#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 -1.15 -0.09 1.61 3.41 -1.24 -4.81 113.62 111.35 1v9x n SER 2 Ca 0.00 -1.24 -0.10 0.00 -0.26 0.00 0.00 58.87 57.27 1v9x n SER 2 Cb 0.00 -1.58 -0.03 0.00 -0.26 0.00 0.00 64.21 62.34 1v9x n SER 2 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1v9x n SER 3 N -2.52 1.90 0.00 4.04 3.41 -1.26 -5.04 113.62 114.15 1v9x n SER 3 Ca 0.01 0.32 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 1v9x n SER 3 Cb 0.50 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 1v9x n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v9x n GLY 4 N 1.53 3.12 0.21 5.00 0.00 -1.26 -4.91 105.19 108.88 1v9x n GLY 4 Ca -0.16 -1.02 -0.03 0.00 0.00 0.00 0.00 46.02 44.81 1v9x n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1v9x h SER 5 N 0.97 0.31 -2.09 1.61 0.02 -2.00 -3.43 113.55 108.94 1v9x h SER 5 Ca 0.00 0.04 -0.60 0.00 -0.84 0.00 0.00 61.79 60.39 1v9x h SER 5 Cb 0.00 -0.01 0.17 0.00 0.14 0.00 0.00 62.40 62.70 1v9x h SER 5 CO 0.00 0.21 -0.91 -1.54 -1.14 0.00 0.00 176.83 173.45 1v9x n SER 6 N -4.93 -2.79 -3.73 3.07 3.41 -1.26 -4.96 113.62 102.44 1v9x n SER 6 Ca 0.05 0.74 -0.30 0.00 -0.26 0.00 0.00 58.87 59.10 1v9x n SER 6 Cb 0.17 -0.93 -0.14 0.00 -0.26 0.00 0.00 64.21 63.05 1v9x n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1v9x s GLY 7 N -1.02 1.41 0.02 5.00 0.00 -1.26 -5.10 107.32 106.36 1v9x s GLY 7 Ca 0.60 -2.19 0.01 0.00 0.00 0.00 0.00 44.72 43.15 1v9x s GLY 7 CO 0.63 1.56 -0.05 -2.38 0.00 0.00 0.00 173.10 172.86 1v9x s HIS 8 N 0.93 0.40 0.52 1.90 0.00 -1.26 -5.14 115.29 112.64 1v9x s HIS 8 Ca 0.14 -0.28 -0.21 0.00 -3.00 0.00 0.00 55.06 51.70 1v9x s HIS 8 Cb -0.21 -0.25 -0.06 0.00 -4.00 0.00 0.00 32.58 28.06 1v9x s HIS 8 CO -0.10 -0.07 1.22 0.15 -1.00 0.00 0.00 174.74 174.94 1v9x s LYS 9 N -0.81 3.36 0.00 -0.38 1.02 -1.26 -4.97 119.74 116.70 1v9x s LYS 9 Ca -0.06 1.89 -0.24 0.00 0.02 0.00 0.00 55.97 57.59 1v9x s LYS 9 Cb -0.06 -2.21 -0.18 0.00 -0.52 0.00 0.00 37.83 34.87 1v9x s LYS 9 CO -0.00 -0.91 1.30 -1.00 -0.92 0.00 0.00 175.35 173.81 1v9x h PRO 10 N 1.52 0.14 -6.04 -1.68 0.13 -1.88 -3.44 132.00 120.74 1v9x h PRO 10 Ca -0.50 -0.07 -0.66 0.00 -0.87 0.00 0.00 66.00 63.90 1v9x h PRO 10 Cb 1.28 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.30 1v9x h PRO 10 CO 0.58 0.58 -0.59 -1.58 -0.23 0.00 0.00 178.00 176.76 1v9x s TRP 11 N -4.28 3.24 0.10 1.56 0.52 -1.20 -0.64 118.94 118.25 1v9x s TRP 11 Ca -0.15 0.18 0.10 0.00 0.02 0.00 0.00 56.10 56.25 1v9x s TRP 11 Cb 0.03 -1.72 -0.04 0.00 -1.15 0.00 0.00 33.47 30.59 1v9x s TRP 11 CO 0.70 0.53 -0.25 -0.98 0.02 0.00 0.00 176.95 176.98 1v9x s ARG 12 N -1.72 1.45 -0.08 4.98 1.70 -0.64 -0.01 118.95 124.63 1v9x s ARG 12 Ca 0.22 -1.23 -0.01 0.00 -0.47 0.00 0.00 55.73 54.25 1v9x s ARG 12 Cb -0.12 -1.80 0.03 0.00 -0.57 0.00 0.00 34.95 32.49 1v9x s ARG 12 CO 0.13 0.44 -0.02 0.00 -1.08 0.00 0.00 175.30 174.77 1v9x s ALA 13 N -0.99 0.85 -0.08 7.88 0.00 0.23 -2.21 121.76 127.43 1v9x s ALA 13 Ca 0.12 -0.23 -0.30 0.00 0.00 0.00 0.00 51.96 51.55 1v9x s ALA 13 Cb -0.10 -0.79 0.10 0.00 0.00 0.00 0.00 23.12 22.33 1v9x s ALA 13 CO 0.04 -0.45 0.84 -1.83 0.00 0.00 0.00 175.76 174.37 1v9x s GLU 14 N 1.91 0.83 -0.08 0.00 -1.05 -1.25 -4.06 118.70 115.00 1v9x s GLU 14 Ca 0.05 0.11 -0.29 0.00 -0.15 0.00 0.00 54.97 54.68 1v9x s GLU 14 Cb -0.12 0.39 -0.02 0.00 -0.44 0.00 0.00 34.13 33.94 1v9x s GLU 14 CO -0.06 -0.28 0.98 0.71 0.95 0.00 0.00 175.26 177.56 1v9x s TYR 15 N -1.51 3.55 0.68 4.83 1.51 -1.26 -3.72 117.35 121.43 1v9x s TYR 15 Ca -0.04 1.59 -0.17 0.00 -1.01 0.00 0.00 57.07 57.44 1v9x s TYR 15 Cb -0.00 -3.14 -0.02 0.00 -0.11 0.00 0.00 41.96 38.69 1v9x s TYR 15 CO 0.03 -0.15 0.97 0.00 -1.11 0.00 0.00 175.55 175.28 1v9x n ALA 16 N 4.65 -0.05 -0.07 3.71 0.00 -1.02 -4.75 120.51 122.98 1v9x n ALA 16 Ca 0.07 -0.11 -0.07 0.00 0.00 0.00 0.00 53.44 53.34 1v9x n ALA 16 Cb 0.49 -2.12 -0.12 0.00 0.00 0.00 0.00 19.45 17.71 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 -1.53 1.52 -4.01 0.00 5.02 -1.26 -1.08 118.16 116.82 1v9x n LYS 17 Ca 0.13 -0.01 -0.08 0.00 -2.02 0.00 0.00 58.31 56.33 1v9x n LYS 17 Cb 0.49 -1.38 -0.10 0.00 -0.02 0.00 0.00 35.03 34.01 1v9x n LYS 17 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1v9x s SER 18 N -4.77 0.32 -0.18 4.39 0.01 -1.26 -4.70 113.70 107.50 1v9x s SER 18 Ca -0.07 -0.67 0.00 0.00 1.31 0.00 0.00 55.95 56.51 1v9x s SER 18 Cb 0.05 0.15 0.17 0.00 0.21 0.00 0.00 66.02 66.59 1v9x s SER 18 CO 0.61 -0.42 1.74 -1.20 0.41 0.00 0.00 173.24 174.37 1v9x n SER 19 N 1.00 5.00 0.02 2.44 7.64 -1.26 -4.10 113.62 124.36 1v9x n SER 19 Ca -0.20 -2.71 -0.22 0.00 1.01 0.00 0.00 58.87 56.75 1v9x n SER 19 Cb 0.57 -0.90 -0.14 0.00 -1.01 0.00 0.00 64.21 62.73 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 0.93 0.28 -7.04 1.43 2.47 -1.96 -3.43 114.38 107.05 1v9x h ARG 20 Ca 0.19 -0.48 -0.52 0.00 -1.26 0.00 0.00 59.98 57.92 1v9x h ARG 20 Cb 1.18 0.18 0.09 0.00 -1.65 0.00 0.00 29.97 29.77 1v9x h ARG 20 CO 0.44 1.23 0.51 0.45 0.56 0.00 0.00 179.97 183.15 1v9x s SER 21 N -7.10 5.73 -0.05 7.04 0.15 -1.26 -4.91 113.70 113.30 1v9x s SER 21 Ca -0.21 2.42 0.03 0.00 0.70 0.00 0.00 55.95 58.89 1v9x s SER 21 Cb 0.06 -2.61 0.01 0.00 -1.71 0.00 0.00 66.02 61.77 1v9x s SER 21 CO 0.78 -1.23 -0.12 -0.44 1.20 0.00 0.00 173.24 173.43 1v9x s SER 22 N -1.33 1.67 0.93 5.45 0.01 -1.26 -1.52 113.70 117.64 1v9x s SER 22 Ca 0.69 -0.27 -0.11 0.00 1.31 0.00 0.00 55.95 57.56 1v9x s SER 22 Cb -0.31 -0.65 0.10 0.00 0.21 0.00 0.00 66.02 65.36 1v9x s SER 22 CO 0.37 0.06 0.81 0.00 0.41 0.00 0.00 173.24 174.88 1v9x n LYS 24 N -3.06 2.05 -0.12 0.00 4.76 -1.15 -2.97 118.16 117.67 1v9x n LYS 24 Ca 0.10 -0.02 -0.12 0.00 -2.87 0.00 0.00 58.31 55.40 1v9x n LYS 24 Cb 0.53 -1.27 -0.03 0.00 -1.84 0.00 0.00 35.03 32.42 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 1.28 0.00 -0.18 2.02 -1.93 -3.31 112.91 110.80 1v9x h THR 25 Ca -0.25 -1.25 0.00 0.00 0.77 0.00 0.00 66.41 65.68 1v9x h THR 25 Cb 1.52 1.36 0.00 0.00 -1.74 0.00 0.00 68.15 69.29 1v9x h THR 25 CO 0.01 0.41 -0.92 0.00 0.37 0.00 0.00 175.52 175.40 1v9x n LYS 27 N -1.51 -5.33 -3.88 0.00 4.01 -1.16 -5.03 118.16 105.27 1v9x n LYS 27 Ca 0.00 0.57 -0.24 0.00 -0.51 0.00 0.00 58.31 58.13 1v9x n LYS 27 Cb 0.22 -4.83 -0.04 0.00 -0.51 0.00 0.00 35.03 29.88 1v9x n LYS 27 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 1v9x n SER 28 N -1.77 2.88 -4.86 4.39 7.64 -1.23 -4.85 113.62 115.83 1v9x n SER 28 Ca -0.03 -2.69 -0.36 0.00 1.01 0.00 0.00 58.87 56.80 1v9x n SER 28 Cb 0.56 0.18 -0.06 0.00 -1.01 0.00 0.00 64.21 63.88 1v9x n SER 28 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1v9x s VAL 29 N -2.37 5.14 -0.71 0.44 1.01 -1.26 0.14 120.40 122.79 1v9x s VAL 29 Ca 0.09 0.50 -0.06 0.00 0.00 0.00 0.00 61.98 62.51 1v9x s VAL 29 Cb -0.01 -3.63 0.18 0.00 0.00 0.00 0.00 36.38 32.92 1v9x s VAL 29 CO 0.05 0.41 0.57 -0.63 0.00 0.00 0.00 175.10 175.50 1v9x s ILE 30 N -1.27 4.30 0.55 2.22 1.01 -0.58 -4.80 121.20 122.65 1v9x s ILE 30 Ca 0.28 -2.93 -0.20 0.00 0.00 0.00 0.00 60.65 57.80 1v9x s ILE 30 Cb -0.14 -3.74 -0.07 0.00 0.01 0.00 0.00 42.46 38.52 1v9x s ILE 30 CO 0.15 -0.94 0.95 0.59 0.00 0.00 0.00 174.94 175.70 1v9x n ASN 31 N 3.48 0.82 -4.66 3.58 4.13 -1.26 -4.25 115.26 117.11 1v9x n ASN 31 Ca 0.11 0.86 -0.30 0.00 1.68 0.00 0.00 54.58 56.93 1v9x n ASN 31 Cb 0.40 -1.37 0.17 0.00 -1.54 0.00 0.00 39.78 37.44 1v9x n ASN 31 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 1v9x s LYS 32 N -2.52 0.80 -0.86 3.52 -2.85 -1.26 -3.59 119.74 112.99 1v9x s LYS 32 Ca 0.72 1.17 0.00 0.00 -1.00 0.00 0.00 55.97 56.85 1v9x s LYS 32 Cb -0.45 -1.73 0.00 0.00 -2.06 0.00 0.00 37.83 33.59 1v9x s LYS 32 CO 0.50 -2.66 0.00 0.39 0.10 0.00 0.00 175.35 173.69 1v9x n GLU 33 N -4.21 -0.67 -4.32 1.78 1.02 -0.24 -4.91 120.64 109.09 1v9x n GLU 33 Ca 0.08 0.62 -0.24 0.00 -0.02 0.00 0.00 57.16 57.61 1v9x n GLU 33 Cb 0.53 -4.56 -0.12 0.00 -0.02 0.00 0.00 31.44 27.27 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 -2.75 2.73 -0.37 1.62 0.01 -1.24 -4.93 114.94 110.02 1v9x s ASN 34 Ca 0.00 -0.77 -0.24 0.00 -0.71 0.00 0.00 52.86 51.15 1v9x s ASN 34 Cb 0.00 -0.16 0.01 0.00 0.41 0.00 0.00 41.25 41.51 1v9x s ASN 34 CO 0.00 0.04 0.82 0.12 -1.51 0.00 0.00 177.10 176.57 1v9x s PHE 35 N -1.49 3.10 0.41 2.20 5.36 -1.26 -2.44 117.98 123.87 1v9x s PHE 35 Ca 0.11 0.60 0.04 0.00 -0.96 0.00 0.00 56.93 56.73 1v9x s PHE 35 Cb -0.08 -3.46 -0.05 0.00 -0.34 0.00 0.00 43.02 39.09 1v9x s PHE 35 CO 0.06 -0.76 0.05 -0.98 -1.46 0.00 0.00 175.22 172.13 1v9x s ARG 36 N 3.19 1.93 0.02 10.12 1.70 -1.24 -3.19 118.95 131.48 1v9x s ARG 36 Ca 0.33 -2.15 0.05 0.00 -0.47 0.00 0.00 55.73 53.49 1v9x s ARG 36 Cb -0.13 -1.19 -0.02 0.00 -0.57 0.00 0.00 34.95 33.05 1v9x s ARG 36 CO 0.17 -0.26 -0.16 -0.51 -1.08 0.00 0.00 175.30 173.46 1v9x s LEU 37 N -3.67 2.12 -0.24 -1.89 1.43 -0.04 -3.95 118.68 112.44 1v9x s LEU 37 Ca 0.25 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 52.95 1v9x s LEU 37 Cb 0.06 -0.77 0.07 0.00 0.03 0.00 0.00 46.19 45.57 1v9x s LEU 37 CO 0.13 0.13 -0.01 -0.83 0.23 0.00 0.00 176.35 175.99 1v9x s GLY 38 N -0.85 1.19 -0.60 -3.19 0.00 -0.94 -0.55 107.32 102.37 1v9x s GLY 38 Ca 0.05 -1.33 -0.27 0.00 0.00 0.00 0.00 44.72 43.16 1v9x s GLY 38 CO 0.01 1.10 1.16 1.25 0.00 0.00 0.00 173.10 176.62 1v9x s LYS 39 N 1.48 3.43 -0.29 2.90 2.20 -0.82 -1.62 119.74 127.02 1v9x s LYS 39 Ca -0.02 0.07 -0.29 0.00 -0.36 0.00 0.00 55.97 55.37 1v9x s LYS 39 Cb -0.18 -4.05 0.00 0.00 -1.51 0.00 0.00 37.83 32.09 1v9x s LYS 39 CO -0.09 -1.72 1.24 -0.51 -0.36 0.00 0.00 175.35 173.91 1v9x s LEU 40 N 4.89 3.93 -0.16 5.43 1.43 0.19 -2.35 118.68 132.04 1v9x s LEU 40 Ca 0.39 1.22 0.01 0.00 -1.03 0.00 0.00 54.13 54.73 1v9x s LEU 40 Cb -0.09 -3.54 0.01 0.00 0.03 0.00 0.00 46.19 42.60 1v9x s LEU 40 CO 0.23 -0.99 -0.18 0.68 0.23 0.00 0.00 176.35 176.31 1v9x s VAL 41 N 4.09 2.39 0.23 -1.59 -7.23 -1.26 -4.84 120.40 112.19 1v9x s VAL 41 Ca 0.53 -0.86 -0.30 0.00 -1.81 0.00 0.00 61.98 59.55 1v9x s VAL 41 Cb -0.16 -2.00 -0.09 0.00 0.56 0.00 0.00 36.38 34.70 1v9x s VAL 41 CO 0.20 0.53 1.03 -1.10 -0.31 0.00 0.00 175.10 175.45 1v9x s GLN 42 N 0.91 4.72 0.52 4.82 -0.21 -1.26 -4.35 119.66 124.80 1v9x s GLN 42 Ca -0.04 1.64 -0.05 0.00 0.02 0.00 0.00 55.36 56.92 1v9x s GLN 42 Cb -0.15 -3.26 -0.02 0.00 1.00 0.00 0.00 33.01 30.58 1v9x s GLN 42 CO -0.03 0.30 0.82 -1.12 -2.12 0.00 0.00 175.29 173.14 1v9x s SER 43 N -0.74 6.05 -0.32 5.90 0.01 -1.26 -4.96 113.70 118.38 1v9x s SER 43 Ca 0.44 0.85 -0.01 0.00 1.31 0.00 0.00 55.95 58.55 1v9x s SER 43 Cb -0.28 -2.07 0.22 0.00 0.21 0.00 0.00 66.02 64.10 1v9x s SER 43 CO 0.35 -0.73 1.99 1.07 0.41 0.00 0.00 173.24 176.33 1v9x n THR 44 N -2.36 2.75 -3.60 1.44 5.66 -1.26 -3.69 114.28 113.22 1v9x n THR 44 Ca 0.02 -1.63 -0.03 0.00 -3.05 0.00 0.00 64.05 59.36 1v9x n THR 44 Cb 0.56 -1.31 -0.02 0.00 -1.55 0.00 0.00 70.33 68.02 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 -1.83 -0.13 -0.53 1.09 5.65 -1.26 -5.02 115.29 113.27 1v9x s HIS 45 Ca 0.31 0.04 -0.26 0.00 0.25 0.00 0.00 55.06 55.40 1v9x s HIS 45 Cb 0.24 0.53 -0.06 0.00 -1.18 0.00 0.00 32.58 32.12 1v9x s HIS 45 CO -0.00 -0.29 2.25 -0.06 -0.65 0.00 0.00 174.74 175.98 1v9x s PHE 46 N -2.54 1.24 0.12 3.88 0.40 -1.26 -2.96 117.98 116.86 1v9x s PHE 46 Ca 0.10 1.35 -0.25 0.00 -0.60 0.00 0.00 56.93 57.53 1v9x s PHE 46 Cb 0.01 -3.73 0.07 0.00 0.51 0.00 0.00 43.02 39.88 1v9x s PHE 46 CO -0.04 -2.46 0.78 -0.51 0.70 0.00 0.00 175.22 173.68 1v9x s ASP 47 N 11.03 -0.38 0.00 1.36 1.01 -1.26 -4.82 116.67 123.60 1v9x s ASP 47 Ca 0.89 -0.18 0.00 0.00 0.71 0.00 0.00 52.55 53.97 1v9x s ASP 47 Cb -0.16 0.53 0.00 0.00 1.01 0.00 0.00 42.92 44.30 1v9x s ASP 47 CO 0.24 -0.91 0.00 0.61 0.21 0.00 0.00 175.17 175.33 1v9x n GLY 48 N -0.37 -2.94 3.06 0.21 0.00 -1.26 -4.30 105.19 99.60 1v9x n GLY 48 Ca -0.10 -0.97 -0.23 0.00 0.00 0.00 0.00 46.02 44.72 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 1.06 -0.64 -0.61 1.01 -1.26 -4.71 121.20 116.05 1v9x s ILE 49 Ca 0.00 -0.52 -0.10 0.00 0.00 0.00 0.00 60.65 60.03 1v9x s ILE 49 Cb 0.00 -0.92 0.17 0.00 0.01 0.00 0.00 42.46 41.72 1v9x s ILE 49 CO 0.00 0.31 0.53 -0.32 0.00 0.00 0.00 174.94 175.46 1v9x s MET 50 N 0.07 2.92 -0.46 2.79 1.75 -1.26 -5.04 119.30 120.08 1v9x s MET 50 Ca -0.02 -2.21 -0.28 0.00 -1.25 0.00 0.00 55.69 51.93 1v9x s MET 50 Cb -0.09 -4.07 -0.02 0.00 2.84 0.00 0.00 34.83 33.49 1v9x s MET 50 CO 0.01 -1.23 1.77 -1.25 -0.65 0.00 0.00 175.02 173.66 1v9x s PRO 51 N 0.57 3.07 -0.68 4.11 0.04 -1.26 -4.26 135.00 136.60 1v9x s PRO 51 Ca 0.13 1.02 -0.26 0.00 0.04 0.00 0.00 61.00 61.93 1v9x s PRO 51 Cb -0.19 -4.25 -0.06 0.00 0.04 0.00 0.00 34.50 30.04 1v9x s PRO 51 CO -0.04 -2.18 2.08 -1.64 0.04 0.00 0.00 177.00 175.27 1v9x s MET 52 N 6.13 2.34 -0.13 4.56 -1.94 -0.99 -4.80 119.30 124.47 1v9x s MET 52 Ca 0.72 0.55 -0.29 0.00 -1.71 0.00 0.00 55.69 54.95 1v9x s MET 52 Cb -0.17 -4.66 -0.02 0.00 2.01 0.00 0.00 34.83 32.00 1v9x s MET 52 CO 0.28 -3.27 1.20 -1.58 -0.01 0.00 0.00 175.02 171.65 1v9x s TRP 53 N 10.86 3.06 -0.13 -0.03 0.23 -1.26 -1.94 118.94 129.73 1v9x s TRP 53 Ca 0.78 1.16 -0.09 0.00 -2.03 0.00 0.00 56.10 55.93 1v9x s TRP 53 Cb -0.12 -3.43 0.04 0.00 0.03 0.00 0.00 33.47 29.99 1v9x s TRP 53 CO 0.15 -1.35 0.33 -0.80 0.96 0.00 0.00 176.95 176.24 1v9x s ASN 54 N 1.67 -0.38 0.20 2.95 0.01 0.28 -2.95 114.94 116.72 1v9x s ASN 54 Ca 0.54 0.70 -0.31 0.00 -0.71 0.00 0.00 52.86 53.08 1v9x s ASN 54 Cb -0.22 0.63 -0.16 0.00 0.41 0.00 0.00 41.25 41.91 1v9x s ASN 54 CO 0.16 -0.15 0.88 1.41 -1.51 0.00 0.00 177.10 177.89 1v9x n HIS 55 N 3.71 0.59 0.28 2.20 8.25 -1.26 -0.86 115.22 128.12 1v9x n HIS 55 Ca -0.20 0.83 0.18 0.00 -0.26 0.00 0.00 57.72 58.27 1v9x n HIS 55 Cb 0.56 -2.14 0.91 0.00 1.12 0.00 0.00 29.99 30.44 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 2.12 1.46 0.00 -1.41 0.00 -1.82 0.29 119.26 119.90 1v9x h ALA 56 Ca -0.38 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.50 1v9x h ALA 56 Cb 1.39 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.18 1v9x h ALA 56 CO 0.62 -0.27 -1.20 0.45 0.00 0.00 0.00 179.25 178.85 1v9x n SER 57 N -3.28 0.74 0.14 0.00 2.88 -1.26 -2.87 113.62 109.96 1v9x n SER 57 Ca -0.00 0.29 0.01 0.00 -1.33 0.00 0.00 58.87 57.83 1v9x n SER 57 Cb 0.31 0.61 0.11 0.00 -0.75 0.00 0.00 64.21 64.48 1v9x n SER 57 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1v9x n ILE 59 N -3.43 1.50 -0.18 0.00 2.08 -0.96 -4.08 119.36 114.29 1v9x n ILE 59 Ca 0.00 0.03 0.25 0.00 0.56 0.00 0.00 62.75 63.59 1v9x n ILE 59 Cb 0.70 -2.15 0.66 0.00 -0.75 0.00 0.00 39.64 38.09 1v9x n ILE 59 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 1v9x h LEU 60 N -1.00 0.11 -1.45 1.39 3.38 -1.67 0.55 115.31 116.63 1v9x h LEU 60 Ca -0.25 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 1v9x h LEU 60 Cb 1.06 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 1v9x h LEU 60 CO -0.15 0.04 -0.26 0.07 0.09 0.00 0.00 178.44 178.23 1v9x h LYS 61 N 0.11 0.00 0.00 1.13 2.10 -1.69 -3.44 116.57 114.78 1v9x h LYS 61 Ca 0.42 0.00 -0.22 0.00 -2.00 0.00 0.00 60.65 58.85 1v9x h LYS 61 Cb 1.48 0.00 0.08 0.00 -0.90 0.00 0.00 32.23 32.89 1v9x h LYS 61 CO -0.05 0.26 0.19 1.63 -2.00 0.00 0.00 179.45 179.48 1v9x n LYS 62 N -3.82 -0.55 -4.43 0.07 5.02 0.19 -5.11 118.16 109.54 1v9x n LYS 62 Ca -0.01 -1.07 -0.22 0.00 -2.02 0.00 0.00 58.31 54.99 1v9x n LYS 62 Cb 0.35 -0.65 -0.10 0.00 -0.02 0.00 0.00 35.03 34.61 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 -2.34 1.94 -1.28 -0.18 2.01 -1.26 -4.81 115.64 109.72 1v9x s THR 63 Ca 0.37 -2.23 -0.12 0.00 0.31 0.00 0.00 61.69 60.03 1v9x s THR 63 Cb -0.01 -2.32 0.00 0.00 0.01 0.00 0.00 72.50 70.18 1v9x s THR 63 CO 0.26 -0.40 0.59 0.29 -0.69 0.00 0.00 174.62 174.67 1v9x n LYS 64 N -0.56 -2.15 -0.03 4.92 5.02 -1.26 -4.90 118.16 119.20 1v9x n LYS 64 Ca -0.06 0.39 -0.08 0.00 -2.02 0.00 0.00 58.31 56.54 1v9x n LYS 64 Cb 0.62 -4.17 -0.03 0.00 -0.02 0.00 0.00 35.03 31.43 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 -4.38 0.18 -4.37 1.97 1.13 -1.26 -5.06 117.38 105.60 1v9x n GLN 65 Ca -0.20 0.08 -0.29 0.00 -1.94 0.00 0.00 57.00 54.64 1v9x n GLN 65 Cb 0.64 -0.81 -0.12 0.00 0.11 0.00 0.00 30.24 30.06 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 -2.19 2.44 -0.26 5.09 1.01 -1.26 -5.05 121.20 120.98 1v9x s ILE 66 Ca -0.11 -1.70 -0.05 0.00 0.00 0.00 0.00 60.65 58.78 1v9x s ILE 66 Cb 0.04 -2.10 -0.16 0.00 0.01 0.00 0.00 42.46 40.25 1v9x s ILE 66 CO 0.15 0.08 -0.22 2.29 0.00 0.00 0.00 174.94 177.24 1v9x n LYS 67 N 0.83 0.63 -3.53 2.79 2.85 -1.26 -3.43 118.16 117.04 1v9x n LYS 67 Ca -0.17 0.21 -0.15 0.00 -1.05 0.00 0.00 58.31 57.15 1v9x n LYS 67 Cb 0.53 -1.53 -0.05 0.00 -0.65 0.00 0.00 35.03 33.33 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 -0.57 0.55 -5.58 0.15 -1.26 -4.31 113.70 95.77 1v9x s SER 68 Ca -0.35 0.58 0.29 0.00 0.70 0.00 0.00 55.95 57.16 1v9x s SER 68 Cb 0.11 0.47 1.58 0.00 -1.71 0.00 0.00 66.02 66.47 1v9x s SER 68 CO 0.57 -0.55 1.87 -0.37 1.20 0.00 0.00 173.24 175.96 1v9x h VAL 69 N 2.80 0.00 0.00 4.45 -1.51 -1.94 0.24 116.25 120.29 1v9x h VAL 69 Ca -0.25 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.22 1v9x h VAL 69 Cb 1.16 0.64 0.00 0.00 -2.13 0.00 0.00 31.29 30.96 1v9x h VAL 69 CO 0.36 0.00 0.00 -0.78 -1.23 0.00 0.00 177.57 175.92 1v9x h ASP 70 N 0.00 0.00 0.98 4.19 3.58 -2.01 -2.39 116.42 120.76 1v9x h ASP 70 Ca 0.00 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.42 1v9x h ASP 70 Cb 0.40 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.45 1v9x h ASP 70 CO 0.00 0.00 -1.04 -2.24 -2.88 0.00 0.00 179.24 173.08 1v9x h ASP 71 N 0.00 0.00 -3.32 2.28 3.04 -0.90 -3.46 116.42 114.06 1v9x h ASP 71 Ca 0.00 0.00 -0.55 0.00 -3.24 0.00 0.00 57.03 53.24 1v9x h ASP 71 Cb 0.44 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 38.70 1v9x h ASP 71 CO 0.00 0.09 0.49 -0.69 -2.04 0.00 0.00 179.24 177.09 1v9x s VAL 72 N -3.29 4.80 0.55 4.15 1.01 -0.90 -3.25 120.40 123.46 1v9x s VAL 72 Ca -0.01 2.03 -0.02 0.00 0.00 0.00 0.00 61.98 63.98 1v9x s VAL 72 Cb 0.09 -4.30 0.02 0.00 0.00 0.00 0.00 36.38 32.19 1v9x s VAL 72 CO 0.79 0.07 0.81 -0.70 0.00 0.00 0.00 175.10 176.07 1v9x s GLU 73 N 1.58 2.78 0.00 2.72 2.12 0.99 -4.14 118.70 124.76 1v9x s GLU 73 Ca 0.50 -0.38 0.00 0.00 0.36 0.00 0.00 54.97 55.45 1v9x s GLU 73 Cb -0.20 -2.40 0.00 0.00 0.26 0.00 0.00 34.13 31.79 1v9x s GLU 73 CO 0.22 -0.64 0.00 0.41 -0.54 0.00 0.00 175.26 174.72 1v9x n GLY 74 N -2.41 -0.26 0.12 -1.50 0.00 -1.26 -0.60 105.19 99.28 1v9x n GLY 74 Ca 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.04 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 1.50 0.00 -0.61 2.10 -1.72 -2.87 117.51 115.91 1v9x h ILE 75 Ca 0.00 -2.36 0.00 0.00 1.08 0.00 0.00 64.86 63.58 1v9x h ILE 75 Cb 0.53 2.28 0.00 0.00 -1.09 0.00 0.00 36.82 38.53 1v9x h ILE 75 CO 0.00 0.68 0.00 -1.84 -1.08 0.00 0.00 178.15 175.91 1v9x n GLU 76 N -3.72 0.07 0.02 2.19 0.28 -1.26 -1.93 120.64 116.29 1v9x n GLU 76 Ca -0.01 0.29 0.12 0.00 -0.16 0.00 0.00 57.16 57.40 1v9x n GLU 76 Cb 0.68 -1.63 0.18 0.00 1.43 0.00 0.00 31.44 32.09 1v9x n GLU 76 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1v9x n SER 77 N -1.77 0.59 -4.81 -1.84 2.88 -1.08 -4.90 113.62 102.68 1v9x n SER 77 Ca 0.03 -0.15 -0.34 0.00 -1.33 0.00 0.00 58.87 57.09 1v9x n SER 77 Cb 0.21 0.33 -0.07 0.00 -0.75 0.00 0.00 64.21 63.93 1v9x n SER 77 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1v9x s LEU 78 N -3.52 4.04 0.46 2.46 1.43 -0.81 -4.96 118.68 117.77 1v9x s LEU 78 Ca 0.08 1.72 -0.24 0.00 -1.03 0.00 0.00 54.13 54.67 1v9x s LEU 78 Cb 0.16 -4.41 -0.09 0.00 0.03 0.00 0.00 46.19 41.88 1v9x s LEU 78 CO 0.73 -0.29 1.20 0.54 0.23 0.00 0.00 176.35 178.75 1v9x n ARG 79 N -0.35 1.66 -0.34 1.70 1.74 -1.26 -4.48 116.66 115.32 1v9x n ARG 79 Ca 0.06 0.60 -0.02 0.00 -0.77 0.00 0.00 57.85 57.72 1v9x n ARG 79 Cb 0.53 -2.32 0.02 0.00 -1.02 0.00 0.00 32.46 29.67 1v9x n ARG 79 CO 0.00 0.00 0.00 1.87 -1.52 0.00 0.00 177.63 177.98 1v9x n TRP 80 N -0.56 -0.02 -0.30 -1.55 -0.00 -1.26 0.15 117.44 113.90 1v9x n TRP 80 Ca 0.08 1.09 0.08 0.00 -0.00 0.00 0.00 57.50 58.75 1v9x n TRP 80 Cb 0.41 -0.80 0.24 0.00 -0.00 0.00 0.00 31.31 31.16 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 0.60 0.20 5.87 4.11 -2.00 -1.10 114.58 122.26 1v9x h GLU 81 Ca 0.29 -0.04 -0.01 0.00 0.07 0.00 0.00 59.36 59.67 1v9x h GLU 81 Cb 0.51 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1v9x h GLU 81 CO -0.87 0.40 -0.10 -0.44 0.07 0.00 0.00 179.01 178.07 1v9x h ASP 82 N 0.62 -0.23 -0.71 3.06 3.32 0.11 -2.65 116.42 119.93 1v9x h ASP 82 Ca 0.48 -0.15 0.18 0.00 0.02 0.00 0.00 57.03 57.57 1v9x h ASP 82 Cb 0.71 0.06 -0.04 0.00 0.22 0.00 0.00 39.33 40.28 1v9x h ASP 82 CO -0.38 0.02 0.50 1.56 -1.72 0.00 0.00 179.24 179.22 1v9x h GLN 83 N -0.48 0.14 -0.33 3.56 4.20 -0.27 0.77 115.11 122.69 1v9x h GLN 83 Ca -0.03 -0.01 -0.15 0.00 0.06 0.00 0.00 58.65 58.53 1v9x h GLN 83 Cb 0.36 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 1v9x h GLN 83 CO 0.05 0.09 -0.38 1.96 -0.67 0.00 0.00 178.83 179.88 1v9x h GLN 84 N 0.14 0.79 -0.05 1.46 1.08 -0.94 -2.77 115.11 114.82 1v9x h GLN 84 Ca 0.35 -0.40 0.01 0.00 -1.45 0.00 0.00 58.65 57.16 1v9x h GLN 84 Cb 1.17 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 28.60 1v9x h GLN 84 CO -0.05 1.03 0.05 0.87 -0.95 0.00 0.00 178.83 179.78 1v9x h LYS 85 N 0.65 0.00 0.00 1.46 1.57 -0.51 0.20 116.57 119.94 1v9x h LYS 85 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1v9x h LYS 85 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.24 1v9x h LYS 85 CO 0.09 0.00 -0.02 0.82 -0.57 0.00 0.00 179.45 179.77 1v9x h ILE 86 N 0.00 0.00 -0.87 1.86 1.08 -1.39 -3.22 117.51 114.97 1v9x h ILE 86 Ca 0.02 -0.40 0.13 0.00 -0.39 0.00 0.00 64.86 64.22 1v9x h ILE 86 Cb 0.12 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 33.79 1v9x h ILE 86 CO -0.00 0.00 0.48 0.08 -0.69 0.00 0.00 178.15 178.02 1v9x h ARG 87 N -0.40 0.72 0.00 2.37 0.11 -1.46 0.60 114.38 116.32 1v9x h ARG 87 Ca 0.00 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 60.04 1v9x h ARG 87 Cb 0.02 -0.16 0.00 0.00 1.11 0.00 0.00 29.97 30.94 1v9x h ARG 87 CO 0.00 0.47 0.00 1.63 0.10 0.00 0.00 179.97 182.17 1v9x n LYS 88 N -4.79 0.43 -0.06 0.08 4.76 0.69 -1.37 118.16 117.92 1v9x n LYS 88 Ca 0.16 0.03 -0.07 0.00 -2.87 0.00 0.00 58.31 55.56 1v9x n LYS 88 Cb 0.38 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 32.01 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 -1.05 0.00 0.18 2.13 4.19 0.19 -4.14 117.16 118.66 1v9x n TYR 89 Ca 0.11 0.00 0.08 0.00 3.31 0.00 0.00 57.90 61.39 1v9x n TYR 89 Cb 0.06 -0.46 0.11 0.00 0.49 0.00 0.00 39.34 39.55 1v9x n TYR 89 CO 0.00 0.00 0.00 -0.39 0.91 0.00 0.00 176.86 177.38 1v9x h VAL 90 N 0.00 0.41 0.05 2.97 -1.51 -0.72 0.90 116.25 118.35 1v9x h VAL 90 Ca -0.26 -1.56 -0.10 0.00 -1.23 0.00 0.00 66.70 63.55 1v9x h VAL 90 Cb 1.46 2.19 0.00 0.00 -2.13 0.00 0.00 31.29 32.81 1v9x h VAL 90 CO -0.02 0.23 -0.47 -0.33 -1.23 0.00 0.00 177.57 175.75 1v9x h GLU 91 N 0.00 0.10 0.00 5.19 4.39 -1.47 -3.34 114.58 119.46 1v9x h GLU 91 Ca -0.00 -0.17 -0.28 0.00 0.34 0.00 0.00 59.36 59.25 1v9x h GLU 91 Cb 1.17 0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 29.83 1v9x h GLU 91 CO 0.03 1.08 -2.04 0.45 -1.16 0.00 0.00 179.01 177.37 1v9x n SER 92 N -4.41 2.46 0.00 1.42 2.88 -1.25 -4.92 113.62 109.80 1v9x n SER 92 Ca -0.15 -0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.33 1v9x n SER 92 Cb 0.63 -0.32 0.00 0.00 -0.75 0.00 0.00 64.21 63.77 1v9x n SER 92 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v9x n GLY 93 N 2.54 -0.98 3.62 0.46 0.00 0.28 -4.88 105.19 106.24 1v9x n GLY 93 Ca -0.33 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 1v9x n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v9x s ALA 94 N -3.07 3.53 0.00 4.61 0.00 0.43 -4.81 121.76 122.45 1v9x s ALA 94 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 51.96 51.59 1v9x s ALA 94 Cb 0.00 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.77 1v9x s ALA 94 CO 0.00 -1.23 0.00 0.41 0.00 0.00 0.00 175.76 174.94 1v9x n GLY 95 N 4.14 0.76 3.41 0.00 0.00 -1.22 -3.98 105.19 108.29 1v9x n GLY 95 Ca 0.05 0.39 -0.37 0.00 0.00 0.00 0.00 46.02 46.09 1v9x n GLY 95 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1v9x n SER 96 N 0.00 -1.83 -4.60 1.61 2.88 -1.26 -4.75 113.62 105.67 1v9x n SER 96 Ca 0.00 0.58 -0.43 0.00 -1.33 0.00 0.00 58.87 57.70 1v9x n SER 96 Cb 0.00 -1.13 -0.03 0.00 -0.75 0.00 0.00 64.21 62.30 1v9x n SER 96 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1v9x s ASN 97 N -1.35 5.97 -0.13 -3.46 3.84 -1.26 -4.86 114.94 113.70 1v9x s ASN 97 Ca 0.63 1.20 -0.14 0.00 0.21 0.00 0.00 52.86 54.76 1v9x s ASN 97 Cb -0.36 -2.53 -0.26 0.00 -0.55 0.00 0.00 41.25 37.55 1v9x s ASN 97 CO 0.60 -1.66 0.45 0.71 -2.79 0.00 0.00 177.10 174.41 1v9x h THR 98 N 6.74 0.90 -1.37 -5.21 1.35 -2.00 -3.49 112.91 109.82 1v9x h THR 98 Ca -0.32 -2.35 0.12 0.00 -0.55 0.00 0.00 66.41 63.31 1v9x h THR 98 Cb 1.16 2.57 -0.28 0.00 -1.73 0.00 0.00 68.15 69.87 1v9x h THR 98 CO 1.04 0.69 0.65 -0.55 -0.25 0.00 0.00 175.52 177.10 1v9x s SER 99 N -7.01 -0.27 -0.82 5.36 0.15 -1.26 -4.98 113.70 104.87 1v9x s SER 99 Ca -0.22 0.50 -0.00 0.00 0.70 0.00 0.00 55.95 56.92 1v9x s SER 99 Cb 0.05 0.49 0.00 0.00 -1.71 0.00 0.00 66.02 64.85 1v9x s SER 99 CO 0.74 -0.12 0.00 1.07 1.20 0.00 0.00 173.24 176.13 1v9x n THR 100 N 1.72 -0.52 -2.02 6.45 5.66 -1.26 -4.75 114.28 119.55 1v9x n THR 100 Ca -0.11 -0.26 -0.42 0.00 -3.05 0.00 0.00 64.05 60.21 1v9x n THR 100 Cb 0.57 -0.53 -0.03 0.00 -1.55 0.00 0.00 70.33 68.79 1v9x n THR 100 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1v9x s SER 101 N -3.72 6.68 0.89 1.09 0.15 -1.26 -5.00 113.70 112.52 1v9x s SER 101 Ca 0.00 2.41 -0.14 0.00 0.70 0.00 0.00 55.95 58.93 1v9x s SER 101 Cb -0.00 -2.57 0.13 0.00 -1.71 0.00 0.00 66.02 61.87 1v9x s SER 101 CO 0.53 -0.81 1.21 0.42 1.20 0.00 0.00 173.24 175.79 1v9x s THR 102 N 2.11 1.98 0.00 6.45 -4.23 -1.26 -5.01 115.64 115.68 1v9x s THR 102 Ca 0.70 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.21 1v9x s THR 102 Cb -0.38 -2.94 0.00 0.00 1.34 0.00 0.00 72.50 70.52 1v9x s THR 102 CO 0.31 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.00 1v9x n GLY 103 N -3.17 -1.18 3.24 3.99 0.00 -1.26 -5.18 105.19 101.63 1v9x n GLY 103 Ca 0.10 0.32 -0.15 0.00 0.00 0.00 0.00 46.02 46.29 1v9x n GLY 103 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1v9x s THR 104 N 0.00 0.10 0.52 2.61 -4.23 -1.26 -5.13 115.64 108.25 1v9x s THR 104 Ca 0.00 -2.00 -0.19 0.00 -1.18 0.00 0.00 61.69 58.32 1v9x s THR 104 Cb 0.00 -2.52 -0.11 0.00 1.34 0.00 0.00 72.50 71.22 1v9x s THR 104 CO 0.00 0.00 0.38 -0.24 -0.54 0.00 0.00 174.62 174.22 1v9x n SER 105 N -0.59 -1.60 -4.05 3.99 2.88 -1.26 -4.96 113.62 108.03 1v9x n SER 105 Ca 0.03 0.76 -0.32 0.00 -1.33 0.00 0.00 58.87 58.01 1v9x n SER 105 Cb 0.65 -1.09 -0.15 0.00 -0.75 0.00 0.00 64.21 62.88 1v9x n SER 105 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1v9x s THR 106 N -1.73 2.15 0.00 2.46 -4.23 -1.26 -5.08 115.64 107.95 1v9x s THR 106 Ca 0.65 -1.74 -0.32 0.00 -1.18 0.00 0.00 61.69 59.10 1v9x s THR 106 Cb -0.49 -2.33 -0.10 0.00 1.34 0.00 0.00 72.50 70.92 1v9x s THR 106 CO 0.58 -0.13 1.91 -1.54 -0.54 0.00 0.00 174.62 174.89 1v9x n SER 107 N 4.41 3.84 -3.92 3.99 3.41 -1.26 -4.97 113.62 119.12 1v9x n SER 107 Ca -0.11 0.95 -0.17 0.00 -0.26 0.00 0.00 58.87 59.28 1v9x n SER 107 Cb 0.42 -1.46 -0.15 0.00 -0.26 0.00 0.00 64.21 62.75 1v9x n SER 107 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1v9x s SER 108 N 4.00 0.68 0.54 4.04 0.15 -1.26 -5.16 113.70 116.70 1v9x s SER 108 Ca 0.89 -0.10 -0.01 0.00 0.70 0.00 0.00 55.95 57.43 1v9x s SER 108 Cb -0.55 -0.20 0.02 0.00 -1.71 0.00 0.00 66.02 63.58 1v9x s SER 108 CO 0.45 0.01 0.79 -0.55 1.20 0.00 0.00 173.24 175.14 1v9x s SER 109 N 0.34 5.51 0.00 5.45 0.15 -1.26 -4.96 113.70 118.93 1v9x s SER 109 Ca -0.04 0.31 0.00 0.00 0.70 0.00 0.00 55.95 56.92 1v9x s SER 109 Cb -0.07 -1.33 0.00 0.00 -1.71 0.00 0.00 66.02 62.90 1v9x s SER 109 CO -0.00 -1.01 0.00 0.61 1.20 0.00 0.00 173.24 174.04 1v9x n GLY 110 N -2.36 0.03 0.00 9.45 0.00 -1.26 -5.00 105.19 106.05 1v9x n GLY 110 Ca 0.05 0.25 0.07 0.00 0.00 0.00 0.00 46.02 46.38 1v9x n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1v9x n PRO 111 N 0.00 0.49 -3.60 1.61 -0.04 -1.26 -4.72 135.00 127.48 1v9x n PRO 111 Ca 0.00 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.08 1v9x n PRO 111 Cb 0.00 -1.45 -0.06 0.00 -0.04 0.00 0.00 33.50 31.95 1v9x n PRO 111 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1v9x s SER 112 N -1.95 6.70 0.11 3.54 1.04 -1.26 -5.09 113.70 116.78 1v9x s SER 112 Ca 0.21 0.83 0.02 0.00 0.48 0.00 0.00 55.95 57.49 1v9x s SER 112 Cb 0.10 -2.20 -0.04 0.00 0.10 0.00 0.00 66.02 63.97 1v9x s SER 112 CO 0.16 0.34 -0.05 -0.94 0.98 0.00 0.00 173.24 173.73 1v9x s SER 113 N -1.11 1.12 0.00 7.02 1.04 -1.26 -5.18 113.70 115.33 1v9x s SER 113 Ca 0.22 -1.04 0.00 0.00 0.48 0.00 0.00 55.95 55.61 1v9x s SER 113 Cb -0.15 0.11 0.00 0.00 0.10 0.00 0.00 66.02 66.07 1v9x s SER 113 CO 0.11 -0.49 0.00 0.61 0.98 0.00 0.00 173.24 174.45