#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v9x n SER 2 N 0.00 3.79 -4.90 1.61 2.88 -1.26 -4.97 113.62 110.77 1v9x n SER 2 Ca 0.00 0.90 -0.26 0.00 -1.33 0.00 0.00 58.87 58.18 1v9x n SER 2 Cb 0.00 -1.45 -0.01 0.00 -0.75 0.00 0.00 64.21 62.00 1v9x n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1v9x s SER 3 N 4.50 4.65 0.00 -3.46 0.01 -1.26 -5.11 113.70 113.04 1v9x s SER 3 Ca 0.92 -1.21 0.00 0.00 1.31 0.00 0.00 55.95 56.97 1v9x s SER 3 Cb -0.55 0.34 0.00 0.00 0.21 0.00 0.00 66.02 66.02 1v9x s SER 3 CO 0.46 -1.07 0.00 0.61 0.41 0.00 0.00 173.24 173.65 1v9x n GLY 4 N -1.75 0.12 3.49 3.44 0.00 -1.26 -5.12 105.19 104.12 1v9x n GLY 4 Ca -0.01 0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 1v9x n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v9x n SER 5 N -0.07 -0.76 -4.89 1.61 7.64 -1.26 -4.97 113.62 110.92 1v9x n SER 5 Ca 0.00 0.69 -0.29 0.00 1.01 0.00 0.00 58.87 60.28 1v9x n SER 5 Cb 0.00 -1.23 0.00 0.00 -1.01 0.00 0.00 64.21 61.97 1v9x n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1v9x s SER 6 N -1.30 6.24 0.00 6.43 0.01 -1.26 -4.91 113.70 118.90 1v9x s SER 6 Ca 0.69 1.15 0.00 0.00 1.31 0.00 0.00 55.95 59.10 1v9x s SER 6 Cb -0.40 -2.34 0.00 0.00 0.21 0.00 0.00 66.02 63.48 1v9x s SER 6 CO 0.54 -0.72 0.00 0.61 0.41 0.00 0.00 173.24 174.08 1v9x n GLY 7 N -2.49 -2.99 3.38 3.44 0.00 -1.26 -5.01 105.19 100.27 1v9x n GLY 7 Ca 0.03 -0.96 -0.35 0.00 0.00 0.00 0.00 46.02 44.75 1v9x n GLY 7 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1v9x s HIS 8 N -0.68 2.99 0.46 1.61 0.09 -1.26 -5.09 115.29 113.40 1v9x s HIS 8 Ca 0.00 -0.67 -0.24 0.00 -0.00 0.00 0.00 55.06 54.15 1v9x s HIS 8 Cb 0.00 -2.07 -0.07 0.00 -0.00 0.00 0.00 32.58 30.43 1v9x s HIS 8 CO 0.00 -0.36 1.29 0.15 -0.00 0.00 0.00 174.74 175.82 1v9x s LYS 9 N 1.15 3.66 0.03 1.40 1.02 -1.26 -4.96 119.74 120.78 1v9x s LYS 9 Ca 0.02 2.10 -0.22 0.00 0.02 0.00 0.00 55.97 57.90 1v9x s LYS 9 Cb -0.15 -2.52 -0.16 0.00 -0.52 0.00 0.00 37.83 34.49 1v9x s LYS 9 CO 0.00 -0.73 1.33 -1.00 -0.92 0.00 0.00 175.35 174.03 1v9x h PRO 10 N 2.15 0.27 -6.16 -1.68 0.13 -1.86 -3.44 132.00 121.41 1v9x h PRO 10 Ca -0.50 -0.14 -0.64 0.00 -0.87 0.00 0.00 66.00 63.85 1v9x h PRO 10 Cb 1.26 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.31 1v9x h PRO 10 CO 0.60 0.68 -0.59 -1.58 -0.23 0.00 0.00 178.00 176.88 1v9x s TRP 11 N -4.30 3.21 0.10 1.56 0.52 -1.20 0.05 118.94 118.88 1v9x s TRP 11 Ca -0.15 0.09 0.07 0.00 0.02 0.00 0.00 56.10 56.14 1v9x s TRP 11 Cb 0.04 -1.63 -0.03 0.00 -1.15 0.00 0.00 33.47 30.70 1v9x s TRP 11 CO 0.73 0.53 -0.19 -0.98 0.02 0.00 0.00 176.95 177.06 1v9x s ARG 12 N -2.39 1.05 -0.07 4.98 1.70 -0.91 -0.67 118.95 122.65 1v9x s ARG 12 Ca 0.30 -1.12 0.00 0.00 -0.47 0.00 0.00 55.73 54.44 1v9x s ARG 12 Cb -0.12 -1.23 0.02 0.00 -0.57 0.00 0.00 34.95 33.05 1v9x s ARG 12 CO 0.22 0.28 -0.06 0.00 -1.08 0.00 0.00 175.30 174.67 1v9x s ALA 13 N -1.27 0.93 -0.24 7.88 0.00 0.14 -2.44 121.76 126.77 1v9x s ALA 13 Ca 0.05 -0.25 -0.29 0.00 0.00 0.00 0.00 51.96 51.47 1v9x s ALA 13 Cb -0.10 -0.63 0.16 0.00 0.00 0.00 0.00 23.12 22.55 1v9x s ALA 13 CO 0.04 -0.18 1.19 -1.83 0.00 0.00 0.00 175.76 174.97 1v9x s GLU 14 N 1.28 0.32 0.02 0.00 -1.05 -1.26 -4.19 118.70 113.83 1v9x s GLU 14 Ca -0.05 0.13 -0.30 0.00 -0.15 0.00 0.00 54.97 54.61 1v9x s GLU 14 Cb -0.14 0.15 -0.04 0.00 -0.44 0.00 0.00 34.13 33.67 1v9x s GLU 14 CO -0.02 -0.09 1.08 0.71 0.95 0.00 0.00 175.26 177.89 1v9x s TYR 15 N -0.81 3.54 0.70 4.83 2.02 -1.26 -3.75 117.35 122.63 1v9x s TYR 15 Ca 0.04 1.51 -0.16 0.00 -0.37 0.00 0.00 57.07 58.09 1v9x s TYR 15 Cb -0.02 -3.26 0.01 0.00 -0.40 0.00 0.00 41.96 38.30 1v9x s TYR 15 CO -0.05 -0.59 1.18 0.00 -1.57 0.00 0.00 175.55 174.52 1v9x n ALA 16 N 4.01 0.49 -0.01 3.71 0.00 -1.07 -4.77 120.51 122.87 1v9x n ALA 16 Ca 0.08 -0.12 0.07 0.00 0.00 0.00 0.00 53.44 53.46 1v9x n ALA 16 Cb 0.49 -2.25 -0.12 0.00 0.00 0.00 0.00 19.45 17.57 1v9x n ALA 16 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1v9x n LYS 17 N -2.17 0.58 -3.86 0.00 5.02 -1.26 -1.32 118.16 115.15 1v9x n LYS 17 Ca 0.15 -0.13 -0.09 0.00 -2.02 0.00 0.00 58.31 56.22 1v9x n LYS 17 Cb 0.49 -1.38 -0.07 0.00 -0.02 0.00 0.00 35.03 34.05 1v9x n LYS 17 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1v9x s SER 18 N -3.92 0.13 -0.34 4.39 0.15 -1.26 -4.76 113.70 108.10 1v9x s SER 18 Ca -0.06 -0.66 0.01 0.00 0.70 0.00 0.00 55.95 55.94 1v9x s SER 18 Cb 0.10 0.33 0.38 0.00 -1.71 0.00 0.00 66.02 65.12 1v9x s SER 18 CO 0.65 -0.72 1.75 -1.20 1.20 0.00 0.00 173.24 174.92 1v9x n SER 19 N -0.05 4.72 0.05 5.45 7.64 -1.26 -3.76 113.62 126.41 1v9x n SER 19 Ca -0.15 -3.12 -0.19 0.00 1.01 0.00 0.00 58.87 56.42 1v9x n SER 19 Cb 0.62 -0.83 -0.14 0.00 -1.01 0.00 0.00 64.21 62.85 1v9x n SER 19 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1v9x h ARG 20 N 1.01 0.28 -7.00 1.43 3.08 -1.97 -3.43 114.38 107.77 1v9x h ARG 20 Ca 0.40 -0.47 -0.50 0.00 0.07 0.00 0.00 59.98 59.48 1v9x h ARG 20 Cb 1.71 0.18 0.05 0.00 0.08 0.00 0.00 29.97 31.99 1v9x h ARG 20 CO 0.82 1.14 0.47 0.45 -1.07 0.00 0.00 179.97 181.78 1v9x s SER 21 N -7.01 6.25 -0.04 7.04 0.15 -1.26 -4.92 113.70 113.91 1v9x s SER 21 Ca -0.13 2.24 0.03 0.00 0.70 0.00 0.00 55.95 58.78 1v9x s SER 21 Cb 0.06 -2.60 0.01 0.00 -1.71 0.00 0.00 66.02 61.78 1v9x s SER 21 CO 0.83 -0.86 -0.12 -0.44 1.20 0.00 0.00 173.24 173.86 1v9x s SER 22 N -1.44 1.64 0.97 5.45 0.01 -1.26 -0.99 113.70 118.08 1v9x s SER 22 Ca 0.63 -0.27 -0.11 0.00 1.31 0.00 0.00 55.95 57.51 1v9x s SER 22 Cb -0.27 -0.58 0.13 0.00 0.21 0.00 0.00 66.02 65.52 1v9x s SER 22 CO 0.33 0.07 0.87 0.00 0.41 0.00 0.00 173.24 174.92 1v9x n LYS 24 N -3.52 2.19 -0.11 0.00 4.76 -1.17 -3.08 118.16 117.23 1v9x n LYS 24 Ca 0.09 -0.02 -0.13 0.00 -2.87 0.00 0.00 58.31 55.38 1v9x n LYS 24 Cb 0.53 -1.24 -0.03 0.00 -1.84 0.00 0.00 35.03 32.45 1v9x n LYS 24 CO 0.00 0.00 0.00 1.15 -1.37 0.00 0.00 177.40 177.18 1v9x h THR 25 N 0.00 1.29 0.00 -0.18 2.02 -1.93 -3.31 112.91 110.79 1v9x h THR 25 Ca -0.22 -1.47 0.00 0.00 0.77 0.00 0.00 66.41 65.49 1v9x h THR 25 Cb 1.42 1.47 0.00 0.00 -1.74 0.00 0.00 68.15 69.29 1v9x h THR 25 CO 0.01 0.48 -1.07 0.00 0.37 0.00 0.00 175.52 175.31 1v9x n LYS 27 N -1.61 -5.18 -4.46 0.00 4.76 -1.18 -5.03 118.16 105.47 1v9x n LYS 27 Ca -0.00 0.55 -0.31 0.00 -2.87 0.00 0.00 58.31 55.68 1v9x n LYS 27 Cb 0.25 -4.74 -0.05 0.00 -1.84 0.00 0.00 35.03 28.65 1v9x n LYS 27 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1v9x s SER 28 N -3.30 4.31 0.02 4.39 0.01 -1.23 -4.85 113.70 113.05 1v9x s SER 28 Ca 0.34 -1.51 -0.17 0.00 1.31 0.00 0.00 55.95 55.92 1v9x s SER 28 Cb -0.15 0.49 -0.06 0.00 0.21 0.00 0.00 66.02 66.51 1v9x s SER 28 CO 0.48 -0.94 0.49 -0.69 0.41 0.00 0.00 173.24 172.99 1v9x s VAL 29 N -2.84 4.91 -0.77 3.43 1.01 -1.26 0.14 120.40 125.01 1v9x s VAL 29 Ca 0.15 1.02 -0.09 0.00 0.00 0.00 0.00 61.98 63.06 1v9x s VAL 29 Cb 0.00 -3.81 0.20 0.00 0.00 0.00 0.00 36.38 32.78 1v9x s VAL 29 CO 0.09 0.55 0.67 -0.63 0.00 0.00 0.00 175.10 175.78 1v9x s ILE 30 N -0.96 4.89 0.61 2.22 1.01 -0.16 -4.81 121.20 124.01 1v9x s ILE 30 Ca 0.26 -2.76 -0.18 0.00 0.00 0.00 0.00 60.65 57.97 1v9x s ILE 30 Cb -0.18 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.19 1v9x s ILE 30 CO 0.16 -0.98 1.09 0.59 0.00 0.00 0.00 174.94 175.79 1v9x n ASN 31 N 3.66 1.27 -4.66 3.58 3.02 -1.26 -4.22 115.26 116.65 1v9x n ASN 31 Ca 0.13 0.82 -0.30 0.00 -0.03 0.00 0.00 54.58 55.19 1v9x n ASN 31 Cb 0.43 -1.45 0.17 0.00 -0.61 0.00 0.00 39.78 38.32 1v9x n ASN 31 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 1v9x s LYS 32 N -2.96 0.84 -0.69 3.52 -2.85 -1.25 -3.62 119.74 112.74 1v9x s LYS 32 Ca 0.78 1.22 0.00 0.00 -1.00 0.00 0.00 55.97 56.97 1v9x s LYS 32 Cb -0.40 -1.73 0.00 0.00 -2.06 0.00 0.00 37.83 33.63 1v9x s LYS 32 CO 0.45 -2.64 0.00 0.39 0.10 0.00 0.00 175.35 173.65 1v9x n GLU 33 N -4.21 -0.54 -4.72 1.78 1.02 -0.43 -4.91 120.64 108.63 1v9x n GLU 33 Ca 0.09 0.55 -0.25 0.00 -0.02 0.00 0.00 57.16 57.53 1v9x n GLU 33 Cb 0.53 -4.40 -0.15 0.00 -0.02 0.00 0.00 31.44 27.40 1v9x n GLU 33 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1v9x s ASN 34 N -2.80 2.18 -0.48 1.62 0.01 -1.24 -4.93 114.94 109.30 1v9x s ASN 34 Ca 0.00 -0.41 -0.29 0.00 -0.71 0.00 0.00 52.86 51.45 1v9x s ASN 34 Cb 0.00 -0.21 0.03 0.00 0.41 0.00 0.00 41.25 41.48 1v9x s ASN 34 CO 0.00 0.18 1.14 0.12 -1.51 0.00 0.00 177.10 177.02 1v9x s PHE 35 N -0.61 2.81 0.53 2.20 5.36 -1.26 -2.59 117.98 124.43 1v9x s PHE 35 Ca 0.06 0.71 0.02 0.00 -0.96 0.00 0.00 56.93 56.76 1v9x s PHE 35 Cb -0.08 -4.45 0.01 0.00 -0.34 0.00 0.00 43.02 38.17 1v9x s PHE 35 CO 0.00 -1.28 0.11 -0.98 -1.46 0.00 0.00 175.22 171.62 1v9x s ARG 36 N 4.46 2.23 -0.04 10.12 1.70 -1.25 -2.79 118.95 133.39 1v9x s ARG 36 Ca 0.48 -2.34 0.01 0.00 -0.47 0.00 0.00 55.73 53.41 1v9x s ARG 36 Cb -0.07 -1.67 0.02 0.00 -0.57 0.00 0.00 34.95 32.66 1v9x s ARG 36 CO 0.32 -0.48 -0.05 -0.51 -1.08 0.00 0.00 175.30 173.51 1v9x s LEU 37 N -4.01 1.37 -0.38 -1.89 1.43 0.53 -4.04 118.68 111.69 1v9x s LEU 37 Ca 0.10 -0.13 -0.04 0.00 -1.03 0.00 0.00 54.13 53.03 1v9x s LEU 37 Cb -0.00 -0.44 0.09 0.00 0.03 0.00 0.00 46.19 45.86 1v9x s LEU 37 CO 0.06 -0.05 0.15 -0.83 0.23 0.00 0.00 176.35 175.92 1v9x s GLY 38 N 0.84 1.92 -0.70 -3.19 0.00 -1.02 -0.61 107.32 104.56 1v9x s GLY 38 Ca -0.11 -2.24 -0.27 0.00 0.00 0.00 0.00 44.72 42.10 1v9x s GLY 38 CO 0.00 0.92 1.52 1.25 0.00 0.00 0.00 173.10 176.80 1v9x s LYS 39 N 1.22 2.96 -0.18 2.90 2.20 -0.54 -2.14 119.74 126.17 1v9x s LYS 39 Ca 0.04 0.08 -0.29 0.00 -0.36 0.00 0.00 55.97 55.44 1v9x s LYS 39 Cb -0.22 -4.29 -0.02 0.00 -1.51 0.00 0.00 37.83 31.79 1v9x s LYS 39 CO -0.02 -2.40 1.38 -0.51 -0.36 0.00 0.00 175.35 173.44 1v9x s LEU 40 N 7.11 4.11 0.35 5.43 1.43 0.11 -2.74 118.68 134.47 1v9x s LEU 40 Ca 0.48 1.68 0.09 0.00 -1.03 0.00 0.00 54.13 55.35 1v9x s LEU 40 Cb -0.10 -3.54 -0.07 0.00 0.03 0.00 0.00 46.19 42.52 1v9x s LEU 40 CO 0.17 -0.92 -0.08 0.68 0.23 0.00 0.00 176.35 176.43 1v9x s VAL 41 N 3.98 2.16 -0.36 -1.59 -7.23 -1.26 -4.79 120.40 111.31 1v9x s VAL 41 Ca 0.60 -2.17 -0.03 0.00 -1.81 0.00 0.00 61.98 58.57 1v9x s VAL 41 Cb -0.23 -2.68 0.08 0.00 0.56 0.00 0.00 36.38 34.11 1v9x s VAL 41 CO 0.21 -0.18 0.12 -1.10 -0.31 0.00 0.00 175.10 173.84 1v9x s GLN 42 N -3.63 2.26 0.43 4.82 1.11 -1.26 -4.39 119.66 119.00 1v9x s GLN 42 Ca 0.33 -1.53 0.02 0.00 0.01 0.00 0.00 55.36 54.19 1v9x s GLN 42 Cb 0.04 -3.44 0.00 0.00 -1.01 0.00 0.00 33.01 28.59 1v9x s GLN 42 CO 0.16 -0.86 0.63 -1.12 0.01 0.00 0.00 175.29 174.11 1v9x s SER 43 N 1.59 5.79 -0.08 5.90 0.01 -1.26 -4.98 113.70 120.67 1v9x s SER 43 Ca 0.02 0.10 -0.00 0.00 1.31 0.00 0.00 55.95 57.38 1v9x s SER 43 Cb -0.21 -1.34 0.06 0.00 0.21 0.00 0.00 66.02 64.74 1v9x s SER 43 CO -0.02 -0.69 1.85 1.07 0.41 0.00 0.00 173.24 175.87 1v9x n THR 44 N -1.99 2.05 -4.22 1.44 5.66 -1.26 -4.85 114.28 111.11 1v9x n THR 44 Ca 0.02 -0.71 -0.28 0.00 -3.05 0.00 0.00 64.05 60.02 1v9x n THR 44 Cb 0.58 -1.37 -0.09 0.00 -1.55 0.00 0.00 70.33 67.91 1v9x n THR 44 CO 0.00 0.00 0.00 -2.28 -3.05 0.00 0.00 175.07 169.74 1v9x s HIS 45 N -0.48 2.78 1.06 1.09 5.65 -1.26 -5.11 115.29 119.02 1v9x s HIS 45 Ca 0.08 -0.15 -0.21 0.00 0.25 0.00 0.00 55.06 55.04 1v9x s HIS 45 Cb 0.06 -1.40 -0.01 0.00 -1.18 0.00 0.00 32.58 30.05 1v9x s HIS 45 CO 0.00 0.47 -0.49 0.34 -0.65 0.00 0.00 174.74 174.41 1v9x n PHE 46 N 0.33 -1.68 -1.11 3.88 7.35 -1.26 -4.48 117.46 120.48 1v9x n PHE 46 Ca -0.12 0.30 -0.45 0.00 -0.76 0.00 0.00 57.45 56.43 1v9x n PHE 46 Cb 0.54 -1.52 -0.11 0.00 0.35 0.00 0.00 39.48 38.74 1v9x n PHE 46 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 1v9x n ASP 47 N 0.33 0.49 0.00 -2.13 -0.08 -1.26 -4.71 116.55 109.20 1v9x n ASP 47 Ca 0.00 0.43 0.00 0.00 -1.51 0.00 0.00 54.79 53.71 1v9x n ASP 47 Cb 0.65 -0.76 0.00 0.00 2.34 0.00 0.00 41.12 43.35 1v9x n ASP 47 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1v9x n GLY 48 N 5.97 -0.29 3.80 0.27 0.00 -1.26 -5.16 105.19 108.52 1v9x n GLY 48 Ca 0.49 0.65 -0.35 0.00 0.00 0.00 0.00 46.02 46.81 1v9x n GLY 48 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1v9x s ILE 49 N 0.00 4.15 -0.43 -0.61 1.01 -1.26 -4.92 121.20 119.14 1v9x s ILE 49 Ca 0.00 1.55 -0.06 0.00 0.00 0.00 0.00 60.65 62.15 1v9x s ILE 49 Cb 0.00 -3.76 0.11 0.00 0.01 0.00 0.00 42.46 38.83 1v9x s ILE 49 CO 0.00 -0.08 0.26 -0.32 0.00 0.00 0.00 174.94 174.80 1v9x s MET 50 N -2.64 2.21 -0.49 2.79 1.75 -1.26 -5.05 119.30 116.60 1v9x s MET 50 Ca 0.57 -1.79 -0.27 0.00 -1.25 0.00 0.00 55.69 52.95 1v9x s MET 50 Cb -0.16 -3.73 -0.02 0.00 2.84 0.00 0.00 34.83 33.77 1v9x s MET 50 CO 0.20 -1.12 1.79 -1.25 -0.65 0.00 0.00 175.02 173.99 1v9x s PRO 51 N 1.24 2.98 -0.69 4.11 0.04 -1.26 -4.28 135.00 137.14 1v9x s PRO 51 Ca 0.07 0.93 -0.26 0.00 0.04 0.00 0.00 61.00 61.79 1v9x s PRO 51 Cb -0.24 -4.28 -0.03 0.00 0.04 0.00 0.00 34.50 29.98 1v9x s PRO 51 CO -0.03 -2.30 1.93 -1.64 0.04 0.00 0.00 177.00 175.01 1v9x s MET 52 N 6.33 2.55 -0.03 4.56 -1.94 -1.11 -4.82 119.30 124.83 1v9x s MET 52 Ca 0.71 0.42 -0.30 0.00 -1.71 0.00 0.00 55.69 54.81 1v9x s MET 52 Cb -0.16 -4.59 -0.04 0.00 2.01 0.00 0.00 34.83 32.05 1v9x s MET 52 CO 0.27 -2.98 1.20 -1.58 -0.01 0.00 0.00 175.02 171.91 1v9x s TRP 53 N 9.70 3.24 -0.15 -0.03 0.23 -1.26 -1.46 118.94 129.20 1v9x s TRP 53 Ca 0.70 1.24 -0.09 0.00 -2.03 0.00 0.00 56.10 55.92 1v9x s TRP 53 Cb -0.11 -3.42 0.05 0.00 0.03 0.00 0.00 33.47 30.02 1v9x s TRP 53 CO 0.15 -1.29 0.37 -0.80 0.96 0.00 0.00 176.95 176.33 1v9x s ASN 54 N 1.40 -0.43 0.22 2.95 0.01 0.22 -3.05 114.94 116.27 1v9x s ASN 54 Ca 0.56 0.78 -0.29 0.00 -0.71 0.00 0.00 52.86 53.20 1v9x s ASN 54 Cb -0.26 0.69 -0.16 0.00 0.41 0.00 0.00 41.25 41.94 1v9x s ASN 54 CO 0.24 -0.17 0.82 1.41 -1.51 0.00 0.00 177.10 177.89 1v9x n HIS 55 N 3.93 0.49 0.26 2.20 8.25 -1.26 -0.34 115.22 128.75 1v9x n HIS 55 Ca -0.21 0.83 0.16 0.00 -0.26 0.00 0.00 57.72 58.24 1v9x n HIS 55 Cb 0.55 -2.12 0.88 0.00 1.12 0.00 0.00 29.99 30.42 1v9x n HIS 55 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1v9x h ALA 56 N 1.78 1.05 0.00 -1.41 0.00 -1.78 0.11 119.26 119.02 1v9x h ALA 56 Ca -0.36 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1v9x h ALA 56 Cb 1.39 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1v9x h ALA 56 CO 0.60 -0.05 -1.65 0.45 0.00 0.00 0.00 179.25 178.61 1v9x n SER 57 N -2.67 0.34 0.12 0.00 2.88 -1.26 -3.33 113.62 109.70 1v9x n SER 57 Ca -0.02 0.13 -0.01 0.00 -1.33 0.00 0.00 58.87 57.64 1v9x n SER 57 Cb 0.11 1.32 0.05 0.00 -0.75 0.00 0.00 64.21 64.94 1v9x n SER 57 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1v9x h ILE 59 N 0.00 0.74 -0.99 0.00 1.08 -1.62 -3.36 117.51 113.36 1v9x h ILE 59 Ca -0.01 -1.81 0.22 0.00 -0.39 0.00 0.00 64.86 62.87 1v9x h ILE 59 Cb 1.39 1.65 -0.10 0.00 -3.07 0.00 0.00 36.82 36.70 1v9x h ILE 59 CO 0.09 0.25 0.62 -0.07 -0.69 0.00 0.00 178.15 178.35 1v9x h LEU 60 N -1.00 0.62 -2.35 1.44 3.38 -1.69 0.55 115.31 116.26 1v9x h LEU 60 Ca -0.18 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1v9x h LEU 60 Cb 0.95 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.68 1v9x h LEU 60 CO -0.11 0.19 -0.00 0.07 0.09 0.00 0.00 178.44 178.68 1v9x h LYS 61 N 0.59 0.00 0.00 1.13 2.10 -1.69 -3.42 116.57 115.28 1v9x h LYS 61 Ca 0.57 0.00 -0.25 0.00 -2.00 0.00 0.00 60.65 58.97 1v9x h LYS 61 Cb 1.13 0.00 0.09 0.00 -0.90 0.00 0.00 32.23 32.55 1v9x h LYS 61 CO -0.33 0.00 0.19 1.63 -2.00 0.00 0.00 179.45 178.94 1v9x n LYS 62 N -4.02 -0.49 -4.27 0.07 5.02 0.19 -5.12 118.16 109.54 1v9x n LYS 62 Ca -0.03 -1.27 -0.15 0.00 -2.02 0.00 0.00 58.31 54.84 1v9x n LYS 62 Cb 0.08 -0.67 -0.10 0.00 -0.02 0.00 0.00 35.03 34.32 1v9x n LYS 62 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1v9x s THR 63 N -2.39 1.28 -1.30 -0.18 2.01 -1.26 -4.84 115.64 108.96 1v9x s THR 63 Ca 0.41 -2.09 -0.02 0.00 0.31 0.00 0.00 61.69 60.30 1v9x s THR 63 Cb -0.01 -1.91 0.01 0.00 0.01 0.00 0.00 72.50 70.59 1v9x s THR 63 CO 0.29 -0.70 0.86 0.29 -0.69 0.00 0.00 174.62 174.68 1v9x n LYS 64 N -0.25 -5.78 -0.05 4.92 5.02 -1.26 -4.87 118.16 115.89 1v9x n LYS 64 Ca -0.09 0.71 -0.11 0.00 -2.02 0.00 0.00 58.31 56.79 1v9x n LYS 64 Cb 0.61 -5.49 -0.04 0.00 -0.02 0.00 0.00 35.03 30.09 1v9x n LYS 64 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1v9x n GLN 65 N -4.33 0.27 -4.73 1.97 1.13 -1.26 -4.93 117.38 105.51 1v9x n GLN 65 Ca -0.24 0.12 -0.28 0.00 -1.94 0.00 0.00 57.00 54.65 1v9x n GLN 65 Cb 0.65 -0.96 -0.14 0.00 0.11 0.00 0.00 30.24 29.90 1v9x n GLN 65 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1v9x s ILE 66 N -2.30 2.00 -0.21 5.09 1.01 -1.26 -5.03 121.20 120.51 1v9x s ILE 66 Ca -0.17 -1.40 -0.08 0.00 0.00 0.00 0.00 60.65 59.00 1v9x s ILE 66 Cb 0.06 -1.74 -0.20 0.00 0.01 0.00 0.00 42.46 40.60 1v9x s ILE 66 CO 0.22 0.26 0.02 2.29 0.00 0.00 0.00 174.94 177.73 1v9x n LYS 67 N 1.63 0.66 -3.65 2.79 2.85 -1.26 -4.32 118.16 116.86 1v9x n LYS 67 Ca -0.17 0.28 -0.15 0.00 -1.05 0.00 0.00 58.31 57.21 1v9x n LYS 67 Cb 0.53 -1.61 -0.08 0.00 -0.65 0.00 0.00 35.03 33.21 1v9x n LYS 67 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1v9x s SER 68 N -6.92 -0.44 0.60 -5.58 0.15 -1.26 -4.72 113.70 95.53 1v9x s SER 68 Ca -0.31 0.50 0.29 0.00 0.70 0.00 0.00 55.95 57.14 1v9x s SER 68 Cb 0.09 0.53 1.54 0.00 -1.71 0.00 0.00 66.02 66.47 1v9x s SER 68 CO 0.64 -0.47 1.94 -0.37 1.20 0.00 0.00 173.24 176.18 1v9x h VAL 69 N 3.58 0.31 0.00 4.45 -1.51 -1.94 0.23 116.25 121.38 1v9x h VAL 69 Ca -0.28 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.16 1v9x h VAL 69 Cb 1.16 0.67 -0.00 0.00 -2.13 0.00 0.00 31.29 30.99 1v9x h VAL 69 CO 0.36 0.00 -0.11 -0.78 -1.23 0.00 0.00 177.57 175.81 1v9x h ASP 70 N 0.00 0.00 1.34 4.19 1.82 -2.01 -1.05 116.42 120.71 1v9x h ASP 70 Ca 0.15 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.76 1v9x h ASP 70 Cb 0.94 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.94 1v9x h ASP 70 CO -0.00 0.11 -0.14 0.44 -1.61 0.00 0.00 179.24 178.03 1v9x h ASP 71 N 0.00 0.00 -3.28 2.28 5.19 -0.91 -3.43 116.42 116.27 1v9x h ASP 71 Ca -0.00 0.00 -0.59 0.00 -0.62 0.00 0.00 57.03 55.82 1v9x h ASP 71 Cb 0.21 0.00 -0.08 0.00 0.18 0.00 0.00 39.33 39.64 1v9x h ASP 71 CO 0.01 0.14 0.46 -0.69 -3.12 0.00 0.00 179.24 176.05 1v9x s VAL 72 N -3.43 4.85 0.53 -1.35 1.01 -0.40 -3.25 120.40 118.36 1v9x s VAL 72 Ca 0.03 1.62 -0.06 0.00 0.00 0.00 0.00 61.98 63.57 1v9x s VAL 72 Cb 0.08 -4.13 -0.02 0.00 0.00 0.00 0.00 36.38 32.30 1v9x s VAL 72 CO 0.64 -0.04 0.85 -0.70 0.00 0.00 0.00 175.10 175.84 1v9x s GLU 73 N 2.59 3.34 -1.02 2.72 2.12 0.16 -3.93 118.70 124.67 1v9x s GLU 73 Ca 0.37 0.18 0.00 0.00 0.36 0.00 0.00 54.97 55.88 1v9x s GLU 73 Cb -0.16 -2.31 0.00 0.00 0.26 0.00 0.00 34.13 31.92 1v9x s GLU 73 CO 0.09 -0.41 0.00 0.41 -0.54 0.00 0.00 175.26 174.82 1v9x n GLY 74 N -2.42 0.92 0.20 -1.50 0.00 -1.26 0.28 105.19 101.42 1v9x n GLY 74 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.14 1v9x n GLY 74 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1v9x h ILE 75 N 0.00 0.39 0.00 -0.61 2.10 -1.74 -3.01 117.51 114.64 1v9x h ILE 75 Ca -0.20 -1.32 0.00 0.00 1.08 0.00 0.00 64.86 64.42 1v9x h ILE 75 Cb 0.65 2.00 0.00 0.00 -1.09 0.00 0.00 36.82 38.38 1v9x h ILE 75 CO 0.29 0.20 0.00 1.05 -1.08 0.00 0.00 178.15 178.61 1v9x h GLU 76 N 0.00 0.00 0.00 2.19 4.11 -1.87 -2.89 114.58 116.12 1v9x h GLU 76 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1v9x h GLU 76 Cb 0.99 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.24 1v9x h GLU 76 CO 0.03 0.00 -0.59 1.03 0.07 0.00 0.00 179.01 179.54 1v9x h SER 77 N 0.00 0.00 -4.21 3.06 0.87 -1.88 -3.47 113.55 107.92 1v9x h SER 77 Ca 0.00 -0.13 -0.50 0.00 -1.23 0.00 0.00 61.79 59.93 1v9x h SER 77 Cb 0.64 0.00 0.08 0.00 -0.44 0.00 0.00 62.40 62.68 1v9x h SER 77 CO 0.00 0.07 0.37 -0.76 -0.53 0.00 0.00 176.83 175.98 1v9x s LEU 78 N -4.66 3.42 0.49 2.23 1.43 -1.09 -4.99 118.68 115.51 1v9x s LEU 78 Ca 0.05 1.87 -0.23 0.00 -1.03 0.00 0.00 54.13 54.79 1v9x s LEU 78 Cb 0.12 -4.54 -0.07 0.00 0.03 0.00 0.00 46.19 41.73 1v9x s LEU 78 CO 0.72 -1.39 1.29 -0.13 0.23 0.00 0.00 176.35 177.08 1v9x s ARG 79 N -4.17 3.52 0.14 1.70 1.81 -1.26 -4.59 118.95 116.10 1v9x s ARG 79 Ca 0.64 2.09 -0.27 0.00 -1.72 0.00 0.00 55.73 56.48 1v9x s ARG 79 Cb -0.18 -2.43 -0.06 0.00 -0.45 0.00 0.00 34.95 31.84 1v9x s ARG 79 CO 0.40 -0.84 1.36 1.87 -0.68 0.00 0.00 175.30 177.42 1v9x n TRP 80 N -0.59 -0.39 -0.32 -0.53 -0.00 -1.26 0.13 117.44 114.49 1v9x n TRP 80 Ca 0.08 1.11 0.17 0.00 -0.00 0.00 0.00 57.50 58.86 1v9x n TRP 80 Cb 0.45 -0.57 0.37 0.00 -0.00 0.00 0.00 31.31 31.56 1v9x n TRP 80 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 177.69 178.74 1v9x h GLU 81 N 0.00 0.40 0.28 5.87 4.11 -2.00 0.56 114.58 123.80 1v9x h GLU 81 Ca 0.14 -0.02 -0.01 0.00 0.07 0.00 0.00 59.36 59.54 1v9x h GLU 81 Cb 0.36 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1v9x h GLU 81 CO -0.83 0.27 -0.13 -0.44 0.07 0.00 0.00 179.01 177.94 1v9x h ASP 82 N 0.42 -0.32 -0.62 3.06 5.19 0.76 -2.77 116.42 122.14 1v9x h ASP 82 Ca 0.63 -0.19 0.18 0.00 -0.62 0.00 0.00 57.03 57.03 1v9x h ASP 82 Cb 1.27 0.08 -0.03 0.00 0.18 0.00 0.00 39.33 40.84 1v9x h ASP 82 CO -0.55 0.05 0.44 1.56 -3.12 0.00 0.00 179.24 177.63 1v9x h GLN 83 N -0.72 0.01 -0.37 3.56 4.20 0.46 -0.06 115.11 122.19 1v9x h GLN 83 Ca -0.04 -0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.55 1v9x h GLN 83 Cb 0.49 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 1v9x h GLN 83 CO 0.06 0.01 -0.23 1.96 -0.67 0.00 0.00 178.83 179.96 1v9x h GLN 84 N 0.01 0.81 -0.21 1.46 1.08 -0.79 -2.77 115.11 114.70 1v9x h GLN 84 Ca 0.29 -0.37 0.06 0.00 -1.45 0.00 0.00 58.65 57.18 1v9x h GLN 84 Cb 1.17 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.58 1v9x h GLN 84 CO -0.01 1.00 0.17 0.87 -0.95 0.00 0.00 178.83 179.92 1v9x h LYS 85 N 0.60 0.00 0.09 1.46 1.57 -0.72 0.25 116.57 119.82 1v9x h LYS 85 Ca 0.08 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1v9x h LYS 85 Cb 0.79 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.10 1v9x h LYS 85 CO 0.06 0.00 -0.04 0.82 -0.57 0.00 0.00 179.45 179.72 1v9x h ILE 86 N 0.00 0.00 -0.88 1.86 1.08 -1.39 -3.08 117.51 115.10 1v9x h ILE 86 Ca 0.10 -0.38 0.12 0.00 -0.39 0.00 0.00 64.86 64.32 1v9x h ILE 86 Cb 0.43 0.00 -0.07 0.00 -3.07 0.00 0.00 36.82 34.12 1v9x h ILE 86 CO -0.00 0.00 0.57 0.08 -0.69 0.00 0.00 178.15 178.11 1v9x h ARG 87 N -0.50 0.73 0.00 2.37 0.11 -1.39 0.52 114.38 116.22 1v9x h ARG 87 Ca -0.01 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 60.02 1v9x h ARG 87 Cb 0.09 -0.16 0.00 0.00 1.11 0.00 0.00 29.97 31.01 1v9x h ARG 87 CO 0.02 0.48 0.00 1.63 0.10 0.00 0.00 179.97 182.20 1v9x n LYS 88 N -4.55 0.75 -0.05 0.08 4.76 0.88 -2.08 118.16 117.95 1v9x n LYS 88 Ca 0.16 0.00 -0.08 0.00 -2.87 0.00 0.00 58.31 55.53 1v9x n LYS 88 Cb 0.40 -1.37 -0.04 0.00 -1.84 0.00 0.00 35.03 32.18 1v9x n LYS 88 CO 0.00 0.00 0.00 0.98 -1.37 0.00 0.00 177.40 177.01 1v9x n TYR 89 N -0.87 0.00 0.12 2.13 9.36 0.17 -4.26 117.16 123.81 1v9x n TYR 89 Ca 0.13 0.00 -0.02 0.00 3.32 0.00 0.00 57.90 61.33 1v9x n TYR 89 Cb 0.06 -0.37 0.15 0.00 -0.63 0.00 0.00 39.34 38.55 1v9x n TYR 89 CO 0.00 0.00 0.00 -0.39 0.22 0.00 0.00 176.86 176.69 1v9x h VAL 90 N -0.08 1.45 0.03 2.97 -1.51 -1.11 -3.28 116.25 114.72 1v9x h VAL 90 Ca -0.23 -2.18 -0.00 0.00 -1.23 0.00 0.00 66.70 63.07 1v9x h VAL 90 Cb 1.31 2.17 0.00 0.00 -2.13 0.00 0.00 31.29 32.64 1v9x h VAL 90 CO -0.06 0.62 -0.01 -0.33 -1.23 0.00 0.00 177.57 176.56 1v9x h GLU 91 N 0.03 -0.04 0.00 5.19 4.39 -1.67 -3.45 114.58 119.03 1v9x h GLU 91 Ca -0.01 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.60 1v9x h GLU 91 Cb 1.14 0.01 0.06 0.00 -0.10 0.00 0.00 28.75 29.86 1v9x h GLU 91 CO 0.09 0.60 -0.05 0.43 -1.16 0.00 0.00 179.01 178.92 1v9x n SER 92 N -4.79 -2.15 0.26 1.42 7.64 -1.24 -4.74 113.62 110.03 1v9x n SER 92 Ca -0.09 -0.24 0.18 0.00 1.01 0.00 0.00 58.87 59.73 1v9x n SER 92 Cb 0.32 -0.37 0.92 0.00 -1.01 0.00 0.00 64.21 64.08 1v9x n SER 92 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1v9x h GLY 93 N -1.68 0.00 -3.02 0.23 0.00 -1.89 -3.43 103.07 93.27 1v9x h GLY 93 Ca -0.11 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.65 1v9x h GLY 93 CO 0.06 0.00 0.26 0.00 0.00 0.00 0.00 176.54 176.87 1v9x n ALA 94 N -2.22 0.57 0.00 3.60 0.00 -1.26 -2.89 120.51 118.31 1v9x n ALA 94 Ca -0.00 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1v9x n ALA 94 Cb 0.25 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.53 1v9x n ALA 94 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1v9x n GLY 95 N 1.11 1.79 3.62 0.00 0.00 -1.26 -4.66 105.19 105.79 1v9x n GLY 95 Ca 0.11 -0.16 -0.27 0.00 0.00 0.00 0.00 46.02 45.70 1v9x n GLY 95 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1v9x n SER 96 N 3.56 0.20 -4.37 1.61 3.41 -1.14 -4.60 113.62 112.29 1v9x n SER 96 Ca 0.00 -1.51 -0.29 0.00 -0.26 0.00 0.00 58.87 56.81 1v9x n SER 96 Cb 0.00 -0.92 0.22 0.00 -0.26 0.00 0.00 64.21 63.25 1v9x n SER 96 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1v9x s ASN 97 N -5.50 1.48 0.00 4.04 2.20 -1.26 -4.90 114.94 111.00 1v9x s ASN 97 Ca 0.70 1.12 0.00 0.00 -0.94 0.00 0.00 52.86 53.74 1v9x s ASN 97 Cb -0.02 -1.72 0.00 0.00 -2.00 0.00 0.00 41.25 37.51 1v9x s ASN 97 CO 0.49 -3.83 0.00 0.35 -2.94 0.00 0.00 177.10 171.17 1v9x n THR 98 N -4.63 0.00 -4.15 0.54 -2.24 -1.26 -4.88 114.28 97.65 1v9x n THR 98 Ca 0.06 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.48 1v9x n THR 98 Cb 0.57 -0.55 -0.04 0.00 -2.10 0.00 0.00 70.33 68.21 1v9x n THR 98 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1v9x n SER 99 N -1.65 -1.43 -3.89 3.42 2.88 -1.26 -4.95 113.62 106.74 1v9x n SER 99 Ca 0.00 -1.24 -0.11 0.00 -1.33 0.00 0.00 58.87 56.19 1v9x n SER 99 Cb 0.32 -1.88 -0.11 0.00 -0.75 0.00 0.00 64.21 61.79 1v9x n SER 99 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1v9x s THR 100 N -3.97 0.07 0.07 2.46 -1.32 -1.26 -5.17 115.64 106.53 1v9x s THR 100 Ca 0.21 -0.60 0.07 0.00 -1.21 0.00 0.00 61.69 60.17 1v9x s THR 100 Cb -0.11 -0.34 -0.03 0.00 -1.51 0.00 0.00 72.50 70.51 1v9x s THR 100 CO 0.97 -0.33 -0.20 -0.94 -2.21 0.00 0.00 174.62 171.91 1v9x s SER 101 N -1.10 2.39 -0.55 8.08 1.04 -1.26 -5.08 113.70 117.22 1v9x s SER 101 Ca -0.12 -0.60 -0.27 0.00 0.48 0.00 0.00 55.95 55.45 1v9x s SER 101 Cb -0.07 -0.16 -0.03 0.00 0.10 0.00 0.00 66.02 65.86 1v9x s SER 101 CO 0.01 0.09 1.97 0.42 0.98 0.00 0.00 173.24 176.71 1v9x s THR 102 N -0.99 3.29 0.17 2.02 -4.23 -1.26 -4.96 115.64 109.69 1v9x s THR 102 Ca 0.06 0.19 -0.28 0.00 -1.18 0.00 0.00 61.69 60.48 1v9x s THR 102 Cb -0.09 -3.70 -0.08 0.00 1.34 0.00 0.00 72.50 69.97 1v9x s THR 102 CO 0.03 -0.65 0.88 -0.83 -0.54 0.00 0.00 174.62 173.51 1v9x s GLY 103 N 8.71 3.01 0.62 3.99 0.00 -1.26 -5.05 107.32 117.33 1v9x s GLY 103 Ca 0.75 0.50 -0.10 0.00 0.00 0.00 0.00 44.72 45.88 1v9x s GLY 103 CO 0.24 1.15 1.01 -1.08 0.00 0.00 0.00 173.10 174.42 1v9x s THR 104 N -0.81 4.45 -0.05 0.90 -1.32 -1.26 -5.09 115.64 112.47 1v9x s THR 104 Ca 0.41 0.70 0.03 0.00 -1.21 0.00 0.00 61.69 61.61 1v9x s THR 104 Cb -0.24 -3.78 0.01 0.00 -1.51 0.00 0.00 72.50 66.98 1v9x s THR 104 CO 0.29 -0.99 -0.13 -0.44 -2.21 0.00 0.00 174.62 171.14 1v9x s SER 105 N -4.21 1.79 -0.07 8.08 0.01 -1.26 -5.10 113.70 112.94 1v9x s SER 105 Ca 0.55 -0.30 -0.30 0.00 1.31 0.00 0.00 55.95 57.22 1v9x s SER 105 Cb -0.11 -0.66 -0.06 0.00 0.21 0.00 0.00 66.02 65.40 1v9x s SER 105 CO 0.52 0.08 1.73 -0.89 0.41 0.00 0.00 173.24 175.09 1v9x s THR 106 N 0.38 3.48 0.00 1.44 2.01 -1.26 -4.99 115.64 116.69 1v9x s THR 106 Ca -0.09 0.57 0.03 0.00 0.31 0.00 0.00 61.69 62.51 1v9x s THR 106 Cb -0.13 -3.39 -0.03 0.00 0.01 0.00 0.00 72.50 68.95 1v9x s THR 106 CO 0.03 -0.08 -0.08 -0.94 -0.69 0.00 0.00 174.62 172.86 1v9x s SER 107 N 3.86 4.54 0.39 3.53 1.04 -1.26 -5.13 113.70 120.67 1v9x s SER 107 Ca 0.77 -0.17 0.08 0.00 0.48 0.00 0.00 55.95 57.11 1v9x s SER 107 Cb -0.34 -1.04 -0.01 0.00 0.10 0.00 0.00 66.02 64.74 1v9x s SER 107 CO 0.32 0.28 0.44 -0.55 0.98 0.00 0.00 173.24 174.71 1v9x s SER 108 N -1.38 5.44 -0.13 7.02 0.15 -1.26 -5.13 113.70 118.40 1v9x s SER 108 Ca 0.17 -0.50 -0.32 0.00 0.70 0.00 0.00 55.95 56.00 1v9x s SER 108 Cb -0.11 -0.79 0.13 0.00 -1.71 0.00 0.00 66.02 63.54 1v9x s SER 108 CO 0.07 -0.59 1.08 -0.94 1.20 0.00 0.00 173.24 174.05 1v9x s SER 109 N -4.18 -0.25 0.00 5.45 1.04 -1.26 -5.11 113.70 109.39 1v9x s SER 109 Ca 0.48 0.09 0.00 0.00 0.48 0.00 0.00 55.95 57.01 1v9x s SER 109 Cb -0.07 0.24 0.00 0.00 0.10 0.00 0.00 66.02 66.29 1v9x s SER 109 CO 0.30 -0.36 0.00 0.61 0.98 0.00 0.00 173.24 174.77 1v9x n GLY 110 N 0.10 -0.36 0.19 7.32 0.00 -1.26 -5.05 105.19 106.12 1v9x n GLY 110 Ca -0.05 0.02 -0.03 0.00 0.00 0.00 0.00 46.02 45.96 1v9x n GLY 110 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v9x h PRO 111 N 0.00 0.24 -6.10 1.61 0.13 -2.09 -3.45 132.00 122.35 1v9x h PRO 111 Ca 0.00 -0.13 -0.77 0.00 -0.87 0.00 0.00 66.00 64.24 1v9x h PRO 111 Cb 0.00 0.00 0.04 0.00 0.13 0.00 0.00 31.00 31.17 1v9x h PRO 111 CO 0.00 0.66 0.43 0.45 -0.23 0.00 0.00 178.00 179.31 1v9x n SER 112 N -3.99 1.09 -3.62 1.44 2.88 -1.26 -4.90 113.62 105.26 1v9x n SER 112 Ca -0.02 1.14 -0.00 0.00 -1.33 0.00 0.00 58.87 58.66 1v9x n SER 112 Cb 0.51 -1.03 0.00 0.00 -0.75 0.00 0.00 64.21 62.95 1v9x n SER 112 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1v9x s SER 113 N 1.28 -0.05 0.00 -3.46 1.04 -1.26 -5.27 113.70 105.98 1v9x s SER 113 Ca 0.93 -0.35 0.00 0.00 0.48 0.00 0.00 55.95 57.01 1v9x s SER 113 Cb -1.19 0.31 0.00 0.00 0.10 0.00 0.00 66.02 65.24 1v9x s SER 113 CO 0.60 -0.60 0.00 0.61 0.98 0.00 0.00 173.24 174.83