#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cg7 s VAL 2 N 0.00 1.71 0.49 1.12 -7.23 -1.26 -4.92 120.40 110.31 1cg7 s VAL 2 Ca 0.00 0.00 -0.20 0.00 -1.81 0.00 0.00 61.98 59.97 1cg7 s VAL 2 Cb 0.00 -2.39 -0.11 0.00 0.56 0.00 0.00 36.38 34.44 1cg7 s VAL 2 CO 0.00 0.00 0.53 1.07 -0.31 0.00 0.00 175.10 176.39 1cg7 n THR 3 N -4.75 1.93 -2.42 5.32 5.66 -1.26 -4.86 114.28 113.91 1cg7 n THR 3 Ca 0.10 -0.50 -0.43 0.00 -3.05 0.00 0.00 64.05 60.17 1cg7 n THR 3 Cb 0.58 -0.62 -0.02 0.00 -1.55 0.00 0.00 70.33 68.73 1cg7 n THR 3 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1cg7 s PRO 4 N -1.80 4.27 0.59 1.09 0.04 -1.26 -5.01 135.00 132.92 1cg7 s PRO 4 Ca 0.65 1.68 -0.16 0.00 0.04 0.00 0.00 61.00 63.22 1cg7 s PRO 4 Cb -0.52 -3.70 -0.04 0.00 0.04 0.00 0.00 34.50 30.29 1cg7 s PRO 4 CO 0.57 -0.62 1.06 -0.98 0.04 0.00 0.00 177.00 177.06 1cg7 s ARG 5 N 3.07 3.30 -0.45 4.56 1.70 -1.26 -5.03 118.95 124.83 1cg7 s ARG 5 Ca 0.56 1.22 0.02 0.00 -0.47 0.00 0.00 55.73 57.06 1cg7 s ARG 5 Cb -0.23 -2.03 0.14 0.00 -0.57 0.00 0.00 34.95 32.26 1cg7 s ARG 5 CO 0.17 -0.83 0.24 -2.00 -1.08 0.00 0.00 175.30 171.81 1cg7 s GLU 6 N -4.05 1.38 -1.06 3.89 2.12 -1.26 -5.05 118.70 114.66 1cg7 s GLU 6 Ca 0.64 -2.09 -0.22 0.00 0.36 0.00 0.00 54.97 53.65 1cg7 s GLU 6 Cb -0.16 -2.45 -0.00 0.00 0.26 0.00 0.00 34.13 31.77 1cg7 s GLU 6 CO 0.37 -1.16 1.74 -1.25 -0.54 0.00 0.00 175.26 174.42 1cg7 s PRO 7 N 0.26 3.15 -0.38 4.30 0.04 -1.26 -4.51 135.00 136.60 1cg7 s PRO 7 Ca 0.18 -1.03 0.04 0.00 0.04 0.00 0.00 61.00 60.23 1cg7 s PRO 7 Cb -0.24 -5.28 0.32 0.00 0.04 0.00 0.00 34.50 29.33 1cg7 s PRO 7 CO -0.00 -2.89 1.26 1.17 0.04 0.00 0.00 177.00 176.58 1cg7 n LYS 8 N 8.68 0.49 -3.69 4.56 4.81 -1.26 -5.15 118.16 126.60 1cg7 n LYS 8 Ca 0.40 -1.19 -0.01 0.00 -0.87 0.00 0.00 58.31 56.64 1cg7 n LYS 8 Cb 0.48 -0.54 -0.01 0.00 0.02 0.00 0.00 35.03 34.98 1cg7 n LYS 8 CO 0.00 0.00 0.00 -1.59 1.17 0.00 0.00 177.40 176.98 1cg7 s LYS 9 N 0.16 0.79 -0.54 1.64 -2.85 -1.26 -5.11 119.74 112.57 1cg7 s LYS 9 Ca 0.22 -0.44 -0.21 0.00 -1.00 0.00 0.00 55.97 54.54 1cg7 s LYS 9 Cb 0.28 0.27 0.05 0.00 -2.06 0.00 0.00 37.83 36.38 1cg7 s LYS 9 CO -0.14 -0.36 0.76 1.03 0.10 0.00 0.00 175.35 176.74 1cg7 s ARG 10 N -2.85 3.19 -0.13 1.78 0.52 -1.26 -4.98 118.95 115.22 1cg7 s ARG 10 Ca 0.13 -0.68 -0.30 0.00 -0.52 0.00 0.00 55.73 54.36 1cg7 s ARG 10 Cb 0.02 -4.10 0.09 0.00 0.52 0.00 0.00 34.95 31.49 1cg7 s ARG 10 CO -0.01 -1.37 0.83 -0.08 0.02 0.00 0.00 175.30 174.69 1cg7 s THR 11 N 3.19 0.00 -0.33 0.02 -1.32 -1.26 -5.13 115.64 110.81 1cg7 s THR 11 Ca 0.21 0.00 0.01 0.00 -1.21 0.00 0.00 61.69 60.69 1cg7 s THR 11 Cb -0.17 -1.00 0.10 0.00 -1.51 0.00 0.00 72.50 69.93 1cg7 s THR 11 CO 0.14 0.00 0.11 -0.89 -2.21 0.00 0.00 174.62 171.77 1cg7 s THR 12 N -0.86 1.22 -0.10 5.08 2.01 -1.26 -5.09 115.64 116.64 1cg7 s THR 12 Ca -0.05 -1.74 0.01 0.00 0.31 0.00 0.00 61.69 60.22 1cg7 s THR 12 Cb -0.01 -1.91 0.02 0.00 0.01 0.00 0.00 72.50 70.61 1cg7 s THR 12 CO 0.05 -0.69 -0.12 -0.13 -0.69 0.00 0.00 174.62 173.04 1cg7 s ARG 13 N 1.31 1.83 -0.30 4.92 0.52 -1.26 -5.06 118.95 120.90 1cg7 s ARG 13 Ca 0.11 -0.42 -0.17 0.00 -0.52 0.00 0.00 55.73 54.74 1cg7 s ARG 13 Cb -0.19 -1.63 0.18 0.00 0.52 0.00 0.00 34.95 33.84 1cg7 s ARG 13 CO -0.19 -0.10 1.19 0.21 0.02 0.00 0.00 175.30 176.44 1cg7 s LYS 14 N 1.10 0.00 0.27 3.54 2.20 -1.26 -5.07 119.74 120.51 1cg7 s LYS 14 Ca -0.06 0.00 0.00 0.00 -0.36 0.00 0.00 55.97 55.55 1cg7 s LYS 14 Cb -0.14 0.00 0.00 0.00 -1.51 0.00 0.00 37.83 36.18 1cg7 s LYS 14 CO -0.02 -0.00 0.00 1.17 -0.36 0.00 0.00 175.35 176.14 1cg7 n LYS 15 N 4.83 0.00 -1.95 4.03 4.81 -1.26 -4.99 118.16 123.63 1cg7 n LYS 15 Ca 0.10 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 57.21 1cg7 n LYS 15 Cb 0.60 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.60 1cg7 n LYS 15 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1cg7 n LYS 16 N -3.14 1.83 -3.07 1.64 5.02 -1.26 -4.62 118.16 114.56 1cg7 n LYS 16 Ca 0.00 -2.47 0.02 0.00 -2.02 0.00 0.00 58.31 53.84 1cg7 n LYS 16 Cb 0.00 -3.53 -0.00 0.00 -0.02 0.00 0.00 35.03 31.47 1cg7 n LYS 16 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1cg7 s ASP 17 N 5.79 -1.15 0.00 4.39 1.11 -1.26 -5.16 116.67 120.39 1cg7 s ASP 17 Ca 0.64 -0.48 0.00 0.00 0.18 0.00 0.00 52.55 52.88 1cg7 s ASP 17 Cb 0.03 1.49 0.00 0.00 1.07 0.00 0.00 42.92 45.52 1cg7 s ASP 17 CO 0.12 -0.14 0.00 -0.81 1.18 0.00 0.00 175.17 175.52 1cg7 n PRO 18 N 4.32 1.19 -3.72 8.23 -0.04 -1.26 -4.65 135.00 139.07 1cg7 n PRO 18 Ca 0.09 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.26 1cg7 n PRO 18 Cb 0.59 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.06 1cg7 n PRO 18 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1cg7 n ASN 19 N 0.00 -5.02 -3.80 3.54 0.23 -1.26 -4.78 115.26 104.18 1cg7 n ASN 19 Ca 0.00 -0.74 -0.11 0.00 -0.53 0.00 0.00 54.58 53.20 1cg7 n ASN 19 Cb 0.00 -1.64 -0.08 0.00 -2.08 0.00 0.00 39.78 35.98 1cg7 n ASN 19 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1cg7 s ALA 20 N -2.56 -0.51 0.98 -2.53 0.00 -1.26 -2.96 121.76 112.92 1cg7 s ALA 20 Ca 0.11 -0.16 -0.14 0.00 0.00 0.00 0.00 51.96 51.77 1cg7 s ALA 20 Cb -0.01 0.31 0.18 0.00 0.00 0.00 0.00 23.12 23.60 1cg7 s ALA 20 CO 0.89 -0.39 1.17 -1.25 0.00 0.00 0.00 175.76 176.18 1cg7 s PRO 21 N -2.60 0.56 -0.48 0.00 0.04 -1.26 -4.97 135.00 126.28 1cg7 s PRO 21 Ca -0.05 0.06 0.03 0.00 0.04 0.00 0.00 61.00 61.09 1cg7 s PRO 21 Cb -0.01 -1.79 0.54 0.00 0.04 0.00 0.00 34.50 33.28 1cg7 s PRO 21 CO -0.04 -2.55 1.79 1.17 0.04 0.00 0.00 177.00 177.42 1cg7 n LYS 22 N -3.97 2.47 -2.55 4.56 3.00 -1.26 -4.95 118.16 115.45 1cg7 n LYS 22 Ca 0.10 -3.27 -0.01 0.00 -0.00 0.00 0.00 58.31 55.13 1cg7 n LYS 22 Cb 0.59 -2.16 -0.01 0.00 0.00 0.00 0.00 35.03 33.46 1cg7 n LYS 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1cg7 n ARG 23 N -1.02 -3.34 -1.66 1.64 1.74 -1.26 -4.84 116.66 107.91 1cg7 n ARG 23 Ca 0.54 2.68 -0.46 0.00 -0.77 0.00 0.00 57.85 59.84 1cg7 n ARG 23 Cb 1.12 -4.84 -0.04 0.00 -1.02 0.00 0.00 32.46 27.68 1cg7 n ARG 23 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1cg7 n ALA 24 N 0.82 1.07 -2.24 7.54 0.00 -1.26 -4.98 120.51 121.47 1cg7 n ALA 24 Ca -0.09 0.45 -0.21 0.00 0.00 0.00 0.00 53.44 53.59 1cg7 n ALA 24 Cb 0.13 -2.31 -0.03 0.00 0.00 0.00 0.00 19.45 17.24 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 0.72 3.40 0.16 0.00 1.43 -1.26 -5.11 118.68 118.01 1cg7 s LEU 25 Ca 0.77 -0.74 -0.14 0.00 -1.03 0.00 0.00 54.13 53.00 1cg7 s LEU 25 Cb -0.70 -2.05 -0.07 0.00 0.03 0.00 0.00 46.19 43.40 1cg7 s LEU 25 CO 0.41 -0.63 0.55 -0.44 0.23 0.00 0.00 176.35 176.47 1cg7 s SER 26 N -4.12 6.80 0.56 2.29 0.01 -1.26 -4.90 113.70 113.08 1cg7 s SER 26 Ca 0.48 1.06 0.49 0.00 1.31 0.00 0.00 55.95 59.29 1cg7 s SER 26 Cb -0.03 -2.28 1.73 0.00 0.21 0.00 0.00 66.02 65.64 1cg7 s SER 26 CO 0.28 0.07 1.59 0.00 0.41 0.00 0.00 173.24 175.59 1cg7 h ALA 27 N 3.39 3.81 -0.13 1.44 0.00 -1.91 1.71 119.26 127.57 1cg7 h ALA 27 Ca -0.48 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.33 1cg7 h ALA 27 Cb 1.19 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 1cg7 h ALA 27 CO 0.66 -2.35 -0.05 -0.92 0.00 0.00 0.00 179.25 176.59 1cg7 h TYR 28 N 0.00 0.30 -0.10 0.00 3.20 -1.97 -2.80 116.97 115.60 1cg7 h TYR 28 Ca 0.91 -0.07 -0.02 0.00 3.14 0.00 0.00 58.73 62.69 1cg7 h TYR 28 Cb 3.65 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 41.84 1cg7 h TYR 28 CO -0.00 0.57 -0.04 0.52 -1.64 0.00 0.00 178.16 177.57 1cg7 h MET 29 N -0.07 0.14 0.44 1.82 2.86 0.22 0.53 114.93 120.86 1cg7 h MET 29 Ca 0.03 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1cg7 h MET 29 Cb 0.49 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.13 1cg7 h MET 29 CO 0.02 0.19 -0.21 0.74 1.06 0.00 0.00 176.91 178.71 1cg7 h PHE 30 N 0.13 -0.54 0.00 -0.22 0.04 -1.14 1.35 116.94 116.56 1cg7 h PHE 30 Ca 0.03 -0.01 -0.10 0.00 2.80 0.00 0.00 57.97 60.69 1cg7 h PHE 30 Cb 0.17 0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.48 1cg7 h PHE 30 CO 0.00 -0.27 -0.49 0.35 -0.60 0.00 0.00 178.31 177.30 1cg7 h PHE 31 N -0.71 0.00 0.01 -0.55 3.04 -1.26 -3.21 116.94 114.26 1cg7 h PHE 31 Ca -0.06 0.00 -0.15 0.00 3.98 0.00 0.00 57.97 61.74 1cg7 h PHE 31 Cb 0.51 0.00 0.01 0.00 2.56 0.00 0.00 35.95 39.03 1cg7 h PHE 31 CO -0.02 0.49 -0.57 0.00 -2.02 0.00 0.00 178.31 176.19 1cg7 h ALA 32 N 1.51 0.06 -0.54 2.41 0.00 0.19 0.60 119.26 123.49 1cg7 h ALA 32 Ca -0.00 -0.57 0.16 0.00 0.00 0.00 0.00 54.91 54.50 1cg7 h ALA 32 Cb 1.15 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1cg7 h ALA 32 CO 0.06 0.32 0.67 -0.91 0.00 0.00 0.00 179.25 179.40 1cg7 h ASN 33 N -0.17 0.00 0.00 0.00 -0.26 0.18 0.77 115.58 116.10 1cg7 h ASN 33 Ca -0.07 0.00 -0.25 0.00 -0.56 0.00 0.00 56.30 55.42 1cg7 h ASN 33 Cb 1.30 0.00 -0.05 0.00 -1.06 0.00 0.00 38.32 38.51 1cg7 h ASN 33 CO 0.11 0.00 -1.94 1.21 -1.06 0.00 0.00 177.43 175.75 1cg7 n GLU 34 N -3.46 1.73 -0.82 0.81 2.13 -1.16 -4.39 120.64 115.48 1cg7 n GLU 34 Ca 0.11 -0.01 -0.13 0.00 0.66 0.00 0.00 57.16 57.79 1cg7 n GLU 34 Cb 0.87 -1.35 0.15 0.00 0.27 0.00 0.00 31.44 31.38 1cg7 n GLU 34 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1cg7 n ASN 35 N -2.50 3.66 0.03 4.31 5.03 0.21 -3.91 115.26 122.09 1cg7 n ASN 35 Ca -0.22 -3.04 0.11 0.00 0.87 0.00 0.00 54.58 52.30 1cg7 n ASN 35 Cb 0.94 -0.72 -0.05 0.00 -1.02 0.00 0.00 39.78 38.94 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 -0.46 0.42 0.00 3.52 0.00 0.23 -4.12 116.66 116.25 1cg7 n ARG 36 Ca 0.38 -0.04 0.01 0.00 -0.00 0.00 0.00 57.85 58.21 1cg7 n ARG 36 Cb 1.25 -1.61 -0.01 0.00 0.00 0.00 0.00 32.46 32.09 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 -2.14 0.32 0.07 6.15 9.92 -1.25 -4.18 116.55 125.44 1cg7 n ASP 37 Ca 0.00 -0.66 -0.10 0.00 -0.53 0.00 0.00 54.79 53.51 1cg7 n ASP 37 Cb 0.49 0.82 0.01 0.00 -0.64 0.00 0.00 41.12 41.80 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 0.10 1.42 0.08 0.53 2.04 -1.72 -1.68 117.51 118.28 1cg7 h ILE 38 Ca 0.00 -2.35 -0.22 0.00 1.00 0.00 0.00 64.86 63.29 1cg7 h ILE 38 Cb 0.07 2.29 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 1cg7 h ILE 38 CO 0.00 0.70 -1.11 0.58 0.00 0.00 0.00 178.15 178.31 1cg7 h VAL 39 N 0.19 1.17 -0.53 1.67 2.07 -1.80 -3.32 116.25 115.70 1cg7 h VAL 39 Ca -0.04 -2.37 0.08 0.00 0.82 0.00 0.00 66.70 65.19 1cg7 h VAL 39 Cb 1.41 2.78 -0.03 0.00 -1.52 0.00 0.00 31.29 33.92 1cg7 h VAL 39 CO 0.13 0.62 0.36 0.08 0.02 0.00 0.00 177.57 178.78 1cg7 h ARG 40 N -0.54 0.37 -0.76 1.57 0.11 -1.72 0.58 114.38 113.97 1cg7 h ARG 40 Ca -0.25 -0.02 -0.00 0.00 0.10 0.00 0.00 59.98 59.80 1cg7 h ARG 40 Cb 1.55 -0.08 -0.04 0.00 1.11 0.00 0.00 29.97 32.51 1cg7 h ARG 40 CO 0.01 0.24 0.46 1.03 0.10 0.00 0.00 179.97 181.81 1cg7 h SER 41 N 0.38 0.91 0.42 0.08 0.87 -1.41 1.44 113.55 116.24 1cg7 h SER 41 Ca 0.24 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 1cg7 h SER 41 Cb 0.45 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.18 1cg7 h SER 41 CO -0.06 0.70 -0.71 -0.62 -0.53 0.00 0.00 176.83 175.61 1cg7 n GLU 42 N -4.38 0.08 -3.12 2.24 -0.58 0.12 -4.32 120.64 110.67 1cg7 n GLU 42 Ca 0.08 0.01 -0.17 0.00 -0.42 0.00 0.00 57.16 56.66 1cg7 n GLU 42 Cb 0.07 -1.53 -0.02 0.00 -0.57 0.00 0.00 31.44 29.39 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 -1.64 0.63 0.00 1.62 3.02 0.18 -4.91 115.26 114.17 1cg7 n ASN 43 Ca 0.04 -3.04 0.05 0.00 -0.03 0.00 0.00 54.58 51.60 1cg7 n ASN 43 Cb 0.36 -0.43 0.27 0.00 -0.61 0.00 0.00 39.78 39.38 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 0.26 0.75 0.09 3.52 -0.04 0.48 -2.26 135.00 137.80 1cg7 n PRO 44 Ca 0.22 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.76 1cg7 n PRO 44 Cb 0.67 -1.19 -0.01 0.00 -0.04 0.00 0.00 33.50 32.93 1cg7 n PRO 44 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1cg7 h ASP 45 N 0.00 0.00 -5.73 3.54 3.32 -1.91 -3.47 116.42 112.18 1cg7 h ASP 45 Ca 0.00 0.00 -0.38 0.00 0.02 0.00 0.00 57.03 56.67 1cg7 h ASP 45 Cb 0.00 0.00 0.04 0.00 0.22 0.00 0.00 39.33 39.59 1cg7 h ASP 45 CO 0.00 0.19 -0.01 2.30 -1.72 0.00 0.00 179.24 180.01 1cg7 n ILE 46 N -2.79 0.00 -4.62 0.35 -0.00 -0.96 -5.14 119.36 106.20 1cg7 n ILE 46 Ca -0.03 -1.43 -0.28 0.00 -0.00 0.00 0.00 62.75 61.01 1cg7 n ILE 46 Cb 0.64 -0.74 -0.07 0.00 -0.00 0.00 0.00 39.64 39.48 1cg7 n ILE 46 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.55 176.90 1cg7 n THR 47 N -2.18 0.00 0.28 7.28 -2.24 -1.26 -4.99 114.28 111.17 1cg7 n THR 47 Ca 0.13 -2.31 0.19 0.00 -2.27 0.00 0.00 64.05 59.79 1cg7 n THR 47 Cb 0.47 0.62 0.98 0.00 -2.10 0.00 0.00 70.33 70.30 1cg7 n THR 47 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1cg7 h PHE 48 N 1.43 0.00 0.00 4.78 3.04 -1.97 0.24 116.94 124.46 1cg7 h PHE 48 Ca -0.36 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.59 1cg7 h PHE 48 Cb 1.21 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.72 1cg7 h PHE 48 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 178.31 176.70 1cg7 n GLY 49 N -1.06 -1.54 0.00 2.40 0.00 -1.26 -0.93 105.19 102.80 1cg7 n GLY 49 Ca -0.02 -0.03 0.02 0.00 0.00 0.00 0.00 46.02 45.98 1cg7 n GLY 49 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1cg7 n GLN 50 N -2.00 1.10 -0.03 1.61 1.13 0.58 -4.30 117.38 115.46 1cg7 n GLN 50 Ca 0.05 -0.02 -0.22 0.00 -1.94 0.00 0.00 57.00 54.87 1cg7 n GLN 50 Cb 0.36 -1.00 -0.13 0.00 0.11 0.00 0.00 30.24 29.58 1cg7 n GLN 50 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1cg7 h VAL 51 N 0.00 0.81 0.00 5.09 2.07 -0.83 -3.25 116.25 120.14 1cg7 h VAL 51 Ca 0.00 -2.29 0.00 0.00 0.82 0.00 0.00 66.70 65.23 1cg7 h VAL 51 Cb 0.13 2.44 0.00 0.00 -1.52 0.00 0.00 31.29 32.34 1cg7 h VAL 51 CO 0.00 0.65 0.00 1.23 0.02 0.00 0.00 177.57 179.47 1cg7 h GLY 52 N 0.12 0.00 -3.08 2.17 0.00 -1.26 0.13 103.07 101.15 1cg7 h GLY 52 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.96 1cg7 h GLY 52 CO -0.03 0.00 0.00 1.17 0.00 0.00 0.00 176.54 177.68 1cg7 n LYS 53 N -2.90 4.08 0.00 4.80 4.81 -1.26 -4.32 118.16 123.38 1cg7 n LYS 53 Ca 0.01 -2.97 0.00 0.00 -0.87 0.00 0.00 58.31 54.48 1cg7 n LYS 53 Cb 0.30 -2.01 0.00 0.00 0.02 0.00 0.00 35.03 33.34 1cg7 n LYS 53 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1cg7 n LYS 54 N 0.80 0.00 -0.32 1.64 5.02 -0.68 -4.78 118.16 119.84 1cg7 n LYS 54 Ca 0.26 0.00 0.15 0.00 -2.02 0.00 0.00 58.31 56.70 1cg7 n LYS 54 Cb 0.99 -0.58 0.30 0.00 -0.02 0.00 0.00 35.03 35.72 1cg7 n LYS 54 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1cg7 h LEU 55 N 0.00 -0.26 -1.42 -0.35 3.38 -0.97 1.55 115.31 117.25 1cg7 h LEU 55 Ca 0.00 0.25 0.32 0.00 0.09 0.00 0.00 57.88 58.54 1cg7 h LEU 55 Cb 0.54 0.39 -0.10 0.00 0.09 0.00 0.00 40.66 41.58 1cg7 h LEU 55 CO 0.00 -0.29 0.73 1.23 0.09 0.00 0.00 178.44 180.21 1cg7 h GLY 56 N 0.08 1.16 2.00 0.83 0.00 -1.83 1.57 103.07 106.88 1cg7 h GLY 56 Ca 0.59 -0.16 -0.07 0.00 0.00 0.00 0.00 47.33 47.68 1cg7 h GLY 56 CO -0.81 -0.20 -0.33 0.83 0.00 0.00 0.00 176.54 176.03 1cg7 h GLU 57 N 0.28 0.00 0.17 4.80 5.08 0.19 -2.08 114.58 123.02 1cg7 h GLU 57 Ca 0.66 -0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.72 1cg7 h GLU 57 Cb 1.86 -0.00 0.03 0.00 0.50 0.00 0.00 28.75 31.14 1cg7 h GLU 57 CO -0.31 0.33 -1.24 0.87 -1.00 0.00 0.00 179.01 177.66 1cg7 h LYS 58 N 0.00 0.54 -0.64 2.33 1.79 0.22 -1.57 116.57 119.25 1cg7 h LYS 58 Ca -0.00 -0.81 0.10 0.00 -2.18 0.00 0.00 60.65 57.75 1cg7 h LYS 58 Cb 0.58 0.28 -0.07 0.00 -1.58 0.00 0.00 32.23 31.44 1cg7 h LYS 58 CO 0.04 1.37 0.26 2.35 -1.08 0.00 0.00 179.45 182.40 1cg7 h TRP 59 N 0.12 0.46 0.00 -1.35 2.91 -0.61 1.78 115.95 119.25 1cg7 h TRP 59 Ca -0.20 0.03 -0.08 0.00 1.13 0.00 0.00 58.89 59.77 1cg7 h TRP 59 Cb 1.95 -0.11 -0.01 0.00 -0.51 0.00 0.00 29.16 30.48 1cg7 h TRP 59 CO 0.13 0.13 -0.36 1.57 -1.03 0.00 0.00 178.44 178.88 1cg7 h LYS 60 N 0.46 0.00 -0.00 2.65 2.10 -1.43 -2.30 116.57 118.05 1cg7 h LYS 60 Ca 0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.97 1cg7 h LYS 60 Cb 0.39 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.72 1cg7 h LYS 60 CO -0.30 0.36 -0.21 0.00 -2.00 0.00 0.00 179.45 177.30 1cg7 n ALA 61 N -2.26 2.93 1.29 0.07 0.00 0.13 -3.29 120.51 119.38 1cg7 n ALA 61 Ca 0.00 -0.27 0.11 0.00 0.00 0.00 0.00 53.44 53.29 1cg7 n ALA 61 Cb 0.54 -1.28 0.64 0.00 0.00 0.00 0.00 19.45 19.35 1cg7 n ALA 61 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1cg7 n LEU 62 N -1.20 0.00 -1.11 0.00 4.32 0.56 -4.99 117.00 114.59 1cg7 n LEU 62 Ca 0.10 0.10 0.12 0.00 -0.02 0.00 0.00 56.01 56.31 1cg7 n LEU 62 Cb 0.31 -0.10 -0.04 0.00 -1.62 0.00 0.00 43.42 41.97 1cg7 n LEU 62 CO 0.28 -0.03 -0.29 1.07 -1.22 0.00 0.00 177.39 177.20 1cg7 n THR 63 N -1.10 -0.00 0.14 -5.08 5.66 -1.21 -2.84 114.28 109.85 1cg7 n THR 63 Ca 0.15 0.31 0.01 0.00 -3.05 0.00 0.00 64.05 61.46 1cg7 n THR 63 Cb 0.11 -0.62 0.15 0.00 -1.55 0.00 0.00 70.33 68.42 1cg7 n THR 63 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 1cg7 h PRO 64 N -1.26 0.00 -0.43 1.09 0.13 -1.92 0.32 132.00 129.93 1cg7 h PRO 64 Ca -0.06 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 65.09 1cg7 h PRO 64 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 1cg7 h PRO 64 CO 0.03 0.59 0.27 0.93 -0.23 0.00 0.00 178.00 179.59 1cg7 h GLU 65 N 0.00 0.53 0.00 0.86 5.08 -1.99 1.75 114.58 120.81 1cg7 h GLU 65 Ca -0.01 -0.03 -0.23 0.00 -1.00 0.00 0.00 59.36 58.09 1cg7 h GLU 65 Cb 1.21 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.30 1cg7 h GLU 65 CO 0.08 0.35 -1.58 -1.91 -1.00 0.00 0.00 179.01 174.95 1cg7 n GLU 66 N -4.82 0.63 0.00 2.33 4.07 -1.13 -3.68 120.64 118.04 1cg7 n GLU 66 Ca 0.01 0.25 0.14 0.00 -0.06 0.00 0.00 57.16 57.51 1cg7 n GLU 66 Cb 0.04 -1.79 0.61 0.00 -0.06 0.00 0.00 31.44 30.24 1cg7 n GLU 66 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1cg7 n LYS 67 N -2.96 0.46 0.22 5.31 4.81 0.11 -2.93 118.16 123.20 1cg7 n LYS 67 Ca -0.14 -0.12 -0.13 0.00 -0.87 0.00 0.00 58.31 57.05 1cg7 n LYS 67 Cb 0.95 -1.50 -0.07 0.00 0.02 0.00 0.00 35.03 34.43 1cg7 n LYS 67 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 1cg7 h GLN 68 N 0.30 -0.58 -0.05 1.64 4.20 0.26 -1.92 115.11 118.96 1cg7 h GLN 68 Ca 0.00 0.04 -0.22 0.00 0.06 0.00 0.00 58.65 58.53 1cg7 h GLN 68 Cb 0.37 0.13 0.01 0.00 0.30 0.00 0.00 27.48 28.30 1cg7 h GLN 68 CO 0.00 -0.28 -0.82 -1.00 -0.67 0.00 0.00 178.83 176.07 1cg7 h PRO 69 N -0.98 0.65 0.28 1.46 0.13 -1.75 -1.61 132.00 130.17 1cg7 h PRO 69 Ca -0.06 -0.62 -0.00 0.00 -0.87 0.00 0.00 66.00 64.44 1cg7 h PRO 69 Cb 0.57 0.16 -0.03 0.00 0.13 0.00 0.00 31.00 31.83 1cg7 h PRO 69 CO 0.10 1.23 -0.44 1.88 -0.23 0.00 0.00 178.00 180.55 1cg7 h TYR 70 N 0.30 -1.23 -0.43 1.56 0.05 -1.64 0.18 116.97 115.76 1cg7 h TYR 70 Ca -0.09 0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.67 1cg7 h TYR 70 Cb 1.47 0.50 -0.02 0.00 1.01 0.00 0.00 36.73 39.69 1cg7 h TYR 70 CO 0.11 -0.54 0.09 1.49 -1.05 0.00 0.00 178.16 178.26 1cg7 h GLU 71 N -0.76 0.64 -0.13 4.88 4.81 -1.47 -0.92 114.58 121.65 1cg7 h GLU 71 Ca -0.03 -0.12 0.04 0.00 -0.13 0.00 0.00 59.36 59.12 1cg7 h GLU 71 Cb 0.69 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 1cg7 h GLU 71 CO -0.14 0.60 0.12 0.00 -0.73 0.00 0.00 179.01 178.87 1cg7 h ALA 72 N 1.48 1.85 0.19 2.92 0.00 -0.69 0.33 119.26 125.34 1cg7 h ALA 72 Ca 0.14 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.78 1cg7 h ALA 72 Cb 0.26 0.01 0.03 0.00 0.00 0.00 0.00 17.79 18.09 1cg7 h ALA 72 CO -0.00 -0.19 -1.17 -0.22 0.00 0.00 0.00 179.25 177.67 1cg7 h LYS 73 N 0.00 0.46 0.00 0.00 1.63 0.43 -3.16 116.57 115.92 1cg7 h LYS 73 Ca 0.06 -0.75 0.00 0.00 -0.85 0.00 0.00 60.65 59.12 1cg7 h LYS 73 Cb 0.31 0.27 0.00 0.00 -0.60 0.00 0.00 32.23 32.21 1cg7 h LYS 73 CO -0.00 1.35 0.00 0.00 -3.45 0.00 0.00 179.45 177.35 1cg7 h ALA 74 N 0.15 1.00 0.00 5.00 0.00 -0.64 -1.60 119.26 123.17 1cg7 h ALA 74 Ca -0.20 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1cg7 h ALA 74 Cb 1.91 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.70 1cg7 h ALA 74 CO 0.22 0.00 -0.15 0.37 0.00 0.00 0.00 179.25 179.69 1cg7 h GLN 75 N 0.00 0.00 0.08 0.00 5.75 -0.39 -2.47 115.11 118.08 1cg7 h GLN 75 Ca 0.00 0.00 -0.27 0.00 -0.15 0.00 0.00 58.65 58.23 1cg7 h GLN 75 Cb 0.41 0.00 0.03 0.00 1.07 0.00 0.00 27.48 28.99 1cg7 h GLN 75 CO 0.00 0.15 -1.10 0.00 -2.65 0.00 0.00 178.83 175.23 1cg7 h ALA 76 N 1.85 0.03 0.00 3.38 0.00 -1.32 -3.05 119.26 120.15 1cg7 h ALA 76 Ca -0.00 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1cg7 h ALA 76 Cb 0.90 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1cg7 h ALA 76 CO 0.02 0.63 0.00 -3.47 0.00 0.00 0.00 179.25 176.43 1cg7 n ASP 77 N -3.88 0.42 0.17 0.00 2.03 -1.18 -1.51 116.55 112.61 1cg7 n ASP 77 Ca -0.13 0.57 0.04 0.00 0.52 0.00 0.00 54.79 55.79 1cg7 n ASP 77 Cb 0.92 -0.67 0.28 0.00 -0.72 0.00 0.00 41.12 40.93 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 -1.33 -2.30 116.57 115.91 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 0.46 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1cg7 h LYS 78 CO 0.00 0.44 -0.81 0.36 -2.27 0.00 0.00 179.45 177.17 1cg7 n LYS 79 N -3.57 1.92 0.11 1.90 -0.00 -0.97 -4.31 118.16 113.25 1cg7 n LYS 79 Ca -0.00 -0.02 -0.00 0.00 -0.00 0.00 0.00 58.31 58.29 1cg7 n LYS 79 Cb 0.55 -1.22 -0.02 0.00 -0.00 0.00 0.00 35.03 34.33 1cg7 n LYS 79 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.40 177.31 1cg7 h ARG 80 N 0.00 0.00 0.00 -1.58 2.43 -1.09 -3.13 114.38 111.01 1cg7 h ARG 80 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1cg7 h ARG 80 Cb 0.39 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 1cg7 h ARG 80 CO 0.00 0.61 0.00 -0.92 -1.51 0.00 0.00 179.97 178.15 1cg7 h TYR 81 N 0.00 0.00 0.00 2.20 3.20 -1.60 -3.02 116.97 117.75 1cg7 h TYR 81 Ca -0.02 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.85 1cg7 h TYR 81 Cb 1.51 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.78 1cg7 h TYR 81 CO 0.00 0.00 -0.87 0.93 -1.64 0.00 0.00 178.16 176.58 1cg7 h GLU 82 N 0.00 0.00 0.01 1.82 5.08 -1.75 -2.83 114.58 116.91 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 0.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.07 1cg7 h GLU 82 CO 0.00 0.00 -0.14 0.77 -1.00 0.00 0.00 179.01 178.64 1cg7 h SER 83 N 0.00 0.10 0.31 1.42 0.02 -1.48 -2.74 113.55 111.19 1cg7 h SER 83 Ca 0.00 -0.89 -0.13 0.00 -0.84 0.00 0.00 61.79 59.93 1cg7 h SER 83 Cb 0.96 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.46 1cg7 h SER 83 CO 0.00 0.97 -0.54 -0.08 -1.14 0.00 0.00 176.83 176.04 1cg7 h GLU 84 N -0.77 0.25 -0.50 3.45 4.81 -1.68 -2.85 114.58 117.28 1cg7 h GLU 84 Ca -0.02 -0.15 -0.05 0.00 -0.13 0.00 0.00 59.36 59.00 1cg7 h GLU 84 Cb 1.01 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.38 1cg7 h GLU 84 CO 0.03 0.73 0.09 -0.22 -0.73 0.00 0.00 179.01 178.90 1cg7 h LYS 85 N 0.19 0.78 -0.91 1.92 1.63 -1.59 -0.72 116.57 117.88 1cg7 h LYS 85 Ca 0.00 -0.17 0.14 0.00 -0.85 0.00 0.00 60.65 59.78 1cg7 h LYS 85 Cb 1.02 -0.11 -0.07 0.00 -0.60 0.00 0.00 32.23 32.46 1cg7 h LYS 85 CO 0.08 0.73 0.58 1.49 -3.45 0.00 0.00 179.45 178.89 1cg7 h GLU 86 N 0.75 0.71 0.05 1.90 4.81 -1.23 1.45 114.58 123.01 1cg7 h GLU 86 Ca 0.16 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.26 1cg7 h GLU 86 Cb 0.33 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 29.56 1cg7 h GLU 86 CO 0.00 0.47 -0.37 -0.07 -0.73 0.00 0.00 179.01 178.31 1cg7 h LEU 87 N 0.73 0.23 -1.06 1.64 3.38 -1.44 -0.86 115.31 117.93 1cg7 h LEU 87 Ca 0.46 -0.94 0.03 0.00 0.09 0.00 0.00 57.88 57.52 1cg7 h LEU 87 Cb 0.70 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.33 1cg7 h LEU 87 CO -0.22 1.15 0.63 0.22 0.09 0.00 0.00 178.44 180.31 1cg7 h TYR 88 N -0.65 1.18 -0.08 1.13 3.20 -0.25 -0.24 116.97 121.26 1cg7 h TYR 88 Ca -0.06 0.03 -0.17 0.00 3.14 0.00 0.00 58.73 61.66 1cg7 h TYR 88 Cb 1.25 -0.40 0.01 0.00 1.54 0.00 0.00 36.73 39.14 1cg7 h TYR 88 CO 0.23 0.70 -0.62 -0.97 -1.64 0.00 0.00 178.16 175.85 1cg7 h ASN 89 N 1.23 0.68 -0.44 -2.11 -1.24 0.19 -2.13 115.58 111.76 1cg7 h ASN 89 Ca 0.37 -0.67 0.11 0.00 0.71 0.00 0.00 56.30 56.82 1cg7 h ASN 89 Cb -0.04 -0.20 -0.02 0.00 0.73 0.00 0.00 38.32 38.79 1cg7 h ASN 89 CO -0.11 1.26 0.31 0.00 -1.29 0.00 0.00 177.43 177.60 1cg7 h ALA 90 N 0.45 2.31 0.06 1.57 0.00 -0.58 0.27 119.26 123.34 1cg7 h ALA 90 Ca -0.06 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.60 1cg7 h ALA 90 Cb 1.28 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 1cg7 h ALA 90 CO 0.13 -0.43 -1.11 1.15 0.00 0.00 0.00 179.25 178.99 1cg7 h THR 91 N 0.08 1.62 -2.26 0.00 2.02 -0.92 -3.35 112.91 110.10 1cg7 h THR 91 Ca 0.21 -3.27 -0.58 0.00 0.77 0.00 0.00 66.41 63.54 1cg7 h THR 91 Cb 0.72 2.89 -0.42 0.00 -1.74 0.00 0.00 68.15 69.61 1cg7 h THR 91 CO -0.02 0.94 -0.67 0.00 0.37 0.00 0.00 175.52 176.14 1cg7 n LEU 92 N -3.43 4.16 0.00 2.58 -0.00 0.64 -5.11 117.00 115.84 1cg7 n LEU 92 Ca -0.04 -5.61 0.00 0.00 -0.00 0.00 0.00 56.01 50.36 1cg7 n LEU 92 Cb 0.98 -0.49 0.00 0.00 -0.00 0.00 0.00 43.42 43.91 1cg7 n LEU 92 CO 0.50 2.32 0.00 0.00 -0.00 0.00 0.00 177.39 180.21