#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 0.00 2.03 0.11 -1.26 -5.13 120.40 116.15 1cg7 s VAL 2 Ca 0.00 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.05 1cg7 s VAL 2 Cb 0.00 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.85 1cg7 s VAL 2 CO 0.00 0.00 0.00 1.07 -3.33 0.00 0.00 175.10 172.84 1cg7 n THR 3 N 0.62 0.00 -1.53 5.04 5.66 -1.26 -5.17 114.28 117.64 1cg7 n THR 3 Ca -0.12 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.60 1cg7 n THR 3 Cb 0.58 0.00 0.14 0.00 -1.55 0.00 0.00 70.33 69.51 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 0.00 1.01 -0.30 1.09 0.04 -1.26 -5.09 135.00 130.49 1cg7 s PRO 4 Ca 0.00 0.24 -0.25 0.00 0.04 0.00 0.00 61.00 61.03 1cg7 s PRO 4 Cb 0.00 -1.83 0.18 0.00 0.04 0.00 0.00 34.50 32.89 1cg7 s PRO 4 CO 0.00 -2.28 1.38 0.50 0.04 0.00 0.00 177.00 176.64 1cg7 s ARG 5 N -5.32 0.12 -0.30 4.56 3.00 -1.26 -5.14 118.95 114.61 1cg7 s ARG 5 Ca 0.65 0.15 -0.13 0.00 -1.00 0.00 0.00 55.73 55.39 1cg7 s ARG 5 Cb -0.14 0.06 0.18 0.00 0.00 0.00 0.00 34.95 35.05 1cg7 s ARG 5 CO 0.53 -0.02 1.11 -2.00 0.00 0.00 0.00 175.30 174.93 1cg7 s GLU 6 N 0.10 0.08 0.00 5.12 2.12 -1.26 -5.18 118.70 119.68 1cg7 s GLU 6 Ca 0.06 0.04 0.00 0.00 0.36 0.00 0.00 54.97 55.43 1cg7 s GLU 6 Cb -0.05 0.03 0.00 0.00 0.26 0.00 0.00 34.13 34.37 1cg7 s GLU 6 CO -0.14 -0.14 0.00 -0.35 -0.54 0.00 0.00 175.26 174.09 1cg7 n PRO 7 N 4.63 -0.03 -3.65 4.30 -0.04 -1.26 -5.11 135.00 133.84 1cg7 n PRO 7 Ca 0.09 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.54 1cg7 n PRO 7 Cb 0.60 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 34.00 1cg7 n PRO 7 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 1cg7 s LYS 8 N -2.06 0.08 -0.23 0.54 -2.85 -1.26 -5.18 119.74 108.78 1cg7 s LYS 8 Ca 0.00 0.11 -0.30 0.00 -1.00 0.00 0.00 55.97 54.78 1cg7 s LYS 8 Cb 0.00 0.03 0.16 0.00 -2.06 0.00 0.00 37.83 35.96 1cg7 s LYS 8 CO 0.00 -0.01 1.20 -1.59 0.10 0.00 0.00 175.35 175.04 1cg7 s LYS 9 N 0.59 0.30 -0.27 1.78 -2.85 -1.26 -5.18 119.74 112.84 1cg7 s LYS 9 Ca -0.01 0.06 -0.29 0.00 -1.00 0.00 0.00 55.97 54.74 1cg7 s LYS 9 Cb -0.04 0.14 0.18 0.00 -2.06 0.00 0.00 37.83 36.06 1cg7 s LYS 9 CO -0.12 -0.10 1.31 -0.98 0.10 0.00 0.00 175.35 175.56 1cg7 s ARG 10 N -1.12 0.14 -0.29 1.78 3.03 -1.26 -5.17 118.95 116.06 1cg7 s ARG 10 Ca 0.04 0.05 -0.16 0.00 2.03 0.00 0.00 55.73 57.70 1cg7 s ARG 10 Cb -0.01 0.07 0.16 0.00 -1.03 0.00 0.00 34.95 34.14 1cg7 s ARG 10 CO -0.04 -0.04 1.02 -0.08 -1.13 0.00 0.00 175.30 175.03 1cg7 s THR 11 N -0.87 -0.12 -0.13 4.99 -1.32 -1.26 -5.16 115.64 111.77 1cg7 s THR 11 Ca 0.07 0.00 -0.05 0.00 -1.21 0.00 0.00 61.69 60.50 1cg7 s THR 11 Cb -0.01 -1.00 0.06 0.00 -1.51 0.00 0.00 72.50 70.04 1cg7 s THR 11 CO -0.08 0.00 0.28 -0.89 -2.21 0.00 0.00 174.62 171.72 1cg7 s THR 12 N 1.58 -0.30 -0.16 5.08 2.01 -1.26 -5.15 115.64 117.44 1cg7 s THR 12 Ca -0.07 0.22 -0.19 0.00 0.31 0.00 0.00 61.69 61.96 1cg7 s THR 12 Cb -0.04 -0.45 0.05 0.00 0.01 0.00 0.00 72.50 72.07 1cg7 s THR 12 CO -0.15 0.09 0.51 0.00 -0.69 0.00 0.00 174.62 174.39 1cg7 s ARG 13 N 2.04 0.66 0.00 4.92 1.70 -1.26 -5.16 118.95 121.85 1cg7 s ARG 13 Ca -0.03 0.58 0.00 0.00 -0.47 0.00 0.00 55.73 55.81 1cg7 s ARG 13 Cb -0.11 0.32 0.00 0.00 -0.57 0.00 0.00 34.95 34.58 1cg7 s ARG 13 CO -0.09 -0.11 0.00 1.63 -1.08 0.00 0.00 175.30 175.65 1cg7 n LYS 14 N 2.45 -1.34 -1.29 3.89 5.02 -1.26 -5.17 118.16 120.46 1cg7 n LYS 14 Ca -0.15 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.14 1cg7 n LYS 14 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.57 1cg7 n LYS 14 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1cg7 n LYS 15 N 0.00 -3.53 -2.60 1.97 4.76 -1.26 -5.07 118.16 112.44 1cg7 n LYS 15 Ca 0.00 2.69 -0.06 0.00 -2.87 0.00 0.00 58.31 58.07 1cg7 n LYS 15 Cb 0.00 -3.22 -0.02 0.00 -1.84 0.00 0.00 35.03 29.95 1cg7 n LYS 15 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1cg7 n LYS 16 N -1.79 0.67 -3.54 1.97 2.85 -1.26 -5.18 118.16 111.87 1cg7 n LYS 16 Ca 0.00 -0.87 -0.13 0.00 -1.05 0.00 0.00 58.31 56.26 1cg7 n LYS 16 Cb 0.23 0.53 -0.04 0.00 -0.65 0.00 0.00 35.03 35.10 1cg7 n LYS 16 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 1cg7 s ASP 17 N -1.63 -0.44 0.00 -5.58 -4.77 -1.26 -5.18 116.67 97.82 1cg7 s ASP 17 Ca 0.06 0.04 0.00 0.00 -3.30 0.00 0.00 52.55 49.36 1cg7 s ASP 17 Cb 0.00 0.52 0.00 0.00 -1.09 0.00 0.00 42.92 42.35 1cg7 s ASP 17 CO 0.05 -0.81 0.00 -0.81 0.70 0.00 0.00 175.17 174.29 1cg7 n PRO 18 N 0.08 1.03 -1.60 2.11 -0.04 -1.26 -4.77 135.00 130.56 1cg7 n PRO 18 Ca -0.17 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.00 1cg7 n PRO 18 Cb 0.62 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 34.00 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 2.25 -4.33 3.54 6.94 -1.26 -4.85 115.26 117.55 1cg7 n ASN 19 Ca 0.00 -2.61 -0.29 0.00 -0.02 0.00 0.00 54.58 51.66 1cg7 n ASN 19 Cb 0.00 -1.49 -0.14 0.00 -2.36 0.00 0.00 39.78 35.79 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 11.40 2.14 -0.32 -2.53 0.00 -1.26 -3.61 121.76 127.58 1cg7 s ALA 20 Ca 0.70 -1.25 -0.29 0.00 0.00 0.00 0.00 51.96 51.12 1cg7 s ALA 20 Cb 0.02 -0.42 0.00 0.00 0.00 0.00 0.00 23.12 22.73 1cg7 s ALA 20 CO 0.17 0.49 1.36 -1.25 0.00 0.00 0.00 175.76 176.54 1cg7 s PRO 21 N -1.39 3.83 0.15 0.00 0.04 -1.25 -4.91 135.00 131.47 1cg7 s PRO 21 Ca 0.11 1.22 -0.29 0.00 0.04 0.00 0.00 61.00 62.08 1cg7 s PRO 21 Cb -0.10 -3.93 -0.07 0.00 0.04 0.00 0.00 34.50 30.45 1cg7 s PRO 21 CO 0.03 -1.24 1.51 -0.22 0.04 0.00 0.00 177.00 177.12 1cg7 h LYS 22 N 9.76 -0.00 0.00 4.56 3.64 -1.97 -3.42 116.57 129.13 1cg7 h LYS 22 Ca -0.27 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 1cg7 h LYS 22 Cb 1.11 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1cg7 h LYS 22 CO 1.04 -0.00 0.00 0.54 -2.27 0.00 0.00 179.45 178.76 1cg7 n ARG 23 N -5.13 0.00 -2.77 1.90 1.74 -1.26 -5.06 116.66 106.08 1cg7 n ARG 23 Ca 0.02 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.06 1cg7 n ARG 23 Cb 0.25 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.66 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 0.00 -2.95 -1.17 7.54 0.00 -1.26 -4.81 120.51 117.85 1cg7 n ALA 24 Ca 0.00 1.49 -0.38 0.00 0.00 0.00 0.00 53.44 54.56 1cg7 n ALA 24 Cb 0.00 -3.07 0.02 0.00 0.00 0.00 0.00 19.45 16.40 1cg7 n ALA 24 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1cg7 n LEU 25 N 1.76 -4.44 -4.89 0.00 4.32 -1.26 -4.92 117.00 107.57 1cg7 n LEU 25 Ca -0.25 0.50 -0.30 0.00 -0.02 0.00 0.00 56.01 55.94 1cg7 n LEU 25 Cb 0.41 -0.82 -0.04 0.00 -1.62 0.00 0.00 43.42 41.35 1cg7 n LEU 25 CO 0.29 -5.20 0.25 -0.44 -1.22 0.00 0.00 177.39 171.07 1cg7 s SER 26 N -1.00 6.51 0.57 -1.43 0.01 -1.26 -4.91 113.70 112.18 1cg7 s SER 26 Ca 0.51 0.85 0.44 0.00 1.31 0.00 0.00 55.95 59.06 1cg7 s SER 26 Cb -0.39 -2.20 1.58 0.00 0.21 0.00 0.00 66.02 65.22 1cg7 s SER 26 CO 0.72 -0.20 1.58 0.00 0.41 0.00 0.00 173.24 175.74 1cg7 h ALA 27 N 1.84 3.58 -0.08 1.44 0.00 -1.91 1.39 119.26 125.53 1cg7 h ALA 27 Ca -0.47 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 1cg7 h ALA 27 Cb 1.18 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 1cg7 h ALA 27 CO 0.66 -2.14 -0.01 -0.92 0.00 0.00 0.00 179.25 176.84 1cg7 h TYR 28 N 0.00 0.15 -0.86 0.00 3.20 -1.96 -2.71 116.97 114.80 1cg7 h TYR 28 Ca 0.79 -0.03 0.12 0.00 3.14 0.00 0.00 58.73 62.75 1cg7 h TYR 28 Cb 3.35 -0.04 -0.06 0.00 1.54 0.00 0.00 36.73 41.52 1cg7 h TYR 28 CO 0.00 0.44 0.55 0.52 -1.64 0.00 0.00 178.16 178.03 1cg7 h MET 29 N -0.17 0.71 0.16 1.82 2.86 0.15 0.64 114.93 121.10 1cg7 h MET 29 Ca 0.02 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 1cg7 h MET 29 Cb 0.38 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.88 1cg7 h MET 29 CO 0.01 0.47 -0.08 0.74 1.06 0.00 0.00 176.91 179.11 1cg7 h PHE 30 N 0.73 -0.20 -0.06 -0.22 0.04 -1.31 1.48 116.94 117.41 1cg7 h PHE 30 Ca 0.41 -0.00 -0.12 0.00 2.80 0.00 0.00 57.97 61.06 1cg7 h PHE 30 Cb 0.58 0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.78 1cg7 h PHE 30 CO -0.00 -0.03 -0.49 0.35 -0.60 0.00 0.00 178.31 177.54 1cg7 h PHE 31 N -0.33 0.17 0.10 -0.55 3.57 -1.04 -3.15 116.94 115.72 1cg7 h PHE 31 Ca -0.02 -0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.42 1cg7 h PHE 31 Cb 0.26 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.96 1cg7 h PHE 31 CO -0.03 0.61 -0.05 0.00 -2.23 0.00 0.00 178.31 176.61 1cg7 h ALA 32 N 1.38 -0.14 -1.79 2.41 0.00 0.48 0.55 119.26 122.17 1cg7 h ALA 32 Ca 0.00 -0.26 0.52 0.00 0.00 0.00 0.00 54.91 55.17 1cg7 h ALA 32 Cb 0.91 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.68 1cg7 h ALA 32 CO 0.07 -0.21 1.34 -0.91 0.00 0.00 0.00 179.25 179.54 1cg7 h ASN 33 N -0.86 0.00 0.03 0.00 2.35 0.21 1.87 115.58 119.16 1cg7 h ASN 33 Ca -0.01 0.00 -0.38 0.00 -0.55 0.00 0.00 56.30 55.36 1cg7 h ASN 33 Cb 0.57 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 38.87 1cg7 h ASN 33 CO 0.02 0.00 -2.39 -0.62 -1.65 0.00 0.00 177.43 172.79 1cg7 n GLU 34 N -3.87 0.67 -0.84 0.81 -0.58 -1.18 -4.25 120.64 111.40 1cg7 n GLU 34 Ca 0.40 0.10 -0.16 0.00 -0.42 0.00 0.00 57.16 57.08 1cg7 n GLU 34 Cb 1.88 -1.54 0.12 0.00 -0.57 0.00 0.00 31.44 31.34 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 -3.06 3.51 -0.06 1.62 5.03 0.43 -3.91 115.26 118.82 1cg7 n ASN 35 Ca -0.39 -3.10 0.11 0.00 0.87 0.00 0.00 54.58 52.07 1cg7 n ASN 35 Cb 1.06 -0.73 0.00 0.00 -1.02 0.00 0.00 39.78 39.09 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 -0.63 0.15 -0.04 3.52 3.00 0.53 -4.15 116.66 119.04 1cg7 n ARG 36 Ca 0.41 -0.11 -0.04 0.00 -0.00 0.00 0.00 57.85 58.11 1cg7 n ARG 36 Cb 1.31 -1.50 -0.07 0.00 0.00 0.00 0.00 32.46 32.20 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 -1.33 2.91 -0.35 6.15 8.00 -1.25 -3.79 116.55 126.89 1cg7 n ASP 37 Ca 0.05 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.59 1cg7 n ASP 37 Cb 0.34 0.72 0.19 0.00 -0.02 0.00 0.00 41.12 42.35 1cg7 n ASP 37 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1cg7 h ILE 38 N 0.00 1.00 0.14 0.53 5.03 -1.76 1.25 117.51 123.71 1cg7 h ILE 38 Ca -0.23 -0.35 -0.26 0.00 -0.12 0.00 0.00 64.86 63.90 1cg7 h ILE 38 Cb 1.51 -0.12 0.01 0.00 -3.03 0.00 0.00 36.82 35.19 1cg7 h ILE 38 CO 0.01 0.19 -1.24 0.58 -0.68 0.00 0.00 178.15 177.01 1cg7 h VAL 39 N 1.03 1.21 -0.03 1.67 2.07 -1.80 -3.26 116.25 117.14 1cg7 h VAL 39 Ca 0.44 -2.48 0.01 0.00 0.82 0.00 0.00 66.70 65.49 1cg7 h VAL 39 Cb 0.31 2.91 -0.00 0.00 -1.52 0.00 0.00 31.29 32.99 1cg7 h VAL 39 CO -0.22 0.73 0.02 0.03 0.02 0.00 0.00 177.57 178.16 1cg7 h ARG 40 N -0.26 0.00 0.00 1.57 3.08 -1.53 0.40 114.38 117.64 1cg7 h ARG 40 Ca -0.25 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.76 1cg7 h ARG 40 Cb 1.78 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.83 1cg7 h ARG 40 CO 0.12 0.00 -0.19 1.03 -1.07 0.00 0.00 179.97 179.86 1cg7 h SER 41 N 0.00 0.00 -0.00 7.04 0.87 0.15 0.41 113.55 122.02 1cg7 h SER 41 Ca 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1cg7 h SER 41 Cb 0.06 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.02 1cg7 h SER 41 CO -0.00 0.19 -0.76 -0.62 -0.53 0.00 0.00 176.83 175.11 1cg7 n GLU 42 N -3.26 0.84 -3.00 2.24 -0.58 0.75 -4.56 120.64 113.08 1cg7 n GLU 42 Ca 0.01 -0.31 -0.15 0.00 -0.42 0.00 0.00 57.16 56.29 1cg7 n GLU 42 Cb 0.47 -1.42 0.01 0.00 -0.57 0.00 0.00 31.44 29.93 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 -0.99 -0.60 0.00 1.62 3.02 0.10 -4.93 115.26 113.49 1cg7 n ASN 43 Ca 0.05 -3.24 0.11 0.00 -0.03 0.00 0.00 54.58 51.48 1cg7 n ASN 43 Cb 0.34 0.43 0.62 0.00 -0.61 0.00 0.00 39.78 40.57 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 0.51 0.46 0.12 3.52 -0.04 0.11 -2.15 135.00 137.53 1cg7 n PRO 44 Ca 0.17 0.05 0.12 0.00 -0.04 0.00 0.00 63.50 63.80 1cg7 n PRO 44 Cb 0.66 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.75 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 -5.71 3.54 5.19 -1.92 -3.46 116.42 114.06 1cg7 h ASP 45 Ca 0.00 -0.06 -0.46 0.00 -0.62 0.00 0.00 57.03 55.89 1cg7 h ASP 45 Cb 0.15 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.64 1cg7 h ASP 45 CO 0.00 0.03 -0.17 2.30 -3.12 0.00 0.00 179.24 178.28 1cg7 n ILE 46 N -2.57 0.00 -4.34 0.35 -5.35 -0.91 -5.15 119.36 101.39 1cg7 n ILE 46 Ca 0.03 -1.76 -0.17 0.00 -0.27 0.00 0.00 62.75 60.58 1cg7 n ILE 46 Cb 0.50 -0.27 -0.05 0.00 -1.74 0.00 0.00 39.64 38.08 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 -1.75 0.00 0.17 7.28 -2.24 -1.26 -5.01 114.28 111.48 1cg7 n THR 47 Ca 0.04 -1.54 0.16 0.00 -2.27 0.00 0.00 64.05 60.44 1cg7 n THR 47 Cb 0.52 0.53 0.76 0.00 -2.10 0.00 0.00 70.33 70.05 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 1.42 0.00 -1.13 4.78 3.04 -1.97 0.19 116.94 123.27 1cg7 h PHE 48 Ca -0.21 0.00 0.33 0.00 3.98 0.00 0.00 57.97 62.07 1cg7 h PHE 48 Cb 0.79 0.00 -0.11 0.00 2.56 0.00 0.00 35.95 39.19 1cg7 h PHE 48 CO 0.00 0.00 0.73 0.78 -2.02 0.00 0.00 178.31 177.80 1cg7 h GLY 49 N 0.00 1.28 0.00 2.40 0.00 -1.97 0.99 103.07 105.77 1cg7 h GLY 49 Ca 0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 1cg7 h GLY 49 CO -0.00 -0.25 -1.24 0.61 0.00 0.00 0.00 176.54 175.66 1cg7 n GLN 50 N -4.67 1.09 -0.03 4.80 0.00 -0.62 -4.26 117.38 113.69 1cg7 n GLN 50 Ca 0.30 -0.03 -0.13 0.00 0.00 0.00 0.00 57.00 57.14 1cg7 n GLN 50 Cb 1.08 -1.11 -0.11 0.00 0.00 0.00 0.00 30.24 30.10 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 1.48 0.00 -0.39 2.07 0.15 -2.15 116.25 117.41 1cg7 h VAL 51 Ca -0.04 -1.60 0.00 0.00 0.82 0.00 0.00 66.70 65.89 1cg7 h VAL 51 Cb 0.53 2.54 0.00 0.00 -1.52 0.00 0.00 31.29 32.85 1cg7 h VAL 51 CO 0.00 0.41 0.00 1.23 0.02 0.00 0.00 177.57 179.23 1cg7 h GLY 52 N -0.72 0.00 -2.47 2.17 0.00 0.77 -0.98 103.07 101.85 1cg7 h GLY 52 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1cg7 h GLY 52 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.54 177.71 1cg7 n LYS 53 N -2.30 3.24 0.00 4.80 3.00 -1.19 -4.34 118.16 121.37 1cg7 n LYS 53 Ca 0.02 -2.66 0.00 0.00 -0.00 0.00 0.00 58.31 55.68 1cg7 n LYS 53 Cb 0.25 -1.68 0.00 0.00 0.00 0.00 0.00 35.03 33.61 1cg7 n LYS 53 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1cg7 n LYS 54 N 0.99 0.00 -0.25 1.64 4.76 -0.61 -4.66 118.16 120.04 1cg7 n LYS 54 Ca 0.22 0.00 0.22 0.00 -2.87 0.00 0.00 58.31 55.88 1cg7 n LYS 54 Cb 0.73 -0.90 0.56 0.00 -1.84 0.00 0.00 35.03 33.58 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 0.32 -2.00 -0.35 3.38 -1.41 0.63 115.31 115.87 1cg7 h LEU 55 Ca 0.00 0.04 0.12 0.00 0.09 0.00 0.00 57.88 58.13 1cg7 h LEU 55 Cb 0.97 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1cg7 h LEU 55 CO 0.00 0.11 0.43 1.23 0.09 0.00 0.00 178.44 180.30 1cg7 h GLY 56 N 0.31 0.00 1.98 0.83 0.00 -1.83 0.73 103.07 105.09 1cg7 h GLY 56 Ca 0.48 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.61 1cg7 h GLY 56 CO -0.16 0.00 -0.98 0.83 0.00 0.00 0.00 176.54 176.24 1cg7 h GLU 57 N 0.00 0.00 0.21 4.80 5.08 -0.03 -2.82 114.58 121.82 1cg7 h GLU 57 Ca 0.20 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.24 1cg7 h GLU 57 Cb 1.06 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.33 1cg7 h GLU 57 CO -0.00 0.96 -1.44 0.87 -1.00 0.00 0.00 179.01 178.40 1cg7 h LYS 58 N 0.00 0.45 0.14 2.33 1.57 0.23 -1.63 116.57 119.67 1cg7 h LYS 58 Ca -0.01 -0.77 0.00 0.00 -1.87 0.00 0.00 60.65 58.00 1cg7 h LYS 58 Cb 1.75 0.29 -0.01 0.00 0.08 0.00 0.00 32.23 34.33 1cg7 h LYS 58 CO 0.12 1.37 -0.13 2.35 -0.57 0.00 0.00 179.45 182.59 1cg7 h TRP 59 N 0.12 -0.33 0.00 -1.35 2.91 -0.30 1.49 115.95 118.49 1cg7 h TRP 59 Ca -0.23 0.00 -0.05 0.00 1.13 0.00 0.00 58.89 59.74 1cg7 h TRP 59 Cb 2.11 0.13 -0.01 0.00 -0.51 0.00 0.00 29.16 30.88 1cg7 h TRP 59 CO 0.11 -0.20 -0.25 1.57 -1.03 0.00 0.00 178.44 178.64 1cg7 h LYS 60 N -0.29 0.00 -0.01 2.65 2.10 -1.59 0.11 116.57 119.54 1cg7 h LYS 60 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1cg7 h LYS 60 Cb 0.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.60 1cg7 h LYS 60 CO -0.03 0.25 -0.06 0.00 -2.00 0.00 0.00 179.45 177.61 1cg7 n ALA 61 N -2.39 2.70 1.86 0.07 0.00 -0.38 -3.45 120.51 118.92 1cg7 n ALA 61 Ca -0.02 -0.38 0.14 0.00 0.00 0.00 0.00 53.44 53.18 1cg7 n ALA 61 Cb 0.33 -1.24 0.81 0.00 0.00 0.00 0.00 19.45 19.35 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 -0.29 0.00 -1.31 0.00 7.94 0.50 -4.98 117.00 118.85 1cg7 n LEU 62 Ca 0.18 0.00 0.16 0.00 -1.11 0.00 0.00 56.01 55.24 1cg7 n LEU 62 Cb 0.31 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.20 1cg7 n LEU 62 CO 0.19 0.00 -0.39 0.41 -1.11 0.00 0.00 177.39 176.49 1cg7 n THR 63 N -0.96 0.00 0.97 1.96 -1.04 -1.22 -2.38 114.28 111.60 1cg7 n THR 63 Ca 0.20 0.41 0.11 0.00 -2.04 0.00 0.00 64.05 62.73 1cg7 n THR 63 Cb 0.09 -0.83 0.54 0.00 -1.82 0.00 0.00 70.33 68.31 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 -3.96 0.22 0.05 -2.82 -0.04 -1.26 -1.96 135.00 125.23 1cg7 n PRO 64 Ca -0.03 0.09 -0.21 0.00 -0.04 0.00 0.00 63.50 63.31 1cg7 n PRO 64 Cb 0.66 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.50 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 0.63 0.00 0.54 5.08 -1.99 0.40 114.58 119.24 1cg7 h GLU 65 Ca 0.00 -0.73 -0.25 0.00 -1.00 0.00 0.00 59.36 57.37 1cg7 h GLU 65 Cb 0.27 0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.70 1cg7 h GLU 65 CO 0.00 1.31 -1.46 0.93 -1.00 0.00 0.00 179.01 178.80 1cg7 h GLU 66 N 0.27 0.00 0.00 2.33 4.39 -1.35 -3.28 114.58 116.94 1cg7 h GLU 66 Ca -0.14 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.56 1cg7 h GLU 66 Cb 1.71 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.36 1cg7 h GLU 66 CO 0.20 0.60 -0.23 1.17 -1.16 0.00 0.00 179.01 179.60 1cg7 n LYS 67 N -3.11 0.23 0.35 2.33 4.81 -0.83 -2.72 118.16 119.22 1cg7 n LYS 67 Ca -0.11 0.14 -0.17 0.00 -0.87 0.00 0.00 58.31 57.29 1cg7 n LYS 67 Cb 0.99 -1.71 -0.09 0.00 0.02 0.00 0.00 35.03 34.24 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 0.00 -0.85 -0.04 1.64 4.20 -0.97 0.48 115.11 119.58 1cg7 h GLN 68 Ca 0.00 0.06 -0.18 0.00 0.06 0.00 0.00 58.65 58.59 1cg7 h GLN 68 Cb 0.70 0.19 0.01 0.00 0.30 0.00 0.00 27.48 28.68 1cg7 h GLN 68 CO 0.00 -0.54 -0.66 -1.00 -0.67 0.00 0.00 178.83 175.95 1cg7 h PRO 69 N -0.96 0.52 0.28 1.46 0.13 -1.72 -2.20 132.00 129.51 1cg7 h PRO 69 Ca -0.09 -0.51 -0.01 0.00 -0.87 0.00 0.00 66.00 64.53 1cg7 h PRO 69 Cb 0.70 0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.95 1cg7 h PRO 69 CO 0.15 1.14 -0.31 1.88 -0.23 0.00 0.00 178.00 180.63 1cg7 h TYR 70 N 0.09 -0.86 -0.94 1.56 0.05 -1.57 -0.76 116.97 114.55 1cg7 h TYR 70 Ca -0.07 0.01 0.09 0.00 0.05 0.00 0.00 58.73 58.81 1cg7 h TYR 70 Cb 1.34 0.34 -0.07 0.00 1.01 0.00 0.00 36.73 39.35 1cg7 h TYR 70 CO 0.13 -0.40 0.60 1.49 -1.05 0.00 0.00 178.16 178.93 1cg7 h GLU 71 N -0.60 0.95 -0.11 4.88 4.81 -1.03 0.35 114.58 123.84 1cg7 h GLU 71 Ca -0.04 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.17 1cg7 h GLU 71 Cb 0.52 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 1cg7 h GLU 71 CO -0.05 0.63 0.13 0.00 -0.73 0.00 0.00 179.01 178.99 1cg7 h ALA 72 N 1.53 1.67 0.18 2.92 0.00 -0.92 0.78 119.26 125.41 1cg7 h ALA 72 Ca 0.43 -0.00 -0.29 0.00 0.00 0.00 0.00 54.91 55.04 1cg7 h ALA 72 Cb 0.35 0.01 0.03 0.00 0.00 0.00 0.00 17.79 18.19 1cg7 h ALA 72 CO -0.19 -0.19 -1.26 -0.22 0.00 0.00 0.00 179.25 177.40 1cg7 h LYS 73 N 0.00 0.54 0.00 0.00 3.64 0.12 -3.08 116.57 117.79 1cg7 h LYS 73 Ca 0.05 -0.82 0.00 0.00 -1.27 0.00 0.00 60.65 58.61 1cg7 h LYS 73 Cb 0.31 0.29 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1cg7 h LYS 73 CO -0.00 1.38 0.00 0.00 -2.27 0.00 0.00 179.45 178.56 1cg7 n ALA 74 N -2.69 1.45 0.53 5.00 0.00 0.15 -1.00 120.51 123.95 1cg7 n ALA 74 Ca -0.15 0.07 0.13 0.00 0.00 0.00 0.00 53.44 53.49 1cg7 n ALA 74 Cb 1.00 -1.30 0.43 0.00 0.00 0.00 0.00 19.45 19.59 1cg7 n ALA 74 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1cg7 n GLN 75 N -2.01 0.25 -0.10 0.00 -0.06 -0.49 -3.20 117.38 111.77 1cg7 n GLN 75 Ca 0.01 0.30 -0.15 0.00 -2.00 0.00 0.00 57.00 55.16 1cg7 n GLN 75 Cb 0.15 -1.85 -0.14 0.00 -4.06 0.00 0.00 30.24 24.35 1cg7 n GLN 75 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1cg7 n ALA 76 N -1.80 1.42 0.26 1.69 0.00 -0.17 -4.11 120.51 117.79 1cg7 n ALA 76 Ca 0.04 -1.13 0.16 0.00 0.00 0.00 0.00 53.44 52.51 1cg7 n ALA 76 Cb 0.37 -0.21 0.85 0.00 0.00 0.00 0.00 19.45 20.46 1cg7 n ALA 76 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1cg7 h ASP 77 N 0.01 0.00 -0.23 0.00 3.58 -1.47 0.38 116.42 118.69 1cg7 h ASP 77 Ca -0.54 0.00 0.07 0.00 0.42 0.00 0.00 57.03 56.97 1cg7 h ASP 77 Cb 2.03 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 43.07 1cg7 h ASP 77 CO -0.03 0.00 0.30 0.50 -2.88 0.00 0.00 179.24 177.13 1cg7 h LYS 78 N 0.00 0.00 0.08 0.28 3.64 -1.70 0.27 116.57 119.14 1cg7 h LYS 78 Ca 0.00 0.00 -0.36 0.00 -1.27 0.00 0.00 60.65 59.02 1cg7 h LYS 78 Cb 0.17 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 1cg7 h LYS 78 CO 0.00 0.00 -2.07 1.17 -2.27 0.00 0.00 179.45 176.28 1cg7 n LYS 79 N -3.61 0.72 -0.04 1.90 3.00 0.12 -4.12 118.16 116.13 1cg7 n LYS 79 Ca 0.03 0.26 0.10 0.00 -0.00 0.00 0.00 58.31 58.70 1cg7 n LYS 79 Cb 0.43 -1.66 0.50 0.00 0.00 0.00 0.00 35.03 34.30 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 -0.06 0.39 0.00 1.64 2.43 -1.04 0.23 114.38 117.98 1cg7 h ARG 80 Ca -0.46 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1cg7 h ARG 80 Cb 1.94 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 31.40 1cg7 h ARG 80 CO 0.01 0.26 0.00 -0.92 -1.51 0.00 0.00 179.97 177.81 1cg7 h TYR 81 N 0.40 0.00 0.00 2.20 3.20 -0.72 0.15 116.97 122.20 1cg7 h TYR 81 Ca 0.23 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.10 1cg7 h TYR 81 Cb 0.38 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.65 1cg7 h TYR 81 CO -0.00 0.00 -0.53 0.93 -1.64 0.00 0.00 178.16 176.92 1cg7 h GLU 82 N 0.00 0.00 -0.50 1.82 5.08 -0.72 -3.06 114.58 117.20 1cg7 h GLU 82 Ca 0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 1cg7 h GLU 82 Cb 0.08 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 1cg7 h GLU 82 CO 0.00 0.00 -0.17 1.03 -1.00 0.00 0.00 179.01 178.87 1cg7 h SER 83 N 0.00 1.01 0.88 1.42 0.87 -0.72 0.13 113.55 117.14 1cg7 h SER 83 Ca 0.00 -0.36 0.00 0.00 -1.23 0.00 0.00 61.79 60.20 1cg7 h SER 83 Cb 0.99 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 62.67 1cg7 h SER 83 CO 0.00 1.15 -0.32 -0.62 -0.53 0.00 0.00 176.83 176.51 1cg7 n GLU 84 N -4.12 0.12 0.03 2.24 -0.58 -1.23 -3.50 120.64 113.59 1cg7 n GLU 84 Ca 0.01 0.05 -0.13 0.00 -0.42 0.00 0.00 57.16 56.68 1cg7 n GLU 84 Cb 0.43 -1.59 -0.14 0.00 -0.57 0.00 0.00 31.44 29.57 1cg7 n GLU 84 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 1cg7 h LYS 85 N 0.00 0.12 -0.44 3.49 3.64 -1.34 -2.96 116.57 119.08 1cg7 h LYS 85 Ca 0.00 -0.21 -0.02 0.00 -1.27 0.00 0.00 60.65 59.15 1cg7 h LYS 85 Cb 0.60 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.48 1cg7 h LYS 85 CO 0.00 0.91 0.20 0.93 -2.27 0.00 0.00 179.45 179.22 1cg7 h GLU 86 N 0.03 0.61 0.02 1.90 4.39 -1.02 -1.29 114.58 119.22 1cg7 h GLU 86 Ca -0.22 -0.07 -0.14 0.00 0.34 0.00 0.00 59.36 59.27 1cg7 h GLU 86 Cb 1.97 -0.12 0.01 0.00 -0.10 0.00 0.00 28.75 30.51 1cg7 h GLU 86 CO 0.12 0.48 -0.57 -0.07 -1.16 0.00 0.00 179.01 177.82 1cg7 h LEU 87 N 0.61 0.47 -0.53 1.33 4.07 -1.66 -1.23 115.31 118.37 1cg7 h LEU 87 Ca 0.15 -0.79 0.10 0.00 0.08 0.00 0.00 57.88 57.43 1cg7 h LEU 87 Cb 0.08 -0.14 -0.09 0.00 1.08 0.00 0.00 40.66 41.59 1cg7 h LEU 87 CO -0.02 1.20 0.01 0.22 -1.08 0.00 0.00 178.44 178.77 1cg7 h TYR 88 N -0.21 -0.02 -0.09 1.13 3.20 -1.28 0.31 116.97 120.01 1cg7 h TYR 88 Ca -0.08 0.04 -0.17 0.00 3.14 0.00 0.00 58.73 61.67 1cg7 h TYR 88 Cb 1.30 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.65 1cg7 h TYR 88 CO 0.16 -0.12 -0.65 -2.95 -1.64 0.00 0.00 178.16 172.96 1cg7 h ASN 89 N 0.13 0.43 -0.28 -2.11 -1.07 -1.32 -2.71 115.58 108.64 1cg7 h ASN 89 Ca 0.27 -0.26 0.08 0.00 0.07 0.00 0.00 56.30 56.46 1cg7 h ASN 89 Cb 0.41 -0.13 -0.01 0.00 -2.07 0.00 0.00 38.32 36.52 1cg7 h ASN 89 CO -0.43 0.96 0.32 0.00 0.07 0.00 0.00 177.43 178.35 1cg7 h ALA 90 N 1.03 1.93 0.00 4.14 0.00 0.29 0.70 119.26 127.36 1cg7 h ALA 90 Ca -0.01 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 1cg7 h ALA 90 Cb 1.20 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1cg7 h ALA 90 CO 0.11 -0.46 -0.80 1.79 0.00 0.00 0.00 179.25 179.89 1cg7 h THR 91 N 0.00 1.40 -2.25 0.00 1.35 -0.91 -3.34 112.91 109.16 1cg7 h THR 91 Ca 0.13 -2.93 -0.58 0.00 -0.55 0.00 0.00 66.41 62.48 1cg7 h THR 91 Cb 0.77 2.66 -0.42 0.00 -1.73 0.00 0.00 68.15 69.43 1cg7 h THR 91 CO -0.00 0.79 -0.68 0.00 -0.25 0.00 0.00 175.52 175.38 1cg7 n LEU 92 N -3.32 4.04 -0.94 3.87 -0.00 0.24 -5.14 117.00 115.74 1cg7 n LEU 92 Ca 0.01 -5.58 0.12 0.00 -0.00 0.00 0.00 56.01 50.55 1cg7 n LEU 92 Cb 0.85 -0.47 0.12 0.00 -0.00 0.00 0.00 43.42 43.92 1cg7 n LEU 92 CO 0.44 2.30 0.64 0.00 -0.00 0.00 0.00 177.39 180.77