#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 0.00 -0.28 2.03 0.11 -1.26 -5.16 120.40 115.83 1cg7 s VAL 2 Ca 0.00 -0.72 -0.06 0.00 -2.93 0.00 0.00 61.98 58.27 1cg7 s VAL 2 Cb 0.00 -2.10 0.15 0.00 -1.53 0.00 0.00 36.38 32.90 1cg7 s VAL 2 CO 0.00 0.00 0.58 -0.89 -3.33 0.00 0.00 175.10 171.46 1cg7 s THR 3 N -3.25 -0.93 1.03 5.04 2.01 -1.26 -5.17 115.64 113.11 1cg7 s THR 3 Ca 0.13 0.01 -0.17 0.00 0.31 0.00 0.00 61.69 61.97 1cg7 s THR 3 Cb -0.02 -0.95 0.25 0.00 0.01 0.00 0.00 72.50 71.79 1cg7 s THR 3 CO 0.04 -0.00 1.14 -0.81 -0.69 0.00 0.00 174.62 174.29 1cg7 n PRO 4 N 5.43 -2.10 -3.82 4.92 -0.04 -1.26 -5.10 135.00 133.04 1cg7 n PRO 4 Ca -0.07 -1.79 -0.08 0.00 -0.04 0.00 0.00 63.50 61.53 1cg7 n PRO 4 Cb 0.50 -1.41 0.03 0.00 -0.04 0.00 0.00 33.50 32.58 1cg7 n PRO 4 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1cg7 s ARG 5 N -5.53 2.12 -0.30 0.54 0.52 -1.26 -5.16 118.95 109.89 1cg7 s ARG 5 Ca 0.69 -1.38 -0.17 0.00 -0.52 0.00 0.00 55.73 54.35 1cg7 s ARG 5 Cb -0.04 0.59 0.18 0.00 0.52 0.00 0.00 34.95 36.19 1cg7 s ARG 5 CO 0.50 -1.00 1.19 -1.83 0.02 0.00 0.00 175.30 174.18 1cg7 s GLU 6 N -2.16 0.05 1.07 3.54 -1.05 -1.26 -5.18 118.70 113.72 1cg7 s GLU 6 Ca 0.17 0.08 -0.18 0.00 -0.15 0.00 0.00 54.97 54.88 1cg7 s GLU 6 Cb -0.05 0.04 0.26 0.00 -0.44 0.00 0.00 34.13 33.94 1cg7 s GLU 6 CO 0.11 -0.07 1.18 -0.35 0.95 0.00 0.00 175.26 177.08 1cg7 n PRO 7 N 5.34 -2.17 -3.52 -4.83 -0.04 -1.26 -5.10 135.00 123.43 1cg7 n PRO 7 Ca -0.03 -1.86 -0.14 0.00 -0.04 0.00 0.00 63.50 61.44 1cg7 n PRO 7 Cb 0.56 -1.46 -0.05 0.00 -0.04 0.00 0.00 33.50 32.51 1cg7 n PRO 7 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1cg7 s LYS 8 N -5.63 0.93 0.25 0.54 1.02 -1.26 -5.18 119.74 110.41 1cg7 s LYS 8 Ca 0.71 0.06 -0.19 0.00 0.02 0.00 0.00 55.97 56.57 1cg7 s LYS 8 Cb -0.04 0.44 0.02 0.00 -0.52 0.00 0.00 37.83 37.72 1cg7 s LYS 8 CO 0.52 -0.32 0.64 -1.59 -0.92 0.00 0.00 175.35 173.68 1cg7 s LYS 9 N -1.75 1.64 -0.13 1.68 0.00 -1.26 -5.19 119.74 114.74 1cg7 s LYS 9 Ca -0.05 -0.96 -0.34 0.00 0.00 0.00 0.00 55.97 54.62 1cg7 s LYS 9 Cb -0.00 0.57 0.14 0.00 0.00 0.00 0.00 37.83 38.54 1cg7 s LYS 9 CO 0.02 -0.73 1.38 -0.98 0.00 0.00 0.00 175.35 175.04 1cg7 s ARG 10 N -3.91 0.12 0.03 1.78 1.70 -1.26 -5.19 118.95 112.22 1cg7 s ARG 10 Ca 0.12 -0.06 -0.28 0.00 -0.47 0.00 0.00 55.73 55.04 1cg7 s ARG 10 Cb -0.04 0.04 0.09 0.00 -0.57 0.00 0.00 34.95 34.48 1cg7 s ARG 10 CO 0.04 -0.05 0.88 -0.08 -1.08 0.00 0.00 175.30 175.01 1cg7 s THR 11 N -2.14 0.00 0.37 4.99 -1.32 -1.26 -5.19 115.64 111.10 1cg7 s THR 11 Ca 0.14 -0.11 0.04 0.00 -1.21 0.00 0.00 61.69 60.55 1cg7 s THR 11 Cb 0.05 -1.16 -0.06 0.00 -1.51 0.00 0.00 72.50 69.81 1cg7 s THR 11 CO -0.05 0.00 0.05 0.28 -2.21 0.00 0.00 174.62 172.69 1cg7 s THR 12 N -3.18 1.33 -0.08 5.08 -1.32 -1.26 -5.16 115.64 111.05 1cg7 s THR 12 Ca 0.06 -2.00 -0.03 0.00 -1.21 0.00 0.00 61.69 58.51 1cg7 s THR 12 Cb -0.01 -2.75 0.04 0.00 -1.51 0.00 0.00 72.50 68.27 1cg7 s THR 12 CO -0.07 0.00 0.17 -0.60 -2.21 0.00 0.00 174.62 171.91 1cg7 s ARG 13 N -3.83 0.10 0.68 7.08 6.06 -1.26 -5.16 118.95 122.63 1cg7 s ARG 13 Ca 0.33 0.45 -0.03 0.00 -2.50 0.00 0.00 55.73 53.97 1cg7 s ARG 13 Cb 0.08 -0.18 0.14 0.00 0.06 0.00 0.00 34.95 35.05 1cg7 s ARG 13 CO 0.15 -0.19 0.93 1.63 -2.50 0.00 0.00 175.30 175.32 1cg7 n LYS 14 N 4.45 -0.25 -4.16 5.12 4.76 -1.26 -5.10 118.16 121.73 1cg7 n LYS 14 Ca -0.22 -2.26 -0.28 0.00 -2.87 0.00 0.00 58.31 52.67 1cg7 n LYS 14 Cb 0.51 -0.70 -0.17 0.00 -1.84 0.00 0.00 35.03 32.83 1cg7 n LYS 14 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 1cg7 s LYS 15 N -4.92 2.04 0.00 1.97 -2.85 -1.26 -5.09 119.74 109.63 1cg7 s LYS 15 Ca 0.60 -0.47 0.00 0.00 -1.00 0.00 0.00 55.97 55.09 1cg7 s LYS 15 Cb -0.03 -1.87 0.00 0.00 -2.06 0.00 0.00 37.83 33.87 1cg7 s LYS 15 CO 0.40 -0.18 0.00 1.63 0.10 0.00 0.00 175.35 177.30 1cg7 n LYS 16 N 4.58 0.00 0.00 1.78 4.76 -1.26 -5.19 118.16 122.83 1cg7 n LYS 16 Ca -0.17 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.27 1cg7 n LYS 16 Cb 0.50 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.69 1cg7 n LYS 16 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1cg7 n ASP 17 N 0.00 0.00 -3.25 4.39 5.68 -1.26 -5.17 116.55 116.94 1cg7 n ASP 17 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1cg7 n ASP 17 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1cg7 n ASP 17 CO 0.00 0.00 0.00 -0.81 -1.33 0.00 0.00 177.20 175.06 1cg7 n PRO 18 N -0.25 1.02 -1.66 0.11 -0.04 -1.26 -4.78 135.00 128.14 1cg7 n PRO 18 Ca 0.00 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.16 1cg7 n PRO 18 Cb 0.00 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.38 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 2.42 -3.97 3.54 6.94 -1.26 -4.82 115.26 118.12 1cg7 n ASN 19 Ca 0.00 -2.63 -0.09 0.00 -0.02 0.00 0.00 54.58 51.83 1cg7 n ASN 19 Cb 0.00 -1.51 -0.11 0.00 -2.36 0.00 0.00 39.78 35.80 1cg7 n ASN 19 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1cg7 s ALA 20 N 10.94 0.08 0.44 -2.53 0.00 -1.26 -3.43 121.76 126.00 1cg7 s ALA 20 Ca 0.69 -0.53 -0.22 0.00 0.00 0.00 0.00 51.96 51.90 1cg7 s ALA 20 Cb 0.03 0.14 -0.09 0.00 0.00 0.00 0.00 23.12 23.20 1cg7 s ALA 20 CO 0.16 -0.16 1.05 -1.25 0.00 0.00 0.00 175.76 175.57 1cg7 s PRO 21 N -1.39 4.01 -0.32 0.00 0.04 -1.26 -4.93 135.00 131.15 1cg7 s PRO 21 Ca -0.15 1.46 -0.05 0.00 0.04 0.00 0.00 61.00 62.30 1cg7 s PRO 21 Cb -0.09 -2.36 -0.08 0.00 0.04 0.00 0.00 34.50 32.01 1cg7 s PRO 21 CO -0.01 -0.27 3.12 1.17 0.04 0.00 0.00 177.00 181.05 1cg7 n LYS 22 N -0.44 2.33 -4.16 4.56 4.81 -1.26 -4.69 118.16 119.30 1cg7 n LYS 22 Ca 0.07 -1.82 -0.34 0.00 -0.87 0.00 0.00 58.31 55.35 1cg7 n LYS 22 Cb 0.51 -2.11 -0.03 0.00 0.02 0.00 0.00 35.03 33.42 1cg7 n LYS 22 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 1cg7 n ARG 23 N 1.63 -3.16 0.00 1.64 0.63 -1.26 -4.58 116.66 111.56 1cg7 n ARG 23 Ca 0.47 0.37 0.00 0.00 -0.92 0.00 0.00 57.85 57.78 1cg7 n ARG 23 Cb 0.69 -4.92 0.00 0.00 0.45 0.00 0.00 32.46 28.68 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 -4.40 0.00 -2.51 5.13 0.00 -1.26 -4.82 120.51 112.65 1cg7 n ALA 24 Ca -0.03 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.17 1cg7 n ALA 24 Cb 0.54 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.92 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 0.00 3.09 0.20 0.00 1.02 -1.26 -5.14 118.68 116.60 1cg7 s LEU 25 Ca 0.00 -0.96 -0.02 0.00 0.02 0.00 0.00 54.13 53.17 1cg7 s LEU 25 Cb 0.00 -1.47 -0.05 0.00 0.02 0.00 0.00 46.19 44.69 1cg7 s LEU 25 CO 0.00 -0.34 0.41 -0.44 0.02 0.00 0.00 176.35 176.01 1cg7 s SER 26 N -3.80 6.41 0.57 2.29 0.01 -1.26 -4.94 113.70 112.99 1cg7 s SER 26 Ca 0.37 0.49 0.39 0.00 1.31 0.00 0.00 55.95 58.50 1cg7 s SER 26 Cb 0.01 -2.05 1.44 0.00 0.21 0.00 0.00 66.02 65.63 1cg7 s SER 26 CO 0.21 -0.05 1.58 0.00 0.41 0.00 0.00 173.24 175.39 1cg7 h ALA 27 N 2.11 3.30 -0.02 1.44 0.00 -1.91 1.05 119.26 125.24 1cg7 h ALA 27 Ca -0.47 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.38 1cg7 h ALA 27 Cb 1.19 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 1cg7 h ALA 27 CO 0.69 -1.87 -0.00 -0.92 0.00 0.00 0.00 179.25 177.14 1cg7 h TYR 28 N 0.00 0.04 -0.06 0.00 3.20 -1.96 -2.62 116.97 115.56 1cg7 h TYR 28 Ca 0.66 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.54 1cg7 h TYR 28 Cb 2.97 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 41.23 1cg7 h TYR 28 CO 0.00 0.37 0.05 0.52 -1.64 0.00 0.00 178.16 177.45 1cg7 h MET 29 N -0.31 0.00 -0.34 1.82 2.86 0.78 0.27 114.93 120.01 1cg7 h MET 29 Ca 0.00 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.58 1cg7 h MET 29 Cb 0.35 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 1cg7 h MET 29 CO 0.00 0.00 -0.05 0.74 1.06 0.00 0.00 176.91 178.67 1cg7 h PHE 30 N 0.00 0.69 0.00 -0.22 -1.00 -1.20 1.06 116.94 116.28 1cg7 h PHE 30 Ca 0.03 -0.14 0.00 0.00 2.81 0.00 0.00 57.97 60.67 1cg7 h PHE 30 Cb 0.12 -0.17 0.00 0.00 3.61 0.00 0.00 35.95 39.51 1cg7 h PHE 30 CO 0.00 0.77 -0.04 0.35 -1.61 0.00 0.00 178.31 177.78 1cg7 h PHE 31 N 0.42 0.00 0.07 -0.55 3.57 -0.96 -3.30 116.94 116.18 1cg7 h PHE 31 Ca 0.09 0.00 -0.23 0.00 3.53 0.00 0.00 57.97 61.36 1cg7 h PHE 31 Cb 0.53 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.25 1cg7 h PHE 31 CO 0.04 0.00 -1.23 0.00 -2.23 0.00 0.00 178.31 174.89 1cg7 h ALA 32 N 2.07 0.20 -0.94 2.41 0.00 -0.29 -1.81 119.26 120.90 1cg7 h ALA 32 Ca 0.00 -1.08 0.27 0.00 0.00 0.00 0.00 54.91 54.11 1cg7 h ALA 32 Cb 0.97 0.52 -0.04 0.00 0.00 0.00 0.00 17.79 19.24 1cg7 h ALA 32 CO 0.00 0.72 0.91 -0.91 0.00 0.00 0.00 179.25 179.97 1cg7 h ASN 33 N -0.58 0.00 0.02 0.00 -0.26 0.11 1.74 115.58 116.61 1cg7 h ASN 33 Ca -0.29 0.00 -0.38 0.00 -0.56 0.00 0.00 56.30 55.07 1cg7 h ASN 33 Cb 1.54 0.00 -0.07 0.00 -1.06 0.00 0.00 38.32 38.74 1cg7 h ASN 33 CO -0.03 0.00 -2.39 1.21 -1.06 0.00 0.00 177.43 175.16 1cg7 n GLU 34 N -3.62 0.67 -0.74 0.81 2.13 -1.25 -4.23 120.64 114.41 1cg7 n GLU 34 Ca 0.20 0.09 -0.08 0.00 0.66 0.00 0.00 57.16 58.03 1cg7 n GLU 34 Cb 1.22 -1.54 0.18 0.00 0.27 0.00 0.00 31.44 31.57 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 -3.05 3.77 0.02 4.31 5.03 0.23 -3.95 115.26 121.63 1cg7 n ASN 35 Ca -0.39 -2.90 0.12 0.00 0.87 0.00 0.00 54.58 52.28 1cg7 n ASN 35 Cb 1.07 -0.69 0.24 0.00 -1.02 0.00 0.00 39.78 39.38 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 0.12 -0.00 3.52 3.00 0.53 -3.75 116.66 119.87 1cg7 n ARG 36 Ca 0.32 0.03 0.02 0.00 -0.00 0.00 0.00 57.85 58.22 1cg7 n ARG 36 Cb 1.13 -1.58 -0.03 0.00 0.00 0.00 0.00 32.46 31.99 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 -1.75 1.20 0.03 6.15 9.92 -1.25 -4.11 116.55 126.74 1cg7 n ASP 37 Ca 0.05 -0.45 -0.07 0.00 -0.53 0.00 0.00 54.79 53.79 1cg7 n ASP 37 Cb 0.38 1.06 0.11 0.00 -0.64 0.00 0.00 41.12 42.02 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 1.33 0.04 0.53 2.04 -1.76 0.50 117.51 120.19 1cg7 h ILE 38 Ca 0.00 -1.75 -0.15 0.00 1.00 0.00 0.00 64.86 63.96 1cg7 h ILE 38 Cb 0.14 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.97 1cg7 h ILE 38 CO 0.00 0.54 -0.79 0.58 0.00 0.00 0.00 178.15 178.47 1cg7 h VAL 39 N 0.34 1.32 -0.45 1.67 2.07 -1.80 -3.26 116.25 116.13 1cg7 h VAL 39 Ca 0.01 -2.32 0.07 0.00 0.82 0.00 0.00 66.70 65.28 1cg7 h VAL 39 Cb 1.01 2.85 -0.03 0.00 -1.52 0.00 0.00 31.29 33.61 1cg7 h VAL 39 CO 0.09 0.54 0.31 0.08 0.02 0.00 0.00 177.57 178.61 1cg7 h ARG 40 N -0.79 0.33 0.00 1.57 0.11 -1.71 0.72 114.38 114.61 1cg7 h ARG 40 Ca -0.19 -0.02 -0.06 0.00 0.10 0.00 0.00 59.98 59.81 1cg7 h ARG 40 Cb 1.32 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 32.32 1cg7 h ARG 40 CO -0.04 0.22 -0.29 1.03 0.10 0.00 0.00 179.97 180.99 1cg7 h SER 41 N 0.34 0.00 0.07 0.08 0.87 -1.00 0.59 113.55 114.50 1cg7 h SER 41 Ca 0.20 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 1cg7 h SER 41 Cb 0.36 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 1cg7 h SER 41 CO -0.05 0.29 -0.97 -0.62 -0.53 0.00 0.00 176.83 174.95 1cg7 n GLU 42 N -4.00 0.03 -3.06 2.24 -0.58 0.65 -4.50 120.64 111.42 1cg7 n GLU 42 Ca -0.02 -0.01 -0.16 0.00 -0.42 0.00 0.00 57.16 56.56 1cg7 n GLU 42 Cb 0.35 -1.50 -0.00 0.00 -0.57 0.00 0.00 31.44 29.72 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 -1.54 -0.14 0.00 1.62 3.02 0.22 -4.92 115.26 113.53 1cg7 n ASN 43 Ca 0.04 -3.16 0.12 0.00 -0.03 0.00 0.00 54.58 51.55 1cg7 n ASN 43 Cb 0.34 0.09 0.72 0.00 -0.61 0.00 0.00 39.78 40.32 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 0.45 0.75 0.02 3.52 -0.04 0.20 -2.02 135.00 137.89 1cg7 n PRO 44 Ca 0.19 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.77 1cg7 n PRO 44 Cb 0.66 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.76 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 -1.00 0.61 -1.92 3.54 -0.08 -1.26 -4.91 116.55 111.53 1cg7 n ASP 45 Ca 0.18 -0.19 0.00 0.00 -1.51 0.00 0.00 54.79 53.27 1cg7 n ASP 45 Cb 0.08 0.43 0.00 0.00 2.34 0.00 0.00 41.12 43.98 1cg7 n ASP 45 CO 0.00 0.00 0.00 2.30 0.12 0.00 0.00 177.20 179.62 1cg7 n ILE 46 N -1.79 0.00 -4.19 5.18 -5.35 -0.86 -5.17 119.36 107.19 1cg7 n ILE 46 Ca 0.04 0.00 -0.14 0.00 -0.27 0.00 0.00 62.75 62.38 1cg7 n ILE 46 Cb 0.39 -0.38 -0.05 0.00 -1.74 0.00 0.00 39.64 37.85 1cg7 n ILE 46 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1cg7 n THR 47 N -0.37 0.00 0.16 7.28 -2.24 -1.26 -5.02 114.28 112.84 1cg7 n THR 47 Ca 0.00 -1.71 0.17 0.00 -2.27 0.00 0.00 64.05 60.24 1cg7 n THR 47 Cb 0.00 0.86 0.78 0.00 -2.10 0.00 0.00 70.33 69.86 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 1.75 0.00 -0.83 4.78 3.57 -1.97 0.22 116.94 124.47 1cg7 h PHE 48 Ca -0.17 0.00 0.24 0.00 3.53 0.00 0.00 57.97 61.57 1cg7 h PHE 48 Cb 0.84 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.55 1cg7 h PHE 48 CO 0.00 0.00 0.62 0.78 -2.23 0.00 0.00 178.31 177.48 1cg7 h GLY 49 N 0.00 0.00 0.00 2.40 0.00 -1.98 1.14 103.07 104.63 1cg7 h GLY 49 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 1cg7 h GLY 49 CO -0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1cg7 n GLN 50 N -4.19 -0.05 -0.08 4.80 0.00 -0.24 -4.58 117.38 113.04 1cg7 n GLN 50 Ca 0.17 -0.47 -0.12 0.00 0.00 0.00 0.00 57.00 56.58 1cg7 n GLN 50 Cb 0.92 -0.79 -0.08 0.00 0.00 0.00 0.00 30.24 30.29 1cg7 n GLN 50 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1cg7 n VAL 51 N -0.07 0.96 0.20 -0.39 0.31 0.61 -4.09 118.33 115.86 1cg7 n VAL 51 Ca 0.00 -0.36 0.06 0.00 -0.01 0.00 0.00 64.34 64.03 1cg7 n VAL 51 Cb 0.16 -1.10 0.38 0.00 -0.91 0.00 0.00 33.84 32.37 1cg7 n VAL 51 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1cg7 h GLY 52 N 1.26 0.00 -2.51 2.92 0.00 0.11 -2.04 103.07 102.80 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 -0.06 0.00 0.00 1.17 0.00 0.00 0.00 176.54 177.65 1cg7 n LYS 53 N -3.59 2.84 -0.01 4.80 4.81 -1.22 -3.83 118.16 121.96 1cg7 n LYS 53 Ca -0.01 -2.38 0.02 0.00 -0.87 0.00 0.00 58.31 55.08 1cg7 n LYS 53 Cb 0.47 -1.62 -0.05 0.00 0.02 0.00 0.00 35.03 33.84 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 1.21 0.72 0.24 1.64 4.76 -0.82 -4.46 118.16 121.45 1cg7 n LYS 54 Ca 0.22 -0.05 0.14 0.00 -2.87 0.00 0.00 58.31 55.74 1cg7 n LYS 54 Cb 0.64 -1.16 0.32 0.00 -1.84 0.00 0.00 35.03 32.99 1cg7 n LYS 54 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1cg7 h LEU 55 N 0.00 0.00 -0.30 -0.35 3.38 -1.53 -3.15 115.31 113.36 1cg7 h LEU 55 Ca -0.03 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.76 1cg7 h LEU 55 Cb 0.51 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 1cg7 h LEU 55 CO 0.00 0.00 -0.51 1.23 0.09 0.00 0.00 178.44 179.25 1cg7 h GLY 56 N 3.44 0.96 2.00 0.83 0.00 -1.78 -1.61 103.07 106.91 1cg7 h GLY 56 Ca 0.00 -1.10 -0.05 0.00 0.00 0.00 0.00 47.33 46.18 1cg7 h GLY 56 CO 0.00 0.99 -0.23 1.05 0.00 0.00 0.00 176.54 178.35 1cg7 h GLU 57 N 0.67 0.00 0.06 4.80 4.11 -1.79 -1.82 114.58 120.61 1cg7 h GLU 57 Ca 0.02 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 59.21 1cg7 h GLU 57 Cb 1.12 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 1cg7 h GLU 57 CO 0.12 0.23 -1.08 0.87 0.07 0.00 0.00 179.01 179.21 1cg7 h LYS 58 N 0.00 0.17 0.19 1.06 1.57 -1.54 -2.02 116.57 116.00 1cg7 h LYS 58 Ca -0.00 -0.26 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 1cg7 h LYS 58 Cb 0.45 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.86 1cg7 h LYS 58 CO 0.03 1.09 -0.09 2.35 -0.57 0.00 0.00 179.45 182.26 1cg7 h TRP 59 N 0.06 -0.23 0.00 -1.35 2.91 -0.52 1.62 115.95 118.43 1cg7 h TRP 59 Ca -0.07 -0.01 -0.04 0.00 1.13 0.00 0.00 58.89 59.90 1cg7 h TRP 59 Cb 1.80 0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 30.52 1cg7 h TRP 59 CO 0.04 -0.05 -0.19 1.57 -1.03 0.00 0.00 178.44 178.77 1cg7 h LYS 60 N -0.36 0.00 -0.20 2.65 2.10 -1.42 0.85 116.57 120.18 1cg7 h LYS 60 Ca -0.03 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 1cg7 h LYS 60 Cb 0.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.61 1cg7 h LYS 60 CO 0.04 0.19 0.00 0.00 -2.00 0.00 0.00 179.45 177.68 1cg7 n ALA 61 N -2.43 2.49 1.85 0.07 0.00 -0.75 -3.81 120.51 117.93 1cg7 n ALA 61 Ca -0.02 -0.67 0.08 0.00 0.00 0.00 0.00 53.44 52.83 1cg7 n ALA 61 Cb 0.26 -1.01 0.44 0.00 0.00 0.00 0.00 19.45 19.14 1cg7 n ALA 61 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1cg7 n LEU 62 N 0.74 0.32 -1.22 0.00 7.94 0.55 -4.98 117.00 120.34 1cg7 n LEU 62 Ca 0.17 -0.14 0.13 0.00 -1.11 0.00 0.00 56.01 55.06 1cg7 n LEU 62 Cb 0.44 -0.02 -0.07 0.00 0.53 0.00 0.00 43.42 44.29 1cg7 n LEU 62 CO 0.14 0.07 -0.48 1.07 -1.11 0.00 0.00 177.39 177.08 1cg7 n THR 63 N -0.54 -0.77 1.38 1.96 5.66 -1.25 -2.85 114.28 117.88 1cg7 n THR 63 Ca 0.12 0.73 0.12 0.00 -3.05 0.00 0.00 64.05 61.97 1cg7 n THR 63 Cb 0.10 -1.11 0.67 0.00 -1.55 0.00 0.00 70.33 68.45 1cg7 n THR 63 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1cg7 n PRO 64 N -3.97 0.63 0.08 1.09 -0.04 -1.26 -2.36 135.00 129.17 1cg7 n PRO 64 Ca -0.07 0.02 0.01 0.00 -0.04 0.00 0.00 63.50 63.42 1cg7 n PRO 64 Cb 0.51 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.43 1cg7 n PRO 64 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1cg7 h GLU 65 N 0.00 0.00 0.00 0.54 4.39 -2.00 -1.97 114.58 115.54 1cg7 h GLU 65 Ca 0.00 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.37 1cg7 h GLU 65 Cb 0.06 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.65 1cg7 h GLU 65 CO 0.00 0.39 -2.20 0.39 -1.16 0.00 0.00 179.01 176.43 1cg7 n GLU 66 N -3.03 0.67 0.07 2.33 -0.58 -1.02 -4.23 120.64 114.87 1cg7 n GLU 66 Ca -0.05 0.05 -0.03 0.00 -0.42 0.00 0.00 57.16 56.71 1cg7 n GLU 66 Cb 0.79 -1.59 -0.07 0.00 -0.57 0.00 0.00 31.44 30.01 1cg7 n GLU 66 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 1cg7 h LYS 67 N 0.00 0.00 -0.42 3.49 3.64 -1.59 -2.92 116.57 118.77 1cg7 h LYS 67 Ca -0.46 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.00 1cg7 h LYS 67 Cb 2.12 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 33.85 1cg7 h LYS 67 CO 0.04 0.72 -0.42 1.96 -2.27 0.00 0.00 179.45 179.48 1cg7 h GLN 68 N 0.00 -0.30 -0.00 1.90 4.20 -1.52 1.20 115.11 120.58 1cg7 h GLN 68 Ca -0.05 0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 1cg7 h GLN 68 Cb 1.65 0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.50 1cg7 h GLN 68 CO 0.10 -0.20 -0.03 -1.00 -0.67 0.00 0.00 178.83 177.03 1cg7 h PRO 69 N -0.31 0.02 -0.02 1.46 0.13 -1.78 -2.22 132.00 129.28 1cg7 h PRO 69 Ca 0.15 -0.02 0.03 0.00 -0.87 0.00 0.00 66.00 65.28 1cg7 h PRO 69 Cb 0.58 0.01 -0.06 0.00 0.13 0.00 0.00 31.00 31.65 1cg7 h PRO 69 CO -0.58 0.76 -0.49 1.88 -0.23 0.00 0.00 178.00 179.34 1cg7 h TYR 70 N -0.72 -1.42 -0.67 1.56 0.05 -1.29 -0.03 116.97 114.46 1cg7 h TYR 70 Ca -0.00 0.05 0.03 0.00 0.05 0.00 0.00 58.73 58.85 1cg7 h TYR 70 Cb 0.77 0.63 -0.04 0.00 1.01 0.00 0.00 36.73 39.10 1cg7 h TYR 70 CO 0.19 -0.54 0.44 1.49 -1.05 0.00 0.00 178.16 178.69 1cg7 h GLU 71 N -0.62 0.79 -0.03 4.88 4.81 0.13 0.11 114.58 124.65 1cg7 h GLU 71 Ca 0.03 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1cg7 h GLU 71 Cb 0.69 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.89 1cg7 h GLU 71 CO -0.36 0.52 0.03 0.00 -0.73 0.00 0.00 179.01 178.47 1cg7 h ALA 72 N 1.61 1.79 0.01 2.92 0.00 -0.45 -0.37 119.26 124.76 1cg7 h ALA 72 Ca 0.26 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.93 1cg7 h ALA 72 Cb 0.05 0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.86 1cg7 h ALA 72 CO -0.07 -0.05 -0.96 -0.22 0.00 0.00 0.00 179.25 177.96 1cg7 h LYS 73 N 0.00 0.64 0.00 0.00 3.64 0.96 -2.95 116.57 118.86 1cg7 h LYS 73 Ca 0.02 -0.69 0.00 0.00 -1.27 0.00 0.00 60.65 58.70 1cg7 h LYS 73 Cb 0.07 0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1cg7 h LYS 73 CO -0.00 1.28 0.00 0.00 -2.27 0.00 0.00 179.45 178.46 1cg7 h ALA 74 N 0.38 1.00 0.00 5.00 0.00 -0.67 0.12 119.26 125.08 1cg7 h ALA 74 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1cg7 h ALA 74 Cb 1.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.41 1cg7 h ALA 74 CO 0.19 0.00 0.00 0.94 0.00 0.00 0.00 179.25 180.38 1cg7 n GLN 75 N -2.51 0.10 -0.02 0.00 -0.06 -0.68 -3.33 117.38 110.89 1cg7 n GLN 75 Ca -0.00 0.12 -0.22 0.00 -2.00 0.00 0.00 57.00 54.90 1cg7 n GLN 75 Cb 0.13 -1.63 -0.13 0.00 -4.06 0.00 0.00 30.24 24.55 1cg7 n GLN 75 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1cg7 h ALA 76 N 2.76 0.32 -0.00 1.69 0.00 -0.85 -3.31 119.26 119.86 1cg7 h ALA 76 Ca 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 54.91 53.65 1cg7 h ALA 76 Cb 0.56 0.65 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1cg7 h ALA 76 CO 0.00 1.03 0.31 0.22 0.00 0.00 0.00 179.25 180.81 1cg7 h ASP 77 N -0.29 0.00 -1.44 0.00 3.58 -1.54 -0.43 116.42 116.31 1cg7 h ASP 77 Ca -0.37 0.00 0.42 0.00 0.42 0.00 0.00 57.03 57.50 1cg7 h ASP 77 Cb 1.79 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 42.76 1cg7 h ASP 77 CO 0.01 0.00 1.01 0.50 -2.88 0.00 0.00 179.24 177.88 1cg7 h LYS 78 N 0.00 0.05 0.20 0.28 3.64 -1.65 1.59 116.57 120.67 1cg7 h LYS 78 Ca 0.00 -0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 59.03 1cg7 h LYS 78 Cb 0.62 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.45 1cg7 h LYS 78 CO -0.00 0.03 -1.70 0.87 -2.27 0.00 0.00 179.45 176.38 1cg7 h LYS 79 N 0.05 0.42 -0.27 1.90 6.56 -1.34 -3.26 116.57 120.63 1cg7 h LYS 79 Ca 0.72 -0.71 -0.04 0.00 -1.06 0.00 0.00 60.65 59.57 1cg7 h LYS 79 Cb 2.71 0.26 -0.02 0.00 -0.57 0.00 0.00 32.23 34.62 1cg7 h LYS 79 CO -0.10 1.33 0.01 0.00 -2.06 0.00 0.00 179.45 178.63 1cg7 h ARG 80 N 0.11 0.40 0.00 3.15 2.47 0.17 -0.11 114.38 120.57 1cg7 h ARG 80 Ca -0.33 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.32 1cg7 h ARG 80 Cb 2.11 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 30.36 1cg7 h ARG 80 CO 0.19 0.42 0.00 0.98 0.56 0.00 0.00 179.97 182.13 1cg7 n TYR 81 N -4.33 0.00 -0.01 3.04 9.36 0.33 -2.90 117.16 122.65 1cg7 n TYR 81 Ca 0.01 0.00 -0.15 0.00 3.32 0.00 0.00 57.90 61.08 1cg7 n TYR 81 Cb 0.21 -0.37 -0.14 0.00 -0.63 0.00 0.00 39.34 38.41 1cg7 n TYR 81 CO 0.00 0.00 0.00 -1.91 0.22 0.00 0.00 176.86 175.17 1cg7 n GLU 82 N -1.37 0.69 -0.27 2.98 2.13 -0.08 -3.48 120.64 121.24 1cg7 n GLU 82 Ca 0.09 0.28 0.08 0.00 0.66 0.00 0.00 57.16 58.27 1cg7 n GLU 82 Cb 0.23 -1.76 0.22 0.00 0.27 0.00 0.00 31.44 30.41 1cg7 n GLU 82 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1cg7 h SER 83 N 0.03 0.29 1.60 4.31 0.87 -1.35 0.74 113.55 120.04 1cg7 h SER 83 Ca -0.35 0.12 -0.03 0.00 -1.23 0.00 0.00 61.79 60.31 1cg7 h SER 83 Cb 2.02 0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 64.09 1cg7 h SER 83 CO 0.09 0.07 -0.13 -0.33 -0.53 0.00 0.00 176.83 176.00 1cg7 h GLU 84 N 0.43 0.00 -0.02 2.24 5.08 -1.71 -3.03 114.58 117.57 1cg7 h GLU 84 Ca 0.46 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.66 1cg7 h GLU 84 Cb 0.75 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 1cg7 h GLU 84 CO -0.45 0.13 -0.70 -0.22 -1.00 0.00 0.00 179.01 176.77 1cg7 h LYS 85 N 0.00 0.12 -0.29 2.33 3.11 0.27 -2.18 116.57 119.93 1cg7 h LYS 85 Ca -0.00 -0.10 -0.03 0.00 -2.81 0.00 0.00 60.65 57.71 1cg7 h LYS 85 Cb 0.97 0.02 -0.02 0.00 -1.00 0.00 0.00 32.23 32.20 1cg7 h LYS 85 CO 0.02 0.77 0.06 0.93 -2.81 0.00 0.00 179.45 178.42 1cg7 h GLU 86 N 0.08 0.42 0.08 1.90 5.08 -0.41 0.80 114.58 122.53 1cg7 h GLU 86 Ca -0.02 -0.06 -0.16 0.00 -1.00 0.00 0.00 59.36 58.12 1cg7 h GLU 86 Cb 1.25 -0.08 0.02 0.00 0.50 0.00 0.00 28.75 30.44 1cg7 h GLU 86 CO 0.10 0.40 -0.68 -0.07 -1.00 0.00 0.00 179.01 177.77 1cg7 h LEU 87 N 0.41 0.45 -0.09 1.33 -0.00 -1.60 -2.62 115.31 113.20 1cg7 h LEU 87 Ca 0.10 -0.89 0.03 0.00 -0.00 0.00 0.00 57.88 57.12 1cg7 h LEU 87 Cb 0.18 -0.14 -0.03 0.00 -0.00 0.00 0.00 40.66 40.67 1cg7 h LEU 87 CO -0.00 1.29 -0.09 0.22 -0.00 0.00 0.00 178.44 179.86 1cg7 h TYR 88 N -0.33 -0.23 -0.14 1.13 3.20 -1.02 -0.86 116.97 118.72 1cg7 h TYR 88 Ca -0.11 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.75 1cg7 h TYR 88 Cb 1.47 0.11 -0.01 0.00 1.54 0.00 0.00 36.73 39.85 1cg7 h TYR 88 CO 0.18 -0.14 -0.02 -2.95 -1.64 0.00 0.00 178.16 173.59 1cg7 h ASN 89 N -0.12 0.18 0.26 -2.11 -1.07 -0.96 0.14 115.58 111.91 1cg7 h ASN 89 Ca 0.07 -0.02 0.00 0.00 0.07 0.00 0.00 56.30 56.42 1cg7 h ASN 89 Cb 0.21 -0.05 0.00 0.00 -2.07 0.00 0.00 38.32 36.42 1cg7 h ASN 89 CO -0.16 0.24 0.00 0.00 0.07 0.00 0.00 177.43 177.58 1cg7 h ALA 90 N 1.79 1.00 -0.03 4.14 0.00 -0.77 0.20 119.26 125.59 1cg7 h ALA 90 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1cg7 h ALA 90 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1cg7 h ALA 90 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 179.25 176.88 1cg7 n THR 91 N -2.37 0.03 0.00 0.00 5.66 0.49 -4.06 114.28 114.03 1cg7 n THR 91 Ca -0.00 -0.10 -0.03 0.00 -3.05 0.00 0.00 64.05 60.86 1cg7 n THR 91 Cb 0.11 -0.11 -0.01 0.00 -1.55 0.00 0.00 70.33 68.76 1cg7 n THR 91 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 1cg7 n LEU 92 N -0.51 1.29 0.00 1.09 4.77 0.65 -5.13 117.00 119.16 1cg7 n LEU 92 Ca 0.19 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 1cg7 n LEU 92 Cb 0.18 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.83 1cg7 n LEU 92 CO 0.15 -0.55 0.00 0.00 -1.33 0.00 0.00 177.39 175.66