -4.87 117.98 113.05 1mx7 s PHE 64 Ca 0.30 0.42 -0.08 0.00 0.12 0.00 0.00 56.93 57.70 1mx7 s PHE 64 Cb 0.02 -3.86 0.08 0.00 -0.57 0.00 0.00 43.02 38.69 1mx7 s PHE 64 CO -0.15 -2.94 0.41 -0.65 -0.10 0.00 0.00 175.22 171.79 1mx7 s GLN 65 N -5.70 0.34 0.33 0.44 -0.21 -1.26 -1.18 119.66 112.40 1mx7 s GLN 65 Ca 0.72 0.93 -0.29 0.00 0.02 0.00 0.00 55.36 56.74 1mx7 s GLN 65 Cb -0.07 0.18 -0.12 0.00 1.00 0.00 0.00 33.01 34.01 1mx7 s GLN 65 CO 0.54 -0.22 1.47 0.28 -2.12 0.00 0.00 175.29 175.23 1mx7 n VAL 66 N 4.98 1.56 -1.00 1.09 0.31 -1.26 -1.99 118.33 122.02 1mx7 n VAL 66 Ca -0.14 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 63.80 1mx7 n VAL 66 Cb 0.52 -1.82 0.00 0.00 -0.91 0.00 0.00 33.84 31.63 1mx7 n VAL 66 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1mx7 n GLY 67 N 1.28 0.15 3.68 2.92 0.00 -1.26 -4.94 105.19 107.02 1mx7 n GLY 67 Ca 0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.84 1mx7 n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mx7 s LYS 68 N -1.42 2.21 0.11 1.61 3.01 -0.84 -5.03 119.74 119.38 1mx7 s LYS 68 Ca 0.00 -1.68 0.09 0.00 -1.01 0.00 0.00 55.97 53.37 1mx7 s LYS 68 Cb 0.00 -2.03 -0.04 0.00 -1.01 0.00 0.00 37.83 34.75 1mx7 s LYS 68 CO 0.00 0.09 -0.24 -2.00 0.51 0.00 0.00 175.35 173.71 1mx7 s GLU 69 N -3.79 1.33 0.02 1.68 2.12 -1.26 -3.85 118.70 114.95 1mx7 s GLU 69 Ca 0.37 -1.22 -0.00 0.00 0.36 0.00 0.00 54.97 54.47 1mx7 s GLU 69 Cb -0.00 -1.68 0.00 0.00 0.26 0.00 0.00 34.13 32.71 1mx7 s GLU 69 CO 0.21 0.40 0.04 1.97 -0.54 0.00 0.00 175.26 177.34 1mx7 n PHE 70 N 1.13 -0.70 -3.53 5.30 1.16 -1.11 -5.05 117.46 114.66 1mx7 n PHE 70 Ca -0.18 -0.15 -0.20 0.00 -1.87 0.00 0.00 57.45 55.04 1mx7 n PHE 70 Cb 0.53 0.05 -0.14 0.00 -1.61 0.00 0.00 39.48 38.31 1mx7 n PHE 70 CO 0.00 0.00 0.00 -1.21 -1.87 0.00 0.00 176.76 173.68 1mx7 s GLU 71 N -2.04 0.15 -1.16 3.97 2.02 -1.26 -3.44 118.70 116.94 1mx7 s GLU 71 Ca 0.02 0.14 -0.07 0.00 0.02 0.00 0.00 54.97 55.07 1mx7 s GLU 71 Cb -0.00 -1.34 0.25 0.00 0.10 0.00 0.00 34.13 33.14 1mx7 s GLU 71 CO 0.01 -0.65 1.54 -0.85 0.02 0.00 0.00 175.26 175.33 1mx7 n GLU 72 N 5.31 3.97 -1.50 1.61 0.28 -1.12 -5.00 120.64 124.18 1mx7 n GLU 72 Ca -0.06 -4.17 -0.49 0.00 -0.16 0.00 0.00 57.16 52.29 1mx7 n GLU 72 Cb 0.49 -2.69 -0.04 0.00 1.43 0.00 0.00 31.44 30.63 1mx7 n GLU 72 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1mx7 n ASP 73 N 2.74 0.19 -1.83 -1.84 5.75 -1.26 -3.92 116.55 116.38 1mx7 n ASP 73 Ca 0.31 1.15 0.00 0.00 -0.01 0.00 0.00 54.79 56.24 1mx7 n ASP 73 Cb 0.36 -1.10 0.00 0.00 -1.03 0.00 0.00 41.12 39.35 1mx7 n ASP 73 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 1mx7 n LEU 74 N 1.76 -5.47 -4.27 -2.12 -0.00 -1.05 -4.87 117.00 100.97 1mx7 n LEU 74 Ca 0.15 2.76 -0.42 0.00 -0.00 0.00 0.00 56.01 58.51 1mx7 n LEU 74 Cb 0.24 -2.83 -0.08 0.00 -0.00 0.00 0.00 43.42 40.76 1mx7 n LEU 74 CO 0.59 -1.51 -0.01 -0.89 -0.00 0.00 0.00 177.39 175.56 1mx7 s THR 75 N -0.44 4.54 -0.50 1.96 2.01 0.01 -4.81 115.64 118.41 1mx7 s THR 75 Ca 0.00 -1.50 -0.27 0.00 0.31 0.00 0.00 61.69 60.23 1mx7 s THR 75 Cb 0.00 -3.86 -0.08 0.00 0.01 0.00 0.00 72.50 68.57 1mx7 s THR 75 CO 0.00 -0.67 2.42 0.61 -0.69 0.00 0.00 174.62 176.29 1mx7 n GLY 76 N 5.01 0.22 0.00 4.40 0.00 -1.26 0.17 105.19 113.73 1mx7 n GLY 76 Ca -0.10 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.64 1mx7 n GLY 76 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1mx7 n ILE 77 N 7.91 0.00 -0.12 -0.61 5.41 -1.26 -4.83 119.36 125.86 1mx7 n ILE 77 Ca 0.39 0.00 0.10 0.00 1.00 0.00 0.00 62.75 64.24 1mx7 n ILE 77 Cb 0.48 0.00 0.24 0.00 -0.71 0.00 0.00 39.64 39.65 1mx7 n ILE 77 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 1mx7 n ASP 78 N 0.00 3.49 -0.13 4.38 5.68 -0.99 -4.85 116.55 124.13 1mx7 n ASP 78 Ca 0.00 -1.97 0.00 0.00 -0.50 0.00 0.00 54.79 52.32 1mx7 n ASP 78 Cb 0.00 -0.34 0.00 0.00 -1.14 0.00 0.00 41.12 39.64 1mx7 n ASP 78 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1mx7 n ASP 79 N 1.28 -1.01 -0.15 -1.12 5.75 0.44 -4.84 116.55 116.91 1mx7 n ASP 79 Ca 0.19 0.00 0.01 0.00 -0.01 0.00 0.00 54.79 54.98 1mx7 n ASP 79 Cb 0.55 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.64 1mx7 n ASP 79 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 1mx7 n ARG 80 N -0.27 -0.36 -3.62 0.11 0.63 -1.26 -3.52 116.66 108.38 1mx7 n ARG 80 Ca 0.00 0.29 -0.37 0.00 -0.92 0.00 0.00 57.85 56.85 1mx7 n ARG 80 Cb 0.00 -0.39 -0.06 0.00 0.45 0.00 0.00 32.46 32.46 1mx7 n ARG 80 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 1mx7 s LYS 81 N -3.48 3.90 -0.04 -0.14 -2.85 -1.26 -0.81 119.74 115.06 1mx7 s LYS 81 Ca 0.00 0.16 0.07 0.00 -1.00 0.00 0.00 55.97 55.20 1mx7 s LYS 81 Cb 0.00 -3.28 -0.01 0.00 -2.06 0.00 0.00 37.83 32.47 1mx7 s LYS 81 CO 0.00 0.56 -0.25 0.00 0.10 0.00 0.00 175.35 175.76 1mx7 s MET 83 N -0.38 3.44 -0.13 0.00 1.00 -0.60 -2.81 119.30 119.83 1mx7 s MET 83 Ca 0.03 -2.37 -0.18 0.00 0.00 0.00 0.00 55.69 53.18 1mx7 s MET 83 Cb -0.12 -4.36 -0.04 0.00 0.00 0.00 0.00 34.83 30.32 1mx7 s MET 83 CO 0.01 -1.29 0.48 0.99 0.00 0.00 0.00 175.02 175.22 1mx7 s THR 84 N 0.34 5.18 -0.15 2.05 2.01 -1.22 -2.22 115.64 121.63 1mx7 s THR 84 Ca 0.16 0.95 -0.00 0.00 0.31 0.00 0.00 61.69 63.11 1mx7 s THR 84 Cb -0.14 -3.82 0.03 0.00 0.01 0.00 0.00 72.50 68.59 1mx7 s THR 84 CO -0.07 0.30 -0.09 -0.89 -0.69 0.00 0.00 174.62 173.18 1mx7 s THR 85 N 0.78 1.29 0.44 -0.82 2.01 -0.81 -2.75 115.64 115.78 1mx7 s THR 85 Ca 0.26 -0.58 -0.01 0.00 0.31 0.00 0.00 61.69 61.67 1mx7 s THR 85 Cb -0.15 -1.33 0.09 0.00 0.01 0.00 0.00 72.50 71.12 1mx7 s THR 85 CO 0.10 0.31 0.61 1.33 -0.69 0.00 0.00 174.62 176.28 1mx7 n VAL 86 N 4.84 0.00 0.00 3.82 0.24 -1.25 -2.83 118.33 123.15 1mx7 n VAL 86 Ca -0.14 -0.90 0.00 0.00 -2.04 0.00 0.00 64.34 61.26 1mx7 n VAL 86 Cb 0.49 -1.14 0.00 0.00 -1.47 0.00 0.00 33.84 31.72 1mx7 n VAL 86 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1mx7 n SER 87 N -2.99 0.00 -4.58 -1.34 2.88 -1.25 -4.45 113.62 101.89 1mx7 n SER 87 Ca 0.10 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.23 1mx7 n SER 87 Cb 0.35 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.80 1mx7 n SER 87 CO 0.00 0.00 0.00 0.86 -1.23 0.00 0.00 175.04 174.67 1mx7 s TRP 88 N -0.28 2.66 -0.50 0.66 -0.00 -1.26 -3.11 118.94 117.12 1mx7 s TRP 88 Ca 0.00 -1.31 -0.18 0.00 -0.00 0.00 0.00 56.10 54.60 1mx7 s TRP 88 Cb 0.00 -4.66 0.06 0.00 -0.00 0.00 0.00 33.47 28.87 1mx7 s TRP 88 CO 0.00 -1.75 0.59 0.34 -0.00 0.00 0.00 176.95 176.13 1mx7 s ASP 89 N 4.58 6.21 -1.11 5.86 2.15 -1.16 -3.94 116.67 129.25 1mx7 s ASP 89 Ca 0.55 -0.98 -0.01 0.00 0.43 0.00 0.00 52.55 52.54 1mx7 s ASP 89 Cb 0.03 -2.27 0.00 0.00 -0.30 0.00 0.00 42.92 40.38 1mx7 s ASP 89 CO 0.07 -0.85 0.12 0.61 -0.17 0.00 0.00 175.17 174.96 1mx7 n GLY 90 N 5.18 -0.16 3.73 2.66 0.00 -1.26 -2.76 105.19 112.57 1mx7 n GLY 90 Ca -0.08 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1mx7 n GLY 90 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1mx7 n ASP 91 N -0.72 0.00 -4.88 1.61 9.92 -1.25 -4.99 116.55 116.23 1mx7 n ASP 91 Ca -0.13 0.00 -0.31 0.00 -0.53 0.00 0.00 54.79 53.82 1mx7 n ASP 91 Cb 0.61 -0.41 -0.05 0.00 -0.64 0.00 0.00 41.12 40.63 1mx7 n ASP 91 CO 0.00 0.00 0.00 -1.59 0.13 0.00 0.00 177.20 175.74 1mx7 s LYS 92 N 0.00 3.76 -0.92 -1.24 -2.85 -1.11 -4.98 119.74 112.40 1mx7 s LYS 92 Ca 0.00 0.24 -0.23 0.00 -1.00 0.00 0.00 55.97 54.98 1mx7 s LYS 92 Cb 0.00 -2.61 0.06 0.00 -2.06 0.00 0.00 37.83 33.23 1mx7 s LYS 92 CO 0.00 0.24 1.32 -0.51 0.10 0.00 0.00 175.35 176.50 1mx7 s LEU 93 N -3.13 3.79 -0.68 2.77 1.43 -1.19 -2.99 118.68 118.69 1mx7 s LEU 93 Ca 0.47 -1.33 -0.16 0.00 -1.03 0.00 0.00 54.13 52.08 1mx7 s LEU 93 Cb -0.11 -2.52 0.16 0.00 0.03 0.00 0.00 46.19 43.74 1mx7 s LEU 93 CO 0.24 -1.49 0.67 -1.58 0.23 0.00 0.00 176.35 174.43 1mx7 s GLN 94 N 4.63 3.25 -0.02 1.70 0.74 -1.18 -2.38 119.66 126.40 1mx7 s GLN 94 Ca 0.39 -1.91 -0.00 0.00 0.05 0.00 0.00 55.36 53.89 1mx7 s GLN 94 Cb -0.04 -4.38 -0.04 0.00 1.10 0.00 0.00 33.01 29.66 1mx7 s GLN 94 CO -0.03 -1.38 0.03 0.00 -0.55 0.00 0.00 175.29 173.36 1mx7 s VAL 96 N -1.08 1.74 -0.64 0.00 0.11 -1.13 -2.44 120.40 116.96 1mx7 s VAL 96 Ca 0.19 -0.93 0.05 0.00 -2.93 0.00 0.00 61.98 58.37 1mx7 s VAL 96 Cb -0.12 -1.45 0.20 0.00 -1.53 0.00 0.00 36.38 33.48 1mx7 s VAL 96 CO 0.10 0.49 0.56 0.00 -3.33 0.00 0.00 175.10 172.92 1mx7 n GLN 97 N 2.65 1.82 -1.65 1.54 10.64 -1.26 -1.92 117.38 129.20 1mx7 n GLN 97 Ca -0.16 -4.33 -0.57 0.00 -1.83 0.00 0.00 57.00 50.11 1mx7 n GLN 97 Cb 0.52 -2.15 -0.07 0.00 -0.86 0.00 0.00 30.24 27.69 1mx7 n GLN 97 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1mx7 n LYS 98 N 1.66 0.91 0.00 2.61 4.76 -0.94 -4.50 118.16 122.65 1mx7 n LYS 98 Ca 0.24 0.33 0.00 0.00 -2.87 0.00 0.00 58.31 56.01 1mx7 n LYS 98 Cb 0.39 -1.96 0.00 0.00 -1.84 0.00 0.00 35.03 31.62 1mx7 n LYS 98 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1mx7 n GLY 99 N 3.25 -1.82 5.36 0.72 0.00 -1.26 -1.55 105.19 109.89 1mx7 n GLY 99 Ca 0.23 0.80 0.01 0.00 0.00 0.00 0.00 46.02 47.06 1mx7 n GLY 99 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1mx7 n GLU 100 N 0.00 -0.15 -0.78 1.61 2.13 -1.26 -5.03 120.64 117.16 1mx7 n GLU 100 Ca 0.00 0.10 0.11 0.00 0.66 0.00 0.00 57.16 58.02 1mx7 n GLU 100 Cb 0.00 -0.18 -0.03 0.00 0.27 0.00 0.00 31.44 31.50 1mx7 n GLU 100 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1mx7 n LYS 101 N -0.72 -1.57 -2.51 5.31 4.76 -1.26 -4.67 118.16 117.50 1mx7 n LYS 101 Ca 0.00 1.04 -0.23 0.00 -2.87 0.00 0.00 58.31 56.25 1mx7 n LYS 101 Cb 0.03 -1.92 0.01 0.00 -1.84 0.00 0.00 35.03 31.31 1mx7 n LYS 101 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1mx7 n GLU 102 N -2.88 2.95 0.00 1.97 1.02 -1.26 -4.84 120.64 117.59 1mx7 n GLU 102 Ca 0.01 -4.23 0.00 0.00 -0.02 0.00 0.00 57.16 52.91 1mx7 n GLU 102 Cb 0.36 -2.04 0.00 0.00 -0.02 0.00 0.00 31.44 29.74 1mx7 n GLU 102 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1mx7 n GLY 103 N -0.40 0.00 3.82 0.62 0.00 -1.26 -4.36 105.19 103.61 1mx7 n GLY 103 Ca 0.33 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.04 1mx7 n GLY 103 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mx7 s ARG 104 N 0.00 2.42 0.00 1.61 0.52 -1.26 -3.22 118.95 119.02 1mx7 s ARG 104 Ca 0.00 0.68 0.00 0.00 -0.52 0.00 0.00 55.73 55.89 1mx7 s ARG 104 Cb 0.00 -1.95 0.00 0.00 0.52 0.00 0.00 34.95 33.52 1mx7 s ARG 104 CO 0.00 -1.39 0.00 0.41 0.02 0.00 0.00 175.30 174.34 1mx7 n GLY 105 N -2.24 3.42 3.83 -3.53 0.00 -1.21 -4.54 105.19 100.92 1mx7 n GLY 105 Ca 0.07 -1.63 -0.25 0.00 0.00 0.00 0.00 46.02 44.21 1mx7 n GLY 105 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1mx7 s TRP 106 N -1.45 2.20 -0.11 1.61 0.52 -1.02 -2.41 118.94 118.26 1mx7 s TRP 106 Ca 0.00 -0.69 -0.08 0.00 0.02 0.00 0.00 56.10 55.34 1mx7 s TRP 106 Cb 0.00 -1.96 0.04 0.00 -1.15 0.00 0.00 33.47 30.39 1mx7 s TRP 106 CO 0.00 -0.13 0.29 0.99 0.02 0.00 0.00 176.95 178.12 1mx7 s THR 107 N -2.66 -0.02 -0.09 2.01 2.01 0.18 -3.66 115.64 113.42 1mx7 s THR 107 Ca 0.37 0.06 0.04 0.00 0.31 0.00 0.00 61.69 62.47 1mx7 s THR 107 Cb -0.00 -0.42 -0.00 0.00 0.01 0.00 0.00 72.50 72.09 1mx7 s THR 107 CO 0.22 0.02 -0.23 -1.10 -0.69 0.00 0.00 174.62 172.84 1mx7 s GLN 108 N 0.64 2.85 -0.11 4.92 -0.21 -1.00 -0.83 119.66 125.92 1mx7 s GLN 108 Ca -0.04 -0.86 -0.05 0.00 0.02 0.00 0.00 55.36 54.44 1mx7 s GLN 108 Cb -0.05 -2.21 0.05 0.00 1.00 0.00 0.00 33.01 31.80 1mx7 s GLN 108 CO -0.04 0.22 0.24 -0.46 -2.12 0.00 0.00 175.29 173.13 1mx7 s TRP 109 N 0.24 -0.36 -0.24 0.91 -0.11 0.08 -3.16 118.94 116.31 1mx7 s TRP 109 Ca -0.15 0.85 -0.11 0.00 1.22 0.00 0.00 56.10 57.90 1mx7 s TRP 109 Cb -0.17 -0.02 -0.05 0.00 -1.50 0.00 0.00 33.47 31.74 1mx7 s TRP 109 CO 0.07 -0.29 0.20 0.42 -4.62 0.00 0.00 176.95 172.73 1mx7 s ILE 110 N 1.85 5.33 -0.21 5.86 1.01 -1.26 0.71 121.20 134.49 1mx7 s ILE 110 Ca -0.04 0.26 -0.01 0.00 0.00 0.00 0.00 60.65 60.86 1mx7 s ILE 110 Cb -0.11 -3.54 0.06 0.00 0.01 0.00 0.00 42.46 38.88 1mx7 s ILE 110 CO -0.08 0.32 -0.01 -1.61 0.00 0.00 0.00 174.94 173.56 1mx7 s GLU 111 N 1.16 1.18 3.41 2.79 0.41 -1.12 -4.99 118.70 121.54 1mx7 s GLU 111 Ca 0.09 -0.72 0.00 0.00 -0.41 0.00 0.00 54.97 53.93 1mx7 s GLU 111 Cb -0.14 -2.35 0.00 0.00 -1.78 0.00 0.00 34.13 29.86 1mx7 s GLU 111 CO 0.05 -0.61 0.00 0.41 -0.49 0.00 0.00 175.26 174.62 1mx7 n GLY 112 N 4.85 0.87 0.29 -1.39 0.00 -1.26 0.68 105.19 109.23 1mx7 n GLY 112 Ca -0.11 0.61 0.03 0.00 0.00 0.00 0.00 46.02 46.55 1mx7 n GLY 112 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1mx7 n ASP 113 N 7.85 1.91 -4.29 1.61 8.00 -1.26 -4.94 116.55 125.44 1mx7 n ASP 113 Ca 0.00 -1.55 -0.43 0.00 0.71 0.00 0.00 54.79 53.51 1mx7 n ASP 113 Cb 0.00 -0.05 -0.07 0.00 -0.02 0.00 0.00 41.12 40.98 1mx7 n ASP 113 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 1mx7 s GLU 114 N -0.71 2.78 -0.38 -1.24 2.12 0.21 0.19 118.70 121.68 1mx7 s GLU 114 Ca 0.09 -1.63 -0.28 0.00 0.36 0.00 0.00 54.97 53.51 1mx7 s GLU 114 Cb 0.06 -4.09 -0.02 0.00 0.26 0.00 0.00 34.13 30.33 1mx7 s GLU 114 CO 0.08 -1.19 1.86 -1.17 -0.54 0.00 0.00 175.26 174.30 1mx7 s LEU 115 N 1.51 3.46 -0.50 2.70 2.96 -0.68 -2.78 118.68 125.35 1mx7 s LEU 115 Ca 0.04 1.16 -0.16 0.00 -0.22 0.00 0.00 54.13 54.95 1mx7 s LEU 115 Cb -0.27 -3.29 0.09 0.00 0.50 0.00 0.00 46.19 43.22 1mx7 s LEU 115 CO 0.02 -1.90 0.45 -2.28 -1.32 0.00 0.00 176.35 171.33 1mx7 s HIS 116 N 7.61 3.22 -0.05 5.38 2.46 0.22 -2.39 115.29 131.74 1mx7 s HIS 116 Ca 0.80 -0.99 -0.02 0.00 0.47 0.00 0.00 55.06 55.31 1mx7 s HIS 116 Cb -0.21 -3.40 -0.04 0.00 -0.13 0.00 0.00 32.58 28.80 1mx7 s HIS 116 CO 0.31 -0.89 0.08 -1.17 -2.47 0.00 0.00 174.74 170.60 1mx7 s LEU 117 N 1.75 3.96 -0.05 8.88 0.20 -1.25 -0.74 118.68 131.43 1mx7 s LEU 117 Ca 0.05 0.23 -0.02 0.00 0.69 0.00 0.00 54.13 55.07 1mx7 s LEU 117 Cb -0.25 -2.15 0.04 0.00 -0.43 0.00 0.00 46.19 43.39 1mx7 s LEU 117 CO 0.06 0.33 0.09 -0.70 -0.29 0.00 0.00 176.35 175.84 1mx7 s GLU 118 N -1.40 -0.05 0.33 1.98 2.12 -0.01 -2.50 118.70 119.17 1mx7 s GLU 118 Ca 0.19 0.43 0.02 0.00 0.36 0.00 0.00 54.97 55.97 1mx7 s GLU 118 Cb -0.12 -0.44 0.06 0.00 0.26 0.00 0.00 34.13 33.90 1mx7 s GLU 118 CO 0.09 -0.32 0.46 -1.33 -0.54 0.00 0.00 175.26 173.62 1mx7 n MET 119 N 5.29 0.48 -3.64 4.30 2.81 0.15 -0.65 117.12 125.86 1mx7 n MET 119 Ca -0.04 -1.44 -0.03 0.00 -1.81 0.00 0.00 57.70 54.38 1mx7 n MET 119 Cb 0.50 -0.25 -0.07 0.00 -0.71 0.00 0.00 33.22 32.70 1mx7 n MET 119 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 1mx7 s ARG 120 N -3.57 0.43 -0.26 0.03 6.06 -1.01 -3.98 118.95 116.65 1mx7 s ARG 120 Ca 0.32 0.75 -0.09 0.00 -2.50 0.00 0.00 55.73 54.21 1mx7 s ARG 120 Cb -0.02 0.09 0.11 0.00 0.06 0.00 0.00 34.95 35.19 1mx7 s ARG 120 CO 0.21 -0.09 0.56 0.00 -2.50 0.00 0.00 175.30 173.48 1mx7 s ALA 121 N 1.41 -1.68 -1.01 6.12 0.00 -1.20 -3.35 121.76 122.05 1mx7 s ALA 121 Ca -0.09 2.03 0.00 0.00 0.00 0.00 0.00 51.96 53.90 1mx7 s ALA 121 Cb -0.04 -1.56 0.00 0.00 0.00 0.00 0.00 23.12 21.52 1mx7 s ALA 121 CO -0.16 -0.80 0.00 -1.91 0.00 0.00 0.00 175.76 172.89 1mx7 n GLU 122 N 5.30 -1.76 0.00 0.00 2.13 -1.26 -2.19 120.64 122.86 1mx7 n GLU 122 Ca -0.12 0.83 0.00 0.00 0.66 0.00 0.00 57.16 58.54 1mx7 n GLU 122 Cb 0.50 -5.28 0.00 0.00 0.27 0.00 0.00 31.44 26.93 1mx7 n GLU 122 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1mx7 n GLY 123 N 0.37 1.13 3.95 8.31 0.00 -1.26 -4.90 105.19 112.78 1mx7 n GLY 123 Ca -0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.73 1mx7 n GLY 123 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1mx7 s VAL 124 N -2.00 4.11 -0.22 1.61 -7.23 -0.93 -5.11 120.40 110.63 1mx7 s VAL 124 Ca 0.00 -1.10 -0.01 0.00 -1.81 0.00 0.00 61.98 59.06 1mx7 s VAL 124 Cb 0.00 -3.41 0.07 0.00 0.56 0.00 0.00 36.38 33.59 1mx7 s VAL 124 CO 0.00 -0.19 0.02 -0.89 -0.31 0.00 0.00 175.10 173.73 1mx7 s THR 125 N -2.18 0.89 -0.08 5.32 2.01 -1.26 -3.40 115.64 116.93 1mx7 s THR 125 Ca 0.42 -0.88 0.01 0.00 0.31 0.00 0.00 61.69 61.55 1mx7 s THR 125 Cb -0.09 -1.36 -0.03 0.00 0.01 0.00 0.00 72.50 71.04 1mx7 s THR 125 CO 0.30 -0.24 -0.09 0.00 -0.69 0.00 0.00 174.62 173.90 1mx7 s LYS 127 N -0.50 1.11 0.11 0.00 1.02 -1.26 0.30 119.74 120.52 1mx7 s LYS 127 Ca 0.07 -1.41 -0.01 0.00 0.02 0.00 0.00 55.97 54.64 1mx7 s LYS 127 Cb -0.12 0.30 -0.04 0.00 -0.52 0.00 0.00 37.83 37.45 1mx7 s LYS 127 CO 0.02 -0.37 0.03 -0.65 -0.92 0.00 0.00 175.35 173.46 1mx7 s GLN 128 N -4.06 0.83 -0.55 1.68 -0.21 -1.04 -2.11 119.66 114.20 1mx7 s GLN 128 Ca 0.26 -1.37 0.07 0.00 0.02 0.00 0.00 55.36 54.34 1mx7 s GLN 128 Cb 0.06 0.23 0.28 0.00 1.00 0.00 0.00 33.01 34.58 1mx7 s GLN 128 CO 0.05 -0.21 0.74 1.33 -2.12 0.00 0.00 175.29 175.08 1mx7 n VAL 129 N -0.03 1.66 -1.69 1.09 0.24 0.35 -3.84 118.33 116.11 1mx7 n VAL 129 Ca -0.08 -5.00 -0.45 0.00 -2.04 0.00 0.00 64.34 56.78 1mx7 n VAL 129 Cb 0.63 -1.75 -0.03 0.00 -1.47 0.00 0.00 33.84 31.21 1mx7 n VAL 129 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1mx7 n PHE 130 N 0.67 2.37 -3.76 6.34 3.72 -1.01 -4.12 117.46 121.68 1mx7 n PHE 130 Ca 0.28 0.30 -0.37 0.00 -0.05 0.00 0.00 57.45 57.61 1mx7 n PHE 130 Cb 0.45 -2.54 -0.12 0.00 -0.94 0.00 0.00 39.48 36.34 1mx7 n PHE 130 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1mx7 s LYS 131 N 0.29 2.33 -0.73 -1.08 2.47 -1.25 -1.68 119.74 120.08 1mx7 s LYS 131 Ca 0.73 -1.52 -0.26 0.00 -1.56 0.00 0.00 55.97 53.35 1mx7 s LYS 131 Cb -0.62 -3.52 -0.00 0.00 -1.46 0.00 0.00 37.83 32.22 1mx7 s LYS 131 CO 0.43 -0.89 1.67 0.21 0.16 0.00 0.00 175.35 176.93 1mx7 s LYS 132 N 1.27 2.87 0.52 4.03 2.20 0.13 -3.45 119.74 127.31 1mx7 s LYS 132 Ca 0.03 0.07 0.40 0.00 -0.36 0.00 0.00 55.97 56.11 1mx7 s LYS 132 Cb -0.22 -4.52 1.59 0.00 -1.51 0.00 0.00 37.83 33.17 1mx7 s LYS 132 CO -0.01 -2.61 1.65 0.28 -0.36 0.00 0.00 175.35 174.30 1mx7 h VAL 133 N 6.68 0.16 0.00 4.02 2.07 -1.81 -3.45 116.25 123.91 1mx7 h VAL 133 Ca -0.17 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1mx7 h VAL 133 Cb 1.09 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1mx7 h VAL 133 CO 1.25 0.01 0.00 1.57 0.02 0.00 0.00 177.57 180.42