#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v9x s SER 2 N 0.00 0.19 -0.00 1.61 0.01 -1.26 -5.08 113.70 109.16 1v9x s SER 2 Ca 0.00 -1.27 -0.24 0.00 1.31 0.00 0.00 55.95 55.75 1v9x s SER 2 Cb 0.00 0.37 -0.15 0.00 0.21 0.00 0.00 66.02 66.44 1v9x s SER 2 CO 0.00 -0.82 1.10 -1.28 0.41 0.00 0.00 173.24 172.65 1v9x h SER 3 N 2.68 -0.41 -3.98 2.44 0.87 -2.11 -3.50 113.55 109.54 1v9x h SER 3 Ca -0.35 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 1v9x h SER 3 Cb 1.23 0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 63.29 1v9x h SER 3 CO 0.54 -0.01 -0.12 0.61 -0.53 0.00 0.00 176.83 177.32 1v9x n GLY 4 N -0.17 -2.92 3.56 5.77 0.00 -1.26 -5.10 105.19 105.07 1v9x n GLY 4 Ca -0.09 -1.26 -0.09 0.00 0.00 0.00 0.00 46.02 44.58 1v9x n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1v9x s SER 5 N -3.39 -0.33 -0.49 1.61 0.15 -1.26 -5.12 113.70 104.87 1v9x s SER 5 Ca 0.00 0.20 -0.24 0.00 0.70 0.00 0.00 55.95 56.61 1v9x s SER 5 Cb 0.00 0.30 0.03 0.00 -1.71 0.00 0.00 66.02 64.65 1v9x s SER 5 CO 0.00 -0.42 0.88 -0.44 1.20 0.00 0.00 173.24 174.46 1v9x s SER 6 N -1.72 6.41 0.00 5.45 0.01 -1.26 -4.42 113.70 118.17 1v9x s SER 6 Ca 0.02 -0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.14 1v9x s SER 6 Cb -0.01 -2.42 0.00 0.00 0.21 0.00 0.00 66.02 63.80 1v9x s SER 6 CO -0.03 -1.07 0.00 0.61 0.41 0.00 0.00 173.24 173.16 1v9x n GLY 7 N 5.02 0.00 3.72 3.44 0.00 -1.26 -5.14 105.19 110.97 1v9x n GLY 7 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 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 0.00 3.74 0.23 1.61 0.09 -1.26 -5.00 115.29 114.70 1v9x s HIS 8 Ca 0.00 1.74 -0.30 0.00 -0.00 0.00 0.00 55.06 56.50 1v9x s HIS 8 Cb 0.00 -3.07 -0.10 0.00 -0.00 0.00 0.00 32.58 29.40 1v9x s HIS 8 CO 0.00 0.12 1.49 0.15 -0.00 0.00 0.00 174.74 176.49 1v9x s LYS 9 N 0.44 4.24 0.31 1.40 1.02 -1.26 -4.92 119.74 120.97 1v9x s LYS 9 Ca 0.49 2.35 0.10 0.00 0.02 0.00 0.00 55.97 58.92 1v9x s LYS 9 Cb -0.22 -3.11 0.51 0.00 -0.52 0.00 0.00 37.83 34.48 1v9x s LYS 9 CO 0.29 -0.49 1.71 -1.00 -0.92 0.00 0.00 175.35 174.94 1v9x h PRO 10 N 5.46 0.07 -6.77 -1.68 0.13 -1.83 -3.43 132.00 123.94 1v9x h PRO 10 Ca -0.45 -0.04 -0.67 0.00 -0.87 0.00 0.00 66.00 63.97 1v9x h PRO 10 Cb 1.21 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.14 1v9x h PRO 10 CO 0.81 0.53 -0.84 -1.58 -0.23 0.00 0.00 178.00 176.69 1v9x s TRP 11 N -3.96 2.34 0.11 1.56 0.52 -1.15 0.14 118.94 118.51 1v9x s TRP 11 Ca -0.03 -0.36 0.06 0.00 0.02 0.00 0.00 56.10 55.79 1v9x s TRP 11 Cb 0.13 -1.22 -0.04 0.00 -1.15 0.00 0.00 33.47 31.20 1v9x s TRP 11 CO 0.75 0.41 -0.14 -0.98 0.02 0.00 0.00 176.95 177.01 1v9x s ARG 12 N -2.31 1.00 -0.07 4.98 1.70 -0.54 -0.46 118.95 123.25 1v9x s ARG 12 Ca 0.17 -1.19 0.00 0.00 -0.47 0.00 0.00 55.73 54.24 1v9x s ARG 12 Cb -0.09 -0.92 0.02 0.00 -0.57 0.00 0.00 34.95 33.39 1v9x s ARG 12 CO 0.08 0.18 -0.06 0.00 -1.08 0.00 0.00 175.30 174.42 1v9x s ALA 13 N -1.94 1.00 -0.26 7.88 0.00 0.56 -2.60 121.76 126.39 1v9x s ALA 13 Ca 0.07 -0.29 -0.27 0.00 0.00 0.00 0.00 51.96 51.47 1v9x s ALA 13 Cb -0.06 -0.66 0.17 0.00 0.00 0.00 0.00 23.12 22.56 1v9x s ALA 13 CO 0.03 -0.19 1.26 -1.83 0.00 0.00 0.00 175.76 175.02 1v9x s GLU 14 N 1.31 0.25 -0.05 0.00 -1.05 -1.26 -4.21 118.70 113.69 1v9x s GLU 14 Ca -0.04 0.16 -0.30 0.00 -0.15 0.00 0.00 54.97 54.65 1v9x s GLU 14 Cb -0.14 0.12 -0.04 0.00 -0.44 0.00 0.00 34.13 33.64 1v9x s GLU 14 CO -0.03 -0.06 1.25 0.71 0.95 0.00 0.00 175.26 178.09 1v9x s TYR 15 N -0.48 3.09 0.12 4.83 2.02 -1.26 -3.74 117.35 121.92 1v9x s TYR 15 Ca 0.05 1.11 -0.33 0.00 -0.37 0.00 0.00 57.07 57.53 1v9x s TYR 15 Cb -0.03 -3.48 -0.12 0.00 -0.40 0.00 0.00 41.96 37.93 1v9x s TYR 15 CO -0.08 -1.60 1.73 0.00 -1.57 0.00 0.00 175.55 174.03 1v9x n ALA 16 N 5.35 1.75 -0.66 3.71 0.00 -1.04 -4.73 120.51 124.89 1v9x n ALA 16 Ca 0.12 0.37 -0.15 0.00 0.00 0.00 0.00 53.44 53.78 1v9x n ALA 16 Cb 0.46 -2.47 0.16 0.00 0.00 0.00 0.00 19.45 17.59 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 4.68 2.23 -3.85 0.00 4.76 -1.26 0.11 118.16 124.83 1v9x n LYS 17 Ca 0.18 -2.30 0.01 0.00 -2.87 0.00 0.00 58.31 53.33 1v9x n LYS 17 Cb 0.32 -1.92 0.01 0.00 -1.84 0.00 0.00 35.03 31.60 1v9x n LYS 17 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1v9x s SER 18 N -0.73 -0.02 -0.21 4.39 0.01 -1.26 -4.97 113.70 110.91 1v9x s SER 18 Ca 0.43 -0.28 0.16 0.00 1.31 0.00 0.00 55.95 57.58 1v9x s SER 18 Cb 0.36 0.23 0.46 0.00 0.21 0.00 0.00 66.02 67.28 1v9x s SER 18 CO 0.09 -0.45 1.17 -1.20 0.41 0.00 0.00 173.24 173.25 1v9x n SER 19 N -0.90 2.56 -0.04 2.44 7.64 -1.26 -1.38 113.62 122.67 1v9x n SER 19 Ca -0.02 -2.89 -0.20 0.00 1.01 0.00 0.00 58.87 56.78 1v9x n SER 19 Cb 0.60 -0.41 -0.13 0.00 -1.01 0.00 0.00 64.21 63.26 1v9x n SER 19 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1v9x n ARG 20 N -0.53 0.72 -1.12 1.43 5.12 -1.26 -4.75 116.66 116.28 1v9x n ARG 20 Ca 0.21 0.22 -0.30 0.00 -1.93 0.00 0.00 57.85 56.04 1v9x n ARG 20 Cb 0.90 -1.65 0.13 0.00 -1.16 0.00 0.00 32.46 30.68 1v9x n ARG 20 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 1v9x s SER 21 N -6.81 3.71 -0.02 0.55 1.04 -1.26 -4.94 113.70 105.97 1v9x s SER 21 Ca -0.26 1.75 0.00 0.00 0.48 0.00 0.00 55.95 57.92 1v9x s SER 21 Cb 0.07 -2.39 0.03 0.00 0.10 0.00 0.00 66.02 63.83 1v9x s SER 21 CO 0.72 -2.53 0.02 -0.44 0.98 0.00 0.00 173.24 171.99 1v9x s SER 22 N -3.25 0.23 0.92 7.02 0.01 -1.26 -2.61 113.70 114.77 1v9x s SER 22 Ca 0.63 0.02 -0.14 0.00 1.31 0.00 0.00 55.95 57.77 1v9x s SER 22 Cb -0.19 -0.12 -0.03 0.00 0.21 0.00 0.00 66.02 65.89 1v9x s SER 22 CO 0.57 -0.12 0.08 0.00 0.41 0.00 0.00 173.24 174.17 1v9x n LYS 24 N -0.33 1.49 0.02 0.00 4.76 -1.22 -2.98 118.16 119.90 1v9x n LYS 24 Ca 0.05 -0.02 -0.13 0.00 -2.87 0.00 0.00 58.31 55.34 1v9x n LYS 24 Cb 0.54 -1.37 -0.09 0.00 -1.84 0.00 0.00 35.03 32.26 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 1.23 0.00 -0.18 2.02 -1.92 -3.33 112.91 110.73 1v9x h THR 25 Ca -0.35 -1.16 0.00 0.00 0.77 0.00 0.00 66.41 65.67 1v9x h THR 25 Cb 1.77 1.96 0.00 0.00 -1.74 0.00 0.00 68.15 70.15 1v9x h THR 25 CO 0.02 0.28 -1.52 0.00 0.37 0.00 0.00 175.52 174.67 1v9x n LYS 27 N -2.20 -4.62 -4.05 0.00 4.76 -1.16 -5.04 118.16 105.85 1v9x n LYS 27 Ca -0.01 0.52 -0.24 0.00 -2.87 0.00 0.00 58.31 55.70 1v9x n LYS 27 Cb 0.51 -4.59 -0.05 0.00 -1.84 0.00 0.00 35.03 29.06 1v9x n LYS 27 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1v9x n SER 28 N -1.70 2.67 -4.84 4.39 7.64 -1.23 -4.85 113.62 115.70 1v9x n SER 28 Ca -0.07 -2.74 -0.36 0.00 1.01 0.00 0.00 58.87 56.71 1v9x n SER 28 Cb 0.56 0.40 -0.06 0.00 -1.01 0.00 0.00 64.21 64.10 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 -2.51 4.88 -0.75 0.44 1.01 -1.26 0.16 120.40 122.37 1v9x s VAL 29 Ca 0.04 0.88 -0.08 0.00 0.00 0.00 0.00 61.98 62.82 1v9x s VAL 29 Cb 0.00 -3.76 0.19 0.00 0.00 0.00 0.00 36.38 32.82 1v9x s VAL 29 CO 0.03 0.37 0.63 -0.63 0.00 0.00 0.00 175.10 175.50 1v9x s ILE 30 N -1.32 4.67 0.21 2.22 1.01 -1.07 -4.79 121.20 122.13 1v9x s ILE 30 Ca 0.33 -2.82 -0.32 0.00 0.00 0.00 0.00 60.65 57.84 1v9x s ILE 30 Cb -0.16 -3.94 -0.14 0.00 0.01 0.00 0.00 42.46 38.23 1v9x s ILE 30 CO 0.18 -0.97 1.46 0.59 0.00 0.00 0.00 174.94 176.21 1v9x n ASN 31 N 3.60 2.83 -4.34 3.58 4.13 -1.26 -4.27 115.26 119.52 1v9x n ASN 31 Ca 0.12 1.12 -0.33 0.00 1.68 0.00 0.00 54.58 57.17 1v9x n ASN 31 Cb 0.42 -1.42 0.14 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 2.53 -0.80 -1.69 3.52 2.85 -0.48 -3.39 118.16 120.69 1v9x n LYS 32 Ca 0.14 -0.20 -0.08 0.00 -1.05 0.00 0.00 58.31 57.11 1v9x n LYS 32 Cb 0.30 -1.76 -0.02 0.00 -0.65 0.00 0.00 35.03 32.90 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 -1.68 -0.59 -4.73 -1.58 1.02 0.12 -4.92 120.64 108.27 1v9x n GLU 33 Ca 0.04 0.58 -0.25 0.00 -0.02 0.00 0.00 57.16 57.51 1v9x n GLU 33 Cb 0.57 -4.47 -0.15 0.00 -0.02 0.00 0.00 31.44 27.37 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 -2.78 2.17 -0.39 1.62 0.01 -1.22 -4.94 114.94 109.42 1v9x s ASN 34 Ca 0.00 -0.41 -0.29 0.00 -0.71 0.00 0.00 52.86 51.46 1v9x s ASN 34 Cb 0.00 -0.21 0.01 0.00 0.41 0.00 0.00 41.25 41.46 1v9x s ASN 34 CO 0.00 0.18 1.30 0.12 -1.51 0.00 0.00 177.10 177.19 1v9x s PHE 35 N -0.60 2.62 0.53 2.20 5.36 -1.26 -2.48 117.98 124.34 1v9x s PHE 35 Ca 0.06 0.77 0.01 0.00 -0.96 0.00 0.00 56.93 56.82 1v9x s PHE 35 Cb -0.08 -4.20 0.00 0.00 -0.34 0.00 0.00 43.02 38.41 1v9x s PHE 35 CO 0.00 -1.67 0.08 -0.98 -1.46 0.00 0.00 175.22 171.19 1v9x s ARG 36 N 4.54 2.22 -0.03 10.12 1.70 -1.25 -2.81 118.95 133.44 1v9x s ARG 36 Ca 0.56 -2.36 0.00 0.00 -0.47 0.00 0.00 55.73 53.46 1v9x s ARG 36 Cb -0.13 -1.63 0.03 0.00 -0.57 0.00 0.00 34.95 32.65 1v9x s ARG 36 CO 0.29 -0.44 -0.00 -0.51 -1.08 0.00 0.00 175.30 173.56 1v9x s LEU 37 N -3.97 1.11 -0.27 -1.89 1.43 0.04 -4.04 118.68 111.09 1v9x s LEU 37 Ca 0.09 -0.04 -0.04 0.00 -1.03 0.00 0.00 54.13 53.11 1v9x s LEU 37 Cb 0.00 -0.26 0.02 0.00 0.03 0.00 0.00 46.19 45.98 1v9x s LEU 37 CO 0.05 -0.11 -0.00 -0.83 0.23 0.00 0.00 176.35 175.69 1v9x s GLY 38 N 1.11 1.69 -0.83 -3.19 0.00 -1.07 -0.80 107.32 104.24 1v9x s GLY 38 Ca -0.08 -1.46 -0.25 0.00 0.00 0.00 0.00 44.72 42.92 1v9x s GLY 38 CO -0.02 0.57 1.29 1.25 0.00 0.00 0.00 173.10 176.19 1v9x s LYS 39 N 1.39 3.33 -0.37 2.90 2.20 -0.98 -1.46 119.74 126.74 1v9x s LYS 39 Ca 0.01 -0.66 -0.27 0.00 -0.36 0.00 0.00 55.97 54.68 1v9x s LYS 39 Cb -0.17 -4.59 -0.04 0.00 -1.51 0.00 0.00 37.83 31.53 1v9x s LYS 39 CO -0.02 -2.11 2.07 -0.51 -0.36 0.00 0.00 175.35 174.42 1v9x s LEU 40 N 5.15 3.43 0.26 5.43 1.43 0.38 -2.52 118.68 132.23 1v9x s LEU 40 Ca 0.37 1.29 0.09 0.00 -1.03 0.00 0.00 54.13 54.84 1v9x s LEU 40 Cb -0.06 -3.15 -0.04 0.00 0.03 0.00 0.00 46.19 42.96 1v9x s LEU 40 CO 0.05 -2.14 0.06 0.68 0.23 0.00 0.00 176.35 175.24 1v9x s VAL 41 N 8.79 3.77 -0.20 -1.59 -7.23 -1.25 -4.72 120.40 117.98 1v9x s VAL 41 Ca 0.88 -1.73 -0.07 0.00 -1.81 0.00 0.00 61.98 59.25 1v9x s VAL 41 Cb -0.23 -3.02 -0.04 0.00 0.56 0.00 0.00 36.38 33.65 1v9x s VAL 41 CO 0.30 -0.36 0.06 -1.10 -0.31 0.00 0.00 175.10 173.70 1v9x s GLN 42 N -3.69 3.89 0.07 4.82 -1.52 -1.26 -3.24 119.66 118.72 1v9x s GLN 42 Ca 0.32 -0.38 -0.26 0.00 -1.95 0.00 0.00 55.36 53.08 1v9x s GLN 42 Cb -0.07 -3.22 -0.12 0.00 -0.22 0.00 0.00 33.01 29.38 1v9x s GLN 42 CO 0.21 0.17 1.41 1.03 -0.25 0.00 0.00 175.29 177.86 1v9x h SER 43 N 7.04 -1.10 0.00 5.90 0.87 -0.26 -3.43 113.55 122.58 1v9x h SER 43 Ca -0.36 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.30 1v9x h SER 43 Cb 1.17 0.38 0.00 0.00 -0.44 0.00 0.00 62.40 63.51 1v9x h SER 43 CO 0.67 -0.47 -0.07 0.35 -0.53 0.00 0.00 176.83 176.78 1v9x n THR 44 N -4.69 0.41 0.00 2.23 -2.24 -1.26 -5.06 114.28 103.68 1v9x n THR 44 Ca -0.08 0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 1v9x n THR 44 Cb 0.33 -1.31 0.00 0.00 -2.10 0.00 0.00 70.33 67.25 1v9x n THR 44 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1v9x n HIS 45 N -2.88 0.00 -2.61 4.78 -0.00 -1.26 -4.98 115.22 108.26 1v9x n HIS 45 Ca -0.01 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.58 1v9x n HIS 45 Cb 0.03 0.27 0.02 0.00 -0.00 0.00 0.00 29.99 30.31 1v9x n HIS 45 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1v9x n PHE 46 N -2.44 1.72 -3.83 1.57 3.72 -1.26 -4.84 117.46 112.11 1v9x n PHE 46 Ca 0.00 -2.86 -0.10 0.00 -0.05 0.00 0.00 57.45 54.45 1v9x n PHE 46 Cb 0.00 -0.30 -0.05 0.00 -0.94 0.00 0.00 39.48 38.18 1v9x n PHE 46 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1v9x s ASP 47 N -3.24 -0.10 -0.07 4.37 2.15 -1.26 -5.06 116.67 113.46 1v9x s ASP 47 Ca 0.32 -0.64 -0.03 0.00 0.43 0.00 0.00 52.55 52.64 1v9x s ASP 47 Cb 0.44 0.48 0.01 0.00 -0.30 0.00 0.00 42.92 43.56 1v9x s ASP 47 CO -0.02 -0.93 0.06 0.61 -0.17 0.00 0.00 175.17 174.72 1v9x n GLY 48 N -0.25 -1.66 3.32 2.66 0.00 -1.26 -1.78 105.19 106.22 1v9x n GLY 48 Ca -0.10 0.49 -0.38 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.49 3.94 -0.45 -0.61 1.01 -1.26 -1.04 121.20 122.31 1v9x s ILE 49 Ca -0.07 -0.90 -0.07 0.00 0.00 0.00 0.00 60.65 59.61 1v9x s ILE 49 Cb 0.00 -3.13 0.11 0.00 0.01 0.00 0.00 42.46 39.45 1v9x s ILE 49 CO 0.26 -0.06 0.30 -0.32 0.00 0.00 0.00 174.94 175.12 1v9x s MET 50 N 1.46 2.37 -0.44 2.79 1.75 -1.20 -4.93 119.30 121.10 1v9x s MET 50 Ca 0.01 -1.74 -0.28 0.00 -1.25 0.00 0.00 55.69 52.42 1v9x s MET 50 Cb -0.18 -3.82 -0.01 0.00 2.84 0.00 0.00 34.83 33.65 1v9x s MET 50 CO 0.03 -1.13 1.76 -1.25 -0.65 0.00 0.00 175.02 173.77 1v9x s PRO 51 N 1.31 3.13 -0.67 4.11 0.04 -1.26 -3.79 135.00 137.87 1v9x s PRO 51 Ca 0.06 1.07 -0.26 0.00 0.04 0.00 0.00 61.00 61.91 1v9x s PRO 51 Cb -0.25 -4.23 -0.06 0.00 0.04 0.00 0.00 34.50 30.00 1v9x s PRO 51 CO -0.01 -2.11 2.13 -1.64 0.04 0.00 0.00 177.00 175.41 1v9x s MET 52 N 6.01 2.28 -0.37 4.56 -1.94 -1.05 -4.65 119.30 124.14 1v9x s MET 52 Ca 0.72 0.62 -0.29 0.00 -1.71 0.00 0.00 55.69 55.04 1v9x s MET 52 Cb -0.18 -4.65 -0.00 0.00 2.01 0.00 0.00 34.83 32.01 1v9x s MET 52 CO 0.29 -3.32 1.60 -1.58 -0.01 0.00 0.00 175.02 172.00 1v9x s TRP 53 N 11.16 2.11 -0.01 -0.03 0.23 -1.26 -2.32 118.94 128.82 1v9x s TRP 53 Ca 0.81 0.64 0.01 0.00 -2.03 0.00 0.00 56.10 55.53 1v9x s TRP 53 Cb -0.13 -4.23 0.01 0.00 0.03 0.00 0.00 33.47 29.15 1v9x s TRP 53 CO 0.15 -2.45 -0.03 -0.80 0.96 0.00 0.00 176.95 174.78 1v9x s ASN 54 N 4.95 0.52 0.13 2.95 0.01 0.02 -3.43 114.94 120.10 1v9x s ASN 54 Ca 0.70 -0.07 -0.34 0.00 -0.71 0.00 0.00 52.86 52.44 1v9x s ASN 54 Cb -0.18 -0.14 -0.17 0.00 0.41 0.00 0.00 41.25 41.18 1v9x s ASN 54 CO 0.33 0.00 1.11 1.41 -1.51 0.00 0.00 177.10 178.44 1v9x n HIS 55 N 3.37 1.03 0.24 2.20 8.25 -1.26 -0.78 115.22 128.26 1v9x n HIS 55 Ca -0.18 0.77 0.17 0.00 -0.26 0.00 0.00 57.72 58.22 1v9x n HIS 55 Cb 0.56 -2.22 0.76 0.00 1.12 0.00 0.00 29.99 30.21 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 3.23 1.67 0.00 -1.41 0.00 -1.78 0.56 119.26 121.53 1v9x h ALA 56 Ca -0.44 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.36 1v9x h ALA 56 Cb 1.37 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 1v9x h ALA 56 CO 0.69 -0.49 -1.35 0.45 0.00 0.00 0.00 179.25 178.54 1v9x n SER 57 N -3.20 0.78 0.16 0.00 2.88 -1.26 -2.86 113.62 110.12 1v9x n SER 57 Ca 0.02 0.33 0.03 0.00 -1.33 0.00 0.00 58.87 57.92 1v9x n SER 57 Cb 0.50 0.39 0.20 0.00 -0.75 0.00 0.00 64.21 64.55 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 -3.46 1.52 -0.16 0.00 2.08 -0.87 -4.10 119.36 114.37 1v9x n ILE 59 Ca 0.00 -0.00 0.20 0.00 0.56 0.00 0.00 62.75 63.51 1v9x n ILE 59 Cb 0.62 -2.09 0.58 0.00 -0.75 0.00 0.00 39.64 38.00 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 0.25 -1.86 1.39 3.38 -1.64 0.45 115.31 116.28 1v9x h LEU 60 Ca -0.31 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 1v9x h LEU 60 Cb 1.20 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1v9x h LEU 60 CO -0.19 0.12 -0.11 0.07 0.09 0.00 0.00 178.44 178.42 1v9x h LYS 61 N 0.26 0.00 0.00 1.13 2.10 -1.67 -3.24 116.57 115.15 1v9x h LYS 61 Ca 0.38 0.00 -0.33 0.00 -2.00 0.00 0.00 60.65 58.70 1v9x h LYS 61 Cb 1.12 0.00 0.07 0.00 -0.90 0.00 0.00 32.23 32.52 1v9x h LYS 61 CO -0.09 0.11 0.13 1.63 -2.00 0.00 0.00 179.45 179.23 1v9x n LYS 62 N -3.51 -0.13 -4.35 0.07 5.02 0.16 -3.76 118.16 111.66 1v9x n LYS 62 Ca -0.01 -1.86 -0.18 0.00 -2.02 0.00 0.00 58.31 54.23 1v9x n LYS 62 Cb 0.25 -0.59 -0.10 0.00 -0.02 0.00 0.00 35.03 34.58 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 -2.36 1.52 -1.34 -0.18 2.01 -1.26 -3.09 115.64 110.93 1v9x s THR 63 Ca 0.49 -2.14 -0.07 0.00 0.31 0.00 0.00 61.69 60.29 1v9x s THR 63 Cb -0.02 -2.17 0.02 0.00 0.01 0.00 0.00 72.50 70.33 1v9x s THR 63 CO 0.33 -0.50 1.05 0.29 -0.69 0.00 0.00 174.62 175.10 1v9x n LYS 64 N -0.41 -6.85 -0.06 4.92 5.02 -1.26 -4.92 118.16 114.60 1v9x n LYS 64 Ca -0.07 0.77 -0.12 0.00 -2.02 0.00 0.00 58.31 56.87 1v9x n LYS 64 Cb 0.62 -5.73 -0.04 0.00 -0.02 0.00 0.00 35.03 29.86 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 -4.65 0.32 -5.09 1.97 1.13 -1.26 -5.04 117.38 104.76 1v9x n GLN 65 Ca -0.10 0.13 -0.30 0.00 -1.94 0.00 0.00 57.00 54.80 1v9x n GLN 65 Cb 0.60 -1.04 -0.15 0.00 0.11 0.00 0.00 30.24 29.75 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 -2.38 2.00 -0.20 5.09 1.01 -1.26 -5.03 121.20 120.44 1v9x s ILE 66 Ca -0.20 -1.18 -0.19 0.00 0.00 0.00 0.00 60.65 59.08 1v9x s ILE 66 Cb 0.06 -1.68 -0.20 0.00 0.01 0.00 0.00 42.46 40.64 1v9x s ILE 66 CO 0.26 0.47 0.23 1.17 0.00 0.00 0.00 174.94 177.07 1v9x n LYS 67 N 2.19 0.60 -3.71 2.79 3.00 -1.26 -4.76 118.16 117.01 1v9x n LYS 67 Ca -0.16 0.52 -0.13 0.00 -0.00 0.00 0.00 58.31 58.54 1v9x n LYS 67 Cb 0.52 -1.74 -0.07 0.00 0.00 0.00 0.00 35.03 33.74 1v9x n LYS 67 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1v9x s SER 68 N -6.90 -0.23 0.57 3.14 0.15 -1.26 -4.74 113.70 104.43 1v9x s SER 68 Ca -0.28 0.01 0.27 0.00 0.70 0.00 0.00 55.95 56.65 1v9x s SER 68 Cb 0.06 0.38 1.53 0.00 -1.71 0.00 0.00 66.02 66.28 1v9x s SER 68 CO 0.62 -0.59 2.02 -0.37 1.20 0.00 0.00 173.24 176.12 1v9x h VAL 69 N 3.31 0.53 -0.20 4.45 -1.51 -1.94 0.97 116.25 121.85 1v9x h VAL 69 Ca -0.31 0.00 -0.04 0.00 -1.23 0.00 0.00 66.70 65.12 1v9x h VAL 69 Cb 1.19 0.76 -0.01 0.00 -2.13 0.00 0.00 31.29 31.10 1v9x h VAL 69 CO 0.43 0.00 -0.06 -0.78 -1.23 0.00 0.00 177.57 175.93 1v9x h ASP 70 N 0.00 0.28 0.84 4.19 3.58 -2.01 -1.31 116.42 122.00 1v9x h ASP 70 Ca 0.16 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.56 1v9x h ASP 70 Cb 0.79 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 41.77 1v9x h ASP 70 CO -0.00 0.39 0.00 -2.24 -2.88 0.00 0.00 179.24 174.51 1v9x h ASP 71 N 0.30 0.00 -3.32 2.28 2.03 -1.18 -3.43 116.42 113.10 1v9x h ASP 71 Ca 0.06 0.00 -0.57 0.00 -0.73 0.00 0.00 57.03 55.79 1v9x h ASP 71 Cb 0.30 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 38.73 1v9x h ASP 71 CO 0.01 0.00 -0.06 -0.69 -1.03 0.00 0.00 179.24 177.48 1v9x s VAL 72 N -3.50 5.08 0.21 4.15 1.01 -0.49 -2.94 120.40 123.91 1v9x s VAL 72 Ca 0.02 1.14 -0.04 0.00 0.00 0.00 0.00 61.98 63.11 1v9x s VAL 72 Cb 0.09 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 1v9x s VAL 72 CO 0.46 0.34 0.44 -0.70 0.00 0.00 0.00 175.10 175.63 1v9x s GLU 73 N 0.42 3.60 -2.01 2.72 2.56 0.40 -4.17 118.70 122.21 1v9x s GLU 73 Ca 0.30 -0.13 0.00 0.00 0.00 0.00 0.00 54.97 55.14 1v9x s GLU 73 Cb -0.17 -2.78 0.00 0.00 2.00 0.00 0.00 34.13 33.18 1v9x s GLU 73 CO 0.14 0.37 0.00 0.41 -0.56 0.00 0.00 175.26 175.62 1v9x n GLY 74 N -0.44 1.78 0.22 -1.50 0.00 -1.26 0.21 105.19 104.20 1v9x n GLY 74 Ca -0.03 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.10 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 0.47 0.00 -0.61 2.10 -1.76 -2.67 117.51 115.04 1v9x h ILE 75 Ca -0.39 -1.13 0.00 0.00 1.08 0.00 0.00 64.86 64.42 1v9x h ILE 75 Cb 1.24 1.80 0.00 0.00 -1.09 0.00 0.00 36.82 38.77 1v9x h ILE 75 CO 0.57 0.20 0.00 -1.84 -1.08 0.00 0.00 178.15 176.00 1v9x n GLU 76 N -3.32 0.17 0.14 2.19 0.28 -1.26 -3.04 120.64 115.81 1v9x n GLU 76 Ca 0.01 0.16 0.12 0.00 -0.16 0.00 0.00 57.16 57.28 1v9x n GLU 76 Cb 0.45 -1.71 0.07 0.00 1.43 0.00 0.00 31.44 31.67 1v9x n GLU 76 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 1v9x h SER 77 N 0.00 0.00 -4.22 -1.84 0.87 -1.83 -3.47 113.55 103.07 1v9x h SER 77 Ca 0.00 -0.01 -0.49 0.00 -1.23 0.00 0.00 61.79 60.06 1v9x h SER 77 Cb 0.64 0.00 0.12 0.00 -0.44 0.00 0.00 62.40 62.72 1v9x h SER 77 CO 0.00 0.00 0.31 -0.76 -0.53 0.00 0.00 176.83 175.85 1v9x s LEU 78 N -5.59 2.56 0.47 2.23 1.43 -1.17 -5.01 118.68 113.60 1v9x s LEU 78 Ca 0.02 1.45 -0.22 0.00 -1.03 0.00 0.00 54.13 54.36 1v9x s LEU 78 Cb 0.08 -4.02 -0.08 0.00 0.03 0.00 0.00 46.19 42.20 1v9x s LEU 78 CO 0.75 -2.17 1.09 -0.13 0.23 0.00 0.00 176.35 176.11 1v9x s ARG 79 N -5.04 3.80 0.15 1.70 0.52 -1.26 -4.67 118.95 114.14 1v9x s ARG 79 Ca 0.62 1.54 -0.25 0.00 -0.52 0.00 0.00 55.73 57.11 1v9x s ARG 79 Cb -0.16 -2.26 -0.02 0.00 0.52 0.00 0.00 34.95 33.04 1v9x s ARG 79 CO 0.55 -0.46 1.35 1.87 0.02 0.00 0.00 175.30 178.63 1v9x n TRP 80 N -0.70 -0.32 -0.30 -0.53 -0.00 -1.26 0.12 117.44 114.46 1v9x n TRP 80 Ca 0.08 1.09 0.12 0.00 -0.00 0.00 0.00 57.50 58.79 1v9x n TRP 80 Cb 0.50 -0.61 0.28 0.00 -0.00 0.00 0.00 31.31 31.48 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 0.37 0.41 5.87 4.11 -2.00 0.54 114.58 123.89 1v9x h GLU 81 Ca 0.17 -0.02 -0.02 0.00 0.07 0.00 0.00 59.36 59.55 1v9x h GLU 81 Cb 0.39 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1v9x h GLU 81 CO -0.83 0.24 -0.20 -0.44 0.07 0.00 0.00 179.01 177.86 1v9x h ASP 82 N 0.38 -0.47 -0.83 3.06 5.19 0.58 -2.70 116.42 121.63 1v9x h ASP 82 Ca 0.53 -0.10 0.21 0.00 -0.62 0.00 0.00 57.03 57.05 1v9x h ASP 82 Cb 0.99 0.12 -0.05 0.00 0.18 0.00 0.00 39.33 40.57 1v9x h ASP 82 CO -0.53 -0.15 0.57 1.56 -3.12 0.00 0.00 179.24 177.58 1v9x h GLN 83 N -0.81 0.22 -0.46 3.56 4.20 0.14 0.38 115.11 122.34 1v9x h GLN 83 Ca -0.06 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.56 1v9x h GLN 83 Cb 0.54 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.26 1v9x h GLN 83 CO 0.09 0.15 -0.02 1.96 -0.67 0.00 0.00 178.83 180.34 1v9x h GLN 84 N 0.23 0.82 -0.42 1.46 1.08 -0.75 -2.66 115.11 114.88 1v9x h GLN 84 Ca 0.41 -0.27 0.12 0.00 -1.45 0.00 0.00 58.65 57.47 1v9x h GLN 84 Cb 1.27 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 28.61 1v9x h GLN 84 CO -0.10 0.89 0.31 0.87 -0.95 0.00 0.00 178.83 179.85 1v9x h LYS 85 N 0.67 0.00 0.06 1.46 1.57 -0.59 0.32 116.57 120.06 1v9x h LYS 85 Ca 0.13 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1v9x h LYS 85 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.84 1v9x h LYS 85 CO 0.03 0.00 -0.03 0.82 -0.57 0.00 0.00 179.45 179.70 1v9x h ILE 86 N 0.00 0.00 -0.99 1.86 1.08 -1.37 -2.97 117.51 115.12 1v9x h ILE 86 Ca 0.20 -0.13 0.14 0.00 -0.39 0.00 0.00 64.86 64.67 1v9x h ILE 86 Cb 0.82 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 34.48 1v9x h ILE 86 CO -0.00 0.00 0.62 0.08 -0.69 0.00 0.00 178.15 178.15 1v9x h ARG 87 N -0.21 0.90 0.00 2.37 0.11 -1.39 0.61 114.38 116.77 1v9x h ARG 87 Ca -0.01 -0.05 0.00 0.00 0.10 0.00 0.00 59.98 60.02 1v9x h ARG 87 Cb 0.06 -0.20 0.00 0.00 1.11 0.00 0.00 29.97 30.94 1v9x h ARG 87 CO 0.01 0.59 0.00 1.63 0.10 0.00 0.00 179.97 182.31 1v9x n LYS 88 N -4.67 0.65 -0.03 0.08 4.76 0.11 -1.46 118.16 117.60 1v9x n LYS 88 Ca 0.20 0.00 -0.05 0.00 -2.87 0.00 0.00 58.31 55.59 1v9x n LYS 88 Cb 0.41 -1.36 -0.03 0.00 -1.84 0.00 0.00 35.03 32.21 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 -0.86 0.00 0.09 2.13 4.19 0.19 -4.30 117.16 118.61 1v9x n TYR 89 Ca 0.11 0.00 -0.15 0.00 3.31 0.00 0.00 57.90 61.18 1v9x n TYR 89 Cb 0.05 -0.27 -0.09 0.00 0.49 0.00 0.00 39.34 39.53 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 1.44 -0.00 2.97 -1.51 -0.86 -3.34 116.25 114.95 1v9x h VAL 90 Ca -0.16 -2.73 -0.00 0.00 -1.23 0.00 0.00 66.70 62.59 1v9x h VAL 90 Cb 1.24 2.67 0.00 0.00 -2.13 0.00 0.00 31.29 33.07 1v9x h VAL 90 CO -0.02 0.80 -0.01 -0.33 -1.23 0.00 0.00 177.57 176.79 1v9x h GLU 91 N 0.15 0.01 -6.88 5.19 4.39 -1.49 -3.46 114.58 112.49 1v9x h GLU 91 Ca -0.11 -0.01 -0.44 0.00 0.34 0.00 0.00 59.36 59.15 1v9x h GLU 91 Cb 1.76 0.00 0.05 0.00 -0.10 0.00 0.00 28.75 30.46 1v9x h GLU 91 CO 0.18 0.59 -0.01 0.45 -1.16 0.00 0.00 179.01 179.07 1v9x s SER 92 N -5.81 5.23 0.01 1.42 0.15 -1.25 -5.01 113.70 108.44 1v9x s SER 92 Ca -0.16 0.04 -0.30 0.00 0.70 0.00 0.00 55.95 56.22 1v9x s SER 92 Cb 0.01 -0.90 -0.08 0.00 -1.71 0.00 0.00 66.02 63.34 1v9x s SER 92 CO 0.68 -1.19 1.87 -0.83 1.20 0.00 0.00 173.24 174.97 1v9x s GLY 93 N -4.43 1.48 1.07 9.45 0.00 -1.26 -4.70 107.32 108.93 1v9x s GLY 93 Ca 0.58 1.22 -0.23 0.00 0.00 0.00 0.00 44.72 46.29 1v9x s GLY 93 CO 0.39 3.33 -0.64 0.00 0.00 0.00 0.00 173.10 176.18 1v9x n ALA 94 N 7.33 -4.81 -0.63 3.20 0.00 -1.25 -4.92 120.51 119.43 1v9x n ALA 94 Ca 0.19 -1.34 -0.07 0.00 0.00 0.00 0.00 53.44 52.22 1v9x n ALA 94 Cb 0.41 -1.20 0.11 0.00 0.00 0.00 0.00 19.45 18.77 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 2.64 -2.08 3.78 0.00 0.00 -1.18 -4.90 105.19 103.45 1v9x n GLY 95 Ca -0.01 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 1v9x n GLY 95 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v9x s SER 96 N -1.94 6.02 0.31 1.61 0.01 -1.25 -4.59 113.70 113.87 1v9x s SER 96 Ca 0.25 2.19 -0.22 0.00 1.31 0.00 0.00 55.95 59.47 1v9x s SER 96 Cb -0.04 -2.59 -0.09 0.00 0.21 0.00 0.00 66.02 63.50 1v9x s SER 96 CO 0.21 -1.01 0.86 0.54 0.41 0.00 0.00 173.24 174.25 1v9x s ASN 97 N -1.63 7.15 -0.01 2.44 4.22 -1.26 -4.59 114.94 121.26 1v9x s ASN 97 Ca 0.68 1.64 0.05 0.00 -2.14 0.00 0.00 52.86 53.09 1v9x s ASN 97 Cb -0.25 -2.51 -0.01 0.00 1.28 0.00 0.00 41.25 39.76 1v9x s ASN 97 CO 0.29 -0.09 -0.16 -0.89 -2.04 0.00 0.00 177.10 174.21 1v9x s THR 98 N -1.70 1.23 0.12 0.54 2.01 -1.26 -5.06 115.64 111.52 1v9x s THR 98 Ca 0.50 -0.70 -0.30 0.00 0.31 0.00 0.00 61.69 61.50 1v9x s THR 98 Cb -0.16 -1.03 -0.08 0.00 0.01 0.00 0.00 72.50 71.24 1v9x s THR 98 CO 0.21 0.32 1.60 -1.28 -0.69 0.00 0.00 174.62 174.77 1v9x h SER 99 N 5.67 -1.15 -6.06 3.53 0.87 -2.07 -3.44 113.55 110.90 1v9x h SER 99 Ca -0.36 0.14 -0.44 0.00 -1.23 0.00 0.00 61.79 59.89 1v9x h SER 99 Cb 1.16 0.44 -0.26 0.00 -0.44 0.00 0.00 62.40 63.30 1v9x h SER 99 CO 0.48 -0.45 -0.65 1.07 -0.53 0.00 0.00 176.83 176.75 1v9x n THR 100 N -5.45 -0.11 -1.50 2.23 5.66 -1.26 -4.63 114.28 109.22 1v9x n THR 100 Ca -0.06 -0.06 -0.43 0.00 -3.05 0.00 0.00 64.05 60.45 1v9x n THR 100 Cb 0.36 -0.41 -0.07 0.00 -1.55 0.00 0.00 70.33 68.66 1v9x n THR 100 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1v9x n SER 101 N -1.58 1.78 -1.96 1.09 7.64 -1.26 -0.18 113.62 119.15 1v9x n SER 101 Ca 0.04 0.02 -0.11 0.00 1.01 0.00 0.00 58.87 59.83 1v9x n SER 101 Cb 0.35 -1.30 0.04 0.00 -1.01 0.00 0.00 64.21 62.28 1v9x n SER 101 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1v9x n THR 102 N 7.58 -1.50 0.01 0.44 -1.04 -1.26 -4.98 114.28 113.52 1v9x n THR 102 Ca 0.46 -0.02 -0.01 0.00 -2.04 0.00 0.00 64.05 62.44 1v9x n THR 102 Cb 0.30 -2.74 -0.00 0.00 -1.82 0.00 0.00 70.33 66.07 1v9x n THR 102 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1v9x h GLY 103 N -1.24 -0.90 -1.30 3.41 0.00 -0.91 -3.43 103.07 98.70 1v9x h GLY 103 Ca -0.27 0.39 -0.51 0.00 0.00 0.00 0.00 47.33 46.95 1v9x h GLY 103 CO 0.26 -0.34 0.40 -1.08 0.00 0.00 0.00 176.54 175.78 1v9x s THR 104 N -3.09 4.27 -0.01 4.70 -1.32 -1.26 -5.08 115.64 113.85 1v9x s THR 104 Ca -0.01 0.74 0.03 0.00 -1.21 0.00 0.00 61.69 61.24 1v9x s THR 104 Cb 0.00 -3.64 -0.01 0.00 -1.51 0.00 0.00 72.50 67.35 1v9x s THR 104 CO 0.02 -0.96 -0.09 -0.94 -2.21 0.00 0.00 174.62 170.43 1v9x s SER 105 N -4.07 1.11 -0.29 8.08 1.04 -1.26 -5.12 113.70 113.19 1v9x s SER 105 Ca 0.57 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.83 1v9x s SER 105 Cb -0.12 -0.14 0.09 0.00 0.10 0.00 0.00 66.02 65.95 1v9x s SER 105 CO 0.54 0.11 0.06 -0.89 0.98 0.00 0.00 173.24 174.04 1v9x s THR 106 N -0.18 1.18 -0.23 2.02 2.01 -1.26 -5.09 115.64 114.10 1v9x s THR 106 Ca 0.03 -1.46 -0.30 0.00 0.31 0.00 0.00 61.69 60.27 1v9x s THR 106 Cb -0.04 -1.81 0.16 0.00 0.01 0.00 0.00 72.50 70.83 1v9x s THR 106 CO -0.00 -0.53 1.21 -0.94 -0.69 0.00 0.00 174.62 173.66 1v9x s SER 107 N 1.48 -0.17 -1.60 3.53 1.04 -1.26 -4.98 113.70 111.74 1v9x s SER 107 Ca 0.07 0.17 -0.13 0.00 0.48 0.00 0.00 55.95 56.53 1v9x s SER 107 Cb -0.18 0.14 0.11 0.00 0.10 0.00 0.00 66.02 66.19 1v9x s SER 107 CO -0.18 -0.17 0.77 -0.24 0.98 0.00 0.00 173.24 174.40 1v9x n SER 108 N 0.53 -3.10 -4.16 7.02 2.88 -1.26 -4.95 113.62 110.58 1v9x n SER 108 Ca -0.04 -0.95 -0.20 0.00 -1.33 0.00 0.00 58.87 56.36 1v9x n SER 108 Cb 0.58 -3.14 -0.13 0.00 -0.75 0.00 0.00 64.21 60.77 1v9x n SER 108 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1v9x s SER 109 N -3.52 1.73 -0.31 -3.46 0.01 -1.26 -5.12 113.70 101.76 1v9x s SER 109 Ca 0.57 -0.48 0.02 0.00 1.31 0.00 0.00 55.95 57.36 1v9x s SER 109 Cb -0.30 -0.11 0.15 0.00 0.21 0.00 0.00 66.02 65.98 1v9x s SER 109 CO 0.89 0.03 0.38 -0.83 0.41 0.00 0.00 173.24 174.12 1v9x s GLY 110 N -1.23 -0.40 1.02 3.44 0.00 -1.26 -5.16 107.32 103.74 1v9x s GLY 110 Ca 0.02 -0.12 -0.13 0.00 0.00 0.00 0.00 44.72 44.49 1v9x s GLY 110 CO 0.01 2.92 1.09 2.56 0.00 0.00 0.00 173.10 179.69 1v9x s PRO 111 N 2.29 0.23 -0.16 2.90 0.04 -1.26 -5.09 135.00 133.96 1v9x s PRO 111 Ca 0.11 0.45 -0.10 0.00 0.04 0.00 0.00 61.00 61.50 1v9x s PRO 111 Cb -0.13 -1.72 0.05 0.00 0.04 0.00 0.00 34.50 32.74 1v9x s PRO 111 CO -0.26 -2.85 0.39 -1.54 0.04 0.00 0.00 177.00 172.78 1v9x s SER 112 N -3.48 -0.46 -0.06 6.66 1.04 -1.26 -5.16 113.70 110.97 1v9x s SER 112 Ca 0.66 0.83 -0.30 0.00 0.48 0.00 0.00 55.95 57.62 1v9x s SER 112 Cb -0.18 0.75 0.11 0.00 0.10 0.00 0.00 66.02 66.80 1v9x s SER 112 CO 0.58 -0.17 0.93 -0.55 0.98 0.00 0.00 173.24 175.01 1v9x s SER 113 N 1.01 -0.36 0.00 7.02 0.15 -1.26 -5.11 113.70 115.14 1v9x s SER 113 Ca -0.06 0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.73 1v9x s SER 113 Cb -0.07 0.35 0.00 0.00 -1.71 0.00 0.00 66.02 64.59 1v9x s SER 113 CO -0.08 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 174.46