#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 -3.69 -4.56 1.61 2.88 -1.26 -4.79 113.62 103.81 1v9x n SER 2 Ca 0.00 0.35 -0.41 0.00 -1.33 0.00 0.00 58.87 57.48 1v9x n SER 2 Cb 0.00 -0.99 -0.03 0.00 -0.75 0.00 0.00 64.21 62.44 1v9x n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1v9x s SER 3 N -1.41 6.42 0.33 -3.46 0.15 -1.26 -4.88 113.70 109.59 1v9x s SER 3 Ca 0.51 -1.32 0.00 0.00 0.70 0.00 0.00 55.95 55.85 1v9x s SER 3 Cb -0.25 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.49 1v9x s SER 3 CO 0.72 -1.58 0.00 0.61 1.20 0.00 0.00 173.24 174.19 1v9x n GLY 4 N 6.72 -1.78 3.80 9.45 0.00 -1.26 -5.05 105.19 117.07 1v9x n GLY 4 Ca 0.30 -0.82 -0.01 0.00 0.00 0.00 0.00 46.02 45.49 1v9x n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1v9x s SER 5 N -5.98 -0.05 -0.22 1.61 1.04 -1.26 -5.08 113.70 103.76 1v9x s SER 5 Ca 0.00 -0.36 -0.17 0.00 0.48 0.00 0.00 55.95 55.90 1v9x s SER 5 Cb 0.00 0.32 -0.12 0.00 0.10 0.00 0.00 66.02 66.32 1v9x s SER 5 CO 0.00 -0.62 -0.13 -1.20 0.98 0.00 0.00 173.24 172.27 1v9x n SER 6 N -0.81 1.90 -4.56 7.02 7.64 -1.26 -4.78 113.62 118.76 1v9x n SER 6 Ca -0.04 0.41 -0.14 0.00 1.01 0.00 0.00 58.87 60.11 1v9x n SER 6 Cb 0.61 -0.87 -0.08 0.00 -1.01 0.00 0.00 64.21 62.86 1v9x n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v9x n GLY 7 N 1.40 -0.16 3.16 0.23 0.00 -1.26 -4.85 105.19 103.71 1v9x n GLY 7 Ca -0.34 0.31 -0.10 0.00 0.00 0.00 0.00 46.02 45.88 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 13.93 0.08 0.40 1.61 0.09 -1.26 -5.15 115.29 124.99 1v9x s HIS 8 Ca 0.96 -0.31 -0.26 0.00 -0.00 0.00 0.00 55.06 55.45 1v9x s HIS 8 Cb -0.18 -0.05 -0.09 0.00 -0.00 0.00 0.00 32.58 32.27 1v9x s HIS 8 CO 0.12 -0.41 1.27 0.15 -0.00 0.00 0.00 174.74 175.87 1v9x s LYS 9 N -2.49 3.98 0.14 1.40 1.02 -1.26 -4.95 119.74 117.58 1v9x s LYS 9 Ca -0.06 2.09 -0.11 0.00 0.02 0.00 0.00 55.97 57.92 1v9x s LYS 9 Cb -0.02 -2.74 -0.04 0.00 -0.52 0.00 0.00 37.83 34.51 1v9x s LYS 9 CO -0.04 -0.46 1.48 -1.00 -0.92 0.00 0.00 175.35 174.42 1v9x h PRO 10 N 2.67 0.95 -6.39 -1.68 0.13 -1.86 -3.44 132.00 122.38 1v9x h PRO 10 Ca -0.49 -0.49 -0.61 0.00 -0.87 0.00 0.00 66.00 63.53 1v9x h PRO 10 Cb 1.24 0.01 -0.13 0.00 0.13 0.00 0.00 31.00 32.26 1v9x h PRO 10 CO 0.63 1.15 -0.71 -1.58 -0.23 0.00 0.00 178.00 177.26 1v9x s TRP 11 N -4.42 2.66 0.12 1.56 0.52 -1.21 -0.00 118.94 118.17 1v9x s TRP 11 Ca -0.11 -0.21 0.06 0.00 0.02 0.00 0.00 56.10 55.86 1v9x s TRP 11 Cb 0.11 -1.28 -0.04 0.00 -1.15 0.00 0.00 33.47 31.12 1v9x s TRP 11 CO 0.88 0.53 -0.15 -0.98 0.02 0.00 0.00 176.95 177.26 1v9x s ARG 12 N -2.97 1.02 -0.07 4.98 1.70 -1.02 -0.42 118.95 122.16 1v9x s ARG 12 Ca 0.26 -1.21 0.00 0.00 -0.47 0.00 0.00 55.73 54.31 1v9x s ARG 12 Cb -0.08 -0.95 0.02 0.00 -0.57 0.00 0.00 34.95 33.37 1v9x s ARG 12 CO 0.16 0.19 -0.05 0.00 -1.08 0.00 0.00 175.30 174.52 1v9x s ALA 13 N -1.98 0.92 -0.24 7.88 0.00 0.51 -3.23 121.76 125.62 1v9x s ALA 13 Ca 0.08 -0.25 -0.29 0.00 0.00 0.00 0.00 51.96 51.50 1v9x s ALA 13 Cb -0.06 -0.66 0.16 0.00 0.00 0.00 0.00 23.12 22.56 1v9x s ALA 13 CO 0.03 -0.23 1.20 -1.83 0.00 0.00 0.00 175.76 174.93 1v9x s GLU 14 N 1.40 0.31 0.01 0.00 -1.05 -1.26 -4.20 118.70 113.91 1v9x s GLU 14 Ca -0.03 0.13 -0.30 0.00 -0.15 0.00 0.00 54.97 54.62 1v9x s GLU 14 Cb -0.13 0.15 -0.03 0.00 -0.44 0.00 0.00 34.13 33.67 1v9x s GLU 14 CO -0.03 -0.09 1.01 0.71 0.95 0.00 0.00 175.26 177.81 1v9x s TYR 15 N -0.81 3.64 0.58 4.83 2.02 -1.26 -3.71 117.35 122.64 1v9x s TYR 15 Ca 0.04 1.65 -0.19 0.00 -0.37 0.00 0.00 57.07 58.20 1v9x s TYR 15 Cb -0.02 -3.16 -0.05 0.00 -0.40 0.00 0.00 41.96 38.34 1v9x s TYR 15 CO -0.05 -0.16 1.06 0.00 -1.57 0.00 0.00 175.55 174.82 1v9x n ALA 16 N 3.84 0.48 -0.09 3.71 0.00 -1.05 -4.72 120.51 122.67 1v9x n ALA 16 Ca 0.06 0.05 -0.10 0.00 0.00 0.00 0.00 53.44 53.45 1v9x n ALA 16 Cb 0.50 -2.16 -0.16 0.00 0.00 0.00 0.00 19.45 17.63 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 -0.97 0.69 -4.12 0.00 5.02 -1.26 -0.92 118.16 116.59 1v9x n LYS 17 Ca 0.13 0.01 -0.09 0.00 -2.02 0.00 0.00 58.31 56.35 1v9x n LYS 17 Cb 0.46 -1.54 -0.10 0.00 -0.02 0.00 0.00 35.03 33.83 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 -5.54 0.48 -0.44 4.39 0.15 -1.26 -4.71 113.70 106.78 1v9x s SER 18 Ca -0.10 -1.09 -0.01 0.00 0.70 0.00 0.00 55.95 55.45 1v9x s SER 18 Cb 0.06 0.23 0.28 0.00 -1.71 0.00 0.00 66.02 64.88 1v9x s SER 18 CO 0.83 -0.64 2.05 -1.20 1.20 0.00 0.00 173.24 175.48 1v9x n SER 19 N 0.01 6.87 -0.03 5.45 7.64 -1.26 -3.76 113.62 128.53 1v9x n SER 19 Ca -0.10 -3.30 -0.21 0.00 1.01 0.00 0.00 58.87 56.27 1v9x n SER 19 Cb 0.62 -1.04 -0.13 0.00 -1.01 0.00 0.00 64.21 62.65 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 -0.03 0.72 -1.72 1.43 5.12 -1.26 -4.76 116.66 116.16 1v9x n ARG 20 Ca 0.41 0.27 -0.34 0.00 -1.93 0.00 0.00 57.85 56.27 1v9x n ARG 20 Cb 0.60 -1.68 0.05 0.00 -1.16 0.00 0.00 32.46 30.28 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 -6.95 4.92 -0.01 0.55 1.04 -1.26 -4.91 113.70 107.08 1v9x s SER 21 Ca -0.26 2.12 0.01 0.00 0.48 0.00 0.00 55.95 58.30 1v9x s SER 21 Cb 0.07 -2.56 -0.00 0.00 0.10 0.00 0.00 66.02 63.63 1v9x s SER 21 CO 0.72 -1.76 -0.04 -0.44 0.98 0.00 0.00 173.24 172.70 1v9x s SER 22 N -2.34 0.54 0.85 7.02 0.01 -1.26 -1.52 113.70 117.00 1v9x s SER 22 Ca 0.70 -0.08 -0.11 0.00 1.31 0.00 0.00 55.95 57.77 1v9x s SER 22 Cb -0.23 -0.09 0.11 0.00 0.21 0.00 0.00 66.02 66.02 1v9x s SER 22 CO 0.41 0.04 1.14 0.00 0.41 0.00 0.00 173.24 175.24 1v9x n LYS 24 N -3.81 1.95 -0.02 0.00 4.76 -1.08 -3.09 118.16 116.86 1v9x n LYS 24 Ca 0.11 0.00 -0.13 0.00 -2.87 0.00 0.00 58.31 55.43 1v9x n LYS 24 Cb 0.52 -1.30 -0.08 0.00 -1.84 0.00 0.00 35.03 32.32 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 -1.94 -3.31 112.91 110.80 1v9x h THR 25 Ca -0.32 -0.91 0.00 0.00 0.77 0.00 0.00 66.41 65.95 1v9x h THR 25 Cb 1.72 1.80 0.00 0.00 -1.74 0.00 0.00 68.15 69.93 1v9x h THR 25 CO 0.01 0.25 -1.79 0.00 0.37 0.00 0.00 175.52 174.36 1v9x n LYS 27 N -2.10 -4.23 -4.72 0.00 4.76 -1.18 -5.04 118.16 105.65 1v9x n LYS 27 Ca -0.02 0.49 -0.32 0.00 -2.87 0.00 0.00 58.31 55.59 1v9x n LYS 27 Cb 0.51 -4.47 -0.08 0.00 -1.84 0.00 0.00 35.03 29.15 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 -3.52 3.92 0.03 4.39 0.01 -1.23 -4.87 113.70 112.43 1v9x s SER 28 Ca 0.15 -1.64 -0.20 0.00 1.31 0.00 0.00 55.95 55.58 1v9x s SER 28 Cb -0.07 0.46 -0.06 0.00 0.21 0.00 0.00 66.02 66.56 1v9x s SER 28 CO 0.43 -0.84 0.57 -0.69 0.41 0.00 0.00 173.24 173.12 1v9x s VAL 29 N -2.91 4.84 -0.80 3.43 1.01 -1.26 0.12 120.40 124.82 1v9x s VAL 29 Ca 0.10 1.21 -0.10 0.00 0.00 0.00 0.00 61.98 63.19 1v9x s VAL 29 Cb 0.02 -3.90 0.21 0.00 0.00 0.00 0.00 36.38 32.71 1v9x s VAL 29 CO 0.06 0.49 0.71 -0.63 0.00 0.00 0.00 175.10 175.72 1v9x s ILE 30 N -0.66 5.12 0.64 2.22 1.01 -0.57 -4.82 121.20 124.14 1v9x s ILE 30 Ca 0.30 -2.72 -0.18 0.00 0.00 0.00 0.00 60.65 58.05 1v9x s ILE 30 Cb -0.19 -4.19 -0.02 0.00 0.01 0.00 0.00 42.46 38.08 1v9x s ILE 30 CO 0.18 -1.00 1.19 0.59 0.00 0.00 0.00 174.94 175.89 1v9x n ASN 31 N 3.70 1.65 -4.60 3.58 4.13 -1.26 -4.33 115.26 118.12 1v9x n ASN 31 Ca 0.13 0.81 -0.29 0.00 1.68 0.00 0.00 54.58 56.91 1v9x n ASN 31 Cb 0.44 -1.50 0.20 0.00 -1.54 0.00 0.00 39.78 37.37 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 -3.20 0.16 -0.93 3.52 -2.85 -1.25 -3.63 119.74 111.56 1v9x s LYS 32 Ca 0.81 1.03 0.00 0.00 -1.00 0.00 0.00 55.97 56.80 1v9x s LYS 32 Cb -0.39 -1.67 0.00 0.00 -2.06 0.00 0.00 37.83 33.72 1v9x s LYS 32 CO 0.42 -3.05 0.00 0.39 0.10 0.00 0.00 175.35 173.21 1v9x n GLU 33 N -4.47 -0.73 -4.73 1.78 1.02 -0.10 -4.88 120.64 108.53 1v9x n GLU 33 Ca 0.06 0.66 -0.24 0.00 -0.02 0.00 0.00 57.16 57.62 1v9x n GLU 33 Cb 0.54 -4.63 -0.15 0.00 -0.02 0.00 0.00 31.44 27.18 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 -2.73 2.12 -0.45 1.62 0.01 -1.24 -4.93 114.94 109.35 1v9x s ASN 34 Ca 0.00 -0.39 -0.29 0.00 -0.71 0.00 0.00 52.86 51.47 1v9x s ASN 34 Cb 0.00 -0.21 0.02 0.00 0.41 0.00 0.00 41.25 41.47 1v9x s ASN 34 CO 0.00 0.18 1.22 0.12 -1.51 0.00 0.00 177.10 177.11 1v9x s PHE 35 N -0.57 2.70 0.53 2.20 5.36 -1.26 -2.52 117.98 124.42 1v9x s PHE 35 Ca 0.06 0.72 0.01 0.00 -0.96 0.00 0.00 56.93 56.76 1v9x s PHE 35 Cb -0.07 -4.37 0.00 0.00 -0.34 0.00 0.00 43.02 38.24 1v9x s PHE 35 CO 0.00 -1.48 0.05 -0.98 -1.46 0.00 0.00 175.22 171.35 1v9x s ARG 36 N 4.57 2.23 -0.01 10.12 1.70 -1.24 -2.95 118.95 133.37 1v9x s ARG 36 Ca 0.52 -2.39 0.00 0.00 -0.47 0.00 0.00 55.73 53.39 1v9x s ARG 36 Cb -0.09 -1.59 0.01 0.00 -0.57 0.00 0.00 34.95 32.71 1v9x s ARG 36 CO 0.31 -0.43 -0.00 -0.51 -1.08 0.00 0.00 175.30 173.59 1v9x s LEU 37 N -3.95 1.72 -0.20 -1.89 1.43 -0.52 -4.10 118.68 111.18 1v9x s LEU 37 Ca 0.06 -0.01 0.01 0.00 -1.03 0.00 0.00 54.13 53.15 1v9x s LEU 37 Cb 0.00 -0.09 0.04 0.00 0.03 0.00 0.00 46.19 46.17 1v9x s LEU 37 CO 0.03 -0.02 -0.11 -0.83 0.23 0.00 0.00 176.35 175.65 1v9x s GLY 38 N 0.31 1.29 -0.84 -3.19 0.00 -1.20 -1.20 107.32 102.49 1v9x s GLY 38 Ca -0.03 -1.22 -0.25 0.00 0.00 0.00 0.00 44.72 43.22 1v9x s GLY 38 CO -0.01 0.66 1.48 1.25 0.00 0.00 0.00 173.10 176.49 1v9x s LYS 39 N 1.38 3.19 -0.27 2.90 2.20 -1.08 -2.43 119.74 125.63 1v9x s LYS 39 Ca -0.01 -0.44 -0.28 0.00 -0.36 0.00 0.00 55.97 54.87 1v9x s LYS 39 Cb -0.16 -4.71 -0.03 0.00 -1.51 0.00 0.00 37.83 31.42 1v9x s LYS 39 CO -0.08 -2.37 1.95 -0.51 -0.36 0.00 0.00 175.35 173.97 1v9x s LEU 40 N 6.35 3.52 0.16 5.43 1.43 0.99 -3.16 118.68 133.40 1v9x s LEU 40 Ca 0.46 1.57 0.10 0.00 -1.03 0.00 0.00 54.13 55.23 1v9x s LEU 40 Cb -0.06 -3.52 -0.04 0.00 0.03 0.00 0.00 46.19 42.60 1v9x s LEU 40 CO 0.05 -1.76 -0.18 0.68 0.23 0.00 0.00 176.35 175.37 1v9x s VAL 41 N 7.24 2.73 -0.49 -1.59 -7.23 -1.26 -4.77 120.40 115.03 1v9x s VAL 41 Ca 0.87 -1.73 -0.07 0.00 -1.81 0.00 0.00 61.98 59.25 1v9x s VAL 41 Cb -0.27 -2.30 0.13 0.00 0.56 0.00 0.00 36.38 34.50 1v9x s VAL 41 CO 0.34 -0.02 0.34 -1.10 -0.31 0.00 0.00 175.10 174.35 1v9x s GLN 42 N -2.48 2.41 0.09 4.82 -0.21 -1.26 -3.89 119.66 119.14 1v9x s GLN 42 Ca 0.20 -1.93 -0.06 0.00 0.02 0.00 0.00 55.36 53.59 1v9x s GLN 42 Cb -0.09 -3.82 -0.21 0.00 1.00 0.00 0.00 33.01 29.89 1v9x s GLN 42 CO 0.11 -1.16 1.20 0.66 -2.12 0.00 0.00 175.29 173.97 1v9x h SER 43 N 8.09 0.56 -4.90 5.90 4.64 -1.96 -3.46 113.55 122.41 1v9x h SER 43 Ca -0.14 -0.52 -0.20 0.00 -0.47 0.00 0.00 61.79 60.46 1v9x h SER 43 Cb 1.05 -0.18 -0.19 0.00 -0.31 0.00 0.00 62.40 62.77 1v9x h SER 43 CO 0.79 1.36 -0.71 -0.89 -0.87 0.00 0.00 176.83 176.51 1v9x s THR 44 N -2.96 0.35 -0.51 2.95 2.01 -1.26 -5.04 115.64 111.18 1v9x s THR 44 Ca -0.06 -1.27 -0.06 0.00 0.31 0.00 0.00 61.69 60.61 1v9x s THR 44 Cb 0.07 -0.79 -0.14 0.00 0.01 0.00 0.00 72.50 71.65 1v9x s THR 44 CO 0.89 -0.60 3.24 1.41 -0.69 0.00 0.00 174.62 178.86 1v9x n HIS 45 N 1.07 0.99 -3.71 4.92 -0.00 -1.26 -4.80 115.22 112.43 1v9x n HIS 45 Ca -0.20 -2.00 -0.10 0.00 -0.00 0.00 0.00 57.72 55.42 1v9x n HIS 45 Cb 0.57 -1.75 -0.04 0.00 -0.00 0.00 0.00 29.99 28.77 1v9x n HIS 45 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 1v9x s PHE 46 N 0.54 -0.15 -0.64 4.41 0.40 -1.26 -5.09 117.98 116.19 1v9x s PHE 46 Ca 0.65 -0.18 -0.31 0.00 -0.60 0.00 0.00 56.93 56.49 1v9x s PHE 46 Cb 0.29 0.38 -0.14 0.00 0.51 0.00 0.00 43.02 44.06 1v9x s PHE 46 CO -0.06 -0.88 2.44 -0.25 0.70 0.00 0.00 175.22 177.17 1v9x n ASP 47 N -0.33 1.43 0.00 1.36 8.00 -1.26 -4.70 116.55 121.05 1v9x n ASP 47 Ca -0.11 0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.45 1v9x n ASP 47 Cb 0.63 -1.22 0.00 0.00 -0.02 0.00 0.00 41.12 40.51 1v9x n ASP 47 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1v9x n GLY 48 N 6.42 0.61 3.24 0.44 0.00 -1.26 -5.12 105.19 109.52 1v9x n GLY 48 Ca 0.50 0.56 -0.29 0.00 0.00 0.00 0.00 46.02 46.79 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 1.77 -0.71 -0.61 1.01 -1.26 -4.55 121.20 116.85 1v9x s ILE 49 Ca 0.00 -0.95 -0.05 0.00 0.00 0.00 0.00 60.65 59.65 1v9x s ILE 49 Cb 0.00 -1.48 0.18 0.00 0.01 0.00 0.00 42.46 41.18 1v9x s ILE 49 CO 0.00 0.50 0.56 -0.04 0.00 0.00 0.00 174.94 175.96 1v9x s MET 50 N -0.45 2.90 -0.42 2.79 -1.94 -1.25 -5.03 119.30 115.89 1v9x s MET 50 Ca 0.07 -2.63 -0.28 0.00 -1.71 0.00 0.00 55.69 51.14 1v9x s MET 50 Cb -0.09 -3.92 -0.01 0.00 2.01 0.00 0.00 34.83 32.81 1v9x s MET 50 CO -0.00 -1.21 1.74 -1.25 -0.01 0.00 0.00 175.02 174.29 1v9x s PRO 51 N -0.21 3.18 -0.68 2.03 0.04 -1.26 -4.23 135.00 133.88 1v9x s PRO 51 Ca 0.19 1.10 -0.26 0.00 0.04 0.00 0.00 61.00 62.07 1v9x s PRO 51 Cb -0.16 -4.22 -0.05 0.00 0.04 0.00 0.00 34.50 30.11 1v9x s PRO 51 CO -0.06 -2.05 2.07 -1.64 0.04 0.00 0.00 177.00 175.36 1v9x s MET 52 N 5.91 2.37 -0.20 4.56 -1.94 -1.19 -4.78 119.30 124.03 1v9x s MET 52 Ca 0.73 0.55 -0.29 0.00 -1.71 0.00 0.00 55.69 54.97 1v9x s MET 52 Cb -0.18 -4.64 -0.02 0.00 2.01 0.00 0.00 34.83 32.00 1v9x s MET 52 CO 0.30 -3.21 1.39 -1.58 -0.01 0.00 0.00 175.02 171.90 1v9x s TRP 53 N 10.69 2.56 -0.09 -0.03 0.23 -1.26 -2.63 118.94 128.41 1v9x s TRP 53 Ca 0.77 0.78 -0.05 0.00 -2.03 0.00 0.00 56.10 55.58 1v9x s TRP 53 Cb -0.12 -3.76 0.04 0.00 0.03 0.00 0.00 33.47 29.66 1v9x s TRP 53 CO 0.15 -2.19 0.21 -0.80 0.96 0.00 0.00 176.95 175.28 1v9x s ASN 54 N 2.79 -0.21 0.16 2.95 0.01 -0.34 -2.65 114.94 117.64 1v9x s ASN 54 Ca 0.60 0.44 -0.33 0.00 -0.71 0.00 0.00 52.86 52.86 1v9x s ASN 54 Cb -0.22 0.35 -0.16 0.00 0.41 0.00 0.00 41.25 41.63 1v9x s ASN 54 CO 0.21 -0.14 1.08 1.41 -1.51 0.00 0.00 177.10 178.16 1v9x n HIS 55 N 3.92 1.03 0.30 2.20 8.25 -1.26 -1.44 115.22 128.22 1v9x n HIS 55 Ca -0.23 0.76 0.15 0.00 -0.26 0.00 0.00 57.72 58.14 1v9x n HIS 55 Cb 0.54 -2.22 0.75 0.00 1.12 0.00 0.00 29.99 30.18 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 3.06 1.51 0.00 -1.41 0.00 -1.80 0.71 119.26 121.34 1v9x h ALA 56 Ca -0.43 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 1v9x h ALA 56 Cb 1.36 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1v9x h ALA 56 CO 0.68 -0.44 -1.42 0.45 0.00 0.00 0.00 179.25 178.52 1v9x n SER 57 N -2.99 0.60 0.17 0.00 2.88 -1.26 -3.13 113.62 109.90 1v9x n SER 57 Ca -0.00 0.24 0.06 0.00 -1.33 0.00 0.00 58.87 57.84 1v9x n SER 57 Cb 0.46 0.77 0.19 0.00 -0.75 0.00 0.00 64.21 64.89 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 -3.29 1.59 0.06 0.00 2.08 -0.90 -4.12 119.36 114.77 1v9x n ILE 59 Ca 0.01 -0.18 0.15 0.00 0.56 0.00 0.00 62.75 63.29 1v9x n ILE 59 Cb 0.61 -1.96 0.64 0.00 -0.75 0.00 0.00 39.64 38.18 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 -0.77 0.07 -1.69 1.39 3.38 -1.65 0.20 115.31 116.24 1v9x h LEU 60 Ca -0.39 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.56 1v9x h LEU 60 Cb 1.48 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 42.22 1v9x h LEU 60 CO -0.16 0.05 -0.10 0.07 0.09 0.00 0.00 178.44 178.38 1v9x h LYS 61 N 0.08 0.00 0.00 1.13 2.10 -1.68 -2.87 116.57 115.33 1v9x h LYS 61 Ca 0.19 0.00 -0.36 0.00 -2.00 0.00 0.00 60.65 58.47 1v9x h LYS 61 Cb 0.63 0.00 0.06 0.00 -0.90 0.00 0.00 32.23 32.02 1v9x h LYS 61 CO -0.02 0.10 0.09 1.63 -2.00 0.00 0.00 179.45 179.25 1v9x n LYS 62 N -3.35 0.06 -4.42 0.07 5.02 0.69 -4.36 118.16 111.87 1v9x n LYS 62 Ca -0.01 -2.12 -0.21 0.00 -2.02 0.00 0.00 58.31 53.95 1v9x n LYS 62 Cb 0.29 -0.51 -0.10 0.00 -0.02 0.00 0.00 35.03 34.69 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 1.89 -1.31 -0.18 2.01 -1.26 -3.86 115.64 110.59 1v9x s THR 63 Ca 0.51 -2.21 -0.02 0.00 0.31 0.00 0.00 61.69 60.28 1v9x s THR 63 Cb -0.03 -2.31 0.01 0.00 0.01 0.00 0.00 72.50 70.18 1v9x s THR 63 CO 0.34 -0.40 0.85 0.29 -0.69 0.00 0.00 174.62 175.01 1v9x n LYS 64 N -0.55 -5.67 -0.04 4.92 5.02 -1.26 -4.89 118.16 115.69 1v9x n LYS 64 Ca -0.06 0.69 -0.09 0.00 -2.02 0.00 0.00 58.31 56.83 1v9x n LYS 64 Cb 0.62 -5.45 -0.03 0.00 -0.02 0.00 0.00 35.03 30.15 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 -4.35 0.25 -5.08 1.97 1.13 -1.26 -5.04 117.38 105.00 1v9x n GLN 65 Ca -0.23 0.11 -0.31 0.00 -1.94 0.00 0.00 57.00 54.63 1v9x n GLN 65 Cb 0.65 -0.93 -0.15 0.00 0.11 0.00 0.00 30.24 29.91 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 -2.32 2.13 -0.19 5.09 1.01 -1.26 -5.03 121.20 120.64 1v9x s ILE 66 Ca -0.15 -1.25 -0.21 0.00 0.00 0.00 0.00 60.65 59.03 1v9x s ILE 66 Cb 0.04 -1.79 -0.21 0.00 0.01 0.00 0.00 42.46 40.52 1v9x s ILE 66 CO 0.21 0.46 0.31 0.50 0.00 0.00 0.00 174.94 176.42 1v9x h LYS 67 N 5.10 0.04 -2.53 2.79 3.64 -1.96 -3.45 116.57 120.20 1v9x h LYS 67 Ca -0.45 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 58.81 1v9x h LYS 67 Cb 1.13 0.02 -0.17 0.00 -0.41 0.00 0.00 32.23 32.80 1v9x h LYS 67 CO 0.45 1.03 0.08 0.45 -2.27 0.00 0.00 179.45 179.19 1v9x s SER 68 N -6.81 -0.51 0.57 4.20 0.15 -1.26 -4.79 113.70 105.25 1v9x s SER 68 Ca -0.27 0.35 0.28 0.00 0.70 0.00 0.00 55.95 57.02 1v9x s SER 68 Cb 0.05 0.50 1.51 0.00 -1.71 0.00 0.00 66.02 66.37 1v9x s SER 68 CO 0.63 -0.68 1.97 -0.37 1.20 0.00 0.00 173.24 175.99 1v9x h VAL 69 N 2.89 0.48 0.00 4.45 -1.51 -1.94 0.33 116.25 120.95 1v9x h VAL 69 Ca -0.30 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.15 1v9x h VAL 69 Cb 1.19 0.70 -0.00 0.00 -2.13 0.00 0.00 31.29 31.05 1v9x h VAL 69 CO 0.40 0.00 -0.12 0.44 -1.23 0.00 0.00 177.57 177.06 1v9x h ASP 70 N 0.00 0.00 1.59 4.19 5.19 -2.01 -1.76 116.42 123.62 1v9x h ASP 70 Ca 0.19 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.55 1v9x h ASP 70 Cb 0.97 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.47 1v9x h ASP 70 CO -0.00 0.12 -0.28 0.44 -3.12 0.00 0.00 179.24 176.40 1v9x h ASP 71 N 0.00 0.00 -3.53 6.45 5.19 -0.73 -3.45 116.42 120.36 1v9x h ASP 71 Ca -0.00 0.00 -0.52 0.00 -0.62 0.00 0.00 57.03 55.89 1v9x h ASP 71 Cb 0.36 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.85 1v9x h ASP 71 CO 0.02 0.28 0.37 -0.69 -3.12 0.00 0.00 179.24 176.09 1v9x s VAL 72 N -3.15 4.58 0.25 -1.35 1.01 -0.66 -3.31 120.40 117.77 1v9x s VAL 72 Ca 0.05 2.06 -0.03 0.00 0.00 0.00 0.00 61.98 64.05 1v9x s VAL 72 Cb 0.07 -4.32 -0.05 0.00 0.00 0.00 0.00 36.38 32.09 1v9x s VAL 72 CO 0.70 0.28 0.48 -0.70 0.00 0.00 0.00 175.10 175.86 1v9x s GLU 73 N 0.24 3.59 -0.97 2.72 2.56 0.44 -4.18 118.70 123.10 1v9x s GLU 73 Ca 0.48 -0.13 0.00 0.00 0.00 0.00 0.00 54.97 55.32 1v9x s GLU 73 Cb -0.23 -2.73 0.00 0.00 2.00 0.00 0.00 34.13 33.17 1v9x s GLU 73 CO 0.29 0.30 0.00 0.41 -0.56 0.00 0.00 175.26 175.70 1v9x n GLY 74 N -0.79 0.42 0.17 -1.50 0.00 -1.26 0.19 105.19 102.42 1v9x n GLY 74 Ca -0.03 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.91 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 1.40 0.00 -0.61 2.10 -1.74 -2.88 117.51 115.78 1v9x h ILE 75 Ca -0.21 -2.17 0.00 0.00 1.08 0.00 0.00 64.86 63.56 1v9x h ILE 75 Cb 0.83 2.13 0.00 0.00 -1.09 0.00 0.00 36.82 38.69 1v9x h ILE 75 CO 0.29 0.64 0.00 -1.84 -1.08 0.00 0.00 178.15 176.16 1v9x n GLU 76 N -3.82 0.02 0.09 2.19 0.28 -1.26 -1.64 120.64 116.50 1v9x n GLU 76 Ca -0.04 0.31 0.12 0.00 -0.16 0.00 0.00 57.16 57.40 1v9x n GLU 76 Cb 0.69 -1.53 0.10 0.00 1.43 0.00 0.00 31.44 32.13 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 -4.15 -1.84 0.87 -1.86 -3.47 113.55 103.10 1v9x h SER 77 Ca 0.00 -0.12 -0.48 0.00 -1.23 0.00 0.00 61.79 59.96 1v9x h SER 77 Cb 0.21 0.00 0.13 0.00 -0.44 0.00 0.00 62.40 62.31 1v9x h SER 77 CO 0.00 0.06 0.28 -0.76 -0.53 0.00 0.00 176.83 175.88 1v9x s LEU 78 N -4.82 2.31 0.43 2.23 1.43 -0.65 -5.01 118.68 114.62 1v9x s LEU 78 Ca 0.03 1.37 -0.23 0.00 -1.03 0.00 0.00 54.13 54.27 1v9x s LEU 78 Cb 0.11 -3.84 -0.08 0.00 0.03 0.00 0.00 46.19 42.41 1v9x s LEU 78 CO 0.75 -2.44 1.10 -0.13 0.23 0.00 0.00 176.35 175.85 1v9x s ARG 79 N -5.03 3.96 0.15 1.70 1.81 -1.26 -4.67 118.95 115.61 1v9x s ARG 79 Ca 0.63 1.61 -0.23 0.00 -1.72 0.00 0.00 55.73 56.01 1v9x s ARG 79 Cb -0.17 -2.44 0.01 0.00 -0.45 0.00 0.00 34.95 31.91 1v9x s ARG 79 CO 0.56 -0.34 1.32 1.87 -0.68 0.00 0.00 175.30 178.03 1v9x n TRP 80 N -0.34 -0.27 -0.34 -0.53 -0.00 -1.26 0.17 117.44 114.87 1v9x n TRP 80 Ca 0.06 1.07 0.15 0.00 -0.00 0.00 0.00 57.50 58.78 1v9x n TRP 80 Cb 0.49 -0.64 0.34 0.00 -0.00 0.00 0.00 31.31 31.51 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 0.64 0.32 5.87 4.11 -2.00 -0.40 114.58 123.13 1v9x h GLU 81 Ca 0.18 -0.04 -0.02 0.00 0.07 0.00 0.00 59.36 59.56 1v9x h GLU 81 Cb 0.39 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1v9x h GLU 81 CO -0.82 0.43 -0.16 -0.44 0.07 0.00 0.00 179.01 178.09 1v9x h ASP 82 N 0.66 -0.37 -0.90 3.06 5.19 0.13 -2.84 116.42 121.36 1v9x h ASP 82 Ca 0.60 -0.17 0.23 0.00 -0.62 0.00 0.00 57.03 57.07 1v9x h ASP 82 Cb 1.03 0.10 -0.06 0.00 0.18 0.00 0.00 39.33 40.58 1v9x h ASP 82 CO -0.43 0.02 0.62 1.56 -3.12 0.00 0.00 179.24 177.89 1v9x h GLN 83 N -0.82 0.22 -0.42 3.56 4.20 0.03 0.76 115.11 122.65 1v9x h GLN 83 Ca -0.04 -0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.58 1v9x h GLN 83 Cb 0.52 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.23 1v9x h GLN 83 CO 0.07 0.15 -0.03 1.96 -0.67 0.00 0.00 178.83 180.31 1v9x h GLN 84 N 0.23 0.76 -0.40 1.46 1.08 -1.00 -2.66 115.11 114.59 1v9x h GLN 84 Ca 0.46 -0.26 0.12 0.00 -1.45 0.00 0.00 58.65 57.51 1v9x h GLN 84 Cb 1.41 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 28.76 1v9x h GLN 84 CO -0.11 0.86 0.31 0.87 -0.95 0.00 0.00 178.83 179.80 1v9x h LYS 85 N 0.59 0.00 0.05 1.46 1.57 -0.60 0.36 116.57 120.00 1v9x h LYS 85 Ca 0.11 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1v9x h LYS 85 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 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 -1.35 -3.09 117.51 115.02 1v9x h ILE 86 Ca 0.19 -0.21 0.14 0.00 -0.39 0.00 0.00 64.86 64.59 1v9x h ILE 86 Cb 0.80 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 34.47 1v9x h ILE 86 CO -0.00 0.00 0.62 0.08 -0.69 0.00 0.00 178.15 178.16 1v9x h ARG 87 N -0.28 0.87 0.00 2.37 0.11 -1.37 0.60 114.38 116.68 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 0.58 0.00 1.63 0.10 0.00 0.00 179.97 182.29 1v9x n LYS 88 N -4.64 0.66 -0.04 0.08 4.76 0.12 -2.11 118.16 117.01 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 0.42 -1.34 -0.03 0.00 -1.84 0.00 0.00 35.03 32.24 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 -0.84 0.00 0.14 2.13 4.19 0.19 -4.16 117.16 118.81 1v9x n TYR 89 Ca 0.11 0.00 -0.01 0.00 3.31 0.00 0.00 57.90 61.31 1v9x n TYR 89 Cb 0.05 -0.28 0.16 0.00 0.49 0.00 0.00 39.34 39.76 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 1.36 0.00 2.97 -1.51 -0.98 -3.32 116.25 114.77 1v9x h VAL 90 Ca -0.16 -2.18 -0.03 0.00 -1.23 0.00 0.00 66.70 63.09 1v9x h VAL 90 Cb 1.26 2.20 -0.00 0.00 -2.13 0.00 0.00 31.29 32.61 1v9x h VAL 90 CO -0.02 0.61 -0.20 -0.33 -1.23 0.00 0.00 177.57 176.39 1v9x h GLU 91 N 0.00 0.00 -6.91 5.19 4.39 -1.67 -3.47 114.58 112.10 1v9x h GLU 91 Ca -0.01 0.00 -0.47 0.00 0.34 0.00 0.00 59.36 59.22 1v9x h GLU 91 Cb 1.15 0.00 0.04 0.00 -0.10 0.00 0.00 28.75 29.85 1v9x h GLU 91 CO 0.08 0.80 0.05 0.45 -1.16 0.00 0.00 179.01 179.23 1v9x s SER 92 N -6.18 5.78 -0.14 1.42 0.15 -1.25 -4.98 113.70 108.50 1v9x s SER 92 Ca -0.17 0.56 -0.30 0.00 0.70 0.00 0.00 55.95 56.74 1v9x s SER 92 Cb -0.01 -1.71 -0.08 0.00 -1.71 0.00 0.00 66.02 62.52 1v9x s SER 92 CO 0.54 -0.84 2.11 0.61 1.20 0.00 0.00 173.24 176.86 1v9x n GLY 93 N -2.32 1.26 3.53 9.45 0.00 -1.26 -4.65 105.19 111.20 1v9x n GLY 93 Ca 0.03 0.82 -0.48 0.00 0.00 0.00 0.00 46.02 46.38 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 9.73 -1.37 -1.35 4.61 0.00 -1.25 -4.58 120.51 126.29 1v9x n ALA 94 Ca 0.27 0.45 0.06 0.00 0.00 0.00 0.00 53.44 54.23 1v9x n ALA 94 Cb 0.40 -1.90 -0.04 0.00 0.00 0.00 0.00 19.45 17.91 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 1.74 -3.69 0.13 0.00 0.00 -1.08 -4.74 105.19 97.55 1v9x n GLY 95 Ca 0.15 -0.98 -0.25 0.00 0.00 0.00 0.00 46.02 44.93 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 -3.15 1.95 -4.81 1.61 2.88 -1.26 -4.99 113.62 105.85 1v9x n SER 96 Ca -0.04 0.28 -0.29 0.00 -1.33 0.00 0.00 58.87 57.50 1v9x n SER 96 Cb 0.51 -0.81 0.13 0.00 -0.75 0.00 0.00 64.21 63.29 1v9x n SER 96 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1v9x s ASN 97 N -7.15 3.68 -0.07 -3.46 -0.87 -1.26 -4.91 114.94 100.90 1v9x s ASN 97 Ca -0.34 0.93 -0.01 0.00 -1.57 0.00 0.00 52.86 51.87 1v9x s ASN 97 Cb 0.11 -1.50 0.01 0.00 -0.02 0.00 0.00 41.25 39.86 1v9x s ASN 97 CO 0.56 -2.44 2.17 1.07 -2.57 0.00 0.00 177.10 175.89 1v9x n THR 98 N -3.69 2.26 -1.50 1.60 5.66 -1.26 -4.94 114.28 112.41 1v9x n THR 98 Ca 0.07 -0.86 -0.36 0.00 -3.05 0.00 0.00 64.05 59.85 1v9x n THR 98 Cb 0.60 -1.52 0.08 0.00 -1.55 0.00 0.00 70.33 67.93 1v9x n THR 98 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1v9x n SER 99 N 1.37 0.99 -4.70 1.09 3.41 -1.26 -5.02 113.62 109.50 1v9x n SER 99 Ca 0.10 0.74 -0.23 0.00 -0.26 0.00 0.00 58.87 59.22 1v9x n SER 99 Cb 0.55 -1.45 -0.06 0.00 -0.26 0.00 0.00 64.21 62.99 1v9x n SER 99 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1v9x s THR 100 N -1.65 3.57 -0.24 6.66 -4.23 -1.26 -4.83 115.64 113.66 1v9x s THR 100 Ca 0.77 -1.76 -0.21 0.00 -1.18 0.00 0.00 61.69 59.31 1v9x s THR 100 Cb -0.37 -2.99 -0.02 0.00 1.34 0.00 0.00 72.50 70.46 1v9x s THR 100 CO 0.47 -0.33 0.65 -0.94 -0.54 0.00 0.00 174.62 173.93 1v9x s SER 101 N -3.75 6.64 -0.18 3.99 1.04 -1.26 -4.87 113.70 115.31 1v9x s SER 101 Ca 0.33 0.79 -0.14 0.00 0.48 0.00 0.00 55.95 57.40 1v9x s SER 101 Cb -0.06 -2.35 -0.08 0.00 0.10 0.00 0.00 66.02 63.63 1v9x s SER 101 CO 0.22 -0.36 -0.17 0.41 0.98 0.00 0.00 173.24 174.32 1v9x n THR 102 N 5.05 1.47 -4.59 2.02 -1.04 -1.26 -5.09 114.28 110.84 1v9x n THR 102 Ca -0.00 0.09 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 1v9x n THR 102 Cb 0.49 -2.26 0.00 0.00 -1.82 0.00 0.00 70.33 66.74 1v9x n THR 102 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1v9x n GLY 103 N 1.50 -1.16 3.55 3.41 0.00 -1.26 -4.46 105.19 106.78 1v9x n GLY 103 Ca -0.19 -1.14 -0.34 0.00 0.00 0.00 0.00 46.02 44.35 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 3.44 -0.16 2.61 -4.23 -1.26 -4.73 115.64 111.31 1v9x s THR 104 Ca 0.00 -0.04 -0.13 0.00 -1.18 0.00 0.00 61.69 60.34 1v9x s THR 104 Cb 0.00 -4.07 -0.07 0.00 1.34 0.00 0.00 72.50 69.70 1v9x s THR 104 CO 0.00 -1.03 -0.28 -1.20 -0.54 0.00 0.00 174.62 171.57 1v9x n SER 105 N 12.84 1.69 -0.01 3.99 7.64 -1.26 -4.71 113.62 133.80 1v9x n SER 105 Ca 0.27 0.28 -0.17 0.00 1.01 0.00 0.00 58.87 60.26 1v9x n SER 105 Cb 0.50 -0.65 -0.13 0.00 -1.01 0.00 0.00 64.21 62.91 1v9x n SER 105 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1v9x h THR 106 N -0.79 1.62 -3.36 0.44 1.35 -1.97 -3.42 112.91 106.78 1v9x h THR 106 Ca -0.21 -2.38 -0.73 0.00 -0.55 0.00 0.00 66.41 62.54 1v9x h THR 106 Cb 1.06 3.20 -0.27 0.00 -1.73 0.00 0.00 68.15 70.40 1v9x h THR 106 CO -0.13 0.65 -0.40 -0.94 -0.25 0.00 0.00 175.52 174.45 1v9x s SER 107 N -6.61 5.79 0.11 5.36 1.04 -1.26 -4.96 113.70 113.17 1v9x s SER 107 Ca -0.16 -1.59 -0.21 0.00 0.48 0.00 0.00 55.95 54.47 1v9x s SER 107 Cb -0.00 -2.05 -0.10 0.00 0.10 0.00 0.00 66.02 63.97 1v9x s SER 107 CO 0.77 -0.62 1.75 0.28 0.98 0.00 0.00 173.24 176.40 1v9x h SER 108 N 8.52 0.08 -3.28 7.02 0.02 -1.84 -3.42 113.55 120.65 1v9x h SER 108 Ca -0.24 0.00 -0.40 0.00 -0.84 0.00 0.00 61.79 60.31 1v9x h SER 108 Cb 1.09 -0.01 -0.39 0.00 0.14 0.00 0.00 62.40 63.22 1v9x h SER 108 CO 0.83 0.07 -0.75 -0.55 -1.14 0.00 0.00 176.83 175.28 1v9x s SER 109 N -5.27 1.37 1.11 3.07 0.15 -1.26 -4.95 113.70 107.91 1v9x s SER 109 Ca -0.13 -0.02 -0.20 0.00 0.70 0.00 0.00 55.95 56.30 1v9x s SER 109 Cb 0.07 -0.25 0.07 0.00 -1.71 0.00 0.00 66.02 64.20 1v9x s SER 109 CO 0.68 -0.24 -0.22 0.61 1.20 0.00 0.00 173.24 175.27 1v9x n GLY 110 N 5.25 -2.58 3.71 9.45 0.00 -1.26 -4.87 105.19 114.89 1v9x n GLY 110 Ca -0.05 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 44.86 1v9x n GLY 110 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v9x s PRO 111 N -3.24 4.32 0.32 1.61 0.04 -1.26 -4.90 135.00 131.88 1v9x s PRO 111 Ca 0.53 2.03 0.09 0.00 0.04 0.00 0.00 61.00 63.69 1v9x s PRO 111 Cb -0.08 -3.33 0.94 0.00 0.04 0.00 0.00 34.50 32.07 1v9x s PRO 111 CO 0.66 -0.46 1.48 0.43 0.04 0.00 0.00 177.00 179.15 1v9x n SER 112 N 4.27 0.07 -4.01 6.66 7.64 -1.26 -2.54 113.62 124.45 1v9x n SER 112 Ca 0.12 1.59 -0.32 0.00 1.01 0.00 0.00 58.87 61.26 1v9x n SER 112 Cb 0.43 -0.66 -0.11 0.00 -1.01 0.00 0.00 64.21 62.86 1v9x n SER 112 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1v9x s SER 113 N -4.82 4.96 0.00 6.43 1.04 -1.26 -5.10 113.70 114.94 1v9x s SER 113 Ca -0.11 -3.26 0.14 0.00 0.48 0.00 0.00 55.95 53.20 1v9x s SER 113 Cb 0.29 -1.75 0.11 0.00 0.10 0.00 0.00 66.02 64.78 1v9x s SER 113 CO 0.74 -0.23 0.95 0.61 0.98 0.00 0.00 173.24 176.29