#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cg9 s ALA 13 N 0.00 2.44 -0.13 -1.67 0.00 0.38 -4.83 121.76 117.95 2cg9 s ALA 13 Ca 0.00 -0.89 -0.00 0.00 0.00 0.00 0.00 51.96 51.07 2cg9 s ALA 13 Cb 0.00 -2.88 0.03 0.00 0.00 0.00 0.00 23.12 20.26 2cg9 s ALA 13 CO 0.00 -2.03 -0.09 -1.14 0.00 0.00 0.00 175.76 172.50 2cg9 s GLN 14 N -5.71 1.68 0.68 0.00 0.74 -1.26 -2.29 119.66 113.50 2cg9 s GLN 14 Ca 0.67 -0.36 -0.14 0.00 0.05 0.00 0.00 55.36 55.59 2cg9 s GLN 14 Cb -0.08 -1.76 0.01 0.00 1.10 0.00 0.00 33.01 32.28 2cg9 s GLN 14 CO 0.51 -0.28 1.10 1.03 -0.55 0.00 0.00 175.29 177.09 2cg9 s ARG 15 N 1.65 2.74 0.27 1.67 0.52 -1.26 -5.04 118.95 119.49 2cg9 s ARG 15 Ca 0.04 1.31 -0.02 0.00 -0.52 0.00 0.00 55.73 56.54 2cg9 s ARG 15 Cb -0.13 -1.95 -0.04 0.00 0.52 0.00 0.00 34.95 33.35 2cg9 s ARG 15 CO -0.09 -1.28 0.49 -1.54 0.02 0.00 0.00 175.30 172.90 2cg9 s SER 16 N -2.82 6.40 0.08 0.23 1.04 -1.26 -4.95 113.70 112.41 2cg9 s SER 16 Ca 0.65 0.55 0.01 0.00 0.48 0.00 0.00 55.95 57.64 2cg9 s SER 16 Cb -0.19 -2.07 -0.00 0.00 0.10 0.00 0.00 66.02 63.85 2cg9 s SER 16 CO 0.45 -0.15 0.04 -1.20 0.98 0.00 0.00 173.24 173.35 2cg9 n SER 17 N -0.98 0.52 -3.16 7.02 7.64 0.54 -3.43 113.62 121.78 2cg9 n SER 17 Ca -0.03 -1.44 0.03 0.00 1.01 0.00 0.00 58.87 58.44 2cg9 n SER 17 Cb 0.54 0.26 -0.00 0.00 -1.01 0.00 0.00 64.21 64.00 2cg9 n SER 17 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2cg9 s THR 18 N -2.02 -0.98 0.77 0.44 2.01 -1.21 -2.13 115.64 112.52 2cg9 s THR 18 Ca 0.06 -0.02 -0.11 0.00 0.31 0.00 0.00 61.69 61.93 2cg9 s THR 18 Cb 0.00 -0.94 0.06 0.00 0.01 0.00 0.00 72.50 71.63 2cg9 s THR 18 CO 0.04 -0.02 1.13 -0.89 -0.69 0.00 0.00 174.62 174.20 2cg9 s THR 19 N 2.76 2.40 0.00 -0.82 2.01 -1.19 -4.18 115.64 116.62 2cg9 s THR 19 Ca 0.10 0.07 0.00 0.00 0.31 0.00 0.00 61.69 62.18 2cg9 s THR 19 Cb -0.10 -3.12 0.00 0.00 0.01 0.00 0.00 72.50 69.30 2cg9 s THR 19 CO -0.25 -0.15 0.00 -0.90 -0.69 0.00 0.00 174.62 172.63 2cg9 n ASP 20 N -3.18 0.00 -4.73 3.53 5.68 -1.26 -2.89 116.55 113.70 2cg9 n ASP 20 Ca 0.08 0.00 -0.36 0.00 -0.50 0.00 0.00 54.79 54.01 2cg9 n ASP 20 Cb 0.60 0.00 0.08 0.00 -1.14 0.00 0.00 41.12 40.66 2cg9 n ASP 20 CO 0.00 0.00 0.00 -2.84 -1.33 0.00 0.00 177.20 173.03 2cg9 s PRO 21 N 0.00 2.37 0.00 0.11 0.02 -1.26 -4.18 135.00 132.07 2cg9 s PRO 21 Ca 0.00 1.92 0.00 0.00 0.02 0.00 0.00 61.00 62.94 2cg9 s PRO 21 Cb 0.00 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.68 2cg9 s PRO 21 CO 0.00 -1.70 0.00 0.39 -0.33 0.00 0.00 177.00 175.36 2cg9 n GLU 22 N -2.26 1.59 0.23 5.54 -0.58 -0.64 -4.43 120.64 120.10 2cg9 n GLU 22 Ca 0.15 0.00 -0.10 0.00 -0.42 0.00 0.00 57.16 56.78 2cg9 n GLU 22 Cb 0.49 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 31.31 2cg9 n GLU 22 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 2cg9 h ARG 23 N 0.00 -0.63 -0.01 3.49 1.12 -1.94 -3.41 114.38 113.00 2cg9 h ARG 23 Ca 0.00 0.04 0.00 0.00 -1.11 0.00 0.00 59.98 58.91 2cg9 h ARG 23 Cb 0.00 0.14 0.00 0.00 -0.01 0.00 0.00 29.97 30.10 2cg9 h ARG 23 CO 0.00 -0.40 0.00 0.27 -3.11 0.00 0.00 179.97 176.73 2cg9 n ASN 24 N -5.21 1.56 -3.91 -3.80 2.04 -1.26 -4.64 115.26 100.03 2cg9 n ASN 24 Ca -0.08 -1.51 -0.09 0.00 -0.44 0.00 0.00 54.58 52.46 2cg9 n ASN 24 Cb 0.26 -0.01 -0.05 0.00 -2.53 0.00 0.00 39.78 37.45 2cg9 n ASN 24 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 2cg9 s TYR 25 N -0.52 0.23 -0.03 -2.53 -0.85 -1.26 -0.40 117.35 111.99 2cg9 s TYR 25 Ca 0.01 -0.59 0.03 0.00 -0.52 0.00 0.00 57.07 56.00 2cg9 s TYR 25 Cb 0.01 0.18 -0.00 0.00 0.38 0.00 0.00 41.96 42.53 2cg9 s TYR 25 CO 0.01 -0.89 -0.12 0.08 -1.52 0.00 0.00 175.55 173.11 2cg9 s VAL 26 N -3.96 1.01 0.18 -3.49 1.01 0.13 -1.62 120.40 113.66 2cg9 s VAL 26 Ca 0.17 -0.49 0.10 0.00 0.00 0.00 0.00 61.98 61.76 2cg9 s VAL 26 Cb 0.00 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 2cg9 s VAL 26 CO 0.03 0.30 -0.21 -1.48 0.00 0.00 0.00 175.10 173.74 2cg9 s LEU 27 N 0.08 2.43 -0.04 3.92 2.34 -1.26 -0.71 118.68 125.43 2cg9 s LEU 27 Ca -0.02 -0.85 -0.02 0.00 0.06 0.00 0.00 54.13 53.30 2cg9 s LEU 27 Cb -0.09 -1.00 0.03 0.00 -0.56 0.00 0.00 46.19 44.57 2cg9 s LEU 27 CO 0.01 0.05 0.08 -0.63 -1.06 0.00 0.00 176.35 174.80 2cg9 s ILE 28 N -1.80 -0.10 -0.23 1.48 1.01 0.21 -4.44 121.20 117.33 2cg9 s ILE 28 Ca 0.18 0.29 -0.06 0.00 0.00 0.00 0.00 60.65 61.05 2cg9 s ILE 28 Cb -0.07 -0.16 -0.03 0.00 0.01 0.00 0.00 42.46 42.21 2cg9 s ILE 28 CO 0.08 0.12 0.04 -0.89 0.00 0.00 0.00 174.94 174.29 2cg9 s THR 29 N 1.58 4.16 0.00 2.92 2.01 -1.26 -0.48 115.64 124.56 2cg9 s THR 29 Ca -0.03 -0.23 0.00 0.00 0.31 0.00 0.00 61.69 61.74 2cg9 s THR 29 Cb -0.12 -2.92 0.00 0.00 0.01 0.00 0.00 72.50 69.47 2cg9 s THR 29 CO -0.04 0.38 0.00 0.52 -0.69 0.00 0.00 174.62 174.79 2cg9 n VAL 30 N 4.66 0.00 -2.98 3.82 0.31 0.14 -3.65 118.33 120.63 2cg9 n VAL 30 Ca -0.17 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.21 2cg9 n VAL 30 Cb 0.51 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.45 2cg9 n VAL 30 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2cg9 s SER 31 N -1.00 -0.02 0.16 4.52 1.04 -1.22 -4.61 113.70 112.57 2cg9 s SER 31 Ca 0.00 -0.00 -0.22 0.00 0.48 0.00 0.00 55.95 56.21 2cg9 s SER 31 Cb 0.00 0.67 0.06 0.00 0.10 0.00 0.00 66.02 66.85 2cg9 s SER 31 CO 0.00 -0.00 0.57 -0.51 0.98 0.00 0.00 173.24 174.28 2cg9 s ILE 32 N 2.65 0.01 0.05 -1.02 -1.16 -1.26 -4.48 121.20 115.99 2cg9 s ILE 32 Ca 0.27 -0.10 -0.30 0.00 -0.51 0.00 0.00 60.65 60.01 2cg9 s ILE 32 Cb 0.02 -1.04 -0.04 0.00 0.61 0.00 0.00 42.46 42.01 2cg9 s ILE 32 CO -0.20 -0.05 0.97 0.00 -2.81 0.00 0.00 174.94 172.85 2cg9 s ALA 33 N -3.76 3.20 -1.36 1.50 0.00 -1.26 -3.32 121.76 116.75 2cg9 s ALA 33 Ca 0.01 0.55 -0.12 0.00 0.00 0.00 0.00 51.96 52.41 2cg9 s ALA 33 Cb -0.01 -3.31 0.01 0.00 0.00 0.00 0.00 23.12 19.82 2cg9 s ALA 33 CO -0.13 -0.14 0.41 -0.25 0.00 0.00 0.00 175.76 175.65 2cg9 n ASP 34 N 3.40 -1.60 -4.77 0.00 9.92 -1.24 -3.91 116.55 118.35 2cg9 n ASP 34 Ca 0.04 -1.17 -0.38 0.00 -0.53 0.00 0.00 54.79 52.76 2cg9 n ASP 34 Cb 0.50 -2.29 -0.05 0.00 -0.64 0.00 0.00 41.12 38.64 2cg9 n ASP 34 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2cg9 s ASP 36 N -1.42 3.11 -0.49 0.00 -1.08 0.88 -4.86 116.67 112.81 2cg9 s ASP 36 Ca 0.52 -0.96 -0.26 0.00 -0.52 0.00 0.00 52.55 51.34 2cg9 s ASP 36 Cb -0.23 -0.22 0.04 0.00 -1.46 0.00 0.00 42.92 41.04 2cg9 s ASP 36 CO 0.30 -0.01 0.64 0.00 0.52 0.00 0.00 175.17 176.62 2cg9 n ALA 37 N -0.18 -2.59 -2.31 3.66 0.00 -1.26 -3.33 120.51 114.50 2cg9 n ALA 37 Ca -0.09 0.55 -0.43 0.00 0.00 0.00 0.00 53.44 53.47 2cg9 n ALA 37 Cb 0.59 -2.59 -0.02 0.00 0.00 0.00 0.00 19.45 17.42 2cg9 n ALA 37 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2cg9 s PRO 38 N -2.76 4.04 -0.75 0.00 0.02 -1.26 -4.21 135.00 130.08 2cg9 s PRO 38 Ca 0.29 1.59 -0.26 0.00 0.02 0.00 0.00 61.00 62.64 2cg9 s PRO 38 Cb -0.04 -3.88 0.04 0.00 0.02 0.00 0.00 34.50 30.63 2cg9 s PRO 38 CO 0.84 -0.97 1.24 -1.21 -0.33 0.00 0.00 177.00 176.57 2cg9 s GLU 39 N 4.01 3.21 0.04 5.54 8.01 -1.26 -4.97 118.70 133.28 2cg9 s GLU 39 Ca 0.61 -0.40 -0.30 0.00 0.01 0.00 0.00 54.97 54.88 2cg9 s GLU 39 Cb -0.22 -4.27 -0.06 0.00 -4.31 0.00 0.00 34.13 25.27 2cg9 s GLU 39 CO 0.22 -2.10 1.27 -0.48 0.01 0.00 0.00 175.26 174.18 2cg9 s LEU 40 N 5.40 4.34 -0.30 1.80 2.34 -1.26 -3.91 118.68 127.09 2cg9 s LEU 40 Ca 0.34 2.06 0.01 0.00 0.06 0.00 0.00 54.13 56.60 2cg9 s LEU 40 Cb -0.09 -3.57 0.15 0.00 -0.56 0.00 0.00 46.19 42.12 2cg9 s LEU 40 CO 0.12 -0.57 0.36 -0.89 -1.06 0.00 0.00 176.35 174.32 2cg9 s THR 41 N 1.53 -0.52 -0.95 5.48 2.01 -1.15 -4.99 115.64 117.05 2cg9 s THR 41 Ca 0.60 -0.42 -0.01 0.00 0.31 0.00 0.00 61.69 62.17 2cg9 s THR 41 Cb -0.30 -0.95 0.31 0.00 0.01 0.00 0.00 72.50 71.56 2cg9 s THR 41 CO 0.28 -0.38 1.41 -0.38 -0.69 0.00 0.00 174.62 174.86 2cg9 n ILE 42 N 5.24 4.87 -2.37 1.82 2.08 -1.26 -2.93 119.36 126.80 2cg9 n ILE 42 Ca 0.01 -5.81 -0.41 0.00 0.56 0.00 0.00 62.75 57.10 2cg9 n ILE 42 Cb 0.48 -1.87 -0.04 0.00 -0.75 0.00 0.00 39.64 37.46 2cg9 n ILE 42 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 2cg9 s LYS 43 N -3.24 4.54 0.25 0.38 1.02 -0.83 -4.79 119.74 117.07 2cg9 s LYS 43 Ca 0.36 1.91 0.04 0.00 0.02 0.00 0.00 55.97 58.30 2cg9 s LYS 43 Cb 0.13 -3.19 0.67 0.00 -0.52 0.00 0.00 37.83 34.92 2cg9 s LYS 43 CO 0.00 0.03 1.22 -2.30 -0.92 0.00 0.00 175.35 173.38 2cg9 n PRO 44 N 1.61 -0.06 0.00 -1.68 -0.02 -1.26 -1.48 135.00 132.11 2cg9 n PRO 44 Ca 0.01 1.15 0.00 0.00 -2.02 0.00 0.00 63.50 62.64 2cg9 n PRO 44 Cb 0.44 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 2cg9 n PRO 44 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2cg9 n SER 45 N -5.04 1.12 -4.30 2.55 2.88 -1.26 -3.28 113.62 106.29 2cg9 n SER 45 Ca 0.20 -1.20 -0.17 0.00 -1.33 0.00 0.00 58.87 56.37 2cg9 n SER 45 Cb 0.67 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 64.03 2cg9 n SER 45 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2cg9 s TYR 46 N -0.20 1.53 -0.02 0.66 2.02 -0.55 0.46 117.35 121.25 2cg9 s TYR 46 Ca 0.00 -0.61 0.02 0.00 -0.37 0.00 0.00 57.07 56.10 2cg9 s TYR 46 Cb 0.00 -0.75 0.01 0.00 -0.40 0.00 0.00 41.96 40.82 2cg9 s TYR 46 CO 0.00 0.24 -0.07 0.42 -1.57 0.00 0.00 175.55 174.57 2cg9 s ILE 47 N -2.84 0.60 -0.05 2.71 -1.09 -0.52 -1.97 121.20 118.05 2cg9 s ILE 47 Ca 0.18 -0.25 -0.05 0.00 -2.23 0.00 0.00 60.65 58.29 2cg9 s ILE 47 Cb -0.01 -0.55 0.01 0.00 -1.58 0.00 0.00 42.46 40.33 2cg9 s ILE 47 CO 0.04 0.20 0.14 -0.70 -1.23 0.00 0.00 174.94 173.39 2cg9 s GLU 48 N 0.29 0.19 -0.21 2.79 2.12 -1.15 -0.21 118.70 122.53 2cg9 s GLU 48 Ca -0.04 0.13 -0.14 0.00 0.36 0.00 0.00 54.97 55.28 2cg9 s GLU 48 Cb -0.08 0.09 0.06 0.00 0.26 0.00 0.00 34.13 34.46 2cg9 s GLU 48 CO 0.00 -0.03 0.53 -1.17 -0.54 0.00 0.00 175.26 174.05 2cg9 s LEU 49 N -0.07 -0.31 -0.18 2.70 2.96 0.40 -2.92 118.68 121.27 2cg9 s LEU 49 Ca -0.01 1.12 0.13 0.00 -0.22 0.00 0.00 54.13 55.15 2cg9 s LEU 49 Cb -0.02 1.79 0.42 0.00 0.50 0.00 0.00 46.19 48.89 2cg9 s LEU 49 CO 0.00 -0.20 1.21 1.17 -1.32 0.00 0.00 176.35 177.21 2cg9 n LYS 50 N 3.77 1.36 -2.11 1.98 4.81 -1.26 0.11 118.16 126.84 2cg9 n LYS 50 Ca -0.19 -3.11 -0.42 0.00 -0.87 0.00 0.00 58.31 53.71 2cg9 n LYS 50 Cb 0.57 -1.37 -0.03 0.00 0.02 0.00 0.00 35.03 34.22 2cg9 n LYS 50 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2cg9 s ALA 51 N -2.73 3.62 0.19 3.14 0.00 -1.01 -4.52 121.76 120.45 2cg9 s ALA 51 Ca 0.38 1.04 -0.11 0.00 0.00 0.00 0.00 51.96 53.26 2cg9 s ALA 51 Cb 0.37 -3.62 -0.07 0.00 0.00 0.00 0.00 23.12 19.80 2cg9 s ALA 51 CO -0.08 -0.94 0.54 1.14 0.00 0.00 0.00 175.76 176.41 2cg9 s GLN 52 N 2.29 3.85 0.05 0.00 0.00 -1.21 -2.92 119.66 121.72 2cg9 s GLN 52 Ca 0.68 0.33 -0.06 0.00 -0.00 0.00 0.00 55.36 56.30 2cg9 s GLN 52 Cb -0.35 -2.76 -0.05 0.00 0.00 0.00 0.00 33.01 29.85 2cg9 s GLN 52 CO 0.29 0.39 0.31 -1.54 0.00 0.00 0.00 175.29 174.74 2cg9 s SER 53 N -2.12 6.51 -1.14 12.60 1.04 -0.78 -0.09 113.70 129.73 2cg9 s SER 53 Ca 0.43 0.59 -0.21 0.00 0.48 0.00 0.00 55.95 57.24 2cg9 s SER 53 Cb -0.13 -2.10 -0.06 0.00 0.10 0.00 0.00 66.02 63.84 2cg9 s SER 53 CO 0.20 0.19 1.91 1.17 0.98 0.00 0.00 173.24 177.69 2cg9 n LYS 54 N 0.80 2.01 -4.32 4.02 0.00 0.52 -3.96 118.16 117.23 2cg9 n LYS 54 Ca -0.08 -2.52 -0.18 0.00 0.00 0.00 0.00 58.31 55.53 2cg9 n LYS 54 Cb 0.52 -3.48 -0.14 0.00 0.00 0.00 0.00 35.03 31.93 2cg9 n LYS 54 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2cg9 s VAL 62 N 7.78 0.74 -0.08 3.15 1.01 -1.26 -4.89 120.40 126.85 2cg9 s VAL 62 Ca 0.62 -0.55 -0.00 0.00 0.00 0.00 0.00 61.98 62.04 2cg9 s VAL 62 Cb 0.05 -0.65 0.02 0.00 0.00 0.00 0.00 36.38 35.80 2cg9 s VAL 62 CO 0.11 0.10 -0.04 -1.00 0.00 0.00 0.00 175.10 174.27 2cg9 s HIS 63 N -0.43 1.01 -0.24 5.22 3.76 -1.25 -5.12 115.29 118.23 2cg9 s HIS 63 Ca 0.02 -0.39 -0.20 0.00 -0.15 0.00 0.00 55.06 54.34 2cg9 s HIS 63 Cb -0.05 -0.93 -0.02 0.00 1.11 0.00 0.00 32.58 32.69 2cg9 s HIS 63 CO 0.00 -0.36 0.61 -1.01 -0.85 0.00 0.00 174.74 173.14 2cg9 s HIS 64 N 1.57 3.31 -0.11 1.40 0.09 -1.26 -1.86 115.29 118.43 2cg9 s HIS 64 Ca 0.00 0.83 -0.01 0.00 -0.00 0.00 0.00 55.06 55.88 2cg9 s HIS 64 Cb -0.13 -2.81 -0.03 0.00 -0.00 0.00 0.00 32.58 29.61 2cg9 s HIS 64 CO -0.04 -0.27 -0.06 0.71 -0.00 0.00 0.00 174.74 175.08 2cg9 s TYR 65 N 2.28 2.97 0.04 1.40 1.51 -1.15 -0.47 117.35 123.93 2cg9 s TYR 65 Ca 0.26 -0.17 0.03 0.00 -1.01 0.00 0.00 57.07 56.18 2cg9 s TYR 65 Cb -0.16 -1.83 -0.02 0.00 -0.11 0.00 0.00 41.96 39.84 2cg9 s TYR 65 CO 0.09 0.13 -0.08 1.14 -1.11 0.00 0.00 175.55 175.72 2cg9 s GLN 66 N -0.22 0.56 -0.17 -0.62 -2.07 -0.97 -2.41 119.66 113.76 2cg9 s GLN 66 Ca 0.03 -0.70 -0.11 0.00 -1.82 0.00 0.00 55.36 52.76 2cg9 s GLN 66 Cb -0.13 -0.39 0.05 0.00 -1.09 0.00 0.00 33.01 31.45 2cg9 s GLN 66 CO 0.03 0.08 0.42 -1.17 -1.32 0.00 0.00 175.29 173.33 2cg9 s LEU 67 N -1.37 0.06 -0.01 2.60 2.96 0.12 -4.58 118.68 118.46 2cg9 s LEU 67 Ca -0.07 0.90 0.01 0.00 -0.22 0.00 0.00 54.13 54.75 2cg9 s LEU 67 Cb -0.09 1.42 -0.00 0.00 0.50 0.00 0.00 46.19 48.02 2cg9 s LEU 67 CO 0.01 -0.18 -0.04 -2.28 -1.32 0.00 0.00 176.35 172.54 2cg9 s HIS 68 N 0.97 0.40 -0.07 5.38 5.65 -1.25 -0.45 115.29 125.92 2cg9 s HIS 68 Ca -0.06 -0.07 -0.03 0.00 0.25 0.00 0.00 55.06 55.14 2cg9 s HIS 68 Cb -0.06 -0.27 0.04 0.00 -1.18 0.00 0.00 32.58 31.10 2cg9 s HIS 68 CO -0.08 -0.02 0.15 0.96 -0.65 0.00 0.00 174.74 175.10 2cg9 s ILE 69 N -0.02 -0.04 0.01 0.89 -4.36 0.71 -4.98 121.20 113.41 2cg9 s ILE 69 Ca 0.01 0.15 -0.30 0.00 -0.26 0.00 0.00 60.65 60.25 2cg9 s ILE 69 Cb -0.03 -0.24 -0.04 0.00 1.25 0.00 0.00 42.46 43.39 2cg9 s ILE 69 CO -0.00 0.06 1.17 -1.81 0.24 0.00 0.00 174.94 174.60 2cg9 s ASP 70 N 1.03 7.10 0.80 4.36 -0.00 -1.26 -1.44 116.67 127.26 2cg9 s ASP 70 Ca -0.08 1.90 -0.11 0.00 -0.00 0.00 0.00 52.55 54.25 2cg9 s ASP 70 Cb -0.10 -2.57 0.07 0.00 -0.00 0.00 0.00 42.92 40.32 2cg9 s ASP 70 CO -0.05 -0.49 1.09 -0.76 -0.00 0.00 0.00 175.17 174.96 2cg9 s LEU 71 N 1.51 2.65 0.03 1.23 2.01 0.17 -3.32 118.68 122.96 2cg9 s LEU 71 Ca 0.57 1.42 0.01 0.00 0.01 0.00 0.00 54.13 56.14 2cg9 s LEU 71 Cb -0.27 -4.05 -0.26 0.00 0.01 0.00 0.00 46.19 41.63 2cg9 s LEU 71 CO 0.26 -2.01 0.95 0.22 1.01 0.00 0.00 176.35 176.78 2cg9 h TYR 72 N -1.11 0.30 -3.48 0.29 3.20 0.02 -3.27 116.97 112.93 2cg9 h TYR 72 Ca -0.47 -0.22 -0.25 0.00 3.14 0.00 0.00 58.73 60.93 2cg9 h TYR 72 Cb 1.26 -0.01 -0.07 0.00 1.54 0.00 0.00 36.73 39.45 2cg9 h TYR 72 CO 0.49 1.24 -0.24 1.63 -1.64 0.00 0.00 178.16 179.64 2cg9 n LYS 73 N -3.39 0.22 -2.85 1.82 5.02 -1.26 -4.90 118.16 112.83 2cg9 n LYS 73 Ca -0.12 -1.74 -0.42 0.00 -2.02 0.00 0.00 58.31 54.01 2cg9 n LYS 73 Cb 1.02 1.44 -0.04 0.00 -0.02 0.00 0.00 35.03 37.43 2cg9 n LYS 73 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2cg9 s GLU 74 N -2.70 3.95 0.00 1.97 2.56 -1.26 -4.81 118.70 118.40 2cg9 s GLU 74 Ca 0.21 0.67 0.00 0.00 0.00 0.00 0.00 54.97 55.85 2cg9 s GLU 74 Cb 0.01 -3.75 0.00 0.00 2.00 0.00 0.00 34.13 32.39 2cg9 s GLU 74 CO 0.15 -0.79 0.00 0.44 -0.56 0.00 0.00 175.26 174.49 2cg9 n ILE 75 N 5.71 0.00 -3.80 -3.70 -5.35 -1.21 -3.37 119.36 107.65 2cg9 n ILE 75 Ca 0.06 0.00 -0.30 0.00 -0.27 0.00 0.00 62.75 62.24 2cg9 n ILE 75 Cb 0.48 -1.91 -0.14 0.00 -1.74 0.00 0.00 39.64 36.33 2cg9 n ILE 75 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2cg9 s ILE 76 N -0.43 1.59 -0.66 7.28 1.01 -0.86 -4.78 121.20 124.35 2cg9 s ILE 76 Ca 0.00 -2.39 0.02 0.00 0.00 0.00 0.00 60.65 58.29 2cg9 s ILE 76 Cb 0.00 -2.14 0.02 0.00 0.01 0.00 0.00 42.46 40.36 2cg9 s ILE 76 CO 0.00 -0.79 0.97 -2.65 0.00 0.00 0.00 174.94 172.47 2cg9 n PRO 77 N 3.87 0.02 0.09 2.79 -0.02 -1.26 -2.55 135.00 137.93 2cg9 n PRO 77 Ca 0.05 0.41 -0.07 0.00 -2.02 0.00 0.00 63.50 61.88 2cg9 n PRO 77 Cb 0.37 -1.68 -0.04 0.00 -0.02 0.00 0.00 33.50 32.13 2cg9 n PRO 77 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2cg9 h GLU 78 N 0.00 -0.30 -2.96 -0.52 4.22 -1.94 -3.40 114.58 109.67 2cg9 h GLU 78 Ca 0.00 0.02 -0.76 0.00 0.08 0.00 0.00 59.36 58.70 2cg9 h GLU 78 Cb 0.25 0.07 -0.31 0.00 0.50 0.00 0.00 28.75 29.26 2cg9 h GLU 78 CO 0.00 -0.11 0.39 1.17 -2.18 0.00 0.00 179.01 178.28 2cg9 n LYS 79 N -4.98 3.77 -3.82 1.92 0.00 -1.06 -4.99 118.16 109.00 2cg9 n LYS 79 Ca -0.05 -4.55 -0.13 0.00 0.00 0.00 0.00 58.31 53.57 2cg9 n LYS 79 Cb 0.17 -2.46 -0.15 0.00 0.00 0.00 0.00 35.03 32.59 2cg9 n LYS 79 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.40 177.32 2cg9 s THR 80 N -2.31 -0.03 -0.09 3.15 -1.32 -1.26 -4.21 115.64 109.57 2cg9 s THR 80 Ca 0.32 0.10 0.02 0.00 -1.21 0.00 0.00 61.69 60.92 2cg9 s THR 80 Cb 0.02 -0.07 -0.02 0.00 -1.51 0.00 0.00 72.50 70.93 2cg9 s THR 80 CO 0.03 0.04 -0.15 0.00 -2.21 0.00 0.00 174.62 172.33 2cg9 s MET 81 N 0.52 2.92 -0.10 7.08 0.23 -1.20 -5.02 119.30 123.73 2cg9 s MET 81 Ca -0.04 -0.71 0.03 0.00 -1.03 0.00 0.00 55.69 53.94 2cg9 s MET 81 Cb -0.06 -2.47 -0.01 0.00 -1.53 0.00 0.00 34.83 30.76 2cg9 s MET 81 CO -0.02 0.41 -0.21 -3.38 -2.03 0.00 0.00 175.02 169.80 2cg9 s HIS 82 N -0.18 2.61 0.26 3.16 -3.43 -1.26 -2.78 115.29 113.67 2cg9 s HIS 82 Ca -0.00 -0.82 -0.04 0.00 -0.80 0.00 0.00 55.06 53.40 2cg9 s HIS 82 Cb -0.13 -1.72 -0.02 0.00 -1.43 0.00 0.00 32.58 29.28 2cg9 s HIS 82 CO 0.03 -0.28 0.32 -1.59 -2.00 0.00 0.00 174.74 171.22 2cg9 s LYS 83 N 0.17 1.52 -0.06 -0.38 -2.85 -0.99 -5.05 119.74 112.11 2cg9 s LYS 83 Ca -0.12 -1.59 0.04 0.00 -1.00 0.00 0.00 55.97 53.29 2cg9 s LYS 83 Cb -0.16 0.37 -0.02 0.00 -2.06 0.00 0.00 37.83 35.96 2cg9 s LYS 83 CO 0.06 -0.58 -0.16 0.54 0.10 0.00 0.00 175.35 175.31 2cg9 s VAL 84 N -3.79 2.87 -0.20 1.79 0.11 -1.26 -1.75 120.40 118.17 2cg9 s VAL 84 Ca 0.33 -0.78 -0.16 0.00 -2.93 0.00 0.00 61.98 58.44 2cg9 s VAL 84 Cb 0.03 -2.12 -0.08 0.00 -1.53 0.00 0.00 36.38 32.68 2cg9 s VAL 84 CO 0.15 0.58 -0.28 0.00 -3.33 0.00 0.00 175.10 172.22 2cg9 n ALA 85 N 2.62 0.85 -1.50 1.54 0.00 -1.12 -4.95 120.51 117.94 2cg9 n ALA 85 Ca -0.17 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.49 2cg9 n ALA 85 Cb 0.52 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2cg9 n ALA 85 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2cg9 n ASN 86 N -4.45 0.00 -2.79 0.00 0.23 -1.26 -4.96 115.26 102.03 2cg9 n ASN 86 Ca -0.22 0.00 -0.10 0.00 -0.53 0.00 0.00 54.58 53.72 2cg9 n ASN 86 Cb 0.56 0.00 0.07 0.00 -2.08 0.00 0.00 39.78 38.33 2cg9 n ASN 86 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2cg9 n GLY 87 N 0.00 0.84 3.64 4.83 0.00 -1.26 -3.62 105.19 109.62 2cg9 n GLY 87 Ca 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 46.02 45.82 2cg9 n GLY 87 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2cg9 s TYR 90 N 0.05 -0.11 0.06 1.61 -0.85 -1.21 -4.51 117.35 112.38 2cg9 s TYR 90 Ca 0.26 0.24 -0.27 0.00 -0.52 0.00 0.00 57.07 56.78 2cg9 s TYR 90 Cb 0.28 0.47 -0.05 0.00 0.38 0.00 0.00 41.96 43.04 2cg9 s TYR 90 CO -0.09 -0.08 0.84 0.12 -1.52 0.00 0.00 175.55 174.83 2cg9 s PHE 91 N -0.48 3.75 0.01 -3.49 2.19 -1.26 -2.79 117.98 115.92 2cg9 s PHE 91 Ca 0.07 1.59 0.04 0.00 0.33 0.00 0.00 56.93 58.96 2cg9 s PHE 91 Cb -0.03 -2.92 -0.03 0.00 -1.31 0.00 0.00 43.02 38.73 2cg9 s PHE 91 CO -0.10 0.23 -0.10 -1.17 1.83 0.00 0.00 175.22 175.91 2cg9 s LEU 92 N 0.06 3.01 0.05 6.12 2.96 -0.72 0.27 118.68 130.43 2cg9 s LEU 92 Ca 0.42 -0.22 -0.06 0.00 -0.22 0.00 0.00 54.13 54.05 2cg9 s LEU 92 Cb -0.21 -1.74 -0.01 0.00 0.50 0.00 0.00 46.19 44.73 2cg9 s LEU 92 CO 0.25 0.28 0.10 -0.75 -1.32 0.00 0.00 176.35 174.91 2cg9 s LYS 93 N -1.42 0.65 -0.19 1.98 2.20 0.36 -2.34 119.74 120.98 2cg9 s LYS 93 Ca 0.16 -0.85 -0.18 0.00 -0.36 0.00 0.00 55.97 54.74 2cg9 s LYS 93 Cb -0.11 0.25 0.05 0.00 -1.51 0.00 0.00 37.83 36.52 2cg9 s LYS 93 CO 0.07 -0.17 0.53 -1.17 -0.36 0.00 0.00 175.35 174.24 2cg9 s LEU 94 N -2.37 -0.01 -0.11 5.43 0.20 -1.12 0.63 118.68 121.34 2cg9 s LEU 94 Ca -0.01 1.04 -0.18 0.00 0.69 0.00 0.00 54.13 55.67 2cg9 s LEU 94 Cb 0.01 1.81 0.04 0.00 -0.43 0.00 0.00 46.19 47.62 2cg9 s LEU 94 CO -0.07 -0.19 0.44 -0.31 -0.29 0.00 0.00 176.35 175.94 2cg9 s TYR 95 N 0.24 -0.43 0.46 5.38 1.51 0.11 -3.25 117.35 121.36 2cg9 s TYR 95 Ca -0.00 0.94 -0.20 0.00 -1.01 0.00 0.00 57.07 56.79 2cg9 s TYR 95 Cb -0.04 0.18 -0.10 0.00 -0.11 0.00 0.00 41.96 41.89 2cg9 s TYR 95 CO 0.01 -0.33 0.97 0.21 -1.11 0.00 0.00 175.55 175.29 2cg9 s LYS 96 N -0.40 4.11 0.00 -0.62 2.20 -1.26 -0.69 119.74 123.08 2cg9 s LYS 96 Ca -0.05 1.12 0.00 0.00 -0.36 0.00 0.00 55.97 56.67 2cg9 s LYS 96 Cb -0.03 -2.16 0.00 0.00 -1.51 0.00 0.00 37.83 34.13 2cg9 s LYS 96 CO 0.03 -0.13 0.00 1.63 -0.36 0.00 0.00 175.35 176.51 2cg9 n LYS 97 N -0.88 1.80 -2.84 4.03 5.02 0.46 -2.03 118.16 123.72 2cg9 n LYS 97 Ca 0.07 0.00 -0.18 0.00 -2.02 0.00 0.00 58.31 56.18 2cg9 n LYS 97 Cb 0.54 0.00 -0.01 0.00 -0.02 0.00 0.00 35.03 35.54 2cg9 n LYS 97 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2cg9 n ASP 98 N 0.00 2.30 0.00 4.39 9.92 -1.22 -4.58 116.55 127.37 2cg9 n ASP 98 Ca 0.00 -3.13 0.00 0.00 -0.53 0.00 0.00 54.79 51.13 2cg9 n ASP 98 Cb 0.00 -0.55 0.00 0.00 -0.64 0.00 0.00 41.12 39.93 2cg9 n ASP 98 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2cg9 n LEU 99 N -0.06 0.00 0.04 0.64 -0.00 -1.26 -5.04 117.00 111.32 2cg9 n LEU 99 Ca 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.24 2cg9 n LEU 99 Cb 0.67 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.09 2cg9 n LEU 99 CO 0.27 0.00 0.00 1.21 -0.00 0.00 0.00 177.39 178.87 2cg9 n GLU 100 N 0.00 0.00 -2.75 1.47 0.00 -1.26 -5.04 120.64 113.06 2cg9 n GLU 100 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 57.16 57.06 2cg9 n GLU 100 Cb 0.00 0.00 0.06 0.00 0.00 0.00 0.00 31.44 31.50 2cg9 n GLU 100 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 2cg9 n SER 101 N -2.71 -0.31 -4.74 4.31 3.41 -1.26 -4.79 113.62 107.53 2cg9 n SER 101 Ca 0.00 -2.79 -0.30 0.00 -0.26 0.00 0.00 58.87 55.52 2cg9 n SER 101 Cb 0.00 0.32 -0.08 0.00 -0.26 0.00 0.00 64.21 64.19 2cg9 n SER 101 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2cg9 s GLU 102 N -1.42 2.15 -0.22 4.33 8.01 -1.26 -5.15 118.70 125.14 2cg9 s GLU 102 Ca 0.26 -2.25 -0.05 0.00 0.01 0.00 0.00 54.97 52.95 2cg9 s GLU 102 Cb 0.40 -1.65 0.11 0.00 -4.31 0.00 0.00 34.13 28.68 2cg9 s GLU 102 CO -0.03 -0.29 0.39 1.52 0.01 0.00 0.00 175.26 176.86 2cg9 s TYR 103 N -2.80 -0.80 0.03 1.61 1.13 -1.26 -4.93 117.35 110.32 2cg9 s TYR 103 Ca 0.19 1.14 -0.30 0.00 -1.41 0.00 0.00 57.07 56.68 2cg9 s TYR 103 Cb 0.03 0.14 -0.05 0.00 -1.10 0.00 0.00 41.96 40.99 2cg9 s TYR 103 CO 0.10 -0.60 1.18 -1.58 -2.51 0.00 0.00 175.55 172.14 2cg9 s TRP 104 N 2.57 3.41 -1.90 -3.49 0.52 -1.26 -4.92 118.94 113.87 2cg9 s TRP 104 Ca 0.06 1.32 0.31 0.00 0.02 0.00 0.00 56.10 57.81 2cg9 s TRP 104 Cb -0.14 -3.39 1.64 0.00 -1.15 0.00 0.00 33.47 30.43 2cg9 s TRP 104 CO -0.14 -1.17 2.09 -0.35 0.02 0.00 0.00 176.95 177.40 2cg9 n PRO 105 N 4.17 0.93 -3.83 4.98 -0.04 -1.26 -4.91 135.00 135.04 2cg9 n PRO 105 Ca 0.09 -0.14 -0.01 0.00 -0.04 0.00 0.00 63.50 63.40 2cg9 n PRO 105 Cb 0.47 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.44 2cg9 n PRO 105 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2cg9 s ARG 106 N -2.17 0.89 -0.23 0.54 1.70 -1.26 -5.07 118.95 113.35 2cg9 s ARG 106 Ca 0.41 -0.55 0.03 0.00 -0.47 0.00 0.00 55.73 55.14 2cg9 s ARG 106 Cb 0.21 0.27 -0.19 0.00 -0.57 0.00 0.00 34.95 34.67 2cg9 s ARG 106 CO 0.40 -0.41 -0.09 -0.11 -1.08 0.00 0.00 175.30 174.00 2cg9 n LEU 107 N -0.67 2.57 0.00 -1.89 0.00 -1.26 -4.72 117.00 111.03 2cg9 n LEU 107 Ca -0.03 -0.06 0.00 0.00 0.00 0.00 0.00 56.01 55.92 2cg9 n LEU 107 Cb 0.60 -0.77 0.00 0.00 0.00 0.00 0.00 43.42 43.26 2cg9 n LEU 107 CO 0.17 0.87 0.00 0.35 0.00 0.00 0.00 177.39 178.77 2cg9 n THR 108 N -3.23 0.00 -2.46 1.96 -2.24 -1.25 0.37 114.28 107.43 2cg9 n THR 108 Ca -0.42 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.14 2cg9 n THR 108 Cb 1.02 -2.00 0.01 0.00 -2.10 0.00 0.00 70.33 67.26 2cg9 n THR 108 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 2cg9 n LYS 109 N -0.88 2.97 0.00 -0.78 2.85 -1.21 -2.98 118.16 118.13 2cg9 n LYS 109 Ca 0.00 -4.19 0.00 0.00 -1.05 0.00 0.00 58.31 53.07 2cg9 n LYS 109 Cb 0.00 -2.04 0.00 0.00 -0.65 0.00 0.00 35.03 32.34 2cg9 n LYS 109 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 2cg9 n GLU 110 N -0.44 0.00 -3.15 -1.58 0.00 -1.26 -5.06 120.64 109.14 2cg9 n GLU 110 Ca 0.33 0.00 -0.43 0.00 0.00 0.00 0.00 57.16 57.06 2cg9 n GLU 110 Cb 0.74 0.00 -0.07 0.00 0.00 0.00 0.00 31.44 32.11 2cg9 n GLU 110 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.13 177.34 2cg9 s LYS 111 N 1.74 3.21 -1.23 3.44 2.47 -1.26 -5.00 119.74 123.11 2cg9 s LYS 111 Ca 0.00 -0.55 -0.16 0.00 -1.56 0.00 0.00 55.97 53.70 2cg9 s LYS 111 Cb 0.00 -3.99 0.12 0.00 -1.46 0.00 0.00 37.83 32.50 2cg9 s LYS 111 CO 0.00 -1.04 1.56 0.14 0.16 0.00 0.00 175.35 176.17 2cg9 s VAL 112 N 2.69 4.57 -0.29 4.02 -7.23 -1.26 -4.47 120.40 118.43 2cg9 s VAL 112 Ca 0.19 -2.20 0.09 0.00 -1.81 0.00 0.00 61.98 58.25 2cg9 s VAL 112 Cb -0.16 -5.04 0.51 0.00 0.56 0.00 0.00 36.38 32.26 2cg9 s VAL 112 CO 0.16 -1.81 1.48 1.17 -0.31 0.00 0.00 175.10 175.79 2cg9 n LYS 113 N 7.03 1.94 -1.78 4.82 4.81 -1.26 -5.02 118.16 128.69 2cg9 n LYS 113 Ca 0.42 -3.15 -0.43 0.00 -0.87 0.00 0.00 58.31 54.28 2cg9 n LYS 113 Cb 0.45 -1.83 -0.03 0.00 0.02 0.00 0.00 35.03 33.64 2cg9 n LYS 113 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 2cg9 s TYR 114 N -3.22 1.48 0.18 5.64 2.02 -1.26 -4.91 117.35 117.28 2cg9 s TYR 114 Ca 0.45 0.28 -0.11 0.00 -0.37 0.00 0.00 57.07 57.31 2cg9 s TYR 114 Cb 0.40 -4.04 0.10 0.00 -0.40 0.00 0.00 41.96 38.02 2cg9 s TYR 114 CO 0.01 -4.11 1.76 -1.00 -1.57 0.00 0.00 175.55 170.63 2cg9 h PRO 115 N 12.60 0.94 0.00 -1.71 0.13 -2.00 -3.22 132.00 138.74 2cg9 h PRO 115 Ca -0.41 -0.15 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 2cg9 h PRO 115 Cb 1.21 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.18 2cg9 h PRO 115 CO 0.97 0.77 -0.97 2.48 -0.23 0.00 0.00 178.00 181.02 2cg9 n TYR 116 N -4.46 0.34 -2.91 1.56 0.18 -1.26 -4.68 117.16 105.93 2cg9 n TYR 116 Ca 0.04 0.10 -0.42 0.00 1.88 0.00 0.00 57.90 59.50 2cg9 n TYR 116 Cb 0.15 -0.49 -0.05 0.00 -0.38 0.00 0.00 39.34 38.57 2cg9 n TYR 116 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 2cg9 s ILE 117 N -3.20 4.70 0.12 -3.48 1.01 -1.22 -0.34 121.20 118.79 2cg9 s ILE 117 Ca 0.04 1.02 0.04 0.00 0.00 0.00 0.00 60.65 61.75 2cg9 s ILE 117 Cb 0.14 -4.24 -0.04 0.00 0.01 0.00 0.00 42.46 38.34 2cg9 s ILE 117 CO 0.79 -0.43 -0.10 -0.54 0.00 0.00 0.00 174.94 174.65 2cg9 s LYS 118 N 3.18 0.94 0.17 2.79 1.02 -0.91 -4.85 119.74 122.08 2cg9 s LYS 118 Ca 0.33 -1.28 -0.30 0.00 0.02 0.00 0.00 55.97 54.74 2cg9 s LYS 118 Cb -0.13 -0.58 -0.07 0.00 -0.52 0.00 0.00 37.83 36.53 2cg9 s LYS 118 CO 0.17 0.08 1.03 0.99 -0.92 0.00 0.00 175.35 176.70 2cg9 s THR 119 N -2.81 4.07 -0.91 2.17 2.01 -1.26 -3.17 115.64 115.74 2cg9 s THR 119 Ca 0.10 1.82 -0.20 0.00 0.31 0.00 0.00 61.69 63.72 2cg9 s THR 119 Cb -0.01 -4.16 0.11 0.00 0.01 0.00 0.00 72.50 68.45 2cg9 s THR 119 CO 0.00 0.33 1.17 -0.62 -0.69 0.00 0.00 174.62 174.80 2cg9 s ASP 120 N -0.27 6.53 0.37 3.53 3.68 -1.14 -4.88 116.67 124.49 2cg9 s ASP 120 Ca 0.47 -1.76 0.27 0.00 2.13 0.00 0.00 52.55 53.66 2cg9 s ASP 120 Cb -0.27 -2.44 1.24 0.00 -1.45 0.00 0.00 42.92 40.00 2cg9 s ASP 120 CO 0.33 -1.21 1.82 -0.26 0.13 0.00 0.00 175.17 175.98 2cg9 h PHE 121 N 9.13 0.00 -0.02 -5.34 -1.00 -1.89 0.64 116.94 118.46 2cg9 h PHE 121 Ca 0.10 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.88 2cg9 h PHE 121 Cb 1.03 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.59 2cg9 h PHE 121 CO 1.16 0.00 0.01 0.22 -1.61 0.00 0.00 178.31 178.09 2cg9 h ASP 122 N 0.00 0.02 0.51 2.17 -0.00 -1.98 -3.27 116.42 113.87 2cg9 h ASP 122 Ca 0.00 -0.13 -0.21 0.00 -0.00 0.00 0.00 57.03 56.69 2cg9 h ASP 122 Cb 0.28 -0.01 -0.04 0.00 -0.00 0.00 0.00 39.33 39.56 2cg9 h ASP 122 CO 0.00 0.15 -1.65 0.29 -0.00 0.00 0.00 179.24 178.03 2cg9 n LYS 123 N -5.01 0.64 -1.74 0.28 4.01 -1.03 -4.93 118.16 110.37 2cg9 n LYS 123 Ca -0.07 0.17 -0.42 0.00 -0.51 0.00 0.00 58.31 57.48 2cg9 n LYS 123 Cb 0.09 -1.74 -0.00 0.00 -0.51 0.00 0.00 35.03 32.86 2cg9 n LYS 123 CO 0.00 0.00 0.00 1.87 -1.11 0.00 0.00 177.40 178.16 2cg9 n TRP 124 N -2.85 2.70 0.13 2.13 -0.00 0.19 -4.87 117.44 114.86 2cg9 n TRP 124 Ca -0.14 0.47 0.00 0.00 -0.00 0.00 0.00 57.50 57.83 2cg9 n TRP 124 Cb 0.90 -2.49 0.00 0.00 -0.00 0.00 0.00 31.31 29.72 2cg9 n TRP 124 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 177.69 179.02 2cg9 n VAL 125 N 0.55 0.00 -0.49 5.87 0.24 -1.26 -4.88 118.33 118.36 2cg9 n VAL 125 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.33 2cg9 n VAL 125 Cb 0.37 -0.18 0.00 0.00 -1.47 0.00 0.00 33.84 32.56 2cg9 n VAL 125 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2cg9 n ASP 126 N -3.15 0.00 0.00 -1.34 9.92 -1.26 -4.64 116.55 116.09 2cg9 n ASP 126 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2cg9 n ASP 126 Cb 0.00 -1.46 0.00 0.00 -0.64 0.00 0.00 41.12 39.02 2cg9 n ASP 126 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2cg9 n ALA 127 N -2.30 0.00 -2.34 2.24 0.00 -1.26 -4.49 120.51 112.36 2cg9 n ALA 127 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 2cg9 n ALA 127 Cb 0.30 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.78 2cg9 n ALA 127 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2cg9 n ASP 128 N 0.97 3.78 0.00 0.00 8.00 -1.26 -4.91 116.55 123.13 2cg9 n ASP 128 Ca 0.00 -3.21 0.00 0.00 0.71 0.00 0.00 54.79 52.29 2cg9 n ASP 128 Cb 0.00 -0.40 0.00 0.00 -0.02 0.00 0.00 41.12 40.70 2cg9 n ASP 128 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2cg9 n GLU 129 N -0.61 0.00 -0.14 -1.24 4.71 -1.26 -2.56 120.64 119.54 2cg9 n GLU 129 Ca 0.31 0.24 0.06 0.00 -0.01 0.00 0.00 57.16 57.77 2cg9 n GLU 129 Cb 0.88 -0.98 0.20 0.00 -1.01 0.00 0.00 31.44 30.53 2cg9 n GLU 129 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 2cg9 n GLN 130 N -0.72 1.71 -1.97 3.49 3.00 -1.26 -4.16 117.38 117.47 2cg9 n GLN 130 Ca 0.00 -1.09 -0.32 0.00 -0.01 0.00 0.00 57.00 55.58 2cg9 n GLN 130 Cb 0.00 -1.28 0.03 0.00 0.00 0.00 0.00 30.24 29.00 2cg9 n GLN 130 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.06 176.66 2cg9 n ASP 131 N 0.37 6.25 0.00 1.08 3.85 -1.06 -4.18 116.55 122.86 2cg9 n ASP 131 Ca 0.12 -3.78 0.00 0.00 -0.71 0.00 0.00 54.79 50.42 2cg9 n ASP 131 Cb 0.27 -0.73 0.00 0.00 -1.35 0.00 0.00 41.12 39.31 2cg9 n ASP 131 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.20 177.40 2cg9 n GLU 132 N -0.64 0.00 -2.15 0.11 2.13 -1.12 -4.75 120.64 114.23 2cg9 n GLU 132 Ca 0.50 -0.43 -0.42 0.00 0.66 0.00 0.00 57.16 57.46 2cg9 n GLU 132 Cb 0.59 -0.45 0.00 0.00 0.27 0.00 0.00 31.44 31.85 2cg9 n GLU 132 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 2cg9 n VAL 133 N 0.00 3.82 -3.68 6.31 0.31 -1.26 -4.93 118.33 118.91 2cg9 n VAL 133 Ca 0.00 -3.70 -0.15 0.00 -0.01 0.00 0.00 64.34 60.49 2cg9 n VAL 133 Cb 0.49 -2.49 -0.08 0.00 -0.91 0.00 0.00 33.84 30.85 2cg9 n VAL 133 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2cg9 s GLU 134 N 2.64 0.74 0.00 5.55 -1.05 -1.26 -5.19 118.70 120.13 2cg9 s GLU 134 Ca 0.46 0.24 0.25 0.00 -0.15 0.00 0.00 54.97 55.78 2cg9 s GLU 134 Cb 0.09 0.35 1.50 0.00 -0.44 0.00 0.00 34.13 35.63 2cg9 s GLU 134 CO -0.03 -0.18 1.86 0.00 0.95 0.00 0.00 175.26 177.87