#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 2.35 -0.12 -1.67 0.00 0.38 -4.84 121.76 117.87 2cg9 s ALA 13 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.21 2cg9 s ALA 13 Cb 0.00 -2.93 0.02 0.00 0.00 0.00 0.00 23.12 20.21 2cg9 s ALA 13 CO 0.00 -2.00 -0.11 -1.14 0.00 0.00 0.00 175.76 172.52 2cg9 s GLN 14 N -5.59 1.82 0.62 0.00 0.74 -1.26 -2.10 119.66 113.89 2cg9 s GLN 14 Ca 0.65 -0.38 -0.16 0.00 0.05 0.00 0.00 55.36 55.52 2cg9 s GLN 14 Cb -0.10 -1.75 -0.02 0.00 1.10 0.00 0.00 33.01 32.24 2cg9 s GLN 14 CO 0.51 -0.22 1.08 1.03 -0.55 0.00 0.00 175.29 177.15 2cg9 s ARG 15 N 1.49 3.11 0.37 1.67 0.52 -1.26 -5.03 118.95 119.81 2cg9 s ARG 15 Ca 0.02 1.31 -0.04 0.00 -0.52 0.00 0.00 55.73 56.51 2cg9 s ARG 15 Cb -0.13 -2.00 -0.04 0.00 0.52 0.00 0.00 34.95 33.30 2cg9 s ARG 15 CO -0.07 -1.00 0.63 -1.54 0.02 0.00 0.00 175.30 173.35 2cg9 s SER 16 N -2.62 6.35 0.09 0.23 1.04 -1.26 -4.95 113.70 112.58 2cg9 s SER 16 Ca 0.66 0.73 0.02 0.00 0.48 0.00 0.00 55.95 57.83 2cg9 s SER 16 Cb -0.18 -2.15 -0.01 0.00 0.10 0.00 0.00 66.02 63.78 2cg9 s SER 16 CO 0.38 -0.35 0.06 -1.20 0.98 0.00 0.00 173.24 173.11 2cg9 n SER 17 N -1.60 0.03 -3.19 7.02 7.64 0.66 -3.49 113.62 120.69 2cg9 n SER 17 Ca -0.02 -1.54 0.01 0.00 1.01 0.00 0.00 58.87 58.33 2cg9 n SER 17 Cb 0.55 0.39 -0.01 0.00 -1.01 0.00 0.00 64.21 64.13 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 -2.26 -0.94 0.80 0.44 2.01 -1.20 -1.98 115.64 112.51 2cg9 s THR 18 Ca 0.09 -0.06 -0.12 0.00 0.31 0.00 0.00 61.69 61.91 2cg9 s THR 18 Cb 0.00 -0.78 0.07 0.00 0.01 0.00 0.00 72.50 71.81 2cg9 s THR 18 CO 0.06 -0.05 1.14 -0.89 -0.69 0.00 0.00 174.62 174.20 2cg9 s THR 19 N 2.55 2.50 0.00 -0.82 2.01 -1.19 -4.16 115.64 116.54 2cg9 s THR 19 Ca 0.11 0.16 0.00 0.00 0.31 0.00 0.00 61.69 62.28 2cg9 s THR 19 Cb -0.09 -3.09 0.00 0.00 0.01 0.00 0.00 72.50 69.33 2cg9 s THR 19 CO -0.22 -0.21 0.00 -0.90 -0.69 0.00 0.00 174.62 172.60 2cg9 n ASP 20 N -3.33 0.00 -4.72 3.53 5.68 -1.26 -2.96 116.55 113.49 2cg9 n ASP 20 Ca 0.07 0.00 -0.36 0.00 -0.50 0.00 0.00 54.79 54.01 2cg9 n ASP 20 Cb 0.59 0.00 0.09 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 2.20 0.00 0.11 0.02 -1.26 -4.20 135.00 131.86 2cg9 s PRO 21 Ca 0.00 1.95 0.00 0.00 0.02 0.00 0.00 61.00 62.97 2cg9 s PRO 21 Cb 0.00 -1.82 0.00 0.00 0.02 0.00 0.00 34.50 32.70 2cg9 s PRO 21 CO 0.00 -1.84 0.00 0.39 -0.33 0.00 0.00 177.00 175.22 2cg9 n GLU 22 N -2.44 1.49 0.23 5.54 -0.58 -0.68 -4.41 120.64 119.79 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 -3.41 114.38 113.01 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 1.67 -3.92 -3.80 2.04 -1.26 -4.63 115.26 100.15 2cg9 n ASN 24 Ca -0.08 -1.64 -0.09 0.00 -0.44 0.00 0.00 54.58 52.33 2cg9 n ASN 24 Cb 0.27 -0.01 -0.05 0.00 -2.53 0.00 0.00 39.78 37.46 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 -0.64 0.22 -0.03 -2.53 -0.85 -1.26 -0.36 117.35 111.89 2cg9 s TYR 25 Ca 0.01 -0.58 0.03 0.00 -0.52 0.00 0.00 57.07 56.01 2cg9 s TYR 25 Cb 0.01 0.22 0.00 0.00 0.38 0.00 0.00 41.96 42.57 2cg9 s TYR 25 CO 0.01 -0.94 -0.10 0.08 -1.52 0.00 0.00 175.55 173.08 2cg9 s VAL 26 N -3.97 0.86 0.25 -3.49 1.01 0.07 -1.69 120.40 113.44 2cg9 s VAL 26 Ca 0.18 -0.40 0.12 0.00 0.00 0.00 0.00 61.98 61.87 2cg9 s VAL 26 Cb -0.00 -0.77 -0.05 0.00 0.00 0.00 0.00 36.38 35.56 2cg9 s VAL 26 CO 0.04 0.27 -0.20 -1.48 0.00 0.00 0.00 175.10 173.73 2cg9 s LEU 27 N 0.23 2.58 -0.07 3.92 2.34 -1.26 -0.64 118.68 125.78 2cg9 s LEU 27 Ca -0.04 -0.94 -0.03 0.00 0.06 0.00 0.00 54.13 53.18 2cg9 s LEU 27 Cb -0.09 -1.17 0.04 0.00 -0.56 0.00 0.00 46.19 44.40 2cg9 s LEU 27 CO 0.01 0.07 0.14 -0.63 -1.06 0.00 0.00 176.35 174.87 2cg9 s ILE 28 N -2.20 -0.13 -0.25 1.48 1.01 0.21 -4.46 121.20 116.86 2cg9 s ILE 28 Ca 0.27 0.26 -0.06 0.00 0.00 0.00 0.00 60.65 61.12 2cg9 s ILE 28 Cb -0.06 -0.24 -0.01 0.00 0.01 0.00 0.00 42.46 42.16 2cg9 s ILE 28 CO 0.14 0.11 0.03 -0.89 0.00 0.00 0.00 174.94 174.32 2cg9 s THR 29 N 1.61 3.84 0.00 2.92 2.01 -1.26 -0.48 115.64 124.28 2cg9 s THR 29 Ca -0.04 -0.47 0.00 0.00 0.31 0.00 0.00 61.69 61.49 2cg9 s THR 29 Cb -0.12 -2.84 0.00 0.00 0.01 0.00 0.00 72.50 69.55 2cg9 s THR 29 CO -0.06 0.28 0.00 0.52 -0.69 0.00 0.00 174.62 174.68 2cg9 n VAL 30 N 4.85 0.00 -2.94 3.82 0.31 0.12 -3.71 118.33 120.78 2cg9 n VAL 30 Ca -0.16 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.21 2cg9 n VAL 30 Cb 0.50 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.43 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 -0.01 0.17 4.52 1.04 -1.23 -4.63 113.70 112.57 2cg9 s SER 31 Ca 0.00 -0.00 -0.21 0.00 0.48 0.00 0.00 55.95 56.22 2cg9 s SER 31 Cb 0.00 0.58 0.06 0.00 0.10 0.00 0.00 66.02 66.75 2cg9 s SER 31 CO 0.00 -0.00 0.58 -0.51 0.98 0.00 0.00 173.24 174.29 2cg9 s ILE 32 N 2.57 0.01 0.04 -1.02 -1.16 -1.26 -4.49 121.20 115.89 2cg9 s ILE 32 Ca 0.25 -0.28 -0.29 0.00 -0.51 0.00 0.00 60.65 59.82 2cg9 s ILE 32 Cb 0.03 -1.20 -0.04 0.00 0.61 0.00 0.00 42.46 41.85 2cg9 s ILE 32 CO -0.20 -0.05 0.94 0.00 -2.81 0.00 0.00 174.94 172.82 2cg9 s ALA 33 N -3.79 3.21 -1.37 1.50 0.00 -1.26 -3.27 121.76 116.79 2cg9 s ALA 33 Ca 0.03 0.51 -0.10 0.00 0.00 0.00 0.00 51.96 52.40 2cg9 s ALA 33 Cb -0.01 -3.27 0.01 0.00 0.00 0.00 0.00 23.12 19.84 2cg9 s ALA 33 CO -0.09 -0.14 0.41 -0.25 0.00 0.00 0.00 175.76 175.69 2cg9 n ASP 34 N 3.45 -1.51 -4.76 0.00 9.92 -1.24 -3.98 116.55 118.44 2cg9 n ASP 34 Ca 0.04 -1.14 -0.39 0.00 -0.53 0.00 0.00 54.79 52.77 2cg9 n ASP 34 Cb 0.50 -2.43 -0.05 0.00 -0.64 0.00 0.00 41.12 38.51 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 -1.21 3.27 -0.49 0.00 -1.08 0.89 -4.85 116.67 113.20 2cg9 s ASP 36 Ca 0.47 -0.93 -0.25 0.00 -0.52 0.00 0.00 52.55 51.32 2cg9 s ASP 36 Cb -0.26 -0.24 0.04 0.00 -1.46 0.00 0.00 42.92 40.99 2cg9 s ASP 36 CO 0.34 0.04 0.64 0.00 0.52 0.00 0.00 175.17 176.71 2cg9 n ALA 37 N -0.07 -2.62 -2.35 3.66 0.00 -1.26 -3.25 120.51 114.62 2cg9 n ALA 37 Ca -0.10 0.59 -0.43 0.00 0.00 0.00 0.00 53.44 53.50 2cg9 n ALA 37 Cb 0.58 -2.67 -0.02 0.00 0.00 0.00 0.00 19.45 17.33 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 -2.74 4.04 -0.75 0.00 0.02 -1.26 -4.20 135.00 130.11 2cg9 s PRO 38 Ca 0.28 1.54 -0.26 0.00 0.02 0.00 0.00 61.00 62.59 2cg9 s PRO 38 Cb -0.05 -3.86 0.04 0.00 0.02 0.00 0.00 34.50 30.65 2cg9 s PRO 38 CO 0.83 -0.96 1.23 -1.21 -0.33 0.00 0.00 177.00 176.56 2cg9 s GLU 39 N 3.96 3.21 0.05 5.54 8.01 -1.26 -4.97 118.70 133.24 2cg9 s GLU 39 Ca 0.59 -0.42 -0.31 0.00 0.01 0.00 0.00 54.97 54.85 2cg9 s GLU 39 Cb -0.21 -4.27 -0.06 0.00 -4.31 0.00 0.00 34.13 25.28 2cg9 s GLU 39 CO 0.21 -2.09 1.28 -0.48 0.01 0.00 0.00 175.26 174.19 2cg9 s LEU 40 N 5.36 4.35 -0.30 1.80 2.34 -1.26 -3.96 118.68 127.01 2cg9 s LEU 40 Ca 0.33 2.08 0.02 0.00 0.06 0.00 0.00 54.13 56.62 2cg9 s LEU 40 Cb -0.09 -3.58 0.15 0.00 -0.56 0.00 0.00 46.19 42.12 2cg9 s LEU 40 CO 0.12 -0.57 0.38 -0.89 -1.06 0.00 0.00 176.35 174.34 2cg9 s THR 41 N 1.43 -0.55 -0.97 5.48 2.01 -1.16 -4.99 115.64 116.89 2cg9 s THR 41 Ca 0.61 -0.42 -0.01 0.00 0.31 0.00 0.00 61.69 62.18 2cg9 s THR 41 Cb -0.31 -0.93 0.31 0.00 0.01 0.00 0.00 72.50 71.58 2cg9 s THR 41 CO 0.28 -0.36 1.44 -0.38 -0.69 0.00 0.00 174.62 174.91 2cg9 n ILE 42 N 5.20 4.99 -2.38 1.82 2.08 -1.26 -2.95 119.36 126.86 2cg9 n ILE 42 Ca 0.01 -5.84 -0.41 0.00 0.56 0.00 0.00 62.75 57.08 2cg9 n ILE 42 Cb 0.48 -1.88 -0.04 0.00 -0.75 0.00 0.00 39.64 37.45 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 4.53 0.26 0.38 1.02 -0.71 -4.79 119.74 117.19 2cg9 s LYS 43 Ca 0.36 1.90 0.07 0.00 0.02 0.00 0.00 55.97 58.31 2cg9 s LYS 43 Cb 0.12 -3.20 0.76 0.00 -0.52 0.00 0.00 37.83 34.99 2cg9 s LYS 43 CO 0.01 0.02 1.24 -2.30 -0.92 0.00 0.00 175.35 173.40 2cg9 n PRO 44 N 1.73 -0.06 0.00 -1.68 -0.02 -1.26 -1.49 135.00 132.23 2cg9 n PRO 44 Ca 0.02 1.15 0.00 0.00 -2.02 0.00 0.00 63.50 62.65 2cg9 n PRO 44 Cb 0.44 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 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 -5.00 1.08 -4.27 2.55 2.88 -1.26 -3.20 113.62 106.39 2cg9 n SER 45 Ca 0.22 -1.24 -0.17 0.00 -1.33 0.00 0.00 58.87 56.36 2cg9 n SER 45 Cb 0.75 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 64.10 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 -0.24 1.44 -0.02 0.66 2.02 -0.55 0.27 117.35 120.93 2cg9 s TYR 46 Ca 0.00 -0.64 0.02 0.00 -0.37 0.00 0.00 57.07 56.08 2cg9 s TYR 46 Cb 0.00 -0.72 0.00 0.00 -0.40 0.00 0.00 41.96 40.85 2cg9 s TYR 46 CO 0.00 0.18 -0.06 0.42 -1.57 0.00 0.00 175.55 174.52 2cg9 s ILE 47 N -2.83 0.55 -0.05 2.71 -1.09 -0.63 -1.74 121.20 118.11 2cg9 s ILE 47 Ca 0.16 -0.24 -0.06 0.00 -2.23 0.00 0.00 60.65 58.28 2cg9 s ILE 47 Cb -0.01 -0.50 0.01 0.00 -1.58 0.00 0.00 42.46 40.38 2cg9 s ILE 47 CO 0.03 0.18 0.16 -0.70 -1.23 0.00 0.00 174.94 173.38 2cg9 s GLU 48 N 0.22 0.22 -0.21 2.79 2.12 -1.15 -0.26 118.70 122.43 2cg9 s GLU 48 Ca -0.03 0.16 -0.14 0.00 0.36 0.00 0.00 54.97 55.32 2cg9 s GLU 48 Cb -0.07 0.11 0.06 0.00 0.26 0.00 0.00 34.13 34.49 2cg9 s GLU 48 CO -0.00 -0.03 0.52 -1.17 -0.54 0.00 0.00 175.26 174.04 2cg9 s LEU 49 N -0.08 -0.26 -0.16 2.70 2.96 0.76 -3.00 118.68 121.59 2cg9 s LEU 49 Ca -0.02 1.10 0.14 0.00 -0.22 0.00 0.00 54.13 55.14 2cg9 s LEU 49 Cb -0.02 1.76 0.41 0.00 0.50 0.00 0.00 46.19 48.85 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 3.70 1.26 -2.13 1.98 4.81 -1.26 0.37 118.16 126.90 2cg9 n LYS 50 Ca -0.19 -3.01 -0.42 0.00 -0.87 0.00 0.00 58.31 53.83 2cg9 n LYS 50 Cb 0.56 -1.30 -0.03 0.00 0.02 0.00 0.00 35.03 34.29 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 -2.58 3.62 0.17 3.14 0.00 -1.02 -4.53 121.76 120.57 2cg9 s ALA 51 Ca 0.37 1.12 -0.07 0.00 0.00 0.00 0.00 51.96 53.37 2cg9 s ALA 51 Cb 0.37 -3.57 -0.06 0.00 0.00 0.00 0.00 23.12 19.85 2cg9 s ALA 51 CO -0.08 -0.73 0.45 1.14 0.00 0.00 0.00 175.76 176.54 2cg9 s GLN 52 N 1.47 3.71 0.01 0.00 0.00 -1.20 -2.82 119.66 120.83 2cg9 s GLN 52 Ca 0.66 0.10 -0.06 0.00 -0.00 0.00 0.00 55.36 56.06 2cg9 s GLN 52 Cb -0.37 -2.78 -0.05 0.00 0.00 0.00 0.00 33.01 29.81 2cg9 s GLN 52 CO 0.30 0.42 0.26 -1.54 0.00 0.00 0.00 175.29 174.72 2cg9 s SER 53 N -2.32 6.47 -0.95 12.60 1.04 -0.81 -0.08 113.70 129.66 2cg9 s SER 53 Ca 0.43 0.52 -0.23 0.00 0.48 0.00 0.00 55.95 57.15 2cg9 s SER 53 Cb -0.12 -2.07 -0.13 0.00 0.10 0.00 0.00 66.02 63.79 2cg9 s SER 53 CO 0.22 0.24 1.92 1.17 0.98 0.00 0.00 173.24 177.78 2cg9 n LYS 54 N 1.03 1.49 -4.23 4.02 0.00 0.28 -3.97 118.16 116.79 2cg9 n LYS 54 Ca -0.11 -2.12 -0.17 0.00 0.00 0.00 0.00 58.31 55.92 2cg9 n LYS 54 Cb 0.53 -3.30 -0.14 0.00 0.00 0.00 0.00 35.03 32.12 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 8.06 0.62 -0.07 3.15 1.01 -1.26 -4.91 120.40 127.00 2cg9 s VAL 62 Ca 0.63 -0.54 -0.00 0.00 0.00 0.00 0.00 61.98 62.08 2cg9 s VAL 62 Cb 0.07 -0.56 0.02 0.00 0.00 0.00 0.00 36.38 35.91 2cg9 s VAL 62 CO 0.14 0.03 -0.04 -1.00 0.00 0.00 0.00 175.10 174.23 2cg9 s HIS 63 N -0.48 0.94 -0.21 5.22 3.76 -1.25 -5.12 115.29 118.14 2cg9 s HIS 63 Ca 0.00 -0.34 -0.20 0.00 -0.15 0.00 0.00 55.06 54.38 2cg9 s HIS 63 Cb -0.05 -0.87 -0.03 0.00 1.11 0.00 0.00 32.58 32.75 2cg9 s HIS 63 CO 0.00 -0.32 0.59 -1.01 -0.85 0.00 0.00 174.74 173.15 2cg9 s HIS 64 N 1.44 3.35 -0.11 1.40 0.09 -1.26 -1.92 115.29 118.28 2cg9 s HIS 64 Ca -0.02 0.84 -0.01 0.00 -0.00 0.00 0.00 55.06 55.87 2cg9 s HIS 64 Cb -0.13 -2.76 -0.03 0.00 -0.00 0.00 0.00 32.58 29.66 2cg9 s HIS 64 CO -0.03 -0.18 -0.07 0.71 -0.00 0.00 0.00 174.74 175.17 2cg9 s TYR 65 N 1.93 2.95 0.04 1.40 1.51 -1.13 -0.47 117.35 123.59 2cg9 s TYR 65 Ca 0.26 -0.19 0.03 0.00 -1.01 0.00 0.00 57.07 56.16 2cg9 s TYR 65 Cb -0.16 -1.82 -0.02 0.00 -0.11 0.00 0.00 41.96 39.85 2cg9 s TYR 65 CO 0.10 0.12 -0.09 1.14 -1.11 0.00 0.00 175.55 175.71 2cg9 s GLN 66 N -0.21 0.58 -0.18 -0.62 -2.07 -0.89 -2.44 119.66 113.83 2cg9 s GLN 66 Ca 0.03 -0.74 -0.12 0.00 -1.82 0.00 0.00 55.36 52.71 2cg9 s GLN 66 Cb -0.13 -0.42 0.05 0.00 -1.09 0.00 0.00 33.01 31.43 2cg9 s GLN 66 CO 0.03 0.09 0.45 -1.17 -1.32 0.00 0.00 175.29 173.36 2cg9 s LEU 67 N -1.45 0.01 0.00 2.60 2.96 0.16 -4.53 118.68 118.43 2cg9 s LEU 67 Ca -0.07 0.94 0.01 0.00 -0.22 0.00 0.00 54.13 54.79 2cg9 s LEU 67 Cb -0.09 1.50 -0.00 0.00 0.50 0.00 0.00 46.19 48.10 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 0.92 0.35 -0.07 5.38 5.65 -1.26 -0.17 115.29 126.09 2cg9 s HIS 68 Ca -0.05 -0.10 -0.04 0.00 0.25 0.00 0.00 55.06 55.11 2cg9 s HIS 68 Cb -0.06 -0.23 0.03 0.00 -1.18 0.00 0.00 32.58 31.15 2cg9 s HIS 68 CO -0.08 -0.01 0.17 0.96 -0.65 0.00 0.00 174.74 175.13 2cg9 s ILE 69 N -0.20 -0.03 -0.04 0.89 -4.36 0.64 -4.98 121.20 113.13 2cg9 s ILE 69 Ca 0.00 0.12 -0.30 0.00 -0.26 0.00 0.00 60.65 60.21 2cg9 s ILE 69 Cb -0.02 -0.26 -0.03 0.00 1.25 0.00 0.00 42.46 43.40 2cg9 s ILE 69 CO -0.00 0.05 1.11 -1.81 0.24 0.00 0.00 174.94 174.53 2cg9 s ASP 70 N 0.87 7.16 0.83 4.36 -0.00 -1.26 -1.61 116.67 127.01 2cg9 s ASP 70 Ca -0.06 1.75 -0.11 0.00 -0.00 0.00 0.00 52.55 54.12 2cg9 s ASP 70 Cb -0.08 -2.56 0.09 0.00 -0.00 0.00 0.00 42.92 40.36 2cg9 s ASP 70 CO -0.05 -0.48 1.09 -0.76 -0.00 0.00 0.00 175.17 174.98 2cg9 s LEU 71 N 1.78 2.52 0.01 1.23 2.01 0.14 -3.18 118.68 123.20 2cg9 s LEU 71 Ca 0.54 1.43 0.01 0.00 0.01 0.00 0.00 54.13 56.11 2cg9 s LEU 71 Cb -0.23 -3.99 -0.26 0.00 0.01 0.00 0.00 46.19 41.72 2cg9 s LEU 71 CO 0.23 -2.21 0.89 0.22 1.01 0.00 0.00 176.35 176.49 2cg9 h TYR 72 N -1.25 0.32 -3.53 0.29 3.20 0.03 -3.25 116.97 112.77 2cg9 h TYR 72 Ca -0.48 -0.23 -0.26 0.00 3.14 0.00 0.00 58.73 60.91 2cg9 h TYR 72 Cb 1.27 -0.01 -0.07 0.00 1.54 0.00 0.00 36.73 39.46 2cg9 h TYR 72 CO 0.46 1.27 -0.25 1.63 -1.64 0.00 0.00 178.16 179.64 2cg9 n LYS 73 N -3.38 0.24 -2.88 1.82 5.02 -1.26 -4.90 118.16 112.82 2cg9 n LYS 73 Ca -0.14 -1.77 -0.42 0.00 -2.02 0.00 0.00 58.31 53.96 2cg9 n LYS 73 Cb 1.03 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 -2.72 4.00 0.00 1.97 2.56 -1.26 -4.81 118.70 118.43 2cg9 s GLU 74 Ca 0.21 0.71 0.00 0.00 0.00 0.00 0.00 54.97 55.89 2cg9 s GLU 74 Cb 0.01 -3.72 0.00 0.00 2.00 0.00 0.00 34.13 32.42 2cg9 s GLU 74 CO 0.15 -0.72 0.00 0.44 -0.56 0.00 0.00 175.26 174.57 2cg9 n ILE 75 N 5.58 0.00 -3.82 -3.70 -5.35 -1.19 -3.43 119.36 107.45 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 -1.99 -0.14 0.00 -1.74 0.00 0.00 39.64 36.25 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 -0.41 1.70 -0.37 7.28 1.01 -0.86 -4.78 121.20 124.78 2cg9 s ILE 76 Ca 0.00 -2.47 0.08 0.00 0.00 0.00 0.00 60.65 58.27 2cg9 s ILE 76 Cb 0.00 -2.22 0.08 0.00 0.01 0.00 0.00 42.46 40.34 2cg9 s ILE 76 CO 0.00 -0.78 1.16 -2.65 0.00 0.00 0.00 174.94 172.66 2cg9 n PRO 77 N 3.82 0.06 0.06 2.79 -0.02 -1.26 -2.60 135.00 137.84 2cg9 n PRO 77 Ca 0.05 0.48 -0.07 0.00 -2.02 0.00 0.00 63.50 61.94 2cg9 n PRO 77 Cb 0.37 -1.86 -0.05 0.00 -0.02 0.00 0.00 33.50 31.94 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 -0.25 -2.93 -0.52 4.22 -1.94 -3.40 114.58 109.76 2cg9 h GLU 78 Ca 0.00 0.02 -0.75 0.00 0.08 0.00 0.00 59.36 58.70 2cg9 h GLU 78 Cb 0.34 0.06 -0.32 0.00 0.50 0.00 0.00 28.75 29.33 2cg9 h GLU 78 CO 0.00 0.02 0.35 1.17 -2.18 0.00 0.00 179.01 178.37 2cg9 n LYS 79 N -4.94 3.72 -3.82 1.92 0.00 -1.07 -4.99 118.16 108.98 2cg9 n LYS 79 Ca -0.05 -4.56 -0.13 0.00 0.00 0.00 0.00 58.31 53.57 2cg9 n LYS 79 Cb 0.19 -2.45 -0.15 0.00 0.00 0.00 0.00 35.03 32.62 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 -2.32 -0.03 -0.08 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 0.03 -0.06 -0.02 0.00 -1.51 0.00 0.00 72.50 70.93 2cg9 s THR 80 CO 0.02 0.04 -0.15 0.00 -2.21 0.00 0.00 174.62 172.33 2cg9 s MET 81 N 0.51 2.88 -0.10 7.08 0.23 -1.21 -5.02 119.30 123.66 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 30.77 2cg9 s MET 81 CO -0.02 0.43 -0.20 -3.38 -2.03 0.00 0.00 175.02 169.82 2cg9 s HIS 82 N -0.23 2.62 0.26 3.16 -3.43 -1.26 -2.90 115.29 113.50 2cg9 s HIS 82 Ca 0.01 -0.80 -0.04 0.00 -0.80 0.00 0.00 55.06 53.42 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 0.33 -1.59 -2.00 0.00 0.00 174.74 171.24 2cg9 s LYS 83 N 0.16 1.53 -0.07 -0.38 -2.85 -1.00 -5.05 119.74 112.08 2cg9 s LYS 83 Ca -0.11 -1.58 0.03 0.00 -1.00 0.00 0.00 55.97 53.31 2cg9 s LYS 83 Cb -0.16 0.38 -0.02 0.00 -2.06 0.00 0.00 37.83 35.97 2cg9 s LYS 83 CO 0.06 -0.59 -0.17 0.54 0.10 0.00 0.00 175.35 175.29 2cg9 s VAL 84 N -3.79 2.77 -0.19 1.79 0.11 -1.26 -1.71 120.40 118.12 2cg9 s VAL 84 Ca 0.32 -0.81 -0.15 0.00 -2.93 0.00 0.00 61.98 58.41 2cg9 s VAL 84 Cb 0.02 -2.09 -0.08 0.00 -1.53 0.00 0.00 36.38 32.71 2cg9 s VAL 84 CO 0.15 0.57 -0.24 0.00 -3.33 0.00 0.00 175.10 172.24 2cg9 n ALA 85 N 2.85 0.82 -1.69 1.54 0.00 -1.10 -4.95 120.51 117.97 2cg9 n ALA 85 Ca -0.17 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.54 2cg9 n ALA 85 Cb 0.52 -0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.95 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 -4.46 0.00 -2.80 0.00 0.23 -1.26 -4.96 115.26 102.01 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 0.54 0.00 0.06 0.00 -2.08 0.00 0.00 39.78 38.31 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 0.92 3.64 4.83 0.00 -1.26 -3.64 105.19 109.68 2cg9 n GLY 87 Ca 0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.02 -0.10 0.07 1.61 -0.85 -1.20 -4.52 117.35 112.34 2cg9 s TYR 90 Ca 0.26 0.21 -0.26 0.00 -0.52 0.00 0.00 57.07 56.77 2cg9 s TYR 90 Cb 0.28 0.48 -0.06 0.00 0.38 0.00 0.00 41.96 43.04 2cg9 s TYR 90 CO -0.09 -0.07 0.79 0.12 -1.52 0.00 0.00 175.55 174.78 2cg9 s PHE 91 N -0.52 3.78 0.03 -3.49 2.19 -1.26 -2.69 117.98 116.01 2cg9 s PHE 91 Ca 0.07 1.54 0.05 0.00 0.33 0.00 0.00 56.93 58.92 2cg9 s PHE 91 Cb -0.03 -2.84 -0.03 0.00 -1.31 0.00 0.00 43.02 38.81 2cg9 s PHE 91 CO -0.10 0.31 -0.10 -1.17 1.83 0.00 0.00 175.22 175.99 2cg9 s LEU 92 N -0.24 3.02 0.05 6.12 2.96 -0.69 0.11 118.68 130.02 2cg9 s LEU 92 Ca 0.39 -0.26 -0.06 0.00 -0.22 0.00 0.00 54.13 53.99 2cg9 s LEU 92 Cb -0.21 -1.76 -0.01 0.00 0.50 0.00 0.00 46.19 44.70 2cg9 s LEU 92 CO 0.24 0.25 0.11 -0.75 -1.32 0.00 0.00 176.35 174.88 2cg9 s LYS 93 N -1.59 0.67 -0.20 1.98 2.20 0.37 -2.36 119.74 120.81 2cg9 s LYS 93 Ca 0.18 -0.89 -0.21 0.00 -0.36 0.00 0.00 55.97 54.68 2cg9 s LYS 93 Cb -0.11 0.26 0.06 0.00 -1.51 0.00 0.00 37.83 36.53 2cg9 s LYS 93 CO 0.08 -0.18 0.60 -1.17 -0.36 0.00 0.00 175.35 174.32 2cg9 s LEU 94 N -2.47 -0.28 -0.11 5.43 0.20 -1.14 0.67 118.68 120.99 2cg9 s LEU 94 Ca -0.00 1.12 -0.19 0.00 0.69 0.00 0.00 54.13 55.75 2cg9 s LEU 94 Cb 0.02 2.07 0.04 0.00 -0.43 0.00 0.00 46.19 47.89 2cg9 s LEU 94 CO -0.07 -0.25 0.47 -0.31 -0.29 0.00 0.00 176.35 175.89 2cg9 s TYR 95 N 0.12 -0.45 0.42 5.38 1.51 0.19 -3.33 117.35 121.19 2cg9 s TYR 95 Ca -0.01 0.96 -0.21 0.00 -1.01 0.00 0.00 57.07 56.79 2cg9 s TYR 95 Cb -0.04 0.20 -0.11 0.00 -0.11 0.00 0.00 41.96 41.90 2cg9 s TYR 95 CO 0.02 -0.36 0.94 0.21 -1.11 0.00 0.00 175.55 175.25 2cg9 s LYS 96 N -0.49 4.24 0.00 -0.62 2.20 -1.26 -0.75 119.74 123.06 2cg9 s LYS 96 Ca -0.06 1.12 0.00 0.00 -0.36 0.00 0.00 55.97 56.67 2cg9 s LYS 96 Cb -0.03 -2.21 0.00 0.00 -1.51 0.00 0.00 37.83 34.07 2cg9 s LYS 96 CO 0.03 -0.01 0.00 1.63 -0.36 0.00 0.00 175.35 176.64 2cg9 n LYS 97 N -0.58 1.96 -2.92 4.03 5.02 0.51 -2.03 118.16 124.15 2cg9 n LYS 97 Ca 0.07 0.00 -0.17 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 1.94 0.00 4.39 9.92 -1.22 -4.55 116.55 127.03 2cg9 n ASP 98 Ca 0.00 -3.09 0.00 0.00 -0.53 0.00 0.00 54.79 51.17 2cg9 n ASP 98 Cb 0.00 -0.57 0.00 0.00 -0.64 0.00 0.00 41.12 39.91 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 0.02 0.00 0.08 0.64 -0.00 -1.26 -5.04 117.00 111.44 2cg9 n LEU 99 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.23 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 0.26 0.00 0.00 1.21 -0.00 0.00 0.00 177.39 178.86 2cg9 n GLU 100 N 0.00 0.00 -2.79 1.47 0.00 -1.26 -5.04 120.64 113.02 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 0.05 0.00 0.00 0.00 0.00 31.44 31.49 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 -2.96 -0.01 -4.73 4.31 3.41 -1.26 -4.76 113.62 107.61 2cg9 n SER 101 Ca 0.00 -2.83 -0.31 0.00 -0.26 0.00 0.00 58.87 55.46 2cg9 n SER 101 Cb 0.00 0.15 -0.08 0.00 -0.26 0.00 0.00 64.21 64.02 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 -1.71 2.14 -0.21 4.33 8.01 -1.26 -5.15 118.70 124.85 2cg9 s GLU 102 Ca 0.28 -2.30 -0.05 0.00 0.01 0.00 0.00 54.97 52.91 2cg9 s GLU 102 Cb 0.40 -1.60 0.11 0.00 -4.31 0.00 0.00 34.13 28.73 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 -2.82 -0.77 0.04 1.61 1.13 -1.26 -4.93 117.35 110.33 2cg9 s TYR 103 Ca 0.15 1.16 -0.30 0.00 -1.41 0.00 0.00 57.07 56.67 2cg9 s TYR 103 Cb 0.04 0.14 -0.05 0.00 -1.10 0.00 0.00 41.96 40.99 2cg9 s TYR 103 CO 0.08 -0.58 1.13 -1.58 -2.51 0.00 0.00 175.55 172.09 2cg9 s TRP 104 N 2.56 3.49 -2.06 -3.49 0.52 -1.26 -4.92 118.94 113.79 2cg9 s TRP 104 Ca 0.05 1.42 0.31 0.00 0.02 0.00 0.00 56.10 57.90 2cg9 s TRP 104 Cb -0.14 -3.33 1.70 0.00 -1.15 0.00 0.00 33.47 30.55 2cg9 s TRP 104 CO -0.14 -0.89 2.11 -0.35 0.02 0.00 0.00 176.95 177.71 2cg9 n PRO 105 N 4.00 1.09 -3.84 4.98 -0.04 -1.26 -4.91 135.00 135.01 2cg9 n PRO 105 Ca 0.08 -0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 2cg9 n PRO 105 Cb 0.48 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.45 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 -2.04 0.74 -0.20 0.54 1.70 -1.26 -5.07 118.95 113.36 2cg9 s ARG 106 Ca 0.44 -0.46 -0.00 0.00 -0.47 0.00 0.00 55.73 55.24 2cg9 s ARG 106 Cb 0.22 0.22 -0.21 0.00 -0.57 0.00 0.00 34.95 34.61 2cg9 s ARG 106 CO 0.37 -0.35 0.02 -0.11 -1.08 0.00 0.00 175.30 174.15 2cg9 n LEU 107 N -0.70 2.70 0.00 -1.89 0.00 -1.26 -4.72 117.00 111.13 2cg9 n LEU 107 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.99 2cg9 n LEU 107 Cb 0.60 -0.91 0.00 0.00 0.00 0.00 0.00 43.42 43.11 2cg9 n LEU 107 CO 0.16 0.88 0.00 0.35 0.00 0.00 0.00 177.39 178.78 2cg9 n THR 108 N -3.32 0.00 -2.45 1.96 -2.24 -1.25 0.41 114.28 107.40 2cg9 n THR 108 Ca -0.40 0.00 -0.23 0.00 -2.27 0.00 0.00 64.05 61.15 2cg9 n THR 108 Cb 1.02 -1.91 0.01 0.00 -2.10 0.00 0.00 70.33 67.35 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 3.07 0.00 -0.78 2.85 -1.19 -3.07 118.16 118.16 2cg9 n LYS 109 Ca 0.00 -4.24 0.00 0.00 -1.05 0.00 0.00 58.31 53.02 2cg9 n LYS 109 Cb 0.00 -2.09 0.00 0.00 -0.65 0.00 0.00 35.03 32.29 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 -0.46 0.00 -3.07 -1.58 0.00 -1.26 -5.06 120.64 109.21 2cg9 n GLU 110 Ca 0.34 0.00 -0.43 0.00 0.00 0.00 0.00 57.16 57.07 2cg9 n GLU 110 Cb 0.74 0.00 -0.06 0.00 0.00 0.00 0.00 31.44 32.12 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 1.57 3.22 -1.28 3.44 2.47 -1.26 -4.99 119.74 122.92 2cg9 s LYS 111 Ca 0.00 -0.57 -0.16 0.00 -1.56 0.00 0.00 55.97 53.68 2cg9 s LYS 111 Cb 0.00 -4.04 0.10 0.00 -1.46 0.00 0.00 37.83 32.44 2cg9 s LYS 111 CO 0.00 -1.21 1.68 1.33 0.16 0.00 0.00 175.35 177.31 2cg9 n VAL 112 N 5.83 4.03 -1.38 4.02 0.24 -1.26 -4.47 118.33 125.33 2cg9 n VAL 112 Ca -0.03 -4.25 -0.07 0.00 -2.04 0.00 0.00 64.34 57.96 2cg9 n VAL 112 Cb 0.47 -2.40 0.20 0.00 -1.47 0.00 0.00 33.84 30.64 2cg9 n VAL 112 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 2cg9 n LYS 113 N 7.22 2.02 -1.93 7.34 4.81 -1.26 -5.02 118.16 131.34 2cg9 n LYS 113 Ca 0.45 -3.14 -0.43 0.00 -0.87 0.00 0.00 58.31 54.33 2cg9 n LYS 113 Cb 0.44 -1.88 -0.03 0.00 0.02 0.00 0.00 35.03 33.58 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 1.76 0.16 5.64 2.02 -1.26 -4.91 117.35 117.54 2cg9 s TYR 114 Ca 0.47 0.29 -0.12 0.00 -0.37 0.00 0.00 57.07 57.33 2cg9 s TYR 114 Cb 0.41 -4.01 0.05 0.00 -0.40 0.00 0.00 41.96 38.01 2cg9 s TYR 114 CO 0.02 -3.80 1.67 -1.00 -1.57 0.00 0.00 175.55 170.87 2cg9 h PRO 115 N 11.22 0.90 0.00 -1.71 0.13 -2.00 -3.25 132.00 137.29 2cg9 h PRO 115 Ca -0.39 -0.22 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 2cg9 h PRO 115 Cb 1.19 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2cg9 h PRO 115 CO 0.97 0.84 -0.93 2.48 -0.23 0.00 0.00 178.00 181.13 2cg9 n TYR 116 N -4.39 0.39 -2.87 1.56 0.18 -1.26 -4.67 117.16 106.10 2cg9 n TYR 116 Ca 0.02 0.11 -0.42 0.00 1.88 0.00 0.00 57.90 59.49 2cg9 n TYR 116 Cb 0.24 -0.53 -0.04 0.00 -0.38 0.00 0.00 39.34 38.62 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 -3.21 4.64 0.13 -3.48 1.01 -1.23 -0.25 121.20 118.82 2cg9 s ILE 117 Ca 0.04 1.06 0.05 0.00 0.00 0.00 0.00 60.65 61.79 2cg9 s ILE 117 Cb 0.14 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.28 2cg9 s ILE 117 CO 0.78 -0.50 -0.11 -0.54 0.00 0.00 0.00 174.94 174.57 2cg9 s LYS 118 N 3.32 0.99 0.18 2.79 1.02 -0.84 -4.85 119.74 122.37 2cg9 s LYS 118 Ca 0.35 -1.33 -0.30 0.00 0.02 0.00 0.00 55.97 54.72 2cg9 s LYS 118 Cb -0.12 -0.66 -0.08 0.00 -0.52 0.00 0.00 37.83 36.45 2cg9 s LYS 118 CO 0.18 0.10 0.97 0.99 -0.92 0.00 0.00 175.35 176.67 2cg9 s THR 119 N -2.83 4.20 -0.88 2.17 2.01 -1.26 -3.18 115.64 115.87 2cg9 s THR 119 Ca 0.12 2.00 -0.19 0.00 0.31 0.00 0.00 61.69 63.93 2cg9 s THR 119 Cb -0.01 -4.28 0.13 0.00 0.01 0.00 0.00 72.50 68.35 2cg9 s THR 119 CO 0.01 0.39 1.08 -0.62 -0.69 0.00 0.00 174.62 174.79 2cg9 s ASP 120 N -0.55 6.56 0.37 3.53 3.68 -1.16 -4.89 116.67 124.23 2cg9 s ASP 120 Ca 0.45 -1.91 0.27 0.00 2.13 0.00 0.00 52.55 53.48 2cg9 s ASP 120 Cb -0.26 -2.39 1.27 0.00 -1.45 0.00 0.00 42.92 40.09 2cg9 s ASP 120 CO 0.32 -1.10 1.82 -0.26 0.13 0.00 0.00 175.17 176.08 2cg9 h PHE 121 N 8.91 0.00 -0.01 -5.34 -1.00 -1.89 0.37 116.94 117.97 2cg9 h PHE 121 Ca 0.09 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.86 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 1.13 0.00 0.01 0.22 -1.61 0.00 0.00 178.31 178.05 2cg9 h ASP 122 N 0.00 0.02 0.56 2.17 -0.00 -1.98 -3.25 116.42 113.94 2cg9 h ASP 122 Ca 0.00 -0.13 -0.17 0.00 -0.00 0.00 0.00 57.03 56.72 2cg9 h ASP 122 Cb 0.24 -0.00 -0.03 0.00 -0.00 0.00 0.00 39.33 39.54 2cg9 h ASP 122 CO 0.00 0.15 -1.58 0.29 -0.00 0.00 0.00 179.24 178.10 2cg9 n LYS 123 N -5.01 0.63 -1.80 0.28 4.01 -1.06 -4.93 118.16 110.28 2cg9 n LYS 123 Ca -0.07 0.15 -0.41 0.00 -0.51 0.00 0.00 58.31 57.47 2cg9 n LYS 123 Cb 0.09 -1.75 -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 -0.46 -1.11 0.00 0.00 177.40 175.83 2cg9 s TRP 124 N -2.94 2.60 0.25 2.13 -0.00 0.10 -4.87 118.94 116.22 2cg9 s TRP 124 Ca -0.04 1.12 0.00 0.00 -0.00 0.00 0.00 56.10 57.18 2cg9 s TRP 124 Cb 0.09 -4.03 0.00 0.00 -0.00 0.00 0.00 33.47 29.53 2cg9 s TRP 124 CO 0.82 -3.08 0.00 1.33 -0.00 0.00 0.00 176.95 176.03 2cg9 n VAL 125 N 0.68 0.00 -0.46 5.86 0.24 -1.26 -4.87 118.33 118.51 2cg9 n VAL 125 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.32 2cg9 n VAL 125 Cb 0.39 -0.19 0.00 0.00 -1.47 0.00 0.00 33.84 32.57 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 -4.62 116.55 116.10 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 -1.39 0.00 0.00 -0.64 0.00 0.00 41.12 39.09 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 -2.16 0.00 -2.27 2.24 0.00 -1.26 -4.49 120.51 112.57 2cg9 n ALA 127 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 2cg9 n ALA 127 Cb 0.31 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.79 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 0.94 4.01 0.00 0.00 8.00 -1.26 -4.94 116.55 123.30 2cg9 n ASP 128 Ca 0.00 -3.30 0.00 0.00 0.71 0.00 0.00 54.79 52.20 2cg9 n ASP 128 Cb 0.00 -0.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.71 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 -0.65 0.00 -0.24 -1.24 4.71 -1.26 -2.20 120.64 119.75 2cg9 n GLU 129 Ca 0.34 0.22 0.02 0.00 -0.01 0.00 0.00 57.16 57.73 2cg9 n GLU 129 Cb 0.90 -0.92 0.11 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 -0.64 2.05 -1.15 3.49 3.00 -1.26 -4.30 117.38 118.57 2cg9 n GLN 130 Ca 0.00 -0.87 -0.15 0.00 -0.01 0.00 0.00 57.00 55.97 2cg9 n GLN 130 Cb 0.00 -1.67 0.15 0.00 0.00 0.00 0.00 30.24 28.72 2cg9 n GLN 130 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2cg9 n ASP 131 N 0.17 3.82 -3.18 1.08 10.43 -0.94 -4.63 116.55 123.30 2cg9 n ASP 131 Ca 0.08 -3.77 -0.23 0.00 2.57 0.00 0.00 54.79 53.44 2cg9 n ASP 131 Cb 0.49 -0.67 -0.07 0.00 1.84 0.00 0.00 41.12 42.71 2cg9 n ASP 131 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34 2cg9 n GLU 132 N -1.03 0.73 -2.82 -1.24 2.13 -1.24 -4.90 120.64 112.27 2cg9 n GLU 132 Ca 0.43 -3.21 -0.18 0.00 0.66 0.00 0.00 57.16 54.86 2cg9 n GLU 132 Cb 1.06 -1.25 -0.01 0.00 0.27 0.00 0.00 31.44 31.51 2cg9 n GLU 132 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 2cg9 n VAL 133 N 1.33 1.31 -2.89 6.31 0.24 -1.26 -5.07 118.33 118.30 2cg9 n VAL 133 Ca 0.21 -4.32 0.00 0.00 -2.04 0.00 0.00 64.34 58.19 2cg9 n VAL 133 Cb 0.54 -0.35 0.00 0.00 -1.47 0.00 0.00 33.84 32.56 2cg9 n VAL 133 CO 0.00 0.00 0.00 -1.84 -2.14 0.00 0.00 176.83 172.85 2cg9 n GLU 134 N -0.08 0.00 0.00 7.34 0.00 -1.26 -5.28 120.64 121.36 2cg9 n GLU 134 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.40 2cg9 n GLU 134 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.11 2cg9 n GLU 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13