#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 -0.65 0.05 1.61 1.04 -1.26 -5.05 113.70 109.44 1v9x s SER 2 Ca 0.00 1.15 -0.18 0.00 0.48 0.00 0.00 55.95 57.40 1v9x s SER 2 Cb 0.00 1.19 -0.15 0.00 0.10 0.00 0.00 66.02 67.16 1v9x s SER 2 CO 0.00 -0.22 1.29 0.77 0.98 0.00 0.00 173.24 176.06 1v9x h SER 3 N 7.35 0.56 -2.42 7.02 4.64 -2.10 -3.50 113.55 125.10 1v9x h SER 3 Ca -0.29 -0.57 0.00 0.00 -0.47 0.00 0.00 61.79 60.45 1v9x h SER 3 Cb 1.18 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 1v9x h SER 3 CO 0.21 1.03 0.00 0.61 -0.87 0.00 0.00 176.83 177.81 1v9x n GLY 4 N 0.47 -2.25 0.11 -0.77 0.00 -1.26 -5.05 105.19 96.45 1v9x n GLY 4 Ca -0.07 -0.55 -0.22 0.00 0.00 0.00 0.00 46.02 45.19 1v9x n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v9x n SER 5 N 0.00 1.90 -4.67 1.61 7.64 -1.26 -4.84 113.62 113.99 1v9x n SER 5 Ca 0.00 0.41 -0.38 0.00 1.01 0.00 0.00 58.87 59.90 1v9x n SER 5 Cb 0.00 -0.89 -0.07 0.00 -1.01 0.00 0.00 64.21 62.24 1v9x n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1v9x s SER 6 N -6.91 6.47 0.00 6.43 0.15 -1.26 -4.42 113.70 114.16 1v9x s SER 6 Ca -0.31 0.55 0.00 0.00 0.70 0.00 0.00 55.95 56.89 1v9x s SER 6 Cb 0.09 -2.24 0.00 0.00 -1.71 0.00 0.00 66.02 62.16 1v9x s SER 6 CO 0.51 -0.08 0.00 0.61 1.20 0.00 0.00 173.24 175.47 1v9x n GLY 7 N 3.87 3.66 3.63 9.45 0.00 -1.26 -5.10 105.19 119.44 1v9x n GLY 7 Ca -0.08 -0.58 -0.54 0.00 0.00 0.00 0.00 46.02 44.83 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 0.00 1.69 -1.82 1.61 -0.00 -1.26 -4.87 115.22 110.57 1v9x n HIS 8 Ca 0.00 0.60 -0.38 0.00 -0.00 0.00 0.00 57.72 57.94 1v9x n HIS 8 Cb 0.00 -2.37 0.04 0.00 -0.00 0.00 0.00 29.99 27.66 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 1.49 3.06 0.05 -0.41 1.02 -1.26 -4.95 119.74 118.74 1v9x s LYS 9 Ca 0.89 2.15 -0.19 0.00 0.02 0.00 0.00 55.97 58.84 1v9x s LYS 9 Cb -0.99 -2.17 -0.13 0.00 -0.52 0.00 0.00 37.83 34.02 1v9x s LYS 9 CO 0.53 -1.22 1.36 -1.00 -0.92 0.00 0.00 175.35 174.09 1v9x h PRO 10 N 1.29 0.43 -6.34 -1.68 0.13 -1.87 -3.45 132.00 120.51 1v9x h PRO 10 Ca -0.51 -0.23 -0.65 0.00 -0.87 0.00 0.00 66.00 63.74 1v9x h PRO 10 Cb 1.30 0.01 -0.12 0.00 0.13 0.00 0.00 31.00 32.32 1v9x h PRO 10 CO 0.57 0.79 -0.67 -1.58 -0.23 0.00 0.00 178.00 176.88 1v9x s TRP 11 N -4.31 2.98 0.11 1.56 0.52 -1.17 -0.44 118.94 118.18 1v9x s TRP 11 Ca -0.14 -0.02 0.05 0.00 0.02 0.00 0.00 56.10 56.01 1v9x s TRP 11 Cb 0.06 -1.54 -0.04 0.00 -1.15 0.00 0.00 33.47 30.80 1v9x s TRP 11 CO 0.77 0.47 -0.13 -0.98 0.02 0.00 0.00 176.95 177.11 1v9x s ARG 12 N -2.23 0.93 -0.06 4.98 1.70 -1.15 -0.09 118.95 123.03 1v9x s ARG 12 Ca 0.25 -1.16 0.01 0.00 -0.47 0.00 0.00 55.73 54.36 1v9x s ARG 12 Cb -0.12 -0.75 0.02 0.00 -0.57 0.00 0.00 34.95 33.53 1v9x s ARG 12 CO 0.17 0.14 -0.08 0.00 -1.08 0.00 0.00 175.30 174.45 1v9x s ALA 13 N -2.12 1.04 -0.24 7.88 0.00 0.35 -3.05 121.76 125.61 1v9x s ALA 13 Ca 0.06 -0.29 -0.28 0.00 0.00 0.00 0.00 51.96 51.45 1v9x s ALA 13 Cb -0.05 -0.57 0.15 0.00 0.00 0.00 0.00 23.12 22.65 1v9x s ALA 13 CO 0.02 -0.02 1.14 -1.83 0.00 0.00 0.00 175.76 175.07 1v9x s GLU 14 N 0.94 0.39 -0.04 0.00 -1.05 -1.26 -4.33 118.70 113.35 1v9x s GLU 14 Ca -0.10 0.25 -0.30 0.00 -0.15 0.00 0.00 54.97 54.67 1v9x s GLU 14 Cb -0.15 0.19 -0.03 0.00 -0.44 0.00 0.00 34.13 33.70 1v9x s GLU 14 CO 0.01 -0.09 1.07 0.71 0.95 0.00 0.00 175.26 177.90 1v9x s TYR 15 N -0.50 3.47 0.73 4.83 2.02 -1.26 -3.75 117.35 122.88 1v9x s TYR 15 Ca 0.03 1.50 -0.16 0.00 -0.37 0.00 0.00 57.07 58.07 1v9x s TYR 15 Cb -0.03 -3.25 0.00 0.00 -0.40 0.00 0.00 41.96 38.28 1v9x s TYR 15 CO -0.05 -0.56 0.91 0.00 -1.57 0.00 0.00 175.55 174.28 1v9x n ALA 16 N 4.62 -0.44 0.35 3.71 0.00 -0.99 -4.75 120.51 123.01 1v9x n ALA 16 Ca 0.09 -0.21 0.06 0.00 0.00 0.00 0.00 53.44 53.38 1v9x n ALA 16 Cb 0.48 -2.08 -0.07 0.00 0.00 0.00 0.00 19.45 17.78 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 -1.75 2.20 -3.92 0.00 5.02 -1.26 -1.33 118.16 117.12 1v9x n LYS 17 Ca 0.13 -0.04 -0.10 0.00 -2.02 0.00 0.00 58.31 56.28 1v9x n LYS 17 Cb 0.50 -1.13 -0.06 0.00 -0.02 0.00 0.00 35.03 34.32 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 -2.53 -0.03 -0.60 4.39 0.01 -1.26 -4.80 113.70 108.86 1v9x s SER 18 Ca 0.01 -0.79 -0.00 0.00 1.31 0.00 0.00 55.95 56.48 1v9x s SER 18 Cb 0.08 0.48 0.51 0.00 0.21 0.00 0.00 66.02 67.30 1v9x s SER 18 CO 0.48 -0.95 1.99 -1.20 0.41 0.00 0.00 173.24 173.97 1v9x n SER 19 N -0.25 6.55 -0.02 2.44 7.64 -1.26 -3.43 113.62 125.28 1v9x n SER 19 Ca -0.07 -3.74 -0.15 0.00 1.01 0.00 0.00 58.87 55.91 1v9x n SER 19 Cb 0.63 -0.93 -0.14 0.00 -1.01 0.00 0.00 64.21 62.76 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 -0.98 0.70 -1.98 1.43 1.74 -1.26 -4.76 116.66 111.54 1v9x n ARG 20 Ca 0.62 0.25 -0.33 0.00 -0.77 0.00 0.00 57.85 57.62 1v9x n ARG 20 Cb 0.95 -1.72 0.02 0.00 -1.02 0.00 0.00 32.46 30.69 1v9x n ARG 20 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1v9x s SER 21 N -6.53 5.50 -0.02 0.55 1.04 -1.26 -4.93 113.70 108.05 1v9x s SER 21 Ca -0.15 1.97 0.01 0.00 0.48 0.00 0.00 55.95 58.26 1v9x s SER 21 Cb 0.07 -2.55 0.02 0.00 0.10 0.00 0.00 66.02 63.66 1v9x s SER 21 CO 0.79 -1.36 -0.01 -0.44 0.98 0.00 0.00 173.24 173.19 1v9x s SER 22 N -2.46 0.42 0.96 7.02 0.01 -1.26 -1.30 113.70 117.09 1v9x s SER 22 Ca 0.67 -0.04 -0.11 0.00 1.31 0.00 0.00 55.95 57.78 1v9x s SER 22 Cb -0.19 -0.16 0.16 0.00 0.21 0.00 0.00 66.02 66.03 1v9x s SER 22 CO 0.36 -0.04 1.02 0.00 0.41 0.00 0.00 173.24 174.99 1v9x n LYS 24 N -4.03 0.54 -0.11 0.00 4.76 -1.09 -3.04 118.16 115.19 1v9x n LYS 24 Ca 0.10 0.08 -0.08 0.00 -2.87 0.00 0.00 58.31 55.54 1v9x n LYS 24 Cb 0.53 -1.29 -0.00 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 1.05 0.00 -0.18 2.02 -1.94 -3.16 112.91 110.71 1v9x h THR 25 Ca -0.32 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 66.70 1v9x h THR 25 Cb 1.52 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 68.50 1v9x h THR 25 CO -0.04 0.08 -1.65 0.00 0.37 0.00 0.00 175.52 174.27 1v9x n LYS 27 N -2.00 -4.55 -4.78 0.00 4.01 -1.17 -5.04 118.16 104.62 1v9x n LYS 27 Ca -0.02 0.52 -0.34 0.00 -0.51 0.00 0.00 58.31 57.96 1v9x n LYS 27 Cb 0.45 -4.59 -0.07 0.00 -0.51 0.00 0.00 35.03 30.32 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 -1.75 3.47 -4.83 4.39 7.64 -1.21 -4.86 113.62 116.46 1v9x n SER 28 Ca -0.08 -3.32 -0.38 0.00 1.01 0.00 0.00 58.87 56.11 1v9x n SER 28 Cb 0.57 0.37 -0.06 0.00 -1.01 0.00 0.00 64.21 64.08 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 -2.91 5.03 -0.78 0.44 1.01 -1.26 0.20 120.40 122.14 1v9x s VAL 29 Ca 0.00 0.84 -0.10 0.00 0.00 0.00 0.00 61.98 62.72 1v9x s VAL 29 Cb 0.00 -3.71 0.20 0.00 0.00 0.00 0.00 36.38 32.87 1v9x s VAL 29 CO 0.00 0.57 0.68 -0.63 0.00 0.00 0.00 175.10 175.72 1v9x s ILE 30 N -1.03 4.95 0.67 2.22 1.01 -0.42 -4.80 121.20 123.81 1v9x s ILE 30 Ca 0.24 -2.75 -0.17 0.00 0.00 0.00 0.00 60.65 57.97 1v9x s ILE 30 Cb -0.17 -4.09 -0.02 0.00 0.01 0.00 0.00 42.46 38.19 1v9x s ILE 30 CO 0.13 -0.99 0.90 0.59 0.00 0.00 0.00 174.94 175.57 1v9x n ASN 31 N 3.67 0.33 -4.70 3.58 4.13 -1.26 -4.34 115.26 116.67 1v9x n ASN 31 Ca 0.13 0.71 -0.31 0.00 1.68 0.00 0.00 54.58 56.79 1v9x n ASN 31 Cb 0.43 -1.37 0.14 0.00 -1.54 0.00 0.00 39.78 37.45 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 -3.02 1.35 -0.67 3.52 -2.85 -1.22 -3.56 119.74 113.28 1v9x s LYS 32 Ca 0.74 1.35 0.00 0.00 -1.00 0.00 0.00 55.97 57.05 1v9x s LYS 32 Cb -0.37 -1.78 0.00 0.00 -2.06 0.00 0.00 37.83 33.62 1v9x s LYS 32 CO 0.50 -2.34 0.00 0.39 0.10 0.00 0.00 175.35 174.00 1v9x n GLU 33 N -4.01 -0.53 -4.67 1.78 1.02 -0.44 -4.92 120.64 108.87 1v9x n GLU 33 Ca 0.10 0.52 -0.26 0.00 -0.02 0.00 0.00 57.16 57.50 1v9x n GLU 33 Cb 0.53 -4.37 -0.14 0.00 -0.02 0.00 0.00 31.44 27.43 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 -2.79 2.61 -0.47 1.62 0.01 -1.23 -4.92 114.94 109.77 1v9x s ASN 34 Ca 0.00 -0.55 -0.26 0.00 -0.71 0.00 0.00 52.86 51.35 1v9x s ASN 34 Cb 0.00 -0.22 0.03 0.00 0.41 0.00 0.00 41.25 41.47 1v9x s ASN 34 CO 0.00 0.17 0.94 0.12 -1.51 0.00 0.00 177.10 176.82 1v9x s PHE 35 N -0.82 2.90 0.45 2.20 5.36 -1.26 -2.35 117.98 124.47 1v9x s PHE 35 Ca 0.08 0.38 0.01 0.00 -0.96 0.00 0.00 56.93 56.44 1v9x s PHE 35 Cb -0.09 -4.01 0.01 0.00 -0.34 0.00 0.00 43.02 38.58 1v9x s PHE 35 CO 0.02 -1.13 0.06 2.89 -1.46 0.00 0.00 175.22 175.60 1v9x n ARG 36 N 7.24 0.89 -3.80 10.12 1.85 -1.25 -3.14 116.66 128.58 1v9x n ARG 36 Ca 0.06 -3.23 -0.14 0.00 -1.00 0.00 0.00 57.85 53.55 1v9x n ARG 36 Cb 0.48 0.79 -0.15 0.00 -1.05 0.00 0.00 32.46 32.53 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 1.33 -0.27 2.89 1.43 -0.66 -4.01 118.68 119.38 1v9x s LEU 37 Ca 0.04 0.11 0.00 0.00 -1.03 0.00 0.00 54.13 53.25 1v9x s LEU 37 Cb -0.00 0.10 0.05 0.00 0.03 0.00 0.00 46.19 46.37 1v9x s LEU 37 CO 0.03 -0.08 -0.06 -0.83 0.23 0.00 0.00 176.35 175.63 1v9x s GLY 38 N 0.65 1.69 -1.00 -3.19 0.00 -1.17 -0.74 107.32 103.57 1v9x s GLY 38 Ca -0.05 -1.72 -0.23 0.00 0.00 0.00 0.00 44.72 42.72 1v9x s GLY 38 CO -0.02 0.63 1.57 1.25 0.00 0.00 0.00 173.10 176.53 1v9x s LYS 39 N 1.20 3.35 0.10 2.90 2.20 -0.57 -2.94 119.74 125.98 1v9x s LYS 39 Ca -0.06 -0.94 -0.31 0.00 -0.36 0.00 0.00 55.97 54.30 1v9x s LYS 39 Cb -0.19 -5.29 -0.10 0.00 -1.51 0.00 0.00 37.83 30.74 1v9x s LYS 39 CO -0.03 -2.49 1.76 -0.51 -0.36 0.00 0.00 175.35 173.72 1v9x s LEU 40 N 6.18 4.39 0.26 5.43 1.43 0.41 -2.96 118.68 133.82 1v9x s LEU 40 Ca 0.52 2.65 0.04 0.00 -1.03 0.00 0.00 54.13 56.31 1v9x s LEU 40 Cb -0.01 -3.56 -0.05 0.00 0.03 0.00 0.00 46.19 42.59 1v9x s LEU 40 CO -0.07 -0.96 0.01 0.68 0.23 0.00 0.00 176.35 176.23 1v9x s VAL 41 N 2.72 1.12 0.08 -1.59 -7.23 -1.26 -4.80 120.40 109.43 1v9x s VAL 41 Ca 0.78 -2.04 0.06 0.00 -1.81 0.00 0.00 61.98 58.97 1v9x s VAL 41 Cb -0.44 -2.46 -0.04 0.00 0.56 0.00 0.00 36.38 34.01 1v9x s VAL 41 CO 0.35 -0.24 -0.07 -1.10 -0.31 0.00 0.00 175.10 173.72 1v9x s GLN 42 N -3.86 2.32 0.53 4.82 -0.21 -1.26 -4.16 119.66 117.84 1v9x s GLN 42 Ca 0.31 -0.91 0.04 0.00 0.02 0.00 0.00 55.36 54.81 1v9x s GLN 42 Cb 0.06 -2.40 0.02 0.00 1.00 0.00 0.00 33.01 31.69 1v9x s GLN 42 CO 0.11 0.54 0.23 0.45 -2.12 0.00 0.00 175.29 174.49 1v9x s SER 43 N -2.02 4.41 0.10 5.90 0.15 -1.26 -5.05 113.70 115.94 1v9x s SER 43 Ca 0.21 -1.42 -0.32 0.00 0.70 0.00 0.00 55.95 55.12 1v9x s SER 43 Cb -0.11 0.45 -0.12 0.00 -1.71 0.00 0.00 66.02 64.53 1v9x s SER 43 CO 0.13 -0.99 1.60 0.71 1.20 0.00 0.00 173.24 175.89 1v9x h THR 44 N 1.02 0.20 -2.37 6.45 1.35 -2.00 -3.43 112.91 114.12 1v9x h THR 44 Ca -0.40 0.00 -0.45 0.00 -0.55 0.00 0.00 66.41 65.01 1v9x h THR 44 Cb 1.31 0.20 0.07 0.00 -1.73 0.00 0.00 68.15 67.99 1v9x h THR 44 CO 0.65 0.00 0.05 -1.00 -0.25 0.00 0.00 175.52 174.97 1v9x s HIS 45 N -5.95 2.19 -0.61 4.73 3.76 -1.26 -5.02 115.29 113.13 1v9x s HIS 45 Ca -0.17 -0.13 0.00 0.00 -0.15 0.00 0.00 55.06 54.61 1v9x s HIS 45 Cb 0.06 -2.89 0.43 0.00 1.11 0.00 0.00 32.58 31.29 1v9x s HIS 45 CO 0.63 -1.33 1.78 1.19 -0.85 0.00 0.00 174.74 176.16 1v9x n PHE 46 N -2.62 3.10 -3.39 1.40 3.01 -1.26 -4.89 117.46 112.81 1v9x n PHE 46 Ca 0.12 -2.72 -0.45 0.00 1.01 0.00 0.00 57.45 55.41 1v9x n PHE 46 Cb 0.60 -1.04 -0.03 0.00 -0.01 0.00 0.00 39.48 39.00 1v9x n PHE 46 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1v9x s ASP 47 N -2.17 6.71 0.44 4.37 1.01 -1.26 -4.94 116.67 120.84 1v9x s ASP 47 Ca 0.58 -3.00 0.00 0.00 0.71 0.00 0.00 52.55 50.83 1v9x s ASP 47 Cb 0.46 -2.16 0.00 0.00 1.01 0.00 0.00 42.92 42.24 1v9x s ASP 47 CO -0.11 -0.46 0.00 0.61 0.21 0.00 0.00 175.17 175.42 1v9x n GLY 48 N 3.50 -4.80 3.81 0.21 0.00 -1.26 -4.92 105.19 101.73 1v9x n GLY 48 Ca 0.16 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 45.27 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 -2.65 4.21 -0.67 -0.61 1.01 -1.26 -4.95 121.20 116.28 1v9x s ILE 49 Ca 0.00 1.35 0.00 0.00 0.00 0.00 0.00 60.65 62.01 1v9x s ILE 49 Cb 0.00 -3.56 0.17 0.00 0.01 0.00 0.00 42.46 39.08 1v9x s ILE 49 CO 0.00 -0.32 0.48 -0.04 0.00 0.00 0.00 174.94 175.06 1v9x s MET 50 N -3.27 2.56 0.86 2.79 -1.94 -1.26 -5.07 119.30 113.97 1v9x s MET 50 Ca 0.63 -2.85 -0.11 0.00 -1.71 0.00 0.00 55.69 51.65 1v9x s MET 50 Cb -0.11 -3.63 0.11 0.00 2.01 0.00 0.00 34.83 33.20 1v9x s MET 50 CO 0.17 -1.20 1.09 -1.25 -0.01 0.00 0.00 175.02 173.82 1v9x s PRO 51 N -0.63 1.56 -0.43 2.03 0.04 -1.26 -4.17 135.00 132.14 1v9x s PRO 51 Ca 0.20 0.93 0.03 0.00 0.04 0.00 0.00 61.00 62.21 1v9x s PRO 51 Cb -0.16 -1.83 0.12 0.00 0.04 0.00 0.00 34.50 32.66 1v9x s PRO 51 CO -0.07 -2.06 0.17 -1.64 0.04 0.00 0.00 177.00 173.44 1v9x s MET 52 N -4.92 1.60 -0.03 4.56 -1.94 -1.15 -4.91 119.30 112.51 1v9x s MET 52 Ca 0.63 -2.15 -0.30 0.00 -1.71 0.00 0.00 55.69 52.16 1v9x s MET 52 Cb -0.18 -3.04 -0.04 0.00 2.01 0.00 0.00 34.83 33.58 1v9x s MET 52 CO 0.57 -1.04 1.17 -1.58 -0.01 0.00 0.00 175.02 174.12 1v9x s TRP 53 N 0.38 3.31 -0.17 -0.03 0.52 -1.26 -1.50 118.94 120.18 1v9x s TRP 53 Ca 0.14 1.30 -0.12 0.00 0.02 0.00 0.00 56.10 57.45 1v9x s TRP 53 Cb -0.23 -3.38 0.05 0.00 -1.15 0.00 0.00 33.47 28.77 1v9x s TRP 53 CO -0.05 -1.11 0.43 -0.80 0.02 0.00 0.00 176.95 175.44 1v9x s ASN 54 N 1.32 -0.51 0.09 2.95 0.01 0.08 -2.68 114.94 116.21 1v9x s ASN 54 Ca 0.56 0.91 -0.36 0.00 -0.71 0.00 0.00 52.86 53.26 1v9x s ASN 54 Cb -0.25 0.83 -0.18 0.00 0.41 0.00 0.00 41.25 42.07 1v9x s ASN 54 CO 0.24 -0.18 1.11 1.41 -1.51 0.00 0.00 177.10 178.17 1v9x n HIS 55 N 3.76 0.93 -0.01 2.20 8.25 -1.26 -1.65 115.22 127.43 1v9x n HIS 55 Ca -0.20 0.83 0.23 0.00 -0.26 0.00 0.00 57.72 58.33 1v9x n HIS 55 Cb 0.56 -2.19 0.65 0.00 1.12 0.00 0.00 29.99 30.12 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 3.30 2.40 0.00 -1.41 0.00 -1.82 1.15 119.26 122.88 1v9x h ALA 56 Ca -0.45 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.31 1v9x h ALA 56 Cb 1.38 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 1v9x h ALA 56 CO 0.69 -1.04 -1.19 1.03 0.00 0.00 0.00 179.25 178.74 1v9x h SER 57 N 0.00 0.00 0.94 0.00 0.87 -1.85 -2.89 113.55 110.61 1v9x h SER 57 Ca 0.30 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.76 1v9x h SER 57 Cb 1.72 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.67 1v9x h SER 57 CO -0.00 0.44 -0.45 0.00 -0.53 0.00 0.00 176.83 176.28 1v9x n ILE 59 N -3.50 1.56 -0.02 0.00 2.08 -0.81 -4.13 119.36 114.55 1v9x n ILE 59 Ca 0.00 -0.12 0.15 0.00 0.56 0.00 0.00 62.75 63.34 1v9x n ILE 59 Cb 0.58 -2.00 0.59 0.00 -0.75 0.00 0.00 39.64 38.06 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 -0.89 0.19 -1.86 1.39 3.38 -1.61 0.21 115.31 116.12 1v9x h LEU 60 Ca -0.39 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.57 1v9x h LEU 60 Cb 1.40 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 42.12 1v9x h LEU 60 CO -0.20 0.11 -0.09 0.07 0.09 0.00 0.00 178.44 178.42 1v9x h LYS 61 N 0.21 0.00 0.00 1.13 2.10 -1.64 -3.44 116.57 114.93 1v9x h LYS 61 Ca 0.24 0.00 -0.26 0.00 -2.00 0.00 0.00 60.65 58.64 1v9x h LYS 61 Cb 0.68 0.00 0.05 0.00 -0.90 0.00 0.00 32.23 32.06 1v9x h LYS 61 CO -0.04 0.09 0.09 1.63 -2.00 0.00 0.00 179.45 179.22 1v9x n LYS 62 N -3.41 0.07 -4.53 0.07 5.02 0.73 -5.12 118.16 111.00 1v9x n LYS 62 Ca -0.01 -1.46 -0.25 0.00 -2.02 0.00 0.00 58.31 54.57 1v9x n LYS 62 Cb 0.25 -0.43 -0.10 0.00 -0.02 0.00 0.00 35.03 34.74 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 -1.76 1.34 -1.41 -0.18 2.01 -1.26 -4.79 115.64 109.58 1v9x s THR 63 Ca 0.38 -2.00 -0.04 0.00 0.31 0.00 0.00 61.69 60.34 1v9x s THR 63 Cb -0.02 -2.75 0.00 0.00 0.01 0.00 0.00 72.50 69.74 1v9x s THR 63 CO 0.25 0.00 0.34 0.29 -0.69 0.00 0.00 174.62 174.81 1v9x n LYS 64 N -0.83 -2.28 -0.02 4.92 4.76 -1.26 -4.87 118.16 118.58 1v9x n LYS 64 Ca -0.05 0.30 -0.06 0.00 -2.87 0.00 0.00 58.31 55.63 1v9x n LYS 64 Cb 0.67 -4.10 -0.02 0.00 -1.84 0.00 0.00 35.03 29.73 1v9x n LYS 64 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 1v9x n GLN 65 N -4.48 0.17 -4.73 1.97 1.13 -1.26 -5.06 117.38 105.12 1v9x n GLN 65 Ca -0.29 0.07 -0.30 0.00 -1.94 0.00 0.00 57.00 54.54 1v9x n GLN 65 Cb 0.68 -0.79 -0.14 0.00 0.11 0.00 0.00 30.24 30.10 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 -2.20 2.28 -0.19 5.09 1.01 -1.26 -5.03 121.20 120.90 1v9x s ILE 66 Ca -0.10 -1.46 -0.11 0.00 0.00 0.00 0.00 60.65 58.98 1v9x s ILE 66 Cb 0.03 -1.93 -0.21 0.00 0.01 0.00 0.00 42.46 40.36 1v9x s ILE 66 CO 0.14 0.29 0.14 1.17 0.00 0.00 0.00 174.94 176.68 1v9x n LYS 67 N 1.50 0.66 -3.50 2.79 0.00 -1.26 -3.64 118.16 114.71 1v9x n LYS 67 Ca -0.17 0.35 -0.15 0.00 0.00 0.00 0.00 58.31 58.34 1v9x n LYS 67 Cb 0.52 -1.67 -0.05 0.00 0.00 0.00 0.00 35.03 33.84 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 -6.97 -0.60 0.65 3.14 0.15 -1.26 -4.38 113.70 104.43 1v9x s SER 68 Ca -0.28 0.46 0.32 0.00 0.70 0.00 0.00 55.95 57.15 1v9x s SER 68 Cb 0.08 0.53 1.76 0.00 -1.71 0.00 0.00 66.02 66.68 1v9x s SER 68 CO 0.65 -0.69 2.02 -0.37 1.20 0.00 0.00 173.24 176.06 1v9x h VAL 69 N 2.64 0.10 0.00 4.45 -1.51 -1.94 0.19 116.25 120.18 1v9x h VAL 69 Ca -0.28 0.00 -0.06 0.00 -1.23 0.00 0.00 66.70 65.13 1v9x h VAL 69 Cb 1.19 0.74 -0.01 0.00 -2.13 0.00 0.00 31.29 31.09 1v9x h VAL 69 CO 0.38 0.00 -0.29 -0.78 -1.23 0.00 0.00 177.57 175.65 1v9x h ASP 70 N 0.00 0.00 1.57 4.19 3.58 -2.01 -1.97 116.42 121.78 1v9x h ASP 70 Ca 0.03 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.48 1v9x h ASP 70 Cb 0.58 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.63 1v9x h ASP 70 CO -0.00 0.29 0.00 -2.24 -2.88 0.00 0.00 179.24 174.41 1v9x h ASP 71 N 0.00 0.00 -3.40 2.28 2.03 -0.99 -3.43 116.42 112.91 1v9x h ASP 71 Ca -0.00 0.00 -0.60 0.00 -0.73 0.00 0.00 57.03 55.70 1v9x h ASP 71 Cb 0.55 0.00 -0.10 0.00 -0.83 0.00 0.00 39.33 38.96 1v9x h ASP 71 CO 0.04 0.00 0.42 -0.69 -1.03 0.00 0.00 179.24 177.98 1v9x s VAL 72 N -3.17 4.80 0.36 4.15 1.01 -0.74 -3.03 120.40 123.79 1v9x s VAL 72 Ca 0.09 1.29 -0.13 0.00 0.00 0.00 0.00 61.98 63.23 1v9x s VAL 72 Cb 0.10 -4.14 -0.08 0.00 0.00 0.00 0.00 36.38 32.26 1v9x s VAL 72 CO 0.60 -0.21 0.76 -0.70 0.00 0.00 0.00 175.10 175.55 1v9x s GLU 73 N 2.94 3.90 -1.69 2.72 -6.30 0.88 -3.84 118.70 117.31 1v9x s GLU 73 Ca 0.33 0.58 0.00 0.00 -2.50 0.00 0.00 54.97 53.38 1v9x s GLU 73 Cb -0.14 -2.41 0.00 0.00 0.00 0.00 0.00 34.13 31.58 1v9x s GLU 73 CO 0.11 0.06 0.00 0.41 0.02 0.00 0.00 175.26 175.86 1v9x n GLY 74 N -0.82 1.51 0.22 -1.50 0.00 -1.26 0.13 105.19 103.47 1v9x n GLY 74 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.15 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 0.55 0.00 -0.61 2.10 -1.78 -2.49 117.51 115.28 1v9x h ILE 75 Ca -0.33 -1.09 0.00 0.00 1.08 0.00 0.00 64.86 64.52 1v9x h ILE 75 Cb 1.28 1.75 0.00 0.00 -1.09 0.00 0.00 36.82 38.75 1v9x h ILE 75 CO 0.48 0.21 0.00 -1.84 -1.08 0.00 0.00 178.15 175.92 1v9x n GLU 76 N -3.39 0.04 0.00 2.19 0.28 -1.26 -2.80 120.64 115.69 1v9x n GLU 76 Ca 0.00 0.07 0.12 0.00 -0.16 0.00 0.00 57.16 57.19 1v9x n GLU 76 Cb 0.42 -1.55 0.19 0.00 1.43 0.00 0.00 31.44 31.93 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 -1.61 0.58 -4.88 -1.84 2.88 -0.94 -4.92 113.62 102.89 1v9x n SER 77 Ca 0.06 -0.34 -0.30 0.00 -1.33 0.00 0.00 58.87 56.97 1v9x n SER 77 Cb 0.32 0.37 -0.00 0.00 -0.75 0.00 0.00 64.21 64.14 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 -3.07 3.48 0.51 2.46 1.43 -1.12 -5.02 118.68 117.35 1v9x s LEU 78 Ca 0.10 1.26 -0.22 0.00 -1.03 0.00 0.00 54.13 54.24 1v9x s LEU 78 Cb 0.17 -4.24 -0.06 0.00 0.03 0.00 0.00 46.19 42.09 1v9x s LEU 78 CO 0.73 -0.69 1.23 -0.13 0.23 0.00 0.00 176.35 177.72 1v9x s ARG 79 N -4.73 3.45 0.17 1.70 0.52 -1.26 -4.60 118.95 114.20 1v9x s ARG 79 Ca 0.53 1.91 -0.21 0.00 -0.52 0.00 0.00 55.73 57.44 1v9x s ARG 79 Cb -0.11 -2.28 0.07 0.00 0.52 0.00 0.00 34.95 33.15 1v9x s ARG 79 CO 0.45 -0.84 1.34 1.87 0.02 0.00 0.00 175.30 178.15 1v9x n TRP 80 N -0.83 -0.19 -0.27 -0.53 -0.00 -1.26 0.13 117.44 114.49 1v9x n TRP 80 Ca 0.09 1.08 0.07 0.00 -0.00 0.00 0.00 57.50 58.75 1v9x n TRP 80 Cb 0.47 -0.69 0.22 0.00 -0.00 0.00 0.00 31.31 31.31 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 0.43 0.21 5.87 4.11 -2.00 -0.73 114.58 122.48 1v9x h GLU 81 Ca 0.22 -0.03 -0.01 0.00 0.07 0.00 0.00 59.36 59.61 1v9x h GLU 81 Cb 0.43 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1v9x h GLU 81 CO -0.84 0.28 -0.10 -0.44 0.07 0.00 0.00 179.01 177.98 1v9x h ASP 82 N 0.44 -0.24 -0.38 3.06 5.19 0.68 -2.52 116.42 122.65 1v9x h ASP 82 Ca 0.46 -0.13 0.11 0.00 -0.62 0.00 0.00 57.03 56.84 1v9x h ASP 82 Cb 0.74 0.06 -0.02 0.00 0.18 0.00 0.00 39.33 40.29 1v9x h ASP 82 CO -0.44 -0.01 0.36 1.56 -3.12 0.00 0.00 179.24 177.59 1v9x h GLN 83 N -0.47 0.00 -0.10 3.56 4.20 0.03 0.51 115.11 122.84 1v9x h GLN 83 Ca -0.03 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.46 1v9x h GLN 83 Cb 0.36 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.14 1v9x h GLN 83 CO 0.05 0.00 -0.81 1.96 -0.67 0.00 0.00 178.83 179.35 1v9x h GLN 84 N 0.00 0.65 -0.20 1.46 1.08 -0.76 -3.01 115.11 114.34 1v9x h GLN 84 Ca 0.18 -0.56 0.06 0.00 -1.45 0.00 0.00 58.65 56.87 1v9x h GLN 84 Cb 0.89 0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 28.44 1v9x h GLN 84 CO -0.00 1.18 0.17 0.87 -0.95 0.00 0.00 178.83 180.10 1v9x h LYS 85 N 0.43 0.00 0.00 1.46 1.57 -0.51 0.29 116.57 119.82 1v9x h LYS 85 Ca -0.06 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1v9x h LYS 85 Cb 1.43 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.74 1v9x h LYS 85 CO 0.16 0.00 -0.00 0.82 -0.57 0.00 0.00 179.45 179.86 1v9x h ILE 86 N 0.00 0.00 -0.90 1.86 1.08 -1.47 -3.20 117.51 114.87 1v9x h ILE 86 Ca 0.09 -0.38 0.13 0.00 -0.39 0.00 0.00 64.86 64.31 1v9x h ILE 86 Cb 0.44 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 34.10 1v9x h ILE 86 CO -0.00 0.00 0.52 0.08 -0.69 0.00 0.00 178.15 178.06 1v9x h ARG 87 N -0.39 0.77 0.00 2.37 0.11 -1.45 0.59 114.38 116.39 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 0.00 -0.17 0.00 0.00 1.11 0.00 0.00 29.97 30.91 1v9x h ARG 87 CO 0.00 0.51 0.00 1.63 0.10 0.00 0.00 179.97 182.21 1v9x n LYS 88 N -4.75 0.49 -0.06 0.08 4.76 0.10 -1.53 118.16 117.25 1v9x n LYS 88 Ca 0.17 0.01 -0.07 0.00 -2.87 0.00 0.00 58.31 55.55 1v9x n LYS 88 Cb 0.38 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 32.02 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 -1.02 0.00 0.09 2.13 4.19 0.19 -4.12 117.16 118.63 1v9x n TYR 89 Ca 0.12 0.00 -0.07 0.00 3.31 0.00 0.00 57.90 61.26 1v9x n TYR 89 Cb 0.06 -0.44 0.01 0.00 0.49 0.00 0.00 39.34 39.46 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 1.52 -0.01 2.97 -1.51 -0.81 0.95 116.25 119.35 1v9x h VAL 90 Ca -0.25 -2.63 -0.04 0.00 -1.23 0.00 0.00 66.70 62.54 1v9x h VAL 90 Cb 1.42 2.45 0.00 0.00 -2.13 0.00 0.00 31.29 33.04 1v9x h VAL 90 CO -0.03 0.76 -0.15 -0.33 -1.23 0.00 0.00 177.57 176.59 1v9x h GLU 91 N 0.08 0.11 0.00 5.19 4.39 -1.52 -3.16 114.58 119.66 1v9x h GLU 91 Ca -0.03 -0.11 -0.31 0.00 0.34 0.00 0.00 59.36 59.25 1v9x h GLU 91 Cb 1.46 0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 30.10 1v9x h GLU 91 CO 0.12 0.84 -2.00 0.43 -1.16 0.00 0.00 179.01 177.25 1v9x n SER 92 N -4.60 1.95 0.00 1.42 7.64 -1.25 -4.90 113.62 113.89 1v9x n SER 92 Ca -0.09 0.34 0.00 0.00 1.01 0.00 0.00 58.87 60.13 1v9x n SER 92 Cb 0.44 -0.80 0.00 0.00 -1.01 0.00 0.00 64.21 62.84 1v9x n SER 92 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v9x n GLY 93 N 1.33 -2.27 3.58 0.23 0.00 0.30 -4.82 105.19 103.55 1v9x n GLY 93 Ca -0.41 -0.43 -0.43 0.00 0.00 0.00 0.00 46.02 44.75 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 -2.40 3.32 0.00 4.61 0.00 0.20 -4.70 121.76 122.79 1v9x s ALA 94 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.31 1v9x s ALA 94 Cb 0.00 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.55 1v9x s ALA 94 CO 0.00 -1.82 0.00 0.41 0.00 0.00 0.00 175.76 174.35 1v9x n GLY 95 N 4.68 -0.36 2.83 0.00 0.00 -1.19 -3.96 105.19 107.19 1v9x n GLY 95 Ca 0.06 0.13 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 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 0.00 0.03 0.52 1.61 0.01 -1.26 -4.63 113.70 109.97 1v9x s SER 96 Ca 0.00 0.03 0.05 0.00 1.31 0.00 0.00 55.95 57.35 1v9x s SER 96 Cb 0.00 -0.02 0.02 0.00 0.21 0.00 0.00 66.02 66.23 1v9x s SER 96 CO 0.00 -0.07 0.34 0.21 0.41 0.00 0.00 173.24 174.13 1v9x s ASN 97 N 0.54 4.59 0.36 2.44 3.84 -1.26 -5.08 114.94 120.36 1v9x s ASN 97 Ca -0.04 -1.23 -0.28 0.00 0.21 0.00 0.00 52.86 51.51 1v9x s ASN 97 Cb -0.06 0.26 -0.11 0.00 -0.55 0.00 0.00 41.25 40.78 1v9x s ASN 97 CO -0.02 -0.99 1.45 1.07 -2.79 0.00 0.00 177.10 175.83 1v9x n THR 98 N -1.65 1.88 -2.51 -5.21 5.66 -1.26 -4.92 114.28 106.27 1v9x n THR 98 Ca -0.03 -0.47 -0.43 0.00 -3.05 0.00 0.00 64.05 60.07 1v9x n THR 98 Cb 0.64 -1.87 -0.02 0.00 -1.55 0.00 0.00 70.33 67.54 1v9x n THR 98 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1v9x s SER 99 N -0.10 6.80 -0.27 1.09 0.01 -1.26 -4.98 113.70 114.99 1v9x s SER 99 Ca 0.55 1.17 -0.13 0.00 1.31 0.00 0.00 55.95 58.85 1v9x s SER 99 Cb -0.50 -2.54 0.09 0.00 0.21 0.00 0.00 66.02 63.28 1v9x s SER 99 CO 0.62 -0.97 0.64 -0.89 0.41 0.00 0.00 173.24 173.04 1v9x s THR 100 N 4.00 -0.30 -0.00 1.44 2.01 -1.26 -5.13 115.64 116.39 1v9x s THR 100 Ca 0.51 0.02 -0.30 0.00 0.31 0.00 0.00 61.69 62.23 1v9x s THR 100 Cb -0.15 -0.94 -0.06 0.00 0.01 0.00 0.00 72.50 71.35 1v9x s THR 100 CO 0.19 0.01 1.60 -0.44 -0.69 0.00 0.00 174.62 175.29 1v9x s SER 101 N 2.00 6.69 0.87 3.53 0.01 -1.26 -5.00 113.70 120.54 1v9x s SER 101 Ca -0.08 2.28 -0.13 0.00 1.31 0.00 0.00 55.95 59.33 1v9x s SER 101 Cb -0.08 -2.55 0.13 0.00 0.21 0.00 0.00 66.02 63.73 1v9x s SER 101 CO -0.19 -0.87 1.22 0.42 0.41 0.00 0.00 173.24 174.23 1v9x s THR 102 N 3.24 1.99 0.00 1.44 -4.23 -1.26 -5.06 115.64 111.76 1v9x s THR 102 Ca 0.71 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.22 1v9x s THR 102 Cb -0.35 -2.97 0.00 0.00 1.34 0.00 0.00 72.50 70.52 1v9x s THR 102 CO 0.30 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.99 1v9x n GLY 103 N -3.31 -3.37 3.43 3.99 0.00 -1.26 -4.84 105.19 99.84 1v9x n GLY 103 Ca 0.10 -1.11 -0.44 0.00 0.00 0.00 0.00 46.02 44.57 1v9x n GLY 103 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1v9x n THR 104 N -2.88 1.65 -3.53 2.61 -2.24 -1.26 -4.98 114.28 103.65 1v9x n THR 104 Ca 0.00 -0.50 -0.09 0.00 -2.27 0.00 0.00 64.05 61.19 1v9x n THR 104 Cb 0.00 -0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 67.84 1v9x n THR 104 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1v9x s SER 105 N -0.91 -0.36 0.06 3.42 1.04 -1.26 -5.17 113.70 110.51 1v9x s SER 105 Ca 0.62 0.14 0.03 0.00 0.48 0.00 0.00 55.95 57.22 1v9x s SER 105 Cb -0.71 0.35 -0.04 0.00 0.10 0.00 0.00 66.02 65.72 1v9x s SER 105 CO 0.59 -0.51 0.04 0.42 0.98 0.00 0.00 173.24 174.75 1v9x s THR 106 N -2.41 4.31 0.04 2.02 -4.23 -1.26 -5.12 115.64 109.00 1v9x s THR 106 Ca 0.03 -0.76 -0.20 0.00 -1.18 0.00 0.00 61.69 59.57 1v9x s THR 106 Cb -0.01 -3.02 0.04 0.00 1.34 0.00 0.00 72.50 70.85 1v9x s THR 106 CO -0.05 0.20 0.47 -0.44 -0.54 0.00 0.00 174.62 174.27 1v9x s SER 107 N -2.11 -0.37 0.28 3.99 0.01 -1.26 -5.18 113.70 109.06 1v9x s SER 107 Ca 0.25 0.10 0.08 0.00 1.31 0.00 0.00 55.95 57.69 1v9x s SER 107 Cb -0.12 0.46 -0.06 0.00 0.21 0.00 0.00 66.02 66.52 1v9x s SER 107 CO 0.17 -0.69 -0.10 -0.55 0.41 0.00 0.00 173.24 172.48 1v9x s SER 108 N -1.98 3.01 0.00 2.44 0.15 -1.26 -5.05 113.70 111.01 1v9x s SER 108 Ca -0.05 -1.14 0.00 0.00 0.70 0.00 0.00 55.95 55.46 1v9x s SER 108 Cb -0.01 -0.21 0.00 0.00 -1.71 0.00 0.00 66.02 64.09 1v9x s SER 108 CO -0.02 -0.23 0.00 -1.54 1.20 0.00 0.00 173.24 172.65 1v9x n SER 109 N -0.59 0.99 -0.33 5.45 3.41 -1.26 -5.14 113.62 116.16 1v9x n SER 109 Ca -0.06 -0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.26 1v9x n SER 109 Cb 0.62 0.79 0.00 0.00 -0.26 0.00 0.00 64.21 65.36 1v9x n SER 109 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v9x n GLY 110 N 1.09 -3.14 3.50 5.00 0.00 -1.26 -5.01 105.19 105.37 1v9x n GLY 110 Ca 0.00 -1.17 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 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 -1.52 -3.15 -3.53 1.61 -0.04 -1.26 -5.10 135.00 122.01 1v9x n PRO 111 Ca 0.00 -1.75 -0.15 0.00 -0.04 0.00 0.00 63.50 61.56 1v9x n PRO 111 Cb 0.07 -1.64 -0.05 0.00 -0.04 0.00 0.00 33.50 31.84 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 -4.45 -0.56 -0.00 3.54 1.04 -1.26 -5.18 113.70 106.83 1v9x s SER 112 Ca 0.71 0.57 -0.12 0.00 0.48 0.00 0.00 55.95 57.59 1v9x s SER 112 Cb -0.07 0.46 0.02 0.00 0.10 0.00 0.00 66.02 66.53 1v9x s SER 112 CO 0.54 -0.54 0.25 -0.55 0.98 0.00 0.00 173.24 173.92 1v9x s SER 113 N -1.26 -0.11 0.00 7.02 0.15 -1.26 -5.34 113.70 112.90 1v9x s SER 113 Ca -0.07 -0.04 0.08 0.00 0.70 0.00 0.00 55.95 56.62 1v9x s SER 113 Cb -0.00 0.28 0.46 0.00 -1.71 0.00 0.00 66.02 65.05 1v9x s SER 113 CO 0.06 -0.43 0.92 0.61 1.20 0.00 0.00 173.24 175.60