#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 -2.14 -4.15 1.61 3.41 -1.26 0.44 113.62 111.53 1v9x n SER 2 Ca 0.00 -1.12 -0.34 0.00 -0.26 0.00 0.00 58.87 57.15 1v9x n SER 2 Cb 0.00 -2.27 -0.02 0.00 -0.26 0.00 0.00 64.21 61.65 1v9x n SER 2 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1v9x n SER 3 N -2.64 -2.76 -4.90 4.04 7.64 -1.26 -4.93 113.62 108.82 1v9x n SER 3 Ca 0.02 -1.00 -0.28 0.00 1.01 0.00 0.00 58.87 58.62 1v9x n SER 3 Cb 0.51 -2.87 0.02 0.00 -1.01 0.00 0.00 64.21 60.87 1v9x n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1v9x s GLY 4 N -3.52 1.59 -0.46 0.23 0.00 0.17 -5.05 107.32 100.28 1v9x s GLY 4 Ca 0.58 -0.51 -0.10 0.00 0.00 0.00 0.00 44.72 44.69 1v9x s GLY 4 CO 0.92 -0.24 0.33 -0.56 0.00 0.00 0.00 173.10 173.54 1v9x s SER 5 N -4.25 5.74 0.18 1.64 0.01 -1.26 -4.83 113.70 110.93 1v9x s SER 5 Ca 0.53 -1.72 -0.23 0.00 1.31 0.00 0.00 55.95 55.84 1v9x s SER 5 Cb -0.11 -2.03 0.06 0.00 0.21 0.00 0.00 66.02 64.16 1v9x s SER 5 CO 0.47 -0.65 0.64 -0.55 0.41 0.00 0.00 173.24 173.57 1v9x s SER 6 N 2.54 -0.49 -0.92 2.44 0.15 -1.26 -5.08 113.70 111.09 1v9x s SER 6 Ca 0.04 -0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.55 1v9x s SER 6 Cb -0.25 0.62 0.32 0.00 -1.71 0.00 0.00 66.02 65.00 1v9x s SER 6 CO 0.01 -1.04 1.58 0.61 1.20 0.00 0.00 173.24 175.60 1v9x n GLY 7 N -0.39 5.96 3.58 9.45 0.00 -1.26 -5.04 105.19 117.49 1v9x n GLY 7 Ca -0.14 -2.64 -0.48 0.00 0.00 0.00 0.00 46.02 42.76 1v9x n GLY 7 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1v9x n HIS 8 N -0.04 1.25 -2.07 1.61 -0.00 -1.26 -4.88 115.22 109.84 1v9x n HIS 8 Ca 0.42 0.69 -0.39 0.00 -0.00 0.00 0.00 57.72 58.44 1v9x n HIS 8 Cb 0.30 -2.27 -0.00 0.00 -0.00 0.00 0.00 29.99 28.02 1v9x n HIS 8 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.34 176.49 1v9x s LYS 9 N -0.54 3.94 0.23 -0.41 1.02 -1.26 -4.94 119.74 117.78 1v9x s LYS 9 Ca 0.71 2.12 -0.00 0.00 0.02 0.00 0.00 55.97 58.82 1v9x s LYS 9 Cb -0.84 -2.72 0.24 0.00 -0.52 0.00 0.00 37.83 33.99 1v9x s LYS 9 CO 0.53 -0.51 1.60 -1.00 -0.92 0.00 0.00 175.35 175.05 1v9x h PRO 10 N 2.62 0.50 -6.69 -1.68 0.13 -1.86 -3.44 132.00 121.57 1v9x h PRO 10 Ca -0.50 -0.26 -0.67 0.00 -0.87 0.00 0.00 66.00 63.71 1v9x h PRO 10 Cb 1.25 0.01 -0.19 0.00 0.13 0.00 0.00 31.00 32.20 1v9x h PRO 10 CO 0.62 0.84 -0.82 -1.58 -0.23 0.00 0.00 178.00 176.83 1v9x s TRP 11 N -4.17 2.40 0.13 1.56 0.52 -1.18 -0.51 118.94 117.69 1v9x s TRP 11 Ca -0.07 -0.32 0.07 0.00 0.02 0.00 0.00 56.10 55.80 1v9x s TRP 11 Cb 0.12 -1.24 -0.04 0.00 -1.15 0.00 0.00 33.47 31.17 1v9x s TRP 11 CO 0.82 0.43 -0.16 -0.98 0.02 0.00 0.00 176.95 177.08 1v9x s ARG 12 N -2.41 1.09 -0.06 4.98 1.70 -0.84 -0.70 118.95 122.71 1v9x s ARG 12 Ca 0.19 -1.25 0.00 0.00 -0.47 0.00 0.00 55.73 54.20 1v9x s ARG 12 Cb -0.09 -1.07 0.02 0.00 -0.57 0.00 0.00 34.95 33.24 1v9x s ARG 12 CO 0.10 0.22 -0.03 0.00 -1.08 0.00 0.00 175.30 174.50 1v9x s ALA 13 N -1.93 0.79 -0.24 7.88 0.00 0.47 -2.94 121.76 125.79 1v9x s ALA 13 Ca 0.10 -0.16 -0.28 0.00 0.00 0.00 0.00 51.96 51.62 1v9x s ALA 13 Cb -0.06 -0.61 0.16 0.00 0.00 0.00 0.00 23.12 22.61 1v9x s ALA 13 CO 0.04 -0.22 1.19 -1.83 0.00 0.00 0.00 175.76 174.94 1v9x s GLU 14 N 1.39 0.32 -0.09 0.00 -1.05 -1.26 -4.22 118.70 113.79 1v9x s GLU 14 Ca -0.03 0.15 -0.30 0.00 -0.15 0.00 0.00 54.97 54.64 1v9x s GLU 14 Cb -0.13 0.15 -0.02 0.00 -0.44 0.00 0.00 34.13 33.69 1v9x s GLU 14 CO -0.03 -0.09 1.10 0.71 0.95 0.00 0.00 175.26 177.91 1v9x s TYR 15 N -0.72 3.35 0.34 4.83 2.02 -1.26 -3.80 117.35 122.11 1v9x s TYR 15 Ca 0.04 1.40 -0.28 0.00 -0.37 0.00 0.00 57.07 57.86 1v9x s TYR 15 Cb -0.02 -3.30 -0.12 0.00 -0.40 0.00 0.00 41.96 38.12 1v9x s TYR 15 CO -0.05 -0.76 1.39 0.00 -1.57 0.00 0.00 175.55 174.55 1v9x n ALA 16 N 5.16 1.73 -1.39 3.71 0.00 -1.08 -4.73 120.51 123.89 1v9x n ALA 16 Ca 0.10 0.36 -0.19 0.00 0.00 0.00 0.00 53.44 53.71 1v9x n ALA 16 Cb 0.47 -2.33 0.16 0.00 0.00 0.00 0.00 19.45 17.75 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 0.81 2.29 -3.70 0.00 5.02 -1.26 -0.11 118.16 121.20 1v9x n LYS 17 Ca 0.05 -3.22 0.02 0.00 -2.02 0.00 0.00 58.31 53.13 1v9x n LYS 17 Cb 0.36 -2.08 0.01 0.00 -0.02 0.00 0.00 35.03 33.31 1v9x n LYS 17 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1v9x n SER 18 N -1.07 -1.14 -0.56 4.39 2.88 -1.26 -4.95 113.62 111.91 1v9x n SER 18 Ca 0.50 -1.32 0.06 0.00 -1.33 0.00 0.00 58.87 56.77 1v9x n SER 18 Cb 1.22 1.79 0.10 0.00 -0.75 0.00 0.00 64.21 66.57 1v9x n SER 18 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1v9x n SER 19 N -1.01 1.41 0.02 -3.46 7.64 -1.26 -0.02 113.62 116.93 1v9x n SER 19 Ca 0.03 -2.86 -0.21 0.00 1.01 0.00 0.00 58.87 56.84 1v9x n SER 19 Cb 0.51 -0.38 -0.14 0.00 -1.01 0.00 0.00 64.21 63.19 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 0.44 0.26 -7.06 1.43 3.08 -1.97 -3.43 114.38 107.13 1v9x h ARG 20 Ca -0.04 -0.44 -0.54 0.00 0.07 0.00 0.00 59.98 59.03 1v9x h ARG 20 Cb 1.25 0.16 0.12 0.00 0.08 0.00 0.00 29.97 31.59 1v9x h ARG 20 CO 0.02 1.21 0.54 -1.54 -1.07 0.00 0.00 179.97 179.13 1v9x s SER 21 N -7.04 5.36 -0.03 7.04 1.04 -1.26 -4.88 113.70 113.92 1v9x s SER 21 Ca -0.19 2.58 0.02 0.00 0.48 0.00 0.00 55.95 58.84 1v9x s SER 21 Cb 0.04 -2.62 0.01 0.00 0.10 0.00 0.00 66.02 63.55 1v9x s SER 21 CO 0.78 -1.49 -0.07 -0.44 0.98 0.00 0.00 173.24 172.99 1v9x s SER 22 N -1.22 1.10 0.94 7.02 0.01 -1.26 -1.17 113.70 119.13 1v9x s SER 22 Ca 0.72 -0.17 -0.12 0.00 1.31 0.00 0.00 55.95 57.70 1v9x s SER 22 Cb -0.36 -0.40 0.06 0.00 0.21 0.00 0.00 66.02 65.53 1v9x s SER 22 CO 0.41 0.02 0.58 0.00 0.41 0.00 0.00 173.24 174.65 1v9x n LYS 24 N -2.30 1.65 -0.20 0.00 4.76 -1.20 -2.84 118.16 118.01 1v9x n LYS 24 Ca 0.08 0.02 -0.09 0.00 -2.87 0.00 0.00 58.31 55.45 1v9x n LYS 24 Cb 0.53 -1.30 0.02 0.00 -1.84 0.00 0.00 35.03 32.44 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 1.26 0.00 -0.18 2.02 -1.93 -3.27 112.91 110.81 1v9x h THR 25 Ca -0.32 -1.04 0.00 0.00 0.77 0.00 0.00 66.41 65.82 1v9x h THR 25 Cb 1.67 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 68.88 1v9x h THR 25 CO -0.00 0.38 -1.25 0.00 0.37 0.00 0.00 175.52 175.02 1v9x n LYS 27 N -1.73 -4.76 -4.65 0.00 4.01 -1.13 -5.04 118.16 104.86 1v9x n LYS 27 Ca -0.01 0.55 -0.29 0.00 -0.51 0.00 0.00 58.31 58.05 1v9x n LYS 27 Cb 0.28 -4.71 -0.09 0.00 -0.51 0.00 0.00 35.03 29.99 1v9x n LYS 27 CO 0.00 0.00 0.00 -1.12 -1.11 0.00 0.00 177.40 175.17 1v9x s SER 28 N -3.57 3.73 0.10 4.39 0.01 -1.21 -4.86 113.70 112.28 1v9x s SER 28 Ca 0.18 -1.52 -0.23 0.00 1.31 0.00 0.00 55.95 55.69 1v9x s SER 28 Cb -0.08 0.12 -0.07 0.00 0.21 0.00 0.00 66.02 66.20 1v9x s SER 28 CO 0.48 -0.69 0.68 -0.69 0.41 0.00 0.00 173.24 173.43 1v9x s VAL 29 N -2.89 4.60 -0.81 3.43 1.01 -1.26 0.18 120.40 124.67 1v9x s VAL 29 Ca 0.21 1.47 -0.11 0.00 0.00 0.00 0.00 61.98 63.55 1v9x s VAL 29 Cb 0.06 -4.03 0.21 0.00 0.00 0.00 0.00 36.38 32.62 1v9x s VAL 29 CO 0.11 0.50 0.72 -0.63 0.00 0.00 0.00 175.10 175.81 1v9x s ILE 30 N -0.89 5.25 0.38 2.22 1.01 -0.32 -4.80 121.20 124.06 1v9x s ILE 30 Ca 0.33 -2.65 -0.26 0.00 0.00 0.00 0.00 60.65 58.07 1v9x s ILE 30 Cb -0.21 -4.26 -0.11 0.00 0.01 0.00 0.00 42.46 37.89 1v9x s ILE 30 CO 0.22 -1.01 1.23 0.59 0.00 0.00 0.00 174.94 175.97 1v9x n ASN 31 N 3.77 2.40 -4.63 3.58 4.13 -1.26 -4.25 115.26 119.00 1v9x n ASN 31 Ca 0.13 1.14 -0.32 0.00 1.68 0.00 0.00 54.58 57.22 1v9x n ASN 31 Cb 0.45 -1.46 0.15 0.00 -1.54 0.00 0.00 39.78 37.38 1v9x n ASN 31 CO 0.00 0.00 0.00 2.29 0.28 0.00 0.00 177.26 179.83 1v9x n LYS 32 N 0.28 -0.32 -1.89 3.52 2.85 0.97 -3.49 118.16 120.09 1v9x n LYS 32 Ca 0.06 -0.03 -0.05 0.00 -1.05 0.00 0.00 58.31 57.24 1v9x n LYS 32 Cb 0.38 -2.29 -0.01 0.00 -0.65 0.00 0.00 35.03 32.46 1v9x n LYS 32 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1v9x n GLU 33 N -3.61 -0.41 -4.61 -1.58 1.02 0.84 -4.91 120.64 107.38 1v9x n GLU 33 Ca 0.11 0.35 -0.24 0.00 -0.02 0.00 0.00 57.16 57.36 1v9x n GLU 33 Cb 0.52 -4.13 -0.14 0.00 -0.02 0.00 0.00 31.44 27.67 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 2.28 -0.50 1.62 0.01 -1.23 -4.94 114.94 109.38 1v9x s ASN 34 Ca 0.00 -0.49 -0.29 0.00 -0.71 0.00 0.00 52.86 51.37 1v9x s ASN 34 Cb 0.00 -0.19 0.03 0.00 0.41 0.00 0.00 41.25 41.50 1v9x s ASN 34 CO 0.00 0.14 1.16 0.12 -1.51 0.00 0.00 177.10 177.01 1v9x s PHE 35 N -0.77 2.76 0.34 2.20 5.36 -1.26 -2.64 117.98 123.97 1v9x s PHE 35 Ca 0.06 0.65 0.00 0.00 -0.96 0.00 0.00 56.93 56.69 1v9x s PHE 35 Cb -0.08 -4.46 0.00 0.00 -0.34 0.00 0.00 43.02 38.14 1v9x s PHE 35 CO 0.01 -1.35 0.03 2.89 -1.46 0.00 0.00 175.22 175.34 1v9x n ARG 36 N 7.98 1.16 -3.81 10.12 1.85 -1.25 -2.68 116.66 130.02 1v9x n ARG 36 Ca 0.11 -2.44 -0.13 0.00 -1.00 0.00 0.00 57.85 54.40 1v9x n ARG 36 Cb 0.49 0.61 -0.14 0.00 -1.05 0.00 0.00 32.46 32.37 1v9x n ARG 36 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1v9x s LEU 37 N 0.00 1.40 -0.15 2.89 1.43 -0.36 -4.10 118.68 119.80 1v9x s LEU 37 Ca 0.02 0.20 0.02 0.00 -1.03 0.00 0.00 54.13 53.34 1v9x s LEU 37 Cb -0.00 0.30 0.02 0.00 0.03 0.00 0.00 46.19 46.53 1v9x s LEU 37 CO 0.02 -0.06 -0.19 -0.83 0.23 0.00 0.00 176.35 175.51 1v9x s GLY 38 N 0.37 1.29 -0.69 -3.19 0.00 -1.15 -0.85 107.32 103.09 1v9x s GLY 38 Ca -0.03 -1.05 -0.25 0.00 0.00 0.00 0.00 44.72 43.40 1v9x s GLY 38 CO -0.01 0.17 1.13 1.25 0.00 0.00 0.00 173.10 175.64 1v9x s LYS 39 N 1.06 3.18 -0.42 2.90 2.20 -1.07 -1.98 119.74 125.60 1v9x s LYS 39 Ca -0.02 -0.47 -0.28 0.00 -0.36 0.00 0.00 55.97 54.85 1v9x s LYS 39 Cb -0.14 -4.19 -0.02 0.00 -1.51 0.00 0.00 37.83 31.97 1v9x s LYS 39 CO -0.06 -1.96 1.83 -0.51 -0.36 0.00 0.00 175.35 174.29 1v9x s LEU 40 N 4.94 3.44 -0.31 5.43 1.43 0.33 -2.99 118.68 130.96 1v9x s LEU 40 Ca 0.30 0.99 -0.07 0.00 -1.03 0.00 0.00 54.13 54.32 1v9x s LEU 40 Cb -0.12 -3.17 0.02 0.00 0.03 0.00 0.00 46.19 42.95 1v9x s LEU 40 CO 0.14 -1.95 0.09 0.68 0.23 0.00 0.00 176.35 175.53 1v9x s VAL 41 N 7.74 3.93 -0.70 -1.59 -7.23 -1.26 -4.78 120.40 116.51 1v9x s VAL 41 Ca 0.76 -0.81 -0.22 0.00 -1.81 0.00 0.00 61.98 59.91 1v9x s VAL 41 Cb -0.19 -3.08 0.08 0.00 0.56 0.00 0.00 36.38 33.76 1v9x s VAL 41 CO 0.29 0.01 0.97 -1.10 -0.31 0.00 0.00 175.10 174.96 1v9x s GLN 42 N 1.48 3.18 0.46 4.82 -0.21 -1.26 -3.79 119.66 124.33 1v9x s GLN 42 Ca 0.02 -1.02 -0.22 0.00 0.02 0.00 0.00 55.36 54.15 1v9x s GLN 42 Cb -0.18 -4.34 -0.08 0.00 1.00 0.00 0.00 33.01 29.41 1v9x s GLN 42 CO 0.03 -1.79 1.11 -1.12 -2.12 0.00 0.00 175.29 171.40 1v9x s SER 43 N 3.69 6.30 0.28 5.90 0.01 -1.26 -4.92 113.70 123.69 1v9x s SER 43 Ca 0.23 2.17 0.02 0.00 1.31 0.00 0.00 55.95 59.67 1v9x s SER 43 Cb -0.16 -2.59 0.68 0.00 0.21 0.00 0.00 66.02 64.16 1v9x s SER 43 CO 0.07 -0.82 1.67 0.00 0.41 0.00 0.00 173.24 174.57 1v9x h THR 44 N 1.85 0.39 -4.35 1.44 1.03 -1.98 -3.41 112.91 107.87 1v9x h THR 44 Ca -0.49 -0.09 -0.47 0.00 -0.01 0.00 0.00 66.41 65.35 1v9x h THR 44 Cb 1.24 0.09 0.12 0.00 -1.07 0.00 0.00 68.15 68.53 1v9x h THR 44 CO 0.60 0.05 0.34 -1.00 -0.01 0.00 0.00 175.52 175.50 1v9x s HIS 45 N -5.94 2.71 -0.19 0.00 3.76 -1.26 -4.92 115.29 109.45 1v9x s HIS 45 Ca -0.12 0.88 -0.00 0.00 -0.15 0.00 0.00 55.06 55.66 1v9x s HIS 45 Cb 0.25 -3.37 0.14 0.00 1.11 0.00 0.00 32.58 30.71 1v9x s HIS 45 CO 0.77 -2.08 1.94 1.19 -0.85 0.00 0.00 174.74 175.71 1v9x n PHE 46 N -3.57 0.93 -0.78 1.40 3.72 -1.26 -4.63 117.46 113.27 1v9x n PHE 46 Ca 0.07 -1.52 -0.07 0.00 -0.05 0.00 0.00 57.45 55.87 1v9x n PHE 46 Cb 0.59 -0.75 -0.10 0.00 -0.94 0.00 0.00 39.48 38.28 1v9x n PHE 46 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1v9x n ASP 47 N 0.72 5.08 0.00 4.37 5.75 -1.26 -4.95 116.55 126.27 1v9x n ASP 47 Ca 0.18 -2.41 0.00 0.00 -0.01 0.00 0.00 54.79 52.55 1v9x n ASP 47 Cb 0.57 -1.26 0.00 0.00 -1.03 0.00 0.00 41.12 39.40 1v9x n ASP 47 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1v9x n GLY 48 N 2.14 1.81 3.15 6.12 0.00 -1.26 -4.63 105.19 112.53 1v9x n GLY 48 Ca 0.26 -0.40 -0.27 0.00 0.00 0.00 0.00 46.02 45.62 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 1.49 -0.93 -0.61 -1.09 -1.26 -4.61 121.20 114.20 1v9x s ILE 49 Ca 0.00 -0.76 -0.04 0.00 -2.23 0.00 0.00 60.65 57.62 1v9x s ILE 49 Cb 0.00 -1.28 0.23 0.00 -1.58 0.00 0.00 42.46 39.83 1v9x s ILE 49 CO 0.00 0.43 0.84 -0.04 -1.23 0.00 0.00 174.94 174.94 1v9x s MET 50 N -0.03 3.49 -0.66 2.79 -1.94 -1.25 -4.91 119.30 116.79 1v9x s MET 50 Ca -0.03 -3.16 -0.26 0.00 -1.71 0.00 0.00 55.69 50.53 1v9x s MET 50 Cb -0.11 -4.12 -0.03 0.00 2.01 0.00 0.00 34.83 32.58 1v9x s MET 50 CO 0.02 -1.25 1.88 -1.25 -0.01 0.00 0.00 175.02 174.41 1v9x s PRO 51 N -1.15 2.61 -0.68 2.03 0.04 -1.26 -4.00 135.00 132.59 1v9x s PRO 51 Ca 0.27 0.47 -0.26 0.00 0.04 0.00 0.00 61.00 61.53 1v9x s PRO 51 Cb -0.09 -4.50 -0.06 0.00 0.04 0.00 0.00 34.50 29.89 1v9x s PRO 51 CO -0.10 -2.84 2.13 -1.64 0.04 0.00 0.00 177.00 174.58 1v9x s MET 52 N 7.05 2.28 -0.11 4.56 -1.94 -1.16 -4.71 119.30 125.28 1v9x s MET 52 Ca 0.68 0.60 -0.29 0.00 -1.71 0.00 0.00 55.69 54.96 1v9x s MET 52 Cb -0.12 -4.66 -0.04 0.00 2.01 0.00 0.00 34.83 32.02 1v9x s MET 52 CO 0.17 -3.34 1.47 -1.58 -0.01 0.00 0.00 175.02 171.74 1v9x s TRP 53 N 11.18 2.37 -0.09 -0.03 0.23 -1.26 -2.59 118.94 128.75 1v9x s TRP 53 Ca 0.80 0.57 -0.05 0.00 -2.03 0.00 0.00 56.10 55.39 1v9x s TRP 53 Cb -0.12 -3.73 0.04 0.00 0.03 0.00 0.00 33.47 29.69 1v9x s TRP 53 CO 0.15 -2.86 0.21 -0.80 0.96 0.00 0.00 176.95 174.61 1v9x s ASN 54 N 2.73 -0.21 0.08 2.95 0.01 -0.03 -3.28 114.94 117.20 1v9x s ASN 54 Ca 0.65 0.45 -0.36 0.00 -0.71 0.00 0.00 52.86 52.88 1v9x s ASN 54 Cb -0.28 0.34 -0.18 0.00 0.41 0.00 0.00 41.25 41.55 1v9x s ASN 54 CO 0.23 -0.15 1.14 1.41 -1.51 0.00 0.00 177.10 178.22 1v9x n HIS 55 N 4.09 0.99 0.29 2.20 8.25 -1.26 -1.22 115.22 128.56 1v9x n HIS 55 Ca -0.24 0.83 0.14 0.00 -0.26 0.00 0.00 57.72 58.18 1v9x n HIS 55 Cb 0.53 -2.20 0.67 0.00 1.12 0.00 0.00 29.99 30.11 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 3.46 1.57 0.00 -1.41 0.00 -1.76 0.86 119.26 121.98 1v9x h ALA 56 Ca -0.46 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.32 1v9x h ALA 56 Cb 1.38 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 1v9x h ALA 56 CO 0.70 -0.51 -1.50 0.45 0.00 0.00 0.00 179.25 178.39 1v9x n SER 57 N -2.93 0.66 0.18 0.00 2.88 -1.26 -2.96 113.62 110.18 1v9x n SER 57 Ca 0.00 0.28 0.06 0.00 -1.33 0.00 0.00 58.87 57.88 1v9x n SER 57 Cb 0.54 0.55 0.22 0.00 -0.75 0.00 0.00 64.21 64.77 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 -3.31 1.49 -0.26 0.00 2.08 -0.84 -4.07 119.36 114.46 1v9x n ILE 59 Ca 0.01 0.03 0.25 0.00 0.56 0.00 0.00 62.75 63.60 1v9x n ILE 59 Cb 0.59 -2.16 0.61 0.00 -0.75 0.00 0.00 39.64 37.93 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 0.24 -1.33 1.39 3.38 -1.66 0.54 115.31 116.87 1v9x h LEU 60 Ca -0.25 0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.69 1v9x h LEU 60 Cb 1.06 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1v9x h LEU 60 CO -0.15 0.07 -0.20 0.07 0.09 0.00 0.00 178.44 178.32 1v9x h LYS 61 N 0.23 0.20 0.00 1.13 5.09 -1.70 -3.16 116.57 118.36 1v9x h LYS 61 Ca 0.51 -0.06 -0.21 0.00 0.09 0.00 0.00 60.65 60.98 1v9x h LYS 61 Cb 1.58 -0.02 0.09 0.00 0.10 0.00 0.00 32.23 33.98 1v9x h LYS 61 CO -0.14 0.40 0.15 1.63 -2.09 0.00 0.00 179.45 179.41 1v9x n LYS 62 N -4.22 -1.18 -4.38 0.07 5.02 0.19 -2.39 118.16 111.27 1v9x n LYS 62 Ca -0.01 -0.96 -0.19 0.00 -2.02 0.00 0.00 58.31 55.13 1v9x n LYS 62 Cb 0.31 -0.73 -0.10 0.00 -0.02 0.00 0.00 35.03 34.49 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 -2.27 1.49 -1.38 -0.18 2.01 -1.26 -3.20 115.64 110.85 1v9x s THR 63 Ca 0.37 -2.12 -0.00 0.00 0.31 0.00 0.00 61.69 60.25 1v9x s THR 63 Cb -0.02 -2.31 0.00 0.00 0.01 0.00 0.00 72.50 70.19 1v9x s THR 63 CO 0.26 -0.39 0.49 0.29 -0.69 0.00 0.00 174.62 174.59 1v9x n LYS 64 N -0.48 -3.74 -0.04 4.92 5.02 -1.26 -4.89 118.16 117.68 1v9x n LYS 64 Ca -0.06 0.46 -0.10 0.00 -2.02 0.00 0.00 58.31 56.60 1v9x n LYS 64 Cb 0.63 -4.71 -0.03 0.00 -0.02 0.00 0.00 35.03 30.89 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 -4.37 0.26 -4.74 1.97 1.13 -1.26 -5.05 117.38 105.32 1v9x n GLN 65 Ca -0.31 0.11 -0.28 0.00 -1.94 0.00 0.00 57.00 54.58 1v9x n GLN 65 Cb 0.68 -0.94 -0.14 0.00 0.11 0.00 0.00 30.24 29.95 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 -2.31 1.97 -0.18 5.09 1.01 -1.26 -5.03 121.20 120.48 1v9x s ILE 66 Ca -0.16 -1.37 -0.12 0.00 0.00 0.00 0.00 60.65 59.00 1v9x s ILE 66 Cb 0.05 -1.70 -0.21 0.00 0.01 0.00 0.00 42.46 40.60 1v9x s ILE 66 CO 0.21 0.27 0.18 1.17 0.00 0.00 0.00 174.94 176.77 1v9x n LYS 67 N 1.69 0.66 -3.49 2.79 4.81 -1.26 -4.77 118.16 118.58 1v9x n LYS 67 Ca -0.17 0.37 -0.13 0.00 -0.87 0.00 0.00 58.31 57.51 1v9x n LYS 67 Cb 0.53 -1.68 -0.04 0.00 0.02 0.00 0.00 35.03 33.85 1v9x n LYS 67 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1v9x s SER 68 N -6.97 -0.54 0.59 3.14 0.15 -1.26 -4.71 113.70 104.09 1v9x s SER 68 Ca -0.28 0.32 0.29 0.00 0.70 0.00 0.00 55.95 56.97 1v9x s SER 68 Cb 0.07 0.50 1.52 0.00 -1.71 0.00 0.00 66.02 66.41 1v9x s SER 68 CO 0.66 -0.70 1.95 -0.37 1.20 0.00 0.00 173.24 175.98 1v9x h VAL 69 N 2.44 0.40 0.00 4.45 -1.51 -1.94 0.22 116.25 120.31 1v9x h VAL 69 Ca -0.27 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.18 1v9x h VAL 69 Cb 1.22 0.68 -0.00 0.00 -2.13 0.00 0.00 31.29 31.05 1v9x h VAL 69 CO 0.36 0.00 -0.09 -0.78 -1.23 0.00 0.00 177.57 175.83 1v9x h ASP 70 N 0.00 0.00 1.86 4.19 1.82 -2.01 -0.77 116.42 121.50 1v9x h ASP 70 Ca 0.18 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.82 1v9x h ASP 70 Cb 1.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.01 1v9x h ASP 70 CO -0.00 0.09 0.00 0.44 -1.61 0.00 0.00 179.24 178.16 1v9x h ASP 71 N 0.00 0.00 -3.36 2.28 3.32 -0.95 -3.44 116.42 114.28 1v9x h ASP 71 Ca -0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 1v9x h ASP 71 Cb 0.17 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.65 1v9x h ASP 71 CO 0.01 0.00 0.18 -0.69 -1.72 0.00 0.00 179.24 177.02 1v9x s VAL 72 N -3.23 5.00 0.23 -1.35 1.01 -0.30 -3.10 120.40 118.65 1v9x s VAL 72 Ca 0.07 1.43 -0.05 0.00 0.00 0.00 0.00 61.98 63.43 1v9x s VAL 72 Cb 0.06 -4.04 -0.05 0.00 0.00 0.00 0.00 36.38 32.34 1v9x s VAL 72 CO 0.65 0.16 0.48 -0.70 0.00 0.00 0.00 175.10 175.69 1v9x s GLU 73 N 1.43 3.64 -0.17 2.72 2.12 0.12 -4.09 118.70 124.46 1v9x s GLU 73 Ca 0.36 -0.03 0.00 0.00 0.36 0.00 0.00 54.97 55.65 1v9x s GLU 73 Cb -0.17 -2.73 0.00 0.00 0.26 0.00 0.00 34.13 31.49 1v9x s GLU 73 CO 0.15 0.33 0.00 0.41 -0.54 0.00 0.00 175.26 175.61 1v9x n GLY 74 N -0.49 0.21 0.32 -1.50 0.00 -1.26 0.18 105.19 102.65 1v9x n GLY 74 Ca -0.02 -0.01 -0.05 0.00 0.00 0.00 0.00 46.02 45.94 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 1.24 0.00 -0.61 2.10 -1.74 -1.53 117.51 116.97 1v9x h ILE 75 Ca -0.03 -0.87 0.00 0.00 1.08 0.00 0.00 64.86 65.04 1v9x h ILE 75 Cb 0.91 0.56 0.00 0.00 -1.09 0.00 0.00 36.82 37.20 1v9x h ILE 75 CO 0.05 0.33 0.00 -1.84 -1.08 0.00 0.00 178.15 175.61 1v9x n GLU 76 N -4.26 0.05 0.02 2.19 0.28 -1.26 -1.04 120.64 116.62 1v9x n GLU 76 Ca 0.05 0.29 0.11 0.00 -0.16 0.00 0.00 57.16 57.46 1v9x n GLU 76 Cb 0.23 -1.50 0.10 0.00 1.43 0.00 0.00 31.44 31.70 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 -1.40 0.63 -4.88 -1.84 2.88 -0.58 -4.93 113.62 103.50 1v9x n SER 77 Ca 0.03 -0.26 -0.30 0.00 -1.33 0.00 0.00 58.87 57.02 1v9x n SER 77 Cb 0.08 0.55 0.07 0.00 -0.75 0.00 0.00 64.21 64.16 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 -3.58 2.67 0.40 2.46 1.43 -0.21 -5.00 118.68 116.84 1v9x s LEU 78 Ca 0.07 0.97 -0.23 0.00 -1.03 0.00 0.00 54.13 53.90 1v9x s LEU 78 Cb 0.15 -3.59 -0.09 0.00 0.03 0.00 0.00 46.19 42.69 1v9x s LEU 78 CO 0.76 -1.68 1.02 -0.13 0.23 0.00 0.00 176.35 176.56 1v9x s ARG 79 N -5.45 4.18 0.13 1.70 1.81 -1.26 -4.70 118.95 115.36 1v9x s ARG 79 Ca 0.60 1.43 -0.26 0.00 -1.72 0.00 0.00 55.73 55.78 1v9x s ARG 79 Cb -0.11 -2.48 -0.06 0.00 -0.45 0.00 0.00 34.95 31.85 1v9x s ARG 79 CO 0.51 -0.11 1.31 1.87 -0.68 0.00 0.00 175.30 178.20 1v9x n TRP 80 N -0.16 -0.37 -0.33 -0.53 -0.00 -1.26 0.14 117.44 114.94 1v9x n TRP 80 Ca 0.05 1.04 0.15 0.00 -0.00 0.00 0.00 57.50 58.75 1v9x n TRP 80 Cb 0.50 -0.56 0.34 0.00 -0.00 0.00 0.00 31.31 31.59 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 0.53 0.32 5.87 4.11 -2.00 -0.38 114.58 123.03 1v9x h GLU 81 Ca 0.13 -0.03 -0.02 0.00 0.07 0.00 0.00 59.36 59.52 1v9x h GLU 81 Cb 0.34 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1v9x h GLU 81 CO -0.78 0.35 -0.16 -0.44 0.07 0.00 0.00 179.01 178.05 1v9x h ASP 82 N 0.54 -0.37 -0.83 3.06 5.19 0.90 -2.84 116.42 122.08 1v9x h ASP 82 Ca 0.60 -0.17 0.24 0.00 -0.62 0.00 0.00 57.03 57.08 1v9x h ASP 82 Cb 1.11 0.10 -0.03 0.00 0.18 0.00 0.00 39.33 40.68 1v9x h ASP 82 CO -0.48 0.02 0.61 1.56 -3.12 0.00 0.00 179.24 177.83 1v9x h GLN 83 N -0.81 0.00 -0.27 3.56 4.20 0.36 0.11 115.11 122.25 1v9x h GLN 83 Ca -0.04 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.54 1v9x h GLN 83 Cb 0.52 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.29 1v9x h GLN 83 CO 0.07 0.00 -0.31 1.96 -0.67 0.00 0.00 178.83 179.89 1v9x h GLN 84 N 0.00 0.69 -0.16 1.46 1.08 -0.96 -2.80 115.11 114.42 1v9x h GLN 84 Ca 0.39 -0.38 0.05 0.00 -1.45 0.00 0.00 58.65 57.26 1v9x h GLN 84 Cb 1.61 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 29.05 1v9x h GLN 84 CO -0.00 0.99 0.26 0.87 -0.95 0.00 0.00 178.83 180.00 1v9x h LYS 85 N 0.43 0.00 0.00 1.46 1.57 -0.54 0.28 116.57 119.76 1v9x h LYS 85 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1v9x h LYS 85 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.19 1v9x h LYS 85 CO 0.07 0.00 -0.07 0.82 -0.57 0.00 0.00 179.45 179.70 1v9x h ILE 86 N 0.00 0.00 -0.95 1.86 1.08 -1.43 -3.25 117.51 114.82 1v9x h ILE 86 Ca 0.07 -0.42 0.13 0.00 -0.39 0.00 0.00 64.86 64.25 1v9x h ILE 86 Cb 0.60 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 34.26 1v9x h ILE 86 CO -0.00 0.00 0.58 0.08 -0.69 0.00 0.00 178.15 178.11 1v9x h ARG 87 N -0.42 0.85 0.00 2.37 0.11 -1.33 0.58 114.38 116.55 1v9x h ARG 87 Ca 0.00 -0.05 0.00 0.00 0.10 0.00 0.00 59.98 60.03 1v9x h ARG 87 Cb 0.07 -0.19 0.00 0.00 1.11 0.00 0.00 29.97 30.96 1v9x h ARG 87 CO 0.00 0.56 0.00 1.63 0.10 0.00 0.00 179.97 182.26 1v9x n LYS 88 N -4.69 0.64 -0.03 0.08 4.76 0.97 -1.71 118.16 118.17 1v9x n LYS 88 Ca 0.18 0.00 -0.04 0.00 -2.87 0.00 0.00 58.31 55.58 1v9x n LYS 88 Cb 0.38 -1.37 -0.03 0.00 -1.84 0.00 0.00 35.03 32.16 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 0.08 2.13 9.36 0.18 -4.30 117.16 123.74 1v9x n TYR 89 Ca 0.11 0.00 -0.11 0.00 3.32 0.00 0.00 57.90 61.22 1v9x n TYR 89 Cb 0.05 -0.27 -0.04 0.00 -0.63 0.00 0.00 39.34 38.46 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 0.00 1.46 0.08 2.97 -1.51 -0.77 -3.33 116.25 115.14 1v9x h VAL 90 Ca -0.15 -2.60 -0.00 0.00 -1.23 0.00 0.00 66.70 62.71 1v9x h VAL 90 Cb 1.26 2.50 0.00 0.00 -2.13 0.00 0.00 31.29 32.92 1v9x h VAL 90 CO -0.02 0.77 -0.04 -0.33 -1.23 0.00 0.00 177.57 176.72 1v9x h GLU 91 N 0.16 -0.10 -6.80 5.19 4.39 -1.57 -3.46 114.58 112.39 1v9x h GLU 91 Ca -0.07 0.01 -0.44 0.00 0.34 0.00 0.00 59.36 59.20 1v9x h GLU 91 Cb 1.59 0.02 0.04 0.00 -0.10 0.00 0.00 28.75 30.30 1v9x h GLU 91 CO 0.15 0.43 -0.06 0.45 -1.16 0.00 0.00 179.01 178.83 1v9x s SER 92 N -5.65 5.37 0.03 1.42 0.15 -1.25 -5.01 113.70 108.76 1v9x s SER 92 Ca -0.15 0.01 -0.31 0.00 0.70 0.00 0.00 55.95 56.20 1v9x s SER 92 Cb 0.00 -0.96 -0.10 0.00 -1.71 0.00 0.00 66.02 63.26 1v9x s SER 92 CO 0.59 -1.06 1.95 0.61 1.20 0.00 0.00 173.24 176.53 1v9x n GLY 93 N -2.28 1.79 3.14 9.45 0.00 -1.26 -4.68 105.19 111.35 1v9x n GLY 93 Ca 0.07 0.82 -0.35 0.00 0.00 0.00 0.00 46.02 46.56 1v9x n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1v9x n ALA 94 N 7.23 -4.77 -1.00 4.61 0.00 -1.25 -4.95 120.51 120.38 1v9x n ALA 94 Ca 0.20 -1.33 0.00 0.00 0.00 0.00 0.00 53.44 52.31 1v9x n ALA 94 Cb 0.39 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.69 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 2.73 -3.07 3.49 0.00 0.00 -1.19 -4.95 105.19 102.19 1v9x n GLY 95 Ca -0.01 -1.03 -0.09 0.00 0.00 0.00 0.00 46.02 44.89 1v9x n GLY 95 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1v9x s SER 96 N -2.05 -0.17 0.02 1.61 1.04 -1.00 -4.63 113.70 108.51 1v9x s SER 96 Ca 0.00 -0.62 -0.28 0.00 0.48 0.00 0.00 55.95 55.53 1v9x s SER 96 Cb 0.00 0.55 0.10 0.00 0.10 0.00 0.00 66.02 66.77 1v9x s SER 96 CO 0.00 -1.03 1.24 0.54 0.98 0.00 0.00 173.24 174.97 1v9x s ASN 97 N -2.91 -0.03 -0.26 7.02 4.22 -1.26 -4.87 114.94 116.85 1v9x s ASN 97 Ca 0.12 -0.24 0.19 0.00 -2.14 0.00 0.00 52.86 50.79 1v9x s ASN 97 Cb -0.00 0.21 0.49 0.00 1.28 0.00 0.00 41.25 43.23 1v9x s ASN 97 CO -0.01 -0.41 1.13 0.35 -2.04 0.00 0.00 177.10 176.13 1v9x n THR 98 N -0.66 1.58 -4.19 0.54 -2.24 -1.26 -5.08 114.28 102.96 1v9x n THR 98 Ca -0.03 -3.21 -0.13 0.00 -2.27 0.00 0.00 64.05 58.40 1v9x n THR 98 Cb 0.61 0.63 -0.09 0.00 -2.10 0.00 0.00 70.33 69.38 1v9x n THR 98 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1v9x s SER 99 N -3.69 0.46 0.20 3.42 0.01 -1.26 -5.18 113.70 107.65 1v9x s SER 99 Ca 0.34 -1.42 -0.03 0.00 1.31 0.00 0.00 55.95 56.15 1v9x s SER 99 Cb 0.35 0.45 -0.03 0.00 0.21 0.00 0.00 66.02 66.99 1v9x s SER 99 CO -0.02 -0.93 0.18 0.42 0.41 0.00 0.00 173.24 173.30 1v9x s THR 100 N -3.96 0.01 -0.51 1.44 -4.23 -1.26 -5.12 115.64 102.01 1v9x s THR 100 Ca 0.37 -1.89 -0.17 0.00 -1.18 0.00 0.00 61.69 58.82 1v9x s THR 100 Cb 0.05 -2.41 0.08 0.00 1.34 0.00 0.00 72.50 71.57 1v9x s THR 100 CO 0.15 -0.04 0.53 -0.94 -0.54 0.00 0.00 174.62 173.78 1v9x s SER 101 N -3.13 6.18 0.29 3.99 1.04 -1.26 -5.04 113.70 115.77 1v9x s SER 101 Ca 0.35 -1.27 0.05 0.00 0.48 0.00 0.00 55.95 55.56 1v9x s SER 101 Cb 0.06 -2.24 -0.06 0.00 0.10 0.00 0.00 66.02 63.88 1v9x s SER 101 CO 0.11 -0.83 -0.00 0.42 0.98 0.00 0.00 173.24 173.91 1v9x s THR 102 N 2.12 1.36 0.00 2.02 -4.23 -1.26 -5.12 115.64 110.53 1v9x s THR 102 Ca 0.09 -2.06 0.00 0.00 -1.18 0.00 0.00 61.69 58.54 1v9x s THR 102 Cb -0.23 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.05 1v9x s THR 102 CO 0.08 -0.20 0.00 0.61 -0.54 0.00 0.00 174.62 174.57 1v9x n GLY 103 N -0.59 1.13 3.72 3.99 0.00 -1.26 -5.03 105.19 107.15 1v9x n GLY 103 Ca -0.04 -2.22 -0.42 0.00 0.00 0.00 0.00 46.02 43.33 1v9x n GLY 103 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1v9x n THR 104 N -0.55 1.98 -2.95 2.61 -1.04 -1.26 -4.95 114.28 108.12 1v9x n THR 104 Ca 0.00 -0.49 -0.41 0.00 -2.04 0.00 0.00 64.05 61.11 1v9x n THR 104 Cb 0.00 -1.69 -0.04 0.00 -1.82 0.00 0.00 70.33 66.78 1v9x n THR 104 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1v9x s SER 105 N -0.24 6.98 -0.09 8.00 0.01 -1.26 -4.97 113.70 122.13 1v9x s SER 105 Ca 0.55 1.20 -0.24 0.00 1.31 0.00 0.00 55.95 58.77 1v9x s SER 105 Cb -0.54 -2.44 -0.20 0.00 0.21 0.00 0.00 66.02 63.05 1v9x s SER 105 CO 0.62 -0.27 0.82 0.71 0.41 0.00 0.00 173.24 175.54 1v9x h THR 106 N 4.99 1.30 -6.02 1.44 1.35 -2.01 -3.48 112.91 110.47 1v9x h THR 106 Ca -0.35 -1.66 -0.42 0.00 -0.55 0.00 0.00 66.41 63.43 1v9x h THR 106 Cb 1.17 2.31 0.07 0.00 -1.73 0.00 0.00 68.15 69.96 1v9x h THR 106 CO 0.79 0.39 -0.75 -0.24 -0.25 0.00 0.00 175.52 175.46 1v9x n SER 107 N -4.76 -4.16 -4.17 5.36 2.88 -1.26 -4.94 113.62 102.57 1v9x n SER 107 Ca -0.08 -0.69 -0.39 0.00 -1.33 0.00 0.00 58.87 56.37 1v9x n SER 107 Cb 0.33 -4.47 -0.06 0.00 -0.75 0.00 0.00 64.21 59.26 1v9x n SER 107 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1v9x s SER 108 N -3.68 5.91 0.04 -3.46 0.15 -1.26 -5.03 113.70 106.37 1v9x s SER 108 Ca 0.41 -3.08 -0.01 0.00 0.70 0.00 0.00 55.95 53.97 1v9x s SER 108 Cb -0.19 -1.98 -0.03 0.00 -1.71 0.00 0.00 66.02 62.11 1v9x s SER 108 CO 0.78 -0.37 -0.03 -0.55 1.20 0.00 0.00 173.24 174.28 1v9x s SER 109 N 0.87 0.43 0.07 5.45 0.15 -1.26 -4.80 113.70 114.60 1v9x s SER 109 Ca 0.21 -0.88 -0.30 0.00 0.70 0.00 0.00 55.95 55.67 1v9x s SER 109 Cb -0.14 0.18 -0.06 0.00 -1.71 0.00 0.00 66.02 64.29 1v9x s SER 109 CO -0.07 -0.53 1.15 -0.83 1.20 0.00 0.00 173.24 174.16 1v9x s GLY 110 N -2.58 2.54 0.11 9.45 0.00 -1.26 -4.95 107.32 110.63 1v9x s GLY 110 Ca 0.02 0.80 -0.14 0.00 0.00 0.00 0.00 44.72 45.40 1v9x s GLY 110 CO -0.08 1.94 1.44 -0.56 0.00 0.00 0.00 173.10 175.84 1v9x h PRO 111 N 6.57 0.78 -5.48 2.90 0.13 -2.00 -3.44 132.00 131.46 1v9x h PRO 111 Ca -0.42 -0.41 -0.67 0.00 -0.87 0.00 0.00 66.00 63.63 1v9x h PRO 111 Cb 1.21 0.01 -0.28 0.00 0.13 0.00 0.00 31.00 32.08 1v9x h PRO 111 CO 0.79 1.04 -0.80 0.45 -0.23 0.00 0.00 178.00 179.25 1v9x s SER 112 N -6.64 3.75 -0.23 1.44 0.15 -1.26 -4.56 113.70 106.34 1v9x s SER 112 Ca -0.12 -0.38 0.02 0.00 0.70 0.00 0.00 55.95 56.18 1v9x s SER 112 Cb 0.09 -1.43 0.05 0.00 -1.71 0.00 0.00 66.02 63.02 1v9x s SER 112 CO 0.85 0.19 -0.14 -0.55 1.20 0.00 0.00 173.24 174.79 1v9x s SER 113 N 0.19 3.96 0.00 5.45 0.15 -1.26 -5.19 113.70 117.00 1v9x s SER 113 Ca -0.10 -1.13 0.24 0.00 0.70 0.00 0.00 55.95 55.66 1v9x s SER 113 Cb -0.16 -1.51 0.19 0.00 -1.71 0.00 0.00 66.02 62.83 1v9x s SER 113 CO 0.06 -0.13 1.25 0.61 1.20 0.00 0.00 173.24 176.23