#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wdn s LEU 6 N 0.00 1.78 -0.14 -2.67 2.34 -1.26 -4.98 118.68 113.75 2wdn s LEU 6 Ca 0.00 1.82 -0.28 0.00 0.06 0.00 0.00 54.13 55.73 2wdn s LEU 6 Cb 0.00 -3.96 -0.25 0.00 -0.56 0.00 0.00 46.19 41.42 2wdn s LEU 6 CO 0.00 -3.67 0.72 0.03 -1.06 0.00 0.00 176.35 172.37 2wdn h ARG 7 N -2.26 0.00 -6.77 1.48 2.47 -2.09 -3.43 114.38 103.78 2wdn h ARG 7 Ca -0.53 0.00 -0.49 0.00 -1.26 0.00 0.00 59.98 57.70 2wdn h ARG 7 Cb 1.30 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.60 2wdn h ARG 7 CO 0.46 0.98 0.36 -1.25 0.56 0.00 0.00 179.97 181.08 2wdn s PRO 8 N -2.22 4.80 0.00 0.04 0.04 -1.26 -4.18 135.00 132.23 2wdn s PRO 8 Ca -0.19 1.49 0.00 0.00 0.04 0.00 0.00 61.00 62.34 2wdn s PRO 8 Cb -0.02 -3.20 0.00 0.00 0.04 0.00 0.00 34.50 31.32 2wdn s PRO 8 CO 0.67 0.46 0.00 -1.71 0.04 0.00 0.00 177.00 176.46 2wdn n ASN 9 N 1.33 0.00 0.00 6.66 5.15 -1.26 -4.88 115.26 122.25 2wdn n ASN 9 Ca -0.01 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.97 2wdn n ASN 9 Cb 0.47 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.72 2wdn n ASN 9 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2wdn n PRO 10 N 0.00 0.00 -0.71 1.20 -0.04 -1.26 -4.69 135.00 129.50 2wdn n PRO 10 Ca 0.00 0.20 -0.23 0.00 -0.04 0.00 0.00 63.50 63.44 2wdn n PRO 10 Cb 0.00 -1.74 0.00 0.00 -0.04 0.00 0.00 33.50 31.73 2wdn n PRO 10 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wdn n GLY 11 N -1.17 -1.65 2.62 0.55 0.00 -1.26 -4.65 105.19 99.64 2wdn n GLY 11 Ca 0.00 -0.05 -0.46 0.00 0.00 0.00 0.00 46.02 45.51 2wdn n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wdn n ALA 12 N -0.69 -2.10 -1.81 4.61 0.00 -1.26 -4.91 120.51 114.35 2wdn n ALA 12 Ca 0.05 0.41 -0.30 0.00 0.00 0.00 0.00 53.44 53.60 2wdn n ALA 12 Cb 0.24 -1.33 0.19 0.00 0.00 0.00 0.00 19.45 18.56 2wdn n ALA 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2wdn s ASN 13 N 0.84 2.77 0.00 0.00 6.03 -1.26 -4.76 114.94 118.57 2wdn s ASN 13 Ca 0.70 0.32 0.00 0.00 -1.03 0.00 0.00 52.86 52.85 2wdn s ASN 13 Cb -0.99 -0.38 0.00 0.00 -3.03 0.00 0.00 41.25 36.85 2wdn s ASN 13 CO 0.49 -2.95 0.00 0.29 -2.03 0.00 0.00 177.10 172.90 2wdn n LYS 14 N -3.92 0.00 -3.44 3.55 5.02 -1.26 -4.16 118.16 113.95 2wdn n LYS 14 Ca 0.15 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.27 2wdn n LYS 14 Cb 0.59 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.49 2wdn n LYS 14 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2wdn s ARG 15 N 0.00 0.26 0.00 1.97 0.52 -1.26 -4.91 118.95 115.53 2wdn s ARG 15 Ca 0.00 0.13 0.00 0.00 -0.52 0.00 0.00 55.73 55.34 2wdn s ARG 15 Cb 0.00 -0.91 0.00 0.00 0.52 0.00 0.00 34.95 34.56 2wdn s ARG 15 CO 0.00 -0.79 0.00 2.89 0.02 0.00 0.00 175.30 177.42 2wdn n ARG 16 N 5.32 2.17 -2.11 3.54 -4.01 -1.26 -5.03 116.66 115.29 2wdn n ARG 16 Ca -0.04 0.00 -0.08 0.00 -1.04 0.00 0.00 57.85 56.69 2wdn n ARG 16 Cb 0.48 -0.90 -0.02 0.00 -3.04 0.00 0.00 32.46 28.99 2wdn n ARG 16 CO 0.00 0.00 0.00 1.17 -3.04 0.00 0.00 177.63 175.76 2wdn n LYS 17 N -1.90 -1.62 0.19 2.89 4.81 -1.26 -4.70 118.16 116.58 2wdn n LYS 17 Ca 0.00 0.03 0.11 0.00 -0.87 0.00 0.00 58.31 57.58 2wdn n LYS 17 Cb 0.40 -2.40 0.33 0.00 0.02 0.00 0.00 35.03 33.38 2wdn n LYS 17 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2wdn h ARG 18 N -0.16 0.00 -5.26 1.64 2.47 -2.04 -3.38 114.38 107.64 2wdn h ARG 18 Ca -0.11 0.00 -0.40 0.00 -1.26 0.00 0.00 59.98 58.21 2wdn h ARG 18 Cb 0.60 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 28.87 2wdn h ARG 18 CO 0.17 0.00 1.52 1.33 0.56 0.00 0.00 179.97 183.55 2wdn n VAL 19 N -2.85 -0.03 -0.34 2.04 0.24 -1.26 -4.91 118.33 111.22 2wdn n VAL 19 Ca 0.05 -0.42 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 2wdn n VAL 19 Cb 0.96 -1.44 0.00 0.00 -1.47 0.00 0.00 33.84 31.89 2wdn n VAL 19 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2wdn n GLY 20 N 6.23 -1.18 3.13 7.63 0.00 -1.26 -5.03 105.19 114.72 2wdn n GLY 20 Ca 0.54 -1.60 -0.37 0.00 0.00 0.00 0.00 46.02 44.59 2wdn n GLY 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wdn s ARG 21 N -1.15 2.06 -0.34 1.61 0.52 -1.26 -5.06 118.95 115.33 2wdn s ARG 21 Ca 0.00 -1.82 -0.20 0.00 -0.52 0.00 0.00 55.73 53.19 2wdn s ARG 21 Cb 0.00 -3.63 -0.00 0.00 0.52 0.00 0.00 34.95 31.84 2wdn s ARG 21 CO 0.00 -1.09 0.59 0.20 0.02 0.00 0.00 175.30 175.02 2wdn s GLY 22 N 1.92 1.78 -0.74 -3.53 0.00 -1.26 -4.99 107.32 100.50 2wdn s GLY 22 Ca 0.08 -0.83 -0.02 0.00 0.00 0.00 0.00 44.72 43.96 2wdn s GLY 22 CO -0.04 1.41 1.99 -1.05 0.00 0.00 0.00 173.10 175.41 2wdn n PRO 23 N 5.89 2.76 -3.98 2.90 -0.02 -1.26 -4.69 135.00 136.61 2wdn n PRO 23 Ca -0.02 -3.45 -0.31 0.00 -2.02 0.00 0.00 63.50 57.70 2wdn n PRO 23 Cb 0.49 -2.28 -0.15 0.00 -0.02 0.00 0.00 33.50 31.54 2wdn n PRO 23 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2wdn s GLY 24 N -1.57 1.72 0.00 -1.23 0.00 -1.25 -4.48 107.32 100.51 2wdn s GLY 24 Ca 0.58 -2.19 0.00 0.00 0.00 0.00 0.00 44.72 43.11 2wdn s GLY 24 CO -0.20 0.99 0.00 -1.14 0.00 0.00 0.00 173.10 172.75 2wdn n SER 25 N 4.40 0.00 0.03 1.64 3.41 -1.26 -5.02 113.62 116.82 2wdn n SER 25 Ca -0.01 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.66 2wdn n SER 25 Cb 0.42 0.00 0.25 0.00 -0.26 0.00 0.00 64.21 64.62 2wdn n SER 25 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wdn n GLY 26 N -0.60 -0.85 2.58 5.00 0.00 -1.26 -3.65 105.19 106.41 2wdn n GLY 26 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 2wdn n GLY 26 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2wdn s HIS 27 N -3.08 0.23 0.00 1.61 5.65 -1.26 -4.92 115.29 113.52 2wdn s HIS 27 Ca 0.04 -0.54 0.00 0.00 0.25 0.00 0.00 55.06 54.80 2wdn s HIS 27 Cb 0.06 -0.77 0.00 0.00 -1.18 0.00 0.00 32.58 30.69 2wdn s HIS 27 CO 0.18 -0.65 0.00 0.41 -0.65 0.00 0.00 174.74 174.03 2wdn n GLY 28 N 5.27 0.36 3.14 1.59 0.00 -1.26 -4.95 105.19 109.34 2wdn n GLY 28 Ca -0.06 -0.30 -0.38 0.00 0.00 0.00 0.00 46.02 45.27 2wdn n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wdn s LYS 29 N 0.00 2.99 0.00 1.61 3.01 -1.26 -4.95 119.74 121.14 2wdn s LYS 29 Ca 0.00 -2.78 0.00 0.00 -1.01 0.00 0.00 55.97 52.18 2wdn s LYS 29 Cb 0.00 -3.93 0.00 0.00 -1.01 0.00 0.00 37.83 32.89 2wdn s LYS 29 CO 0.00 -1.22 0.00 2.41 0.51 0.00 0.00 175.35 177.05 2wdn n THR 30 N 3.17 0.00 0.00 2.17 -1.04 -1.24 -3.80 114.28 113.54 2wdn n THR 30 Ca 0.13 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.14 2wdn n THR 30 Cb 0.39 -0.57 0.00 0.00 -1.82 0.00 0.00 70.33 68.33 2wdn n THR 30 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2wdn n ALA 31 N -3.00 0.00 0.22 2.41 0.00 -1.26 0.16 120.51 119.04 2wdn n ALA 31 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 2wdn n ALA 31 Cb 0.00 0.00 0.49 0.00 0.00 0.00 0.00 19.45 19.94 2wdn n ALA 31 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2wdn h THR 32 N 0.00 1.14 -1.23 0.00 1.35 -1.91 -3.49 112.91 108.76 2wdn h THR 32 Ca 0.00 -0.67 0.00 0.00 -0.55 0.00 0.00 66.41 65.19 2wdn h THR 32 Cb 0.00 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 2wdn h THR 32 CO 0.00 0.19 0.00 -1.14 -0.25 0.00 0.00 175.52 174.32 2wdn n ARG 33 N -4.30 0.00 0.00 4.72 3.00 0.43 -4.69 116.66 115.81 2wdn n ARG 33 Ca -0.02 0.27 0.00 0.00 -0.00 0.00 0.00 57.85 58.10 2wdn n ARG 33 Cb 0.26 -0.34 0.00 0.00 0.00 0.00 0.00 32.46 32.37 2wdn n ARG 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2wdn n GLY 34 N 1.13 0.00 0.00 5.14 0.00 -1.26 -4.11 105.19 106.09 2wdn n GLY 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2wdn n GLY 34 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2wdn n HIS 35 N 0.00 0.00 -2.86 1.61 8.25 -1.26 -5.14 115.22 115.82 2wdn n HIS 35 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2wdn n HIS 35 Cb 0.00 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.11 2wdn n HIS 35 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2wdn n LYS 36 N -0.96 -0.06 0.00 -0.41 5.02 -1.26 -4.77 118.16 115.73 2wdn n LYS 36 Ca 0.00 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 2wdn n LYS 36 Cb 0.00 -0.07 0.00 0.00 -0.02 0.00 0.00 35.03 34.94 2wdn n LYS 36 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wdn n GLY 37 N -0.36 1.05 0.00 0.72 0.00 -1.26 -4.95 105.19 100.38 2wdn n GLY 37 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2wdn n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdn n GLN 38 N 0.00 0.00 0.00 1.61 10.64 -1.26 -5.13 117.38 123.24 2wdn n GLN 38 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2wdn n GLN 38 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 2wdn n GLN 38 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 2wdn n LYS 39 N 0.00 0.00 -1.69 2.61 4.76 -1.26 -4.99 118.16 117.58 2wdn n LYS 39 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2wdn n LYS 39 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2wdn n LYS 39 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2wdn n SER 40 N 0.00 -1.26 -2.96 4.39 2.88 -1.26 -4.96 113.62 110.45 2wdn n SER 40 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 2wdn n SER 40 Cb 0.00 -0.36 -0.02 0.00 -0.75 0.00 0.00 64.21 63.08 2wdn n SER 40 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2wdn n ARG 41 N -0.51 0.49 -2.67 -1.46 5.12 -1.26 -4.82 116.66 111.55 2wdn n ARG 41 Ca 0.00 -2.39 -0.04 0.00 -1.93 0.00 0.00 57.85 53.48 2wdn n ARG 41 Cb 0.36 -1.51 0.06 0.00 -1.16 0.00 0.00 32.46 30.21 2wdn n ARG 41 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2wdn n SER 42 N 2.62 -1.44 -2.67 0.55 3.41 -1.26 -4.87 113.62 109.97 2wdn n SER 42 Ca 0.20 -1.66 -0.11 0.00 -0.26 0.00 0.00 58.87 57.04 2wdn n SER 42 Cb 0.55 0.78 0.05 0.00 -0.26 0.00 0.00 64.21 65.33 2wdn n SER 42 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wdn n GLY 43 N 1.80 -0.37 0.00 5.00 0.00 -1.26 -4.98 105.19 105.39 2wdn n GLY 43 Ca 0.04 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2wdn n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdn n GLY 44 N -1.25 3.19 3.57 -0.02 0.00 -1.26 -5.15 105.19 104.28 2wdn n GLY 44 Ca -0.09 -1.62 -0.14 0.00 0.00 0.00 0.00 46.02 44.17 2wdn n GLY 44 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wdn s LEU 45 N 0.00 -0.54 0.15 0.99 0.20 -1.26 -4.53 118.68 113.69 2wdn s LEU 45 Ca 0.00 1.34 -0.11 0.00 0.69 0.00 0.00 54.13 56.05 2wdn s LEU 45 Cb 0.00 2.28 0.17 0.00 -0.43 0.00 0.00 46.19 48.21 2wdn s LEU 45 CO 0.00 -0.23 0.99 1.17 -0.29 0.00 0.00 176.35 177.99 2wdn n LYS 46 N 2.73 -0.14 0.00 1.98 3.00 -1.26 -4.87 118.16 119.59 2wdn n LYS 46 Ca -0.14 0.98 0.00 0.00 -0.00 0.00 0.00 58.31 59.15 2wdn n LYS 46 Cb 0.55 -1.46 0.00 0.00 0.00 0.00 0.00 35.03 34.13 2wdn n LYS 46 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2wdn n ASP 47 N -4.95 0.00 -0.01 3.14 -0.08 -1.26 -4.95 116.55 108.44 2wdn n ASP 47 Ca 0.07 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.34 2wdn n ASP 47 Cb 0.26 0.00 -0.00 0.00 2.34 0.00 0.00 41.12 43.72 2wdn n ASP 47 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2wdn n PRO 48 N 0.00 0.07 0.00 -0.67 -0.04 -1.26 -5.06 135.00 128.04 2wdn n PRO 48 Ca 0.00 0.14 0.00 0.00 -0.04 0.00 0.00 63.50 63.60 2wdn n PRO 48 Cb 0.00 -0.74 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 2wdn n PRO 48 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2wdn n ARG 49 N -2.71 0.00 -0.04 0.54 1.74 -1.26 0.17 116.66 115.11 2wdn n ARG 49 Ca -0.02 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 57.02 2wdn n ARG 49 Cb 0.06 0.00 -0.14 0.00 -1.02 0.00 0.00 32.46 31.36 2wdn n ARG 49 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2wdn n ARG 50 N 0.00 0.66 -1.86 5.56 1.85 -1.26 -5.01 116.66 116.59 2wdn n ARG 50 Ca 0.00 0.09 -0.29 0.00 -1.00 0.00 0.00 57.85 56.65 2wdn n ARG 50 Cb 0.00 -1.65 0.09 0.00 -1.05 0.00 0.00 32.46 29.85 2wdn n ARG 50 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2wdn s PHE 51 N -2.75 2.92 0.22 2.89 0.08 0.46 -4.71 117.98 117.09 2wdn s PHE 51 Ca -0.07 0.77 0.00 0.00 0.12 0.00 0.00 56.93 57.76 2wdn s PHE 51 Cb 0.08 -3.47 0.00 0.00 -0.57 0.00 0.00 43.02 39.06 2wdn s PHE 51 CO 0.83 -1.81 0.00 0.39 -0.10 0.00 0.00 175.22 174.53 2wdn n GLU 52 N -3.35 -1.55 0.00 0.44 -0.58 -1.26 -4.77 120.64 109.57 2wdn n GLU 52 Ca 0.08 1.12 0.00 0.00 -0.42 0.00 0.00 57.16 57.93 2wdn n GLU 52 Cb 0.61 -2.03 0.00 0.00 -0.57 0.00 0.00 31.44 29.44 2wdn n GLU 52 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wdn n GLY 53 N -2.92 3.80 0.13 0.62 0.00 -1.26 -4.43 105.19 101.12 2wdn n GLY 53 Ca -0.01 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.08 2wdn n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wdn n GLY 54 N 0.00 0.96 0.00 -0.02 0.00 -1.26 -5.03 105.19 99.84 2wdn n GLY 54 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2wdn n GLY 54 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2wdn n ARG 55 N -2.07 0.00 -2.71 1.61 0.63 -1.26 -4.98 116.66 107.88 2wdn n ARG 55 Ca 0.00 0.00 -0.04 0.00 -0.92 0.00 0.00 57.85 56.89 2wdn n ARG 55 Cb 0.00 0.00 0.10 0.00 0.45 0.00 0.00 32.46 33.01 2wdn n ARG 55 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2wdn n SER 56 N 0.00 -0.58 0.00 6.15 7.64 -1.26 -5.10 113.62 120.47 2wdn n SER 56 Ca 0.00 -2.34 0.00 0.00 1.01 0.00 0.00 58.87 57.54 2wdn n SER 56 Cb 0.00 0.38 0.00 0.00 -1.01 0.00 0.00 64.21 63.58 2wdn n SER 56 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2wdn n THR 57 N -0.83 0.00 -1.79 0.44 -2.24 -1.26 -2.73 114.28 105.86 2wdn n THR 57 Ca -0.04 0.00 -0.04 0.00 -2.27 0.00 0.00 64.05 61.70 2wdn n THR 57 Cb 0.85 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 69.04 2wdn n THR 57 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2wdn n THR 58 N 0.00 0.00 1.38 4.28 -1.04 -1.26 -4.91 114.28 112.73 2wdn n THR 58 Ca 0.00 0.00 0.14 0.00 -2.04 0.00 0.00 64.05 62.15 2wdn n THR 58 Cb 0.00 0.29 0.55 0.00 -1.82 0.00 0.00 70.33 69.35 2wdn n THR 58 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2wdn n LEU 59 N 0.00 0.68 -0.35 -4.42 0.00 -1.11 -3.98 117.00 107.83 2wdn n LEU 59 Ca -0.16 -0.10 0.12 0.00 0.00 0.00 0.00 56.01 55.87 2wdn n LEU 59 Cb 0.51 -0.15 0.30 0.00 0.00 0.00 0.00 43.42 44.08 2wdn n LEU 59 CO -0.08 0.12 1.18 0.24 0.00 0.00 0.00 177.39 178.86 2wdn h MET 60 N 0.84 0.74 -6.18 1.96 2.86 -1.91 -3.41 114.93 109.83 2wdn h MET 60 Ca 0.00 -0.04 -0.69 0.00 -2.06 0.00 0.00 59.70 56.91 2wdn h MET 60 Cb 0.40 -0.17 0.01 0.00 0.06 0.00 0.00 31.60 31.91 2wdn h MET 60 CO 0.00 0.49 1.02 2.89 1.06 0.00 0.00 176.91 182.37 2wdn n ARG 61 N -4.77 1.55 -1.69 1.72 -4.01 -1.26 -4.94 116.66 103.26 2wdn n ARG 61 Ca 0.22 0.56 -0.31 0.00 -1.04 0.00 0.00 57.85 57.28 2wdn n ARG 61 Cb 0.53 -2.34 0.04 0.00 -3.04 0.00 0.00 32.46 27.65 2wdn n ARG 61 CO 0.00 0.00 0.00 -0.48 -3.04 0.00 0.00 177.63 174.11 2wdn s LEU 62 N 4.07 3.20 -1.08 2.89 2.34 -1.26 -5.02 118.68 123.82 2wdn s LEU 62 Ca 0.97 1.62 -0.06 0.00 0.06 0.00 0.00 54.13 56.72 2wdn s LEU 62 Cb -0.91 -4.50 0.29 0.00 -0.56 0.00 0.00 46.19 40.52 2wdn s LEU 62 CO 0.59 -1.31 1.30 -0.81 -1.06 0.00 0.00 176.35 175.06 2wdn n PRO 63 N -2.90 4.02 0.00 1.48 -0.04 -1.26 -4.84 135.00 131.45 2wdn n PRO 63 Ca 0.07 -4.52 0.03 0.00 -0.04 0.00 0.00 63.50 59.04 2wdn n PRO 63 Cb 0.53 -2.52 0.16 0.00 -0.04 0.00 0.00 33.50 31.64 2wdn n PRO 63 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2wdn n LYS 64 N 1.86 0.17 -0.90 0.54 0.00 -1.26 -3.82 118.16 114.75 2wdn n LYS 64 Ca 0.25 0.00 -0.28 0.00 0.00 0.00 0.00 58.31 58.29 2wdn n LYS 64 Cb 0.36 -1.50 -0.02 0.00 0.00 0.00 0.00 35.03 33.87 2wdn n LYS 64 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 2wdn n ARG 65 N -1.00 2.27 -0.87 1.64 0.63 -1.26 -4.89 116.66 113.18 2wdn n ARG 65 Ca 0.04 -1.64 -0.30 0.00 -0.92 0.00 0.00 57.85 55.03 2wdn n ARG 65 Cb 0.02 -2.58 0.24 0.00 0.45 0.00 0.00 32.46 30.59 2wdn n ARG 65 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2wdn s GLY 66 N 3.42 1.53 -0.09 5.14 0.00 -1.25 -4.67 107.32 111.40 2wdn s GLY 66 Ca 0.46 -0.76 -0.00 0.00 0.00 0.00 0.00 44.72 44.42 2wdn s GLY 66 CO -0.02 0.10 0.00 -0.13 0.00 0.00 0.00 173.10 173.05 2wdn n MET 67 N -4.92 -1.06 0.00 2.90 0.00 -1.26 -5.04 117.12 107.74 2wdn n MET 67 Ca 0.11 1.20 0.00 0.00 -0.00 0.00 0.00 57.70 59.01 2wdn n MET 67 Cb 0.59 -2.34 0.00 0.00 0.00 0.00 0.00 33.22 31.47 2wdn n MET 67 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 2wdn n GLN 68 N 0.21 4.75 0.00 2.12 6.02 -1.26 -5.12 117.38 124.09 2wdn n GLN 68 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2wdn n GLN 68 Cb 0.00 -0.37 0.00 0.00 1.02 0.00 0.00 30.24 30.89 2wdn n GLN 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wdn n GLY 69 N 0.74 3.37 3.83 1.08 0.00 -1.26 -5.09 105.19 107.85 2wdn n GLY 69 Ca 0.00 -1.00 -0.31 0.00 0.00 0.00 0.00 46.02 44.71 2wdn n GLY 69 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2wdn s GLN 70 N -4.64 3.20 0.23 1.61 2.00 -1.26 -4.95 119.66 115.86 2wdn s GLN 70 Ca 0.00 0.93 -0.08 0.00 -2.00 0.00 0.00 55.36 54.21 2wdn s GLN 70 Cb 0.00 -2.03 0.39 0.00 0.80 0.00 0.00 33.01 32.18 2wdn s GLN 70 CO 0.00 -0.89 1.66 -0.24 -0.50 0.00 0.00 175.29 175.32 2wdn h VAL 71 N -0.39 0.43 -0.76 1.34 3.04 -2.04 -2.66 116.25 115.20 2wdn h VAL 71 Ca -0.44 -0.05 0.18 0.00 -1.01 0.00 0.00 66.70 65.37 2wdn h VAL 71 Cb 1.20 0.27 -0.13 0.00 -2.01 0.00 0.00 31.29 30.63 2wdn h VAL 71 CO 0.58 0.03 0.06 -0.65 -1.01 0.00 0.00 177.57 176.59 2wdn h PRO 72 N 0.14 0.14 0.00 4.17 0.11 -2.05 -3.47 132.00 131.04 2wdn h PRO 72 Ca 0.38 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.48 2wdn h PRO 72 Cb 0.65 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.73 2wdn h PRO 72 CO -0.58 0.09 0.00 0.41 -0.21 0.00 0.00 178.00 177.71 2wdn n GLY 73 N -1.40 0.17 3.90 -0.55 0.00 -1.01 -5.10 105.19 101.21 2wdn n GLY 73 Ca 0.14 -1.31 -0.28 0.00 0.00 0.00 0.00 46.02 44.57 2wdn n GLY 73 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wdn s GLU 74 N -2.00 3.63 -0.32 1.61 -1.05 -1.26 -4.25 118.70 115.06 2wdn s GLU 74 Ca 0.00 0.04 -0.20 0.00 -0.15 0.00 0.00 54.97 54.66 2wdn s GLU 74 Cb 0.00 -2.61 -0.01 0.00 -0.44 0.00 0.00 34.13 31.08 2wdn s GLU 74 CO 0.00 0.16 0.62 0.42 0.95 0.00 0.00 175.26 177.41 2wdn s ILE 75 N -2.17 4.94 -0.69 1.83 1.09 -1.26 -4.98 121.20 119.97 2wdn s ILE 75 Ca 0.45 0.75 -0.25 0.00 -1.10 0.00 0.00 60.65 60.49 2wdn s ILE 75 Cb -0.11 -4.01 -0.13 0.00 -1.06 0.00 0.00 42.46 37.16 2wdn s ILE 75 CO 0.31 -0.18 2.43 1.17 -0.10 0.00 0.00 174.94 178.57 2wdn n LYS 76 N 5.89 0.69 -4.35 2.79 3.00 -1.26 -4.92 118.16 120.00 2wdn n LYS 76 Ca -0.02 -0.33 -0.19 0.00 -0.00 0.00 0.00 58.31 57.77 2wdn n LYS 76 Cb 0.49 -3.20 -0.13 0.00 0.00 0.00 0.00 35.03 32.19 2wdn n LYS 76 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 2wdn s ARG 77 N 8.51 0.89 -0.45 1.64 1.70 -1.26 -5.10 118.95 124.87 2wdn s ARG 77 Ca 1.02 -0.69 -0.28 0.00 -0.47 0.00 0.00 55.73 55.31 2wdn s ARG 77 Cb -0.30 -0.88 -0.08 0.00 -0.57 0.00 0.00 34.95 33.12 2wdn s ARG 77 CO 0.24 0.22 2.37 -0.35 -1.08 0.00 0.00 175.30 176.70 2wdn n PRO 78 N 2.04 1.18 -3.08 3.89 -0.04 -1.26 -4.98 135.00 132.74 2wdn n PRO 78 Ca -0.18 0.16 -0.37 0.00 -0.04 0.00 0.00 63.50 63.07 2wdn n PRO 78 Cb 0.55 -3.11 -0.06 0.00 -0.04 0.00 0.00 33.50 30.84 2wdn n PRO 78 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 2wdn s ARG 79 N 7.64 4.35 0.35 0.54 1.70 -1.26 -5.03 118.95 127.24 2wdn s ARG 79 Ca 1.04 0.94 0.07 0.00 -0.47 0.00 0.00 55.73 57.31 2wdn s ARG 79 Cb -0.39 -3.05 -0.02 0.00 -0.57 0.00 0.00 34.95 30.92 2wdn s ARG 79 CO 0.33 0.48 0.38 0.71 -1.08 0.00 0.00 175.30 176.13 2wdn s TYR 80 N -1.35 2.95 -0.23 5.89 2.02 -1.26 -3.77 117.35 121.61 2wdn s TYR 80 Ca 0.39 -0.30 -0.03 0.00 -0.37 0.00 0.00 57.07 56.76 2wdn s TYR 80 Cb -0.19 -1.94 0.07 0.00 -0.40 0.00 0.00 41.96 39.50 2wdn s TYR 80 CO 0.22 0.04 0.06 -1.14 -1.57 0.00 0.00 175.55 173.17 2wdn s GLN 81 N -4.10 0.57 1.08 -0.62 2.00 0.02 -4.97 119.66 113.64 2wdn s GLN 81 Ca 0.44 -0.53 -0.12 0.00 -2.00 0.00 0.00 55.36 53.15 2wdn s GLN 81 Cb -0.07 -1.97 0.23 0.00 0.80 0.00 0.00 33.01 32.01 2wdn s GLN 81 CO 0.29 -0.75 1.06 0.20 -0.50 0.00 0.00 175.29 175.59 2wdn s GLY 82 N 1.86 1.58 -0.30 2.59 0.00 -1.26 -1.80 107.32 109.99 2wdn s GLY 82 Ca 0.02 -0.02 -0.12 0.00 0.00 0.00 0.00 44.72 44.60 2wdn s GLY 82 CO -0.15 0.61 1.06 0.54 0.00 0.00 0.00 173.10 175.17 2wdn s VAL 83 N -2.60 -0.27 0.61 1.40 0.11 -0.98 -4.80 120.40 113.87 2wdn s VAL 83 Ca 0.67 0.00 -0.18 0.00 -2.93 0.00 0.00 61.98 59.54 2wdn s VAL 83 Cb -0.23 -0.63 -0.04 0.00 -1.53 0.00 0.00 36.38 33.95 2wdn s VAL 83 CO 0.62 0.00 1.00 0.59 -3.33 0.00 0.00 175.10 173.97 2wdn n ASN 84 N 5.29 0.88 0.25 3.54 3.02 -0.99 -2.22 115.26 125.03 2wdn n ASN 84 Ca 0.01 0.80 0.14 0.00 -0.03 0.00 0.00 54.58 55.50 2wdn n ASN 84 Cb 0.56 -1.41 0.50 0.00 -0.61 0.00 0.00 39.78 38.83 2wdn n ASN 84 CO 0.00 0.00 0.00 0.17 -2.62 0.00 0.00 177.26 174.81 2wdn h LEU 85 N 0.45 0.00 0.00 3.41 -0.00 -1.65 -2.27 115.31 115.24 2wdn h LEU 85 Ca -0.49 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.39 2wdn h LEU 85 Cb 1.36 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.02 2wdn h LEU 85 CO 0.51 0.06 0.00 1.17 -0.00 0.00 0.00 178.44 180.18 2wdn n LYS 86 N -3.15 0.00 -0.01 0.17 4.81 -0.61 0.04 118.16 119.42 2wdn n LYS 86 Ca 0.01 0.45 0.09 0.00 -0.87 0.00 0.00 58.31 57.99 2wdn n LYS 86 Cb 0.39 -1.50 -0.14 0.00 0.02 0.00 0.00 35.03 33.81 2wdn n LYS 86 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2wdn n ASP 87 N -1.47 0.67 0.07 3.14 8.00 -0.86 -4.24 116.55 121.86 2wdn n ASP 87 Ca 0.00 -0.25 0.13 0.00 0.71 0.00 0.00 54.79 55.39 2wdn n ASP 87 Cb 0.02 1.65 0.34 0.00 -0.02 0.00 0.00 41.12 43.11 2wdn n ASP 87 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2wdn n LEU 88 N -1.98 0.69 -0.18 0.64 4.32 0.11 -4.11 117.00 116.49 2wdn n LEU 88 Ca -0.02 0.42 -0.04 0.00 -0.02 0.00 0.00 56.01 56.35 2wdn n LEU 88 Cb 0.45 -0.29 0.02 0.00 -1.62 0.00 0.00 43.42 41.98 2wdn n LEU 88 CO 0.40 -0.11 0.67 0.00 -1.22 0.00 0.00 177.39 177.13 2wdn h ALA 89 N 2.59 0.08 -0.92 -1.18 0.00 -1.69 -2.79 119.26 115.36 2wdn h ALA 89 Ca 0.00 0.18 0.15 0.00 0.00 0.00 0.00 54.91 55.24 2wdn h ALA 89 Cb 0.71 0.65 -0.15 0.00 0.00 0.00 0.00 17.79 18.99 2wdn h ALA 89 CO 0.00 -0.60 -0.33 2.89 0.00 0.00 0.00 179.25 181.21 2wdn n ARG 90 N -5.43 -0.18 -4.06 0.00 0.00 -1.26 -4.52 116.66 101.20 2wdn n ARG 90 Ca 0.04 1.41 -0.26 0.00 -0.00 0.00 0.00 57.85 59.05 2wdn n ARG 90 Cb 0.34 -2.10 -0.05 0.00 -0.00 0.00 0.00 32.46 30.65 2wdn n ARG 90 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.63 177.04 2wdn s PHE 91 N -5.93 3.20 0.00 2.89 -0.12 -1.05 -5.12 117.98 111.84 2wdn s PHE 91 Ca -0.13 -0.00 0.00 0.00 -0.05 0.00 0.00 56.93 56.75 2wdn s PHE 91 Cb 0.20 -1.53 0.00 0.00 -0.63 0.00 0.00 43.02 41.06 2wdn s PHE 91 CO 0.67 0.52 0.00 0.39 -0.05 0.00 0.00 175.22 176.75 2wdn n GLU 92 N -0.40 3.64 0.00 1.99 1.02 -1.26 -4.96 120.64 120.66 2wdn n GLU 92 Ca -0.08 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 2wdn n GLU 92 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.97 2wdn n GLU 92 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wdn n GLY 93 N 5.00 -0.40 3.74 0.62 0.00 -1.26 -4.64 105.19 108.26 2wdn n GLY 93 Ca 0.00 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.74 2wdn n GLY 93 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wdn s GLU 94 N 0.00 4.42 -0.18 1.61 2.12 -1.26 -4.44 118.70 120.97 2wdn s GLU 94 Ca 0.00 2.00 -0.00 0.00 0.36 0.00 0.00 54.97 57.33 2wdn s GLU 94 Cb 0.00 -3.20 0.01 0.00 0.26 0.00 0.00 34.13 31.20 2wdn s GLU 94 CO 0.00 -0.19 -0.16 0.14 -0.54 0.00 0.00 175.26 174.51 2wdn s VAL 95 N -0.01 2.48 0.20 3.70 -7.23 -0.68 -5.01 120.40 113.84 2wdn s VAL 95 Ca 0.55 -0.81 0.09 0.00 -1.81 0.00 0.00 61.98 60.00 2wdn s VAL 95 Cb -0.35 -2.06 -0.05 0.00 0.56 0.00 0.00 36.38 34.48 2wdn s VAL 95 CO 0.38 0.51 -0.17 0.42 -0.31 0.00 0.00 175.10 175.94 2wdn s THR 96 N 1.19 1.86 1.36 5.32 -4.23 -1.26 -1.12 115.64 118.77 2wdn s THR 96 Ca 0.02 -2.12 -0.22 0.00 -1.18 0.00 0.00 61.69 58.19 2wdn s THR 96 Cb -0.14 -1.99 0.34 0.00 1.34 0.00 0.00 72.50 72.05 2wdn s THR 96 CO -0.07 -0.46 0.78 -2.65 -0.54 0.00 0.00 174.62 171.68 2wdn n PRO 97 N -0.14 -4.30 0.00 3.99 -0.02 -1.26 -1.88 135.00 131.39 2wdn n PRO 97 Ca -0.10 -1.31 0.00 0.00 -2.02 0.00 0.00 63.50 60.08 2wdn n PRO 97 Cb 0.59 -1.78 0.00 0.00 -0.02 0.00 0.00 33.50 32.29 2wdn n PRO 97 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2wdn n GLU 98 N -5.03 0.00 0.04 -0.52 -0.00 -1.26 -4.13 120.64 109.74 2wdn n GLU 98 Ca 0.12 0.00 -0.11 0.00 -0.00 0.00 0.00 57.16 57.17 2wdn n GLU 98 Cb 0.54 -2.61 -0.13 0.00 -0.00 0.00 0.00 31.44 29.24 2wdn n GLU 98 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 2wdn h LEU 99 N 0.00 0.16 -0.55 -1.84 6.46 -1.75 -2.55 115.31 115.24 2wdn h LEU 99 Ca 0.00 -0.23 -0.12 0.00 -0.12 0.00 0.00 57.88 57.41 2wdn h LEU 99 Cb 0.00 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 39.86 2wdn h LEU 99 CO 0.00 1.19 -0.58 -0.07 -0.62 0.00 0.00 178.44 178.36 2wdn h LEU 100 N 0.03 0.00 -0.01 2.25 -0.00 -1.67 -3.21 115.31 112.70 2wdn h LEU 100 Ca -0.19 0.00 -0.17 0.00 -0.00 0.00 0.00 57.88 57.52 2wdn h LEU 100 Cb 1.94 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 42.61 2wdn h LEU 100 CO 0.13 0.58 -0.66 -0.37 -0.00 0.00 0.00 178.44 178.12 2wdn h VAL 101 N 0.00 1.40 0.00 1.22 -1.51 -1.56 -2.97 116.25 112.83 2wdn h VAL 101 Ca -0.01 -2.09 -0.12 0.00 -1.23 0.00 0.00 66.70 63.25 2wdn h VAL 101 Cb 1.20 2.55 -0.04 0.00 -2.13 0.00 0.00 31.29 32.86 2wdn h VAL 101 CO 0.08 0.61 -0.08 -1.14 -1.23 0.00 0.00 177.57 175.81 2wdn n ARG 102 N -4.17 1.29 0.00 5.19 0.63 -0.96 -4.55 116.66 114.09 2wdn n ARG 102 Ca -0.10 -0.63 0.00 0.00 -0.92 0.00 0.00 57.85 56.19 2wdn n ARG 102 Cb 0.70 -1.80 0.00 0.00 0.45 0.00 0.00 32.46 31.80 2wdn n ARG 102 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2wdn n ALA 103 N 2.63 0.00 -0.50 5.13 0.00 -1.19 -4.95 120.51 121.63 2wdn n ALA 103 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.71 2wdn n ALA 103 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 2wdn n ALA 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wdn n GLY 104 N 0.00 0.00 0.00 0.00 0.00 -1.13 -4.90 105.19 99.16 2wdn n GLY 104 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2wdn n GLY 104 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wdn n LEU 105 N 0.00 0.00 0.00 0.99 4.32 -1.21 -4.87 117.00 116.22 2wdn n LEU 105 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 2wdn n LEU 105 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 2wdn n LEU 105 CO 0.00 -0.14 0.00 -0.11 -1.22 0.00 0.00 177.39 175.92 2wdn n LEU 106 N 0.00 0.00 -2.56 2.23 7.94 -1.26 -3.18 117.00 120.17 2wdn n LEU 106 Ca 0.00 0.00 -0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2wdn n LEU 106 Cb 0.00 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 43.95 2wdn n LEU 106 CO 0.00 0.00 -0.04 2.29 -1.11 0.00 0.00 177.39 178.53 2wdn n LYS 107 N 0.00 -0.96 -0.05 1.96 2.85 -1.26 -2.58 118.16 118.13 2wdn n LYS 107 Ca 0.00 0.84 0.00 0.00 -1.05 0.00 0.00 58.31 58.10 2wdn n LYS 107 Cb 0.00 -0.94 0.00 0.00 -0.65 0.00 0.00 35.03 33.44 2wdn n LYS 107 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2wdn n LYS 108 N 2.25 0.00 0.00 -1.58 4.01 -1.26 -4.56 118.16 117.02 2wdn n LYS 108 Ca -0.01 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.79 2wdn n LYS 108 Cb 0.02 -1.30 0.00 0.00 -0.51 0.00 0.00 35.03 33.25 2wdn n LYS 108 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2wdn n GLY 109 N 0.64 0.00 1.48 0.72 0.00 -1.06 -4.89 105.19 102.08 2wdn n GLY 109 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2wdn n GLY 109 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2wdn n TYR 110 N -0.88 -4.01 -0.67 1.61 9.36 -1.26 -4.54 117.16 116.77 2wdn n TYR 110 Ca 0.00 2.20 0.00 0.00 3.32 0.00 0.00 57.90 63.42 2wdn n TYR 110 Cb 0.00 -3.55 0.00 0.00 -0.63 0.00 0.00 39.34 35.16 2wdn n TYR 110 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2wdn n ARG 111 N -3.79 0.00 -3.18 2.98 1.74 -1.25 -3.77 116.66 109.39 2wdn n ARG 111 Ca -0.07 0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 56.62 2wdn n ARG 111 Cb 0.62 -0.18 -0.07 0.00 -1.02 0.00 0.00 32.46 31.82 2wdn n ARG 111 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2wdn s LEU 112 N 0.00 4.12 -0.39 0.55 1.98 -1.26 -0.80 118.68 122.88 2wdn s LEU 112 Ca 0.00 0.70 0.01 0.00 -2.89 0.00 0.00 54.13 51.95 2wdn s LEU 112 Cb 0.00 -2.78 0.11 0.00 0.66 0.00 0.00 46.19 44.18 2wdn s LEU 112 CO 0.00 -0.26 0.14 -0.75 -1.89 0.00 0.00 176.35 173.59 2wdn s LYS 113 N 1.97 1.77 0.10 1.98 2.20 -0.75 -0.35 119.74 126.66 2wdn s LYS 113 Ca 0.25 -1.89 -0.29 0.00 -0.36 0.00 0.00 55.97 53.68 2wdn s LYS 113 Cb -0.16 -3.41 -0.06 0.00 -1.51 0.00 0.00 37.83 32.70 2wdn s LYS 113 CO 0.10 -1.02 0.92 -1.50 -0.36 0.00 0.00 175.35 173.49 2wdn s ILE 114 N 0.95 4.54 -0.29 5.43 1.10 -0.17 -2.33 121.20 130.43 2wdn s ILE 114 Ca 0.10 1.98 -0.31 0.00 -0.51 0.00 0.00 60.65 61.91 2wdn s ILE 114 Cb -0.21 -4.28 0.19 0.00 0.15 0.00 0.00 42.46 38.31 2wdn s ILE 114 CO -0.06 0.33 1.37 -1.48 -2.11 0.00 0.00 174.94 173.00 2wdn s LEU 115 N -0.05 -0.02 0.00 8.50 2.34 -0.94 -3.23 118.68 125.28 2wdn s LEU 115 Ca 0.45 0.02 0.00 0.00 0.06 0.00 0.00 54.13 54.66 2wdn s LEU 115 Cb -0.23 1.05 0.00 0.00 -0.56 0.00 0.00 46.19 46.46 2wdn s LEU 115 CO 0.28 -0.02 0.00 0.61 -1.06 0.00 0.00 176.35 176.16 2wdn n GLY 116 N 0.41 0.33 2.93 -3.48 0.00 -1.26 -2.34 105.19 101.78 2wdn n GLY 116 Ca 0.01 -1.45 -0.15 0.00 0.00 0.00 0.00 46.02 44.43 2wdn n GLY 116 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wdn n GLU 117 N 0.00 0.62 -1.14 1.61 1.02 -1.26 -4.73 120.64 116.75 2wdn n GLU 117 Ca 0.00 -2.30 0.00 0.00 -0.02 0.00 0.00 57.16 54.84 2wdn n GLU 117 Cb 0.00 -0.22 0.00 0.00 -0.02 0.00 0.00 31.44 31.20 2wdn n GLU 117 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wdn n GLY 118 N -0.37 -4.39 3.34 0.62 0.00 -1.26 -1.57 105.19 101.56 2wdn n GLY 118 Ca 0.12 -0.62 -0.34 0.00 0.00 0.00 0.00 46.02 45.18 2wdn n GLY 118 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wdn n GLU 119 N 0.28 -0.16 -0.01 1.61 -0.58 -1.26 -4.20 120.64 116.33 2wdn n GLU 119 Ca 0.00 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 2wdn n GLU 119 Cb 0.00 -1.68 0.00 0.00 -0.57 0.00 0.00 31.44 29.19 2wdn n GLU 119 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2wdn n ALA 120 N -3.21 0.00 -3.65 0.62 0.00 -1.26 -4.63 120.51 108.39 2wdn n ALA 120 Ca 0.05 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.42 2wdn n ALA 120 Cb 0.53 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.91 2wdn n ALA 120 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2wdn s LYS 121 N 0.60 0.65 -0.65 0.00 1.02 -1.26 -5.07 119.74 115.03 2wdn s LYS 121 Ca 0.00 1.13 -0.26 0.00 0.02 0.00 0.00 55.97 56.86 2wdn s LYS 121 Cb 0.00 0.12 -0.12 0.00 -0.52 0.00 0.00 37.83 37.31 2wdn s LYS 121 CO 0.00 -0.15 2.44 -2.30 -0.92 0.00 0.00 175.35 174.43 2wdn n PRO 122 N 4.24 0.75 -3.64 -1.68 -0.02 -1.26 -4.63 135.00 128.76 2wdn n PRO 122 Ca -0.20 -0.19 -0.05 0.00 -2.02 0.00 0.00 63.50 61.03 2wdn n PRO 122 Cb 0.58 -3.13 -0.07 0.00 -0.02 0.00 0.00 33.50 30.86 2wdn n PRO 122 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 2wdn s LEU 123 N 11.84 -0.38 0.34 2.45 0.05 -1.26 -4.87 118.68 126.85 2wdn s LEU 123 Ca 1.04 0.68 -0.28 0.00 0.05 0.00 0.00 54.13 55.61 2wdn s LEU 123 Cb -0.34 1.66 -0.12 0.00 -2.05 0.00 0.00 46.19 45.34 2wdn s LEU 123 CO 0.27 -0.11 1.29 1.17 -0.55 0.00 0.00 176.35 178.41 2wdn n LYS 124 N 2.64 2.12 -3.56 1.48 3.00 -1.26 -3.85 118.16 118.73 2wdn n LYS 124 Ca -0.14 0.74 -0.12 0.00 -0.00 0.00 0.00 58.31 58.79 2wdn n LYS 124 Cb 0.57 -2.32 -0.11 0.00 0.00 0.00 0.00 35.03 33.16 2wdn n LYS 124 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2wdn s VAL 125 N -1.10 -0.50 0.41 3.15 0.11 -1.26 -1.69 120.40 119.52 2wdn s VAL 125 Ca 0.55 0.11 -0.02 0.00 -2.93 0.00 0.00 61.98 59.69 2wdn s VAL 125 Cb -0.57 -0.62 -0.03 0.00 -1.53 0.00 0.00 36.38 33.63 2wdn s VAL 125 CO 0.62 -0.00 0.66 -0.69 -3.33 0.00 0.00 175.10 172.36 2wdn s VAL 126 N 2.48 5.01 -0.02 2.04 1.01 -0.28 -3.65 120.40 127.00 2wdn s VAL 126 Ca 0.04 -0.16 -0.11 0.00 0.00 0.00 0.00 61.98 61.75 2wdn s VAL 126 Cb -0.13 -3.86 0.04 0.00 0.00 0.00 0.00 36.38 32.42 2wdn s VAL 126 CO -0.12 -0.69 0.48 0.00 0.00 0.00 0.00 175.10 174.77 2wdn n ALA 127 N -2.01 -1.37 0.13 5.51 0.00 -0.50 -4.43 120.51 117.84 2wdn n ALA 127 Ca -0.02 -0.29 0.05 0.00 0.00 0.00 0.00 53.44 53.18 2wdn n ALA 127 Cb 0.56 0.04 -0.07 0.00 0.00 0.00 0.00 19.45 19.98 2wdn n ALA 127 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2wdn n HIS 128 N -0.35 0.00 -3.60 0.00 8.25 0.52 -4.23 115.22 115.81 2wdn n HIS 128 Ca 0.02 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.40 2wdn n HIS 128 Cb 0.21 -0.16 -0.05 0.00 1.12 0.00 0.00 29.99 31.11 2wdn n HIS 128 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2wdn s ALA 129 N -2.45 -1.99 -0.01 -1.41 0.00 -1.13 -4.71 121.76 110.05 2wdn s ALA 129 Ca -0.02 1.69 0.03 0.00 0.00 0.00 0.00 51.96 53.66 2wdn s ALA 129 Cb 0.07 -1.01 -0.01 0.00 0.00 0.00 0.00 23.12 22.17 2wdn s ALA 129 CO 0.40 -0.28 -0.10 -0.06 0.00 0.00 0.00 175.76 175.73 2wdn s PHE 130 N -0.86 0.90 0.59 0.00 2.99 -1.25 -0.99 117.98 119.35 2wdn s PHE 130 Ca 0.01 -0.18 -0.16 0.00 0.00 0.00 0.00 56.93 56.60 2wdn s PHE 130 Cb -0.01 -0.59 -0.04 0.00 0.00 0.00 0.00 43.02 42.38 2wdn s PHE 130 CO -0.02 -0.03 1.07 -1.54 -0.00 0.00 0.00 175.22 174.70 2wdn s SER 131 N -0.16 5.69 0.17 1.36 1.04 -1.20 -4.78 113.70 115.82 2wdn s SER 131 Ca 0.03 1.90 -0.24 0.00 0.48 0.00 0.00 55.95 58.11 2wdn s SER 131 Cb -0.05 -2.54 0.06 0.00 0.10 0.00 0.00 66.02 63.59 2wdn s SER 131 CO -0.00 -1.23 1.58 0.11 0.98 0.00 0.00 173.24 174.68 2wdn h LYS 132 N 0.52 -0.22 -0.96 4.02 1.57 -2.00 0.27 116.57 119.77 2wdn h LYS 132 Ca -0.47 0.02 0.15 0.00 -1.87 0.00 0.00 60.65 58.47 2wdn h LYS 132 Cb 1.23 0.05 -0.08 0.00 0.08 0.00 0.00 32.23 33.51 2wdn h LYS 132 CO 0.57 -0.15 0.61 1.03 -0.57 0.00 0.00 179.45 180.93 2wdn h SER 133 N -0.23 0.76 -0.36 0.86 0.87 -1.97 -2.52 113.55 110.96 2wdn h SER 133 Ca 0.19 0.06 -0.07 0.00 -1.23 0.00 0.00 61.79 60.73 2wdn h SER 133 Cb 0.56 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.42 2wdn h SER 133 CO -0.64 0.36 -0.04 0.00 -0.53 0.00 0.00 176.83 175.99 2wdn h ALA 134 N 1.59 0.49 0.00 6.23 0.00 -0.80 -2.12 119.26 124.65 2wdn h ALA 134 Ca 0.50 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 2wdn h ALA 134 Cb 0.71 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2wdn h ALA 134 CO -0.26 0.30 -0.10 1.25 0.00 0.00 0.00 179.25 180.43 2wdn h LEU 135 N 0.47 0.00 0.08 0.00 7.12 -0.82 -2.05 115.31 120.10 2wdn h LEU 135 Ca 0.10 0.00 -0.00 0.00 0.13 0.00 0.00 57.88 58.10 2wdn h LEU 135 Cb 0.52 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.65 2wdn h LEU 135 CO 0.03 0.10 -0.04 -0.33 -0.13 0.00 0.00 178.44 178.07 2wdn h GLU 136 N 0.00 -0.10 -0.26 1.25 5.08 -1.26 -0.48 114.58 118.81 2wdn h GLU 136 Ca -0.00 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.44 2wdn h GLU 136 Cb 0.19 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2wdn h GLU 136 CO 0.01 0.46 0.25 0.87 -1.00 0.00 0.00 179.01 179.60 2wdn h LYS 137 N -0.81 0.00 0.00 2.33 1.57 -1.20 0.52 116.57 118.98 2wdn h LYS 137 Ca -0.01 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.68 2wdn h LYS 137 Cb 0.60 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 2wdn h LYS 137 CO 0.02 0.00 -0.87 1.25 -0.57 0.00 0.00 179.45 179.28 2wdn h LEU 138 N 0.00 0.00 -0.90 2.94 5.85 -1.33 -3.33 115.31 118.54 2wdn h LEU 138 Ca 0.12 0.00 0.25 0.00 0.84 0.00 0.00 57.88 59.10 2wdn h LEU 138 Cb 0.62 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 41.50 2wdn h LEU 138 CO -0.00 0.34 0.25 0.50 -0.34 0.00 0.00 178.44 179.19 2wdn h LYS 139 N 0.00 0.18 -2.44 1.25 1.63 0.18 -0.98 116.57 116.39 2wdn h LYS 139 Ca -0.06 -0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.71 2wdn h LYS 139 Cb 1.31 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 32.90 2wdn h LYS 139 CO 0.03 0.12 0.18 0.00 -3.45 0.00 0.00 179.45 176.34 2wdn n ALA 140 N -2.70 1.92 0.00 5.00 0.00 -1.24 -4.62 120.51 118.86 2wdn n ALA 140 Ca 0.23 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2wdn n ALA 140 Cb 0.74 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 18.13 2wdn n ALA 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wdn n ALA 141 N 2.45 -0.54 0.00 0.00 0.00 -0.37 -4.59 120.51 117.45 2wdn n ALA 141 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2wdn n ALA 141 Cb 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 19.45 19.39 2wdn n ALA 141 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wdn n GLY 142 N 0.87 0.07 3.29 0.00 0.00 -1.24 -4.22 105.19 103.97 2wdn n GLY 142 Ca 0.00 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 45.08 2wdn n GLY 142 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wdn s GLY 143 N 0.00 -0.19 -0.12 -0.02 0.00 -1.25 -4.48 107.32 101.27 2wdn s GLY 143 Ca 0.00 -0.18 0.15 0.00 0.00 0.00 0.00 44.72 44.69 2wdn s GLY 143 CO 0.00 -0.42 1.14 -2.21 0.00 0.00 0.00 173.10 171.60 2wdn n GLU 144 N -0.19 1.08 -1.46 2.90 2.13 -1.26 -4.55 120.64 119.29 2wdn n GLU 144 Ca -0.16 -2.41 -0.52 0.00 0.66 0.00 0.00 57.16 54.73 2wdn n GLU 144 Cb 0.63 -1.32 -0.07 0.00 0.27 0.00 0.00 31.44 30.96 2wdn n GLU 144 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42 2wdn n PRO 145 N -1.12 1.07 0.00 5.31 -0.02 -1.24 -4.78 135.00 134.22 2wdn n PRO 145 Ca 0.14 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2wdn n PRO 145 Cb 0.67 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 2wdn n PRO 145 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 2wdn n VAL 146 N 6.88 0.00 0.00 -1.45 3.14 -1.26 -1.41 118.33 124.24 2wdn n VAL 146 Ca 0.40 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.78 2wdn n VAL 146 Cb 0.21 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.99 2wdn n VAL 146 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 2wdn n LEU 147 N 0.00 0.00 0.00 6.55 7.94 -1.26 -4.70 117.00 125.53 2wdn n LEU 147 Ca 0.00 0.00 0.15 0.00 -1.11 0.00 0.00 56.01 55.05 2wdn n LEU 147 Cb 0.00 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 43.91 2wdn n LEU 147 CO 0.00 0.00 -0.20 0.18 -1.11 0.00 0.00 177.39 176.26 2wdn n LEU 148 N 0.00 0.00 -0.54 -1.96 4.77 -1.26 -4.81 117.00 113.21 2wdn n LEU 148 Ca 0.00 1.17 0.00 0.00 -0.03 0.00 0.00 56.01 57.15 2wdn n LEU 148 Cb 0.00 -3.30 0.00 0.00 -2.33 0.00 0.00 43.42 37.79 2wdn n LEU 148 CO 0.00 -2.50 -0.08 -0.62 -1.33 0.00 0.00 177.39 172.87 2wdn n GLU 149 N -3.66 -0.88 0.00 3.23 -0.58 -1.26 -5.13 120.64 112.36 2wdn n GLU 149 Ca 0.01 0.85 0.00 0.00 -0.42 0.00 0.00 57.16 57.59 2wdn n GLU 149 Cb 0.50 -0.68 0.00 0.00 -0.57 0.00 0.00 31.44 30.68 2wdn n GLU 149 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65