#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cg7 n VAL 2 N 0.00 0.00 -3.46 2.03 3.14 -1.26 -5.12 118.33 113.67 1cg7 n VAL 2 Ca 0.00 -0.85 -0.43 0.00 -2.96 0.00 0.00 64.34 60.10 1cg7 n VAL 2 Cb 0.00 1.17 -0.09 0.00 -1.06 0.00 0.00 33.84 33.86 1cg7 n VAL 2 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 1cg7 s THR 3 N 0.12 5.13 -0.07 1.55 -1.32 -1.26 -4.95 115.64 114.84 1cg7 s THR 3 Ca 0.22 -0.87 -0.16 0.00 -1.21 0.00 0.00 61.69 59.68 1cg7 s THR 3 Cb 0.28 -3.94 -0.12 0.00 -1.51 0.00 0.00 72.50 67.21 1cg7 s THR 3 CO -0.16 -0.41 0.61 1.55 -2.21 0.00 0.00 174.62 174.00 1cg7 h PRO 4 N 8.64 -0.21 -4.67 7.08 0.13 -2.08 -3.48 132.00 137.41 1cg7 h PRO 4 Ca -0.27 0.01 -0.26 0.00 -0.87 0.00 0.00 66.00 64.61 1cg7 h PRO 4 Cb 1.11 0.05 -0.15 0.00 0.13 0.00 0.00 31.00 32.14 1cg7 h PRO 4 CO 0.78 0.13 -0.65 1.03 -0.23 0.00 0.00 178.00 179.06 1cg7 s ARG 5 N -2.85 1.10 0.31 0.86 0.52 -1.26 -5.15 118.95 112.48 1cg7 s ARG 5 Ca -0.09 -1.54 -0.25 0.00 -0.52 0.00 0.00 55.73 53.33 1cg7 s ARG 5 Cb 0.00 -0.06 -0.10 0.00 0.52 0.00 0.00 34.95 35.31 1cg7 s ARG 5 CO 0.34 -0.22 0.90 -1.83 0.02 0.00 0.00 175.30 174.52 1cg7 s GLU 6 N -3.99 4.50 1.06 3.54 -1.05 -1.26 -5.06 118.70 116.44 1cg7 s GLU 6 Ca 0.27 1.23 -0.17 0.00 -0.15 0.00 0.00 54.97 56.15 1cg7 s GLU 6 Cb 0.07 -2.79 0.23 0.00 -0.44 0.00 0.00 34.13 31.20 1cg7 s GLU 6 CO 0.05 0.29 1.21 -1.25 0.95 0.00 0.00 175.26 176.51 1cg7 s PRO 7 N -2.08 -0.08 -0.08 -4.83 0.04 -1.26 -5.09 135.00 121.62 1cg7 s PRO 7 Ca 0.49 -0.17 -0.03 0.00 0.04 0.00 0.00 61.00 61.33 1cg7 s PRO 7 Cb -0.18 -1.74 0.05 0.00 0.04 0.00 0.00 34.50 32.67 1cg7 s PRO 7 CO 0.23 -2.93 0.17 0.15 0.04 0.00 0.00 177.00 174.66 1cg7 s LYS 8 N -5.60 0.08 -0.13 4.56 1.02 -1.26 -5.14 119.74 113.26 1cg7 s LYS 8 Ca 0.71 0.51 -0.31 0.00 0.02 0.00 0.00 55.97 56.90 1cg7 s LYS 8 Cb -0.08 -0.21 0.13 0.00 -0.52 0.00 0.00 37.83 37.15 1cg7 s LYS 8 CO 0.54 -0.25 1.07 0.21 -0.92 0.00 0.00 175.35 176.00 1cg7 s LYS 9 N 1.85 0.52 -0.30 1.68 2.20 -1.26 -5.16 119.74 119.27 1cg7 s LYS 9 Ca -0.02 -0.10 -0.06 0.00 -0.36 0.00 0.00 55.97 55.42 1cg7 s LYS 9 Cb -0.12 0.24 0.16 0.00 -1.51 0.00 0.00 37.83 36.60 1cg7 s LYS 9 CO -0.06 -0.21 0.66 -0.98 -0.36 0.00 0.00 175.35 174.40 1cg7 s ARG 10 N -2.23 0.55 0.95 4.03 1.70 -1.26 -5.16 118.95 117.52 1cg7 s ARG 10 Ca 0.05 1.18 -0.11 0.00 -0.47 0.00 0.00 55.73 56.38 1cg7 s ARG 10 Cb -0.01 0.69 0.16 0.00 -0.57 0.00 0.00 34.95 35.22 1cg7 s ARG 10 CO -0.05 -0.39 1.11 0.95 -1.08 0.00 0.00 175.30 175.85 1cg7 s THR 11 N 2.86 2.27 0.24 4.99 -4.23 -1.26 -5.05 115.64 115.47 1cg7 s THR 11 Ca 0.07 0.09 0.10 0.00 -1.18 0.00 0.00 61.69 60.76 1cg7 s THR 11 Cb -0.13 -2.22 -0.05 0.00 1.34 0.00 0.00 72.50 71.45 1cg7 s THR 11 CO -0.20 -0.11 -0.17 -0.89 -0.54 0.00 0.00 174.62 172.71 1cg7 s THR 12 N -2.67 2.11 0.56 3.99 2.01 -1.26 -5.14 115.64 115.24 1cg7 s THR 12 Ca 0.66 -2.31 -0.10 0.00 0.31 0.00 0.00 61.69 60.25 1cg7 s THR 12 Cb -0.22 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 70.06 1cg7 s THR 12 CO 0.59 -0.49 0.94 -0.60 -0.69 0.00 0.00 174.62 174.37 1cg7 s ARG 13 N -3.58 3.62 0.20 4.92 3.52 -1.26 -5.08 118.95 121.29 1cg7 s ARG 13 Ca 0.26 0.59 0.05 0.00 -0.13 0.00 0.00 55.73 56.50 1cg7 s ARG 13 Cb -0.03 -2.19 -0.03 0.00 -1.56 0.00 0.00 34.95 31.14 1cg7 s ARG 13 CO 0.11 -0.41 0.25 -1.59 -0.81 0.00 0.00 175.30 172.85 1cg7 s LYS 14 N -4.89 3.18 0.35 5.12 -2.85 -1.26 -5.13 119.74 114.27 1cg7 s LYS 14 Ca 0.53 -0.82 0.04 0.00 -1.00 0.00 0.00 55.97 54.72 1cg7 s LYS 14 Cb -0.11 -2.77 -0.06 0.00 -2.06 0.00 0.00 37.83 32.83 1cg7 s LYS 14 CO 0.48 0.46 0.06 0.15 0.10 0.00 0.00 175.35 176.60 1cg7 s LYS 15 N -3.55 1.74 -0.24 1.78 1.02 -1.26 -5.13 119.74 114.10 1cg7 s LYS 15 Ca 0.33 -1.99 0.02 0.00 0.02 0.00 0.00 55.97 54.35 1cg7 s LYS 15 Cb -0.09 -0.95 0.05 0.00 -0.52 0.00 0.00 37.83 36.31 1cg7 s LYS 15 CO 0.27 -0.21 -0.12 0.15 -0.92 0.00 0.00 175.35 174.51 1cg7 s LYS 16 N -3.85 2.29 0.34 1.68 1.02 -1.26 -5.12 119.74 114.84 1cg7 s LYS 16 Ca 0.34 -1.16 0.07 0.00 0.02 0.00 0.00 55.97 55.24 1cg7 s LYS 16 Cb 0.08 -2.75 -0.03 0.00 -0.52 0.00 0.00 37.83 34.61 1cg7 s LYS 16 CO 0.15 -0.49 0.29 -0.51 -0.92 0.00 0.00 175.35 173.87 1cg7 s ASP 17 N 1.20 5.26 0.00 2.83 1.01 -1.26 -5.13 116.67 120.58 1cg7 s ASP 17 Ca -0.05 -0.51 0.00 0.00 0.71 0.00 0.00 52.55 52.70 1cg7 s ASP 17 Cb -0.18 -0.96 0.00 0.00 1.01 0.00 0.00 42.92 42.79 1cg7 s ASP 17 CO -0.07 -0.36 0.00 -0.81 0.21 0.00 0.00 175.17 174.14 1cg7 n PRO 18 N -1.37 1.02 -1.98 8.23 -0.04 -1.26 -4.81 135.00 134.80 1cg7 n PRO 18 Ca -0.02 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.12 1cg7 n PRO 18 Cb 0.60 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 34.01 1cg7 n PRO 18 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1cg7 n ASN 19 N 0.00 3.23 -4.41 3.54 3.02 -1.26 -4.88 115.26 114.50 1cg7 n ASN 19 Ca 0.00 -2.72 -0.26 0.00 -0.03 0.00 0.00 54.58 51.56 1cg7 n ASN 19 Cb 0.00 -1.64 -0.12 0.00 -0.61 0.00 0.00 39.78 37.41 1cg7 n ASN 19 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1cg7 s ALA 20 N 9.17 2.45 0.75 5.41 0.00 -1.26 -2.55 121.76 135.73 1cg7 s ALA 20 Ca 0.65 -1.60 -0.11 0.00 0.00 0.00 0.00 51.96 50.89 1cg7 s ALA 20 Cb 0.03 -0.31 0.04 0.00 0.00 0.00 0.00 23.12 22.87 1cg7 s ALA 20 CO 0.12 0.41 1.08 -1.25 0.00 0.00 0.00 175.76 176.13 1cg7 s PRO 21 N -2.62 2.48 -0.63 0.00 0.04 -1.26 -4.95 135.00 128.05 1cg7 s PRO 21 Ca 0.19 0.78 -0.02 0.00 0.04 0.00 0.00 61.00 61.99 1cg7 s PRO 21 Cb -0.08 -1.95 0.31 0.00 0.04 0.00 0.00 34.50 32.82 1cg7 s PRO 21 CO 0.09 -1.38 2.16 1.17 0.04 0.00 0.00 177.00 179.09 1cg7 n LYS 22 N -3.29 2.51 -2.94 4.56 3.00 -1.26 -4.91 118.16 115.83 1cg7 n LYS 22 Ca 0.07 -2.91 -0.01 0.00 -0.00 0.00 0.00 58.31 55.46 1cg7 n LYS 22 Cb 0.55 -2.15 -0.01 0.00 0.00 0.00 0.00 35.03 33.42 1cg7 n LYS 22 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 1cg7 n ARG 23 N -0.27 -2.12 -1.44 1.64 0.63 -1.26 -4.56 116.66 109.27 1cg7 n ARG 23 Ca 0.52 1.88 -0.58 0.00 -0.92 0.00 0.00 57.85 58.75 1cg7 n ARG 23 Cb 0.49 -2.69 -0.10 0.00 0.45 0.00 0.00 32.46 30.62 1cg7 n ARG 23 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1cg7 n ALA 24 N 1.61 0.23 -0.62 5.13 0.00 -1.26 -4.86 120.51 120.74 1cg7 n ALA 24 Ca -0.09 0.18 -0.29 0.00 0.00 0.00 0.00 53.44 53.24 1cg7 n ALA 24 Cb 0.29 -2.23 0.22 0.00 0.00 0.00 0.00 19.45 17.73 1cg7 n ALA 24 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1cg7 s LEU 25 N 5.66 1.54 0.26 0.00 1.02 -1.26 -5.01 118.68 120.88 1cg7 s LEU 25 Ca 1.12 1.74 -0.01 0.00 0.02 0.00 0.00 54.13 56.99 1cg7 s LEU 25 Cb -1.24 -3.82 -0.04 0.00 0.02 0.00 0.00 46.19 41.11 1cg7 s LEU 25 CO 0.63 -3.79 0.46 -0.44 0.02 0.00 0.00 176.35 173.23 1cg7 s SER 26 N -2.60 6.38 0.59 2.29 0.01 -1.26 -4.94 113.70 114.17 1cg7 s SER 26 Ca 0.68 0.48 0.30 0.00 1.31 0.00 0.00 55.95 58.72 1cg7 s SER 26 Cb -0.24 -2.04 1.25 0.00 0.21 0.00 0.00 66.02 65.20 1cg7 s SER 26 CO 0.62 -0.13 1.59 0.00 0.41 0.00 0.00 173.24 175.72 1cg7 h ALA 27 N 1.63 2.77 -0.03 1.44 0.00 -1.92 0.80 119.26 123.95 1cg7 h ALA 27 Ca -0.48 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 1cg7 h ALA 27 Cb 1.20 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 1cg7 h ALA 27 CO 0.66 -1.41 -0.04 -0.92 0.00 0.00 0.00 179.25 177.54 1cg7 h TYR 28 N 0.00 0.10 0.00 0.00 3.20 -1.97 -2.74 116.97 115.56 1cg7 h TYR 28 Ca 0.44 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.27 1cg7 h TYR 28 Cb 2.31 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 40.56 1cg7 h TYR 28 CO 0.00 0.57 -0.03 0.52 -1.64 0.00 0.00 178.16 177.58 1cg7 h MET 29 N -0.40 0.00 0.12 1.82 2.86 0.23 0.24 114.93 119.80 1cg7 h MET 29 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 1cg7 h MET 29 Cb 0.56 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.22 1cg7 h MET 29 CO 0.01 0.03 -0.06 0.74 1.06 0.00 0.00 176.91 178.69 1cg7 h PHE 30 N 0.00 -0.15 0.00 -0.22 -1.00 -1.20 0.17 116.94 114.54 1cg7 h PHE 30 Ca -0.00 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1cg7 h PHE 30 Cb 0.14 0.05 0.00 0.00 3.61 0.00 0.00 35.95 39.75 1cg7 h PHE 30 CO 0.00 0.33 0.00 0.34 -1.61 0.00 0.00 178.31 177.37 1cg7 n PHE 31 N -4.90 0.81 -0.09 -0.55 -0.00 -1.02 -3.51 117.46 108.20 1cg7 n PHE 31 Ca -0.08 0.26 -0.18 0.00 -0.00 0.00 0.00 57.45 57.45 1cg7 n PHE 31 Cb 0.27 -0.92 -0.11 0.00 -0.00 0.00 0.00 39.48 38.73 1cg7 n PHE 31 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1cg7 h ALA 32 N 2.50 0.16 -0.97 3.13 0.00 -0.54 -1.30 119.26 122.24 1cg7 h ALA 32 Ca 0.00 -0.91 0.28 0.00 0.00 0.00 0.00 54.91 54.28 1cg7 h ALA 32 Cb 0.62 0.46 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 1cg7 h ALA 32 CO 0.00 0.44 0.96 -0.91 0.00 0.00 0.00 179.25 179.73 1cg7 h ASN 33 N -1.00 0.00 0.04 0.00 2.35 -0.69 1.82 115.58 118.10 1cg7 h ASN 33 Ca -0.21 0.00 -0.37 0.00 -0.55 0.00 0.00 56.30 55.17 1cg7 h ASN 33 Cb 1.13 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 39.44 1cg7 h ASN 33 CO -0.13 0.00 -2.35 -0.62 -1.65 0.00 0.00 177.43 172.68 1cg7 n GLU 34 N -3.59 0.68 -0.88 0.81 -0.58 -1.24 -4.20 120.64 111.64 1cg7 n GLU 34 Ca 0.21 0.04 -0.08 0.00 -0.42 0.00 0.00 57.16 56.91 1cg7 n GLU 34 Cb 1.27 -1.54 0.23 0.00 -0.57 0.00 0.00 31.44 30.83 1cg7 n GLU 34 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1cg7 n ASN 35 N -2.87 4.22 -0.95 1.62 5.03 0.39 -4.03 115.26 118.68 1cg7 n ASN 35 Ca -0.34 -3.06 0.12 0.00 0.87 0.00 0.00 54.58 52.17 1cg7 n ASN 35 Cb 1.12 -0.72 0.26 0.00 -1.02 0.00 0.00 39.78 39.42 1cg7 n ASN 35 CO 0.00 0.00 0.00 -1.14 -1.83 0.00 0.00 177.26 174.29 1cg7 n ARG 36 N -0.21 2.25 -0.00 3.52 0.00 0.52 -3.89 116.66 118.85 1cg7 n ARG 36 Ca 0.37 -1.87 0.04 0.00 -0.00 0.00 0.00 57.85 56.39 1cg7 n ARG 36 Cb 1.26 -1.47 -0.06 0.00 0.00 0.00 0.00 32.46 32.19 1cg7 n ARG 36 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1cg7 n ASP 37 N 1.11 2.98 0.05 6.15 9.92 -1.26 -3.77 116.55 131.73 1cg7 n ASP 37 Ca 0.18 -0.04 -0.15 0.00 -0.53 0.00 0.00 54.79 54.25 1cg7 n ASP 37 Cb 0.52 1.36 -0.05 0.00 -0.64 0.00 0.00 41.12 42.30 1cg7 n ASP 37 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 1cg7 h ILE 38 N 0.00 1.36 0.13 0.53 5.03 -1.82 -2.55 117.51 120.18 1cg7 h ILE 38 Ca 0.00 -2.31 -0.23 0.00 -0.12 0.00 0.00 64.86 62.20 1cg7 h ILE 38 Cb 0.37 2.32 0.01 0.00 -3.03 0.00 0.00 36.82 36.49 1cg7 h ILE 38 CO 0.00 0.70 -1.10 0.58 -0.68 0.00 0.00 178.15 177.65 1cg7 h VAL 39 N 0.31 1.29 -0.65 1.67 2.07 -1.80 -3.29 116.25 115.85 1cg7 h VAL 39 Ca -0.08 -2.48 0.17 0.00 0.82 0.00 0.00 66.70 65.12 1cg7 h VAL 39 Cb 1.55 2.98 -0.03 0.00 -1.52 0.00 0.00 31.29 34.27 1cg7 h VAL 39 CO 0.17 0.71 0.45 0.08 0.02 0.00 0.00 177.57 179.00 1cg7 h ARG 40 N -0.33 0.13 -0.48 1.57 0.11 -1.65 0.73 114.38 114.46 1cg7 h ARG 40 Ca -0.22 -0.01 0.03 0.00 0.10 0.00 0.00 59.98 59.89 1cg7 h ARG 40 Cb 1.71 -0.03 -0.04 0.00 1.11 0.00 0.00 29.97 32.72 1cg7 h ARG 40 CO 0.11 0.09 0.26 1.03 0.10 0.00 0.00 179.97 181.57 1cg7 h SER 41 N 0.14 0.40 0.78 0.08 0.87 -1.52 1.41 113.55 115.71 1cg7 h SER 41 Ca 0.31 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.89 1cg7 h SER 41 Cb 1.04 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 1cg7 h SER 41 CO -0.04 0.28 -0.09 -0.62 -0.53 0.00 0.00 176.83 175.83 1cg7 n GLU 42 N -4.86 0.15 -3.08 2.24 -0.58 0.09 -4.00 120.64 110.61 1cg7 n GLU 42 Ca 0.03 -0.03 -0.17 0.00 -0.42 0.00 0.00 57.16 56.58 1cg7 n GLU 42 Cb 0.10 -1.50 -0.01 0.00 -0.57 0.00 0.00 31.44 29.46 1cg7 n GLU 42 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1cg7 n ASN 43 N -1.40 -0.15 0.00 1.62 3.02 -0.06 -4.92 115.26 113.37 1cg7 n ASN 43 Ca 0.09 -3.08 0.12 0.00 -0.03 0.00 0.00 54.58 51.68 1cg7 n ASN 43 Cb 0.31 0.00 0.69 0.00 -0.61 0.00 0.00 39.78 40.18 1cg7 n ASN 43 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1cg7 n PRO 44 N 0.65 0.67 0.01 3.52 -0.04 0.46 -1.96 135.00 138.32 1cg7 n PRO 44 Ca 0.20 0.01 0.11 0.00 -0.04 0.00 0.00 63.50 63.78 1cg7 n PRO 44 Cb 0.64 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.62 1cg7 n PRO 44 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1cg7 n ASP 45 N -1.05 0.66 -4.49 3.54 -0.08 -1.26 -4.93 116.55 108.94 1cg7 n ASP 45 Ca 0.17 -0.40 -0.24 0.00 -1.51 0.00 0.00 54.79 52.82 1cg7 n ASP 45 Cb 0.10 0.77 -0.10 0.00 2.34 0.00 0.00 41.12 44.23 1cg7 n ASP 45 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 1cg7 s ILE 46 N -3.12 1.85 0.01 5.18 -5.25 -0.83 -5.16 121.20 113.88 1cg7 s ILE 46 Ca 0.06 -2.13 0.00 0.00 -0.99 0.00 0.00 60.65 57.59 1cg7 s ILE 46 Cb 0.15 -2.61 -0.00 0.00 2.95 0.00 0.00 42.46 42.96 1cg7 s ILE 46 CO 0.80 -0.21 0.00 0.35 -1.79 0.00 0.00 174.94 174.10 1cg7 n THR 47 N -0.71 0.00 -0.61 8.37 -2.24 -1.26 -4.91 114.28 112.92 1cg7 n THR 47 Ca -0.05 -0.08 0.47 0.00 -2.27 0.00 0.00 64.05 62.12 1cg7 n THR 47 Cb 0.64 0.03 0.72 0.00 -2.10 0.00 0.00 70.33 69.62 1cg7 n THR 47 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 1cg7 n PHE 48 N -0.03 0.00 -0.32 4.78 7.35 -1.26 -0.37 117.46 127.61 1cg7 n PHE 48 Ca -0.00 0.00 0.10 0.00 -0.76 0.00 0.00 57.45 56.78 1cg7 n PHE 48 Cb 0.02 -0.43 0.20 0.00 0.35 0.00 0.00 39.48 39.61 1cg7 n PHE 48 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1cg7 n GLY 49 N -1.82 -1.38 0.00 7.13 0.00 -1.26 -0.74 105.19 107.12 1cg7 n GLY 49 Ca 0.39 0.93 0.01 0.00 0.00 0.00 0.00 46.02 47.35 1cg7 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cg7 n GLN 50 N -5.41 0.82 -0.20 1.61 0.00 0.50 -4.55 117.38 110.15 1cg7 n GLN 50 Ca 0.18 -0.01 -0.06 0.00 0.00 0.00 0.00 57.00 57.10 1cg7 n GLN 50 Cb 0.58 -1.05 0.03 0.00 0.00 0.00 0.00 30.24 29.81 1cg7 n GLN 50 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1cg7 h VAL 51 N 0.00 1.16 0.00 -0.39 2.07 -0.66 0.18 116.25 118.61 1cg7 h VAL 51 Ca -0.01 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.19 1cg7 h VAL 51 Cb 0.30 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1cg7 h VAL 51 CO 0.00 0.16 0.00 0.61 0.02 0.00 0.00 177.57 178.36 1cg7 n GLY 52 N -1.20 -1.18 0.88 2.17 0.00 0.08 -0.13 105.19 105.80 1cg7 n GLY 52 Ca 0.04 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.17 1cg7 n GLY 52 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1cg7 n LYS 53 N -1.76 2.20 -0.01 1.61 4.76 -0.03 -4.27 118.16 120.66 1cg7 n LYS 53 Ca 0.04 -1.75 -0.02 0.00 -2.87 0.00 0.00 58.31 53.71 1cg7 n LYS 53 Cb 0.22 -1.47 -0.01 0.00 -1.84 0.00 0.00 35.03 31.94 1cg7 n LYS 53 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1cg7 n LYS 54 N 1.09 0.04 -0.40 1.97 4.01 -0.56 -4.66 118.16 119.65 1cg7 n LYS 54 Ca 0.16 0.01 0.35 0.00 -0.51 0.00 0.00 58.31 58.33 1cg7 n LYS 54 Cb 0.54 -0.70 0.63 0.00 -0.51 0.00 0.00 35.03 34.99 1cg7 n LYS 54 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1cg7 h LEU 55 N -0.04 0.27 -1.77 -0.35 3.38 -0.73 1.77 115.31 117.84 1cg7 h LEU 55 Ca -0.04 0.20 0.36 0.00 0.09 0.00 0.00 57.88 58.49 1cg7 h LEU 55 Cb 1.04 0.20 -0.07 0.00 0.09 0.00 0.00 40.66 41.91 1cg7 h LEU 55 CO -0.02 -0.31 0.87 1.23 0.09 0.00 0.00 178.44 180.30 1cg7 h GLY 56 N 0.04 0.45 1.79 0.83 0.00 -1.81 1.57 103.07 105.94 1cg7 h GLY 56 Ca 0.85 -0.06 -0.17 0.00 0.00 0.00 0.00 47.33 47.95 1cg7 h GLY 56 CO -0.59 -0.08 -0.71 1.05 0.00 0.00 0.00 176.54 176.21 1cg7 h GLU 57 N 0.10 0.21 0.02 4.80 -0.00 0.24 -2.31 114.58 117.64 1cg7 h GLU 57 Ca 0.64 -0.17 -0.24 0.00 -0.00 0.00 0.00 59.36 59.59 1cg7 h GLU 57 Cb 2.29 0.04 0.00 0.00 -0.00 0.00 0.00 28.75 31.08 1cg7 h GLU 57 CO -0.13 0.84 -0.99 0.87 -0.00 0.00 0.00 179.01 179.60 1cg7 h LYS 58 N 0.14 0.41 0.64 1.06 1.57 0.20 -2.33 116.57 118.25 1cg7 h LYS 58 Ca -0.02 -0.47 -0.03 0.00 -1.87 0.00 0.00 60.65 58.26 1cg7 h LYS 58 Cb 1.27 0.14 0.01 0.00 0.08 0.00 0.00 32.23 33.72 1cg7 h LYS 58 CO 0.11 1.14 -0.31 2.35 -0.57 0.00 0.00 179.45 182.17 1cg7 h TRP 59 N 0.22 -0.79 -0.53 -1.35 2.91 -0.38 1.87 115.95 117.89 1cg7 h TRP 59 Ca -0.09 -0.02 0.15 0.00 1.13 0.00 0.00 58.89 60.06 1cg7 h TRP 59 Cb 1.64 0.26 -0.02 0.00 -0.51 0.00 0.00 29.16 30.53 1cg7 h TRP 59 CO 0.06 -0.49 0.49 1.57 -1.03 0.00 0.00 178.44 179.04 1cg7 h LYS 60 N -0.87 0.00 0.00 2.65 2.10 -1.52 1.50 116.57 120.43 1cg7 h LYS 60 Ca -0.09 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.45 1cg7 h LYS 60 Cb 0.65 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.97 1cg7 h LYS 60 CO 0.14 0.00 -0.81 0.00 -2.00 0.00 0.00 179.45 176.79 1cg7 h ALA 61 N 1.51 0.67 0.00 0.07 0.00 -0.76 -3.16 119.26 117.60 1cg7 h ALA 61 Ca 0.25 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1cg7 h ALA 61 Cb 1.23 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1cg7 h ALA 61 CO -0.00 0.64 0.00 1.47 0.00 0.00 0.00 179.25 181.36 1cg7 n LEU 62 N -3.07 0.27 -0.97 0.00 -0.00 0.63 -4.95 117.00 108.90 1cg7 n LEU 62 Ca -0.02 0.60 0.12 0.00 -0.00 0.00 0.00 56.01 56.71 1cg7 n LEU 62 Cb 0.74 -0.59 -0.04 0.00 -0.00 0.00 0.00 43.42 43.54 1cg7 n LEU 62 CO 0.41 -0.55 -0.21 0.41 -0.00 0.00 0.00 177.39 177.45 1cg7 n THR 63 N -1.83 0.00 0.72 1.47 -1.04 -1.11 -2.31 114.28 110.19 1cg7 n THR 63 Ca 0.01 0.11 0.11 0.00 -2.04 0.00 0.00 64.05 62.24 1cg7 n THR 63 Cb 0.10 -0.42 0.46 0.00 -1.82 0.00 0.00 70.33 68.66 1cg7 n THR 63 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1cg7 n PRO 64 N -3.05 0.03 -0.02 -2.82 -0.04 -1.26 -1.61 135.00 126.23 1cg7 n PRO 64 Ca -0.01 0.15 -0.07 0.00 -0.04 0.00 0.00 63.50 63.53 1cg7 n PRO 64 Cb 0.61 -1.54 0.11 0.00 -0.04 0.00 0.00 33.50 32.63 1cg7 n PRO 64 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1cg7 h GLU 65 N 0.00 0.60 0.00 0.54 4.11 -1.98 0.36 114.58 118.21 1cg7 h GLU 65 Ca 0.00 -0.29 -0.15 0.00 0.07 0.00 0.00 59.36 58.99 1cg7 h GLU 65 Cb 0.40 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 1cg7 h GLU 65 CO 0.00 0.87 -2.15 0.39 0.07 0.00 0.00 179.01 178.19 1cg7 n GLU 66 N -4.05 0.68 0.15 1.06 -0.58 -0.98 -4.16 120.64 112.77 1cg7 n GLU 66 Ca -0.01 -0.12 0.12 0.00 -0.42 0.00 0.00 57.16 56.73 1cg7 n GLU 66 Cb 0.49 -1.51 0.20 0.00 -0.57 0.00 0.00 31.44 30.05 1cg7 n GLU 66 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 1cg7 h LYS 67 N 0.00 0.00 0.34 3.49 2.10 -1.30 -2.99 116.57 118.22 1cg7 h LYS 67 Ca -0.23 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.42 1cg7 h LYS 67 Cb 1.51 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.82 1cg7 h LYS 67 CO 0.01 0.00 -0.39 1.96 -2.00 0.00 0.00 179.45 179.03 1cg7 h GLN 68 N 0.00 -0.74 -0.03 0.07 4.20 -0.43 0.63 115.11 118.81 1cg7 h GLN 68 Ca 0.00 0.05 -0.17 0.00 0.06 0.00 0.00 58.65 58.59 1cg7 h GLN 68 Cb 0.90 0.17 0.01 0.00 0.30 0.00 0.00 27.48 28.86 1cg7 h GLN 68 CO 0.00 -0.49 -0.65 -1.00 -0.67 0.00 0.00 178.83 176.02 1cg7 h PRO 69 N -0.77 0.50 0.46 1.46 0.13 -1.80 -1.93 132.00 130.05 1cg7 h PRO 69 Ca -0.02 -0.49 -0.02 0.00 -0.87 0.00 0.00 66.00 64.60 1cg7 h PRO 69 Cb 0.70 0.13 -0.01 0.00 0.13 0.00 0.00 31.00 31.95 1cg7 h PRO 69 CO -0.09 1.13 -0.36 1.88 -0.23 0.00 0.00 178.00 180.33 1cg7 h TYR 70 N 0.05 -0.98 -0.92 1.56 0.05 -1.47 -1.40 116.97 113.86 1cg7 h TYR 70 Ca -0.07 -0.00 0.07 0.00 0.05 0.00 0.00 58.73 58.78 1cg7 h TYR 70 Cb 1.33 0.37 -0.06 0.00 1.01 0.00 0.00 36.73 39.37 1cg7 h TYR 70 CO 0.13 -0.50 0.60 1.49 -1.05 0.00 0.00 178.16 178.83 1cg7 h GLU 71 N -0.79 0.99 -0.68 4.88 4.81 0.14 0.11 114.58 124.04 1cg7 h GLU 71 Ca -0.06 -0.06 0.15 0.00 -0.13 0.00 0.00 59.36 59.26 1cg7 h GLU 71 Cb 0.66 -0.22 -0.04 0.00 0.63 0.00 0.00 28.75 29.77 1cg7 h GLU 71 CO 0.01 0.66 0.47 0.00 -0.73 0.00 0.00 179.01 179.41 1cg7 h ALA 72 N 1.51 2.25 -0.07 2.92 0.00 -0.99 0.38 119.26 125.26 1cg7 h ALA 72 Ca 0.41 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 55.10 1cg7 h ALA 72 Cb 0.25 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1cg7 h ALA 72 CO -0.16 -0.44 -0.81 -0.22 0.00 0.00 0.00 179.25 177.62 1cg7 h LYS 73 N 0.28 0.52 0.00 0.00 3.64 0.32 -2.67 116.57 118.65 1cg7 h LYS 73 Ca 0.33 -0.46 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 1cg7 h LYS 73 Cb 0.91 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1cg7 h LYS 73 CO -0.08 1.09 0.00 0.00 -2.27 0.00 0.00 179.45 178.19 1cg7 n ALA 74 N -2.55 1.70 0.22 5.00 0.00 0.11 -1.71 120.51 123.28 1cg7 n ALA 74 Ca -0.06 0.01 0.12 0.00 0.00 0.00 0.00 53.44 53.51 1cg7 n ALA 74 Cb 0.75 -1.32 0.30 0.00 0.00 0.00 0.00 19.45 19.18 1cg7 n ALA 74 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1cg7 h GLN 75 N 0.00 0.00 0.17 0.00 5.75 -0.65 -2.90 115.11 117.47 1cg7 h GLN 75 Ca 0.00 0.00 -0.32 0.00 -0.15 0.00 0.00 58.65 58.18 1cg7 h GLN 75 Cb 0.33 0.00 0.01 0.00 1.07 0.00 0.00 27.48 28.88 1cg7 h GLN 75 CO 0.00 0.09 -1.62 0.00 -2.65 0.00 0.00 178.83 174.65 1cg7 h ALA 76 N 1.91 0.15 0.00 3.38 0.00 -1.41 -3.26 119.26 120.02 1cg7 h ALA 76 Ca -0.00 -1.11 0.00 0.00 0.00 0.00 0.00 54.91 53.80 1cg7 h ALA 76 Cb 0.91 0.45 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1cg7 h ALA 76 CO 0.01 0.94 0.00 -3.47 0.00 0.00 0.00 179.25 176.73 1cg7 n ASP 77 N -3.71 0.51 0.25 0.00 2.03 -1.18 -0.72 116.55 113.72 1cg7 n ASP 77 Ca -0.24 0.67 0.15 0.00 0.52 0.00 0.00 54.79 55.89 1cg7 n ASP 77 Cb 1.02 -0.76 0.48 0.00 -0.72 0.00 0.00 41.12 41.13 1cg7 n ASP 77 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 1cg7 h LYS 78 N 0.00 0.00 0.00 -0.67 3.64 -1.55 -0.98 116.57 117.01 1cg7 h LYS 78 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1cg7 h LYS 78 Cb 0.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1cg7 h LYS 78 CO 0.00 0.03 -1.78 0.36 -2.27 0.00 0.00 179.45 175.79 1cg7 n LYS 79 N -3.12 0.61 0.08 1.90 2.85 0.10 -4.21 118.16 116.37 1cg7 n LYS 79 Ca 0.02 -0.14 -0.15 0.00 -1.05 0.00 0.00 58.31 57.00 1cg7 n LYS 79 Cb 0.40 -1.57 -0.14 0.00 -0.65 0.00 0.00 35.03 33.07 1cg7 n LYS 79 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 177.40 177.26 1cg7 h ARG 80 N 0.00 0.21 0.00 -1.58 2.43 -1.16 -3.21 114.38 111.08 1cg7 h ARG 80 Ca 0.00 -0.37 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 1cg7 h ARG 80 Cb 0.97 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 1cg7 h ARG 80 CO 0.00 1.12 0.00 0.98 -1.51 0.00 0.00 179.97 180.56 1cg7 n TYR 81 N -3.46 0.45 0.19 2.20 9.36 -0.40 -1.40 117.16 124.10 1cg7 n TYR 81 Ca -0.10 0.19 0.12 0.00 3.32 0.00 0.00 57.90 61.42 1cg7 n TYR 81 Cb 1.02 -0.80 0.09 0.00 -0.63 0.00 0.00 39.34 39.02 1cg7 n TYR 81 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 1cg7 h GLU 82 N 0.00 0.00 -0.11 2.98 5.08 -1.72 -2.99 114.58 117.82 1cg7 h GLU 82 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1cg7 h GLU 82 Cb 0.25 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.50 1cg7 h GLU 82 CO 0.00 0.00 -0.06 0.77 -1.00 0.00 0.00 179.01 178.72 1cg7 h SER 83 N 0.00 0.24 0.26 1.42 0.02 -1.34 -1.00 113.55 113.15 1cg7 h SER 83 Ca 0.00 -0.42 -0.16 0.00 -0.84 0.00 0.00 61.79 60.37 1cg7 h SER 83 Cb 0.98 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.44 1cg7 h SER 83 CO 0.00 0.61 -0.62 -0.33 -1.14 0.00 0.00 176.83 175.35 1cg7 h GLU 84 N -0.13 0.35 -0.25 3.45 5.08 -1.67 -2.88 114.58 118.54 1cg7 h GLU 84 Ca 0.02 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 58.08 1cg7 h GLU 84 Cb 0.52 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1cg7 h GLU 84 CO 0.02 0.86 -0.10 -0.22 -1.00 0.00 0.00 179.01 178.57 1cg7 h LYS 85 N 0.26 0.40 -0.01 2.33 3.11 -1.47 0.12 116.57 121.32 1cg7 h LYS 85 Ca -0.01 -0.10 0.00 0.00 -2.81 0.00 0.00 60.65 57.73 1cg7 h LYS 85 Cb 1.15 -0.05 -0.00 0.00 -1.00 0.00 0.00 32.23 32.33 1cg7 h LYS 85 CO 0.10 0.51 0.01 1.49 -2.81 0.00 0.00 179.45 178.75 1cg7 h GLU 86 N 0.38 0.01 -0.05 1.90 4.81 -0.96 0.62 114.58 121.29 1cg7 h GLU 86 Ca 0.08 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1cg7 h GLU 86 Cb 0.41 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.79 1cg7 h GLU 86 CO 0.02 0.03 -0.01 -0.07 -0.73 0.00 0.00 179.01 178.25 1cg7 h LEU 87 N -0.01 0.10 -0.73 1.64 4.07 -1.44 0.91 115.31 119.85 1cg7 h LEU 87 Ca 0.00 -0.38 0.09 0.00 0.08 0.00 0.00 57.88 57.67 1cg7 h LEU 87 Cb 0.02 -0.03 -0.07 0.00 1.08 0.00 0.00 40.66 41.67 1cg7 h LEU 87 CO -0.00 0.46 0.38 0.22 -1.08 0.00 0.00 178.44 178.42 1cg7 h TYR 88 N -0.26 0.68 -0.29 1.13 3.20 -0.47 0.48 116.97 121.43 1cg7 h TYR 88 Ca 0.01 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.84 1cg7 h TYR 88 Cb 0.42 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 1cg7 h TYR 88 CO 0.06 0.26 -0.10 -0.97 -1.64 0.00 0.00 178.16 175.76 1cg7 h ASN 89 N 0.65 0.60 -0.82 -2.11 -1.24 0.33 -1.68 115.58 111.30 1cg7 h ASN 89 Ca 0.36 -0.39 0.14 0.00 0.71 0.00 0.00 56.30 57.12 1cg7 h ASN 89 Cb 0.36 -0.16 -0.06 0.00 0.73 0.00 0.00 38.32 39.18 1cg7 h ASN 89 CO -0.26 0.85 0.54 0.00 -1.29 0.00 0.00 177.43 177.27 1cg7 h ALA 90 N 0.77 1.94 -0.01 1.57 0.00 0.22 0.31 119.26 124.06 1cg7 h ALA 90 Ca 0.07 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.83 1cg7 h ALA 90 Cb 0.61 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1cg7 h ALA 90 CO 0.04 -0.16 -0.72 1.15 0.00 0.00 0.00 179.25 179.56 1cg7 h THR 91 N 0.58 1.49 -1.63 0.00 2.02 -0.59 -3.42 112.91 111.37 1cg7 h THR 91 Ca 0.41 -2.39 -0.45 0.00 0.77 0.00 0.00 66.41 64.75 1cg7 h THR 91 Cb 0.74 2.29 0.00 0.00 -1.74 0.00 0.00 68.15 69.44 1cg7 h THR 91 CO -0.16 0.69 1.52 -0.76 0.37 0.00 0.00 175.52 177.18 1cg7 s LEU 92 N -7.49 3.36 0.00 2.58 1.02 0.11 -5.10 118.68 113.16 1cg7 s LEU 92 Ca -0.02 0.90 0.00 0.00 0.02 0.00 0.00 54.13 55.03 1cg7 s LEU 92 Cb 0.12 -2.51 0.00 0.00 0.02 0.00 0.00 46.19 43.82 1cg7 s LEU 92 CO 0.79 -2.84 0.00 0.00 0.02 0.00 0.00 176.35 174.32