#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q3s n ALA 2 N 0.00 -1.01 -2.94 7.33 0.00 -1.26 -4.94 120.51 117.68 2q3s n ALA 2 Ca 0.00 0.43 -0.11 0.00 0.00 0.00 0.00 53.44 53.76 2q3s n ALA 2 Cb 0.00 -1.91 -0.06 0.00 0.00 0.00 0.00 19.45 17.48 2q3s n ALA 2 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2q3s s SER 3 N 3.53 0.12 -1.03 0.00 1.04 -1.26 -5.05 113.70 111.04 2q3s s SER 3 Ca 1.06 -1.11 -0.03 0.00 0.48 0.00 0.00 55.95 56.34 2q3s s SER 3 Cb -1.47 0.56 0.30 0.00 0.10 0.00 0.00 66.02 65.51 2q3s s SER 3 CO 0.77 -1.11 1.36 0.49 0.98 0.00 0.00 173.24 175.73 2q3s n PHE 4 N -0.39 2.66 -0.10 5.02 3.01 -1.26 -4.83 117.46 121.56 2q3s n PHE 4 Ca -0.01 -2.88 0.04 0.00 1.01 0.00 0.00 57.45 55.62 2q3s n PHE 4 Cb 0.63 -1.21 0.24 0.00 -0.01 0.00 0.00 39.48 39.13 2q3s n PHE 4 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 2q3s n ASP 5 N 1.38 3.77 -4.15 4.37 5.68 -1.25 -4.30 116.55 122.05 2q3s n ASP 5 Ca 0.26 -2.53 -0.30 0.00 -0.50 0.00 0.00 54.79 51.72 2q3s n ASP 5 Cb 0.34 -0.60 0.18 0.00 -1.14 0.00 0.00 41.12 39.91 2q3s n ASP 5 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 2q3s s GLY 6 N -0.49 1.77 0.45 6.12 0.00 -0.55 -4.98 107.32 109.65 2q3s s GLY 6 Ca 0.32 -1.18 -0.23 0.00 0.00 0.00 0.00 44.72 43.64 2q3s s GLY 6 CO 0.10 -0.42 0.88 -1.55 0.00 0.00 0.00 173.10 172.11 2q3s n PRO 7 N -3.78 1.07 -4.11 2.90 -0.04 -1.26 -4.39 135.00 125.39 2q3s n PRO 7 Ca 0.15 0.39 -0.24 0.00 -0.04 0.00 0.00 63.50 63.76 2q3s n PRO 7 Cb 0.59 -1.93 -0.05 0.00 -0.04 0.00 0.00 33.50 32.08 2q3s n PRO 7 CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 2q3s s LYS 8 N -2.03 2.86 0.01 0.54 -2.85 -1.26 -3.41 119.74 113.60 2q3s s LYS 8 Ca 0.65 -1.00 0.03 0.00 -1.00 0.00 0.00 55.97 54.65 2q3s s LYS 8 Cb -0.54 -2.57 -0.01 0.00 -2.06 0.00 0.00 37.83 32.65 2q3s s LYS 8 CO 0.56 0.44 -0.08 -0.06 0.10 0.00 0.00 175.35 176.30 2q3s s PHE 9 N -1.96 0.73 0.68 1.78 0.08 -0.59 -4.92 117.98 113.79 2q3s s PHE 9 Ca 0.32 -0.23 0.01 0.00 0.12 0.00 0.00 56.93 57.15 2q3s s PHE 9 Cb -0.09 -0.46 0.11 0.00 -0.57 0.00 0.00 43.02 42.02 2q3s s PHE 9 CO 0.24 -0.02 0.94 0.21 -0.10 0.00 0.00 175.22 176.49 2q3s s LYS 10 N -0.58 1.85 0.05 0.44 2.20 -1.26 0.99 119.74 123.44 2q3s s LYS 10 Ca 0.00 -1.18 0.14 0.00 -0.36 0.00 0.00 55.97 54.58 2q3s s LYS 10 Cb -0.05 -2.40 -0.15 0.00 -1.51 0.00 0.00 37.83 33.72 2q3s s LYS 10 CO 0.00 -1.29 0.87 1.79 -0.36 0.00 0.00 175.35 176.36 2q3s h THR 12 N -0.36 0.74 -0.20 3.43 1.35 -1.87 -3.49 112.91 112.52 2q3s h THR 12 Ca -0.36 -2.36 0.00 0.00 -0.55 0.00 0.00 66.41 63.15 2q3s h THR 12 Cb 1.27 2.26 0.00 0.00 -1.73 0.00 0.00 68.15 69.95 2q3s h THR 12 CO 0.41 0.42 0.00 -0.90 -0.25 0.00 0.00 175.52 175.20 2q3s n ASP 13 N -3.01 1.06 0.00 5.36 5.75 -1.26 -4.88 116.55 119.57 2q3s n ASP 13 Ca -0.10 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.68 2q3s n ASP 13 Cb 0.91 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.86 2q3s n ASP 13 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2q3s n GLY 14 N 0.82 1.77 3.81 6.12 0.00 -1.26 -5.06 105.19 111.40 2q3s n GLY 14 Ca 0.07 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 2q3s n GLY 14 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2q3s s SER 15 N -2.66 4.61 0.10 1.61 1.04 -1.26 -5.00 113.70 112.14 2q3s s SER 15 Ca 0.00 1.29 0.08 0.00 0.48 0.00 0.00 55.95 57.80 2q3s s SER 15 Cb 0.00 -2.03 -0.04 0.00 0.10 0.00 0.00 66.02 64.05 2q3s s SER 15 CO 0.00 -1.89 -0.14 -0.31 0.98 0.00 0.00 173.24 171.88 2q3s s TYR 16 N -3.18 2.63 -0.18 5.02 1.51 -1.26 -4.25 117.35 117.65 2q3s s TYR 16 Ca 0.60 -0.21 -0.01 0.00 -1.01 0.00 0.00 57.07 56.45 2q3s s TYR 16 Cb -0.14 -1.40 0.00 0.00 -0.11 0.00 0.00 41.96 40.31 2q3s s TYR 16 CO 0.54 0.39 -0.14 0.08 -1.11 0.00 0.00 175.55 175.31 2q3s s VAL 17 N -1.15 2.67 0.14 0.71 1.01 0.28 -4.89 120.40 119.17 2q3s s VAL 17 Ca 0.19 -0.75 -0.20 0.00 0.00 0.00 0.00 61.98 61.22 2q3s s VAL 17 Cb -0.11 -2.15 -0.07 0.00 0.00 0.00 0.00 36.38 34.05 2q3s s VAL 17 CO 0.11 0.50 0.65 -1.10 0.00 0.00 0.00 175.10 175.26 2q3s s GLN 18 N 1.12 4.26 0.16 2.72 -0.21 -1.12 -1.55 119.66 125.03 2q3s s GLN 18 Ca 0.00 0.82 0.07 0.00 0.02 0.00 0.00 55.36 56.28 2q3s s GLN 18 Cb -0.14 -3.10 -0.04 0.00 1.00 0.00 0.00 33.01 30.72 2q3s s GLN 18 CO -0.05 0.54 -0.15 0.95 -2.12 0.00 0.00 175.29 174.46 2q3s s THR 19 N -1.28 1.59 -0.08 -0.19 -4.23 -1.22 -3.01 115.64 107.22 2q3s s THR 19 Ca 0.35 -1.93 -0.07 0.00 -1.18 0.00 0.00 61.69 58.86 2q3s s THR 19 Cb -0.19 -1.79 0.02 0.00 1.34 0.00 0.00 72.50 71.89 2q3s s THR 19 CO 0.21 -0.45 0.21 -0.75 -0.54 0.00 0.00 174.62 173.29 2q3s s LYS 20 N -3.04 0.23 -0.10 3.99 2.47 -1.15 -1.49 119.74 120.65 2q3s s LYS 20 Ca 0.15 0.31 0.04 0.00 -1.56 0.00 0.00 55.97 54.91 2q3s s LYS 20 Cb -0.04 0.09 0.00 0.00 -1.46 0.00 0.00 37.83 36.42 2q3s s LYS 20 CO 0.05 -0.04 -0.24 0.99 0.16 0.00 0.00 175.35 176.27 2q3s s THR 21 N 0.24 2.04 0.28 3.43 2.01 -1.26 -1.18 115.64 121.20 2q3s s THR 21 Ca -0.01 -1.01 0.04 0.00 0.31 0.00 0.00 61.69 61.03 2q3s s THR 21 Cb -0.03 -1.77 -0.06 0.00 0.01 0.00 0.00 72.50 70.66 2q3s s THR 21 CO -0.01 0.56 0.01 -0.63 -0.69 0.00 0.00 174.62 173.85 2q3s s ILE 22 N 0.37 1.26 -0.15 1.82 1.01 0.40 -5.00 121.20 120.92 2q3s s ILE 22 Ca -0.18 -2.05 0.01 0.00 0.00 0.00 0.00 60.65 58.43 2q3s s ILE 22 Cb -0.18 -2.55 0.02 0.00 0.01 0.00 0.00 42.46 39.76 2q3s s ILE 22 CO 0.08 -0.19 -0.16 -1.81 0.00 0.00 0.00 174.94 172.86 2q3s s ASP 23 N -3.41 2.78 -1.21 3.58 1.01 -1.26 -0.00 116.67 118.15 2q3s s ASP 23 Ca 0.32 -0.52 -0.18 0.00 0.71 0.00 0.00 52.55 52.88 2q3s s ASP 23 Cb 0.06 -1.25 -0.02 0.00 1.01 0.00 0.00 42.92 42.72 2q3s s ASP 23 CO 0.12 -0.02 2.02 0.52 0.21 0.00 0.00 175.17 178.03 2q3s n VAL 24 N 4.57 2.93 -1.28 -1.27 0.31 -1.09 -4.65 118.33 117.84 2q3s n VAL 24 Ca -0.18 -2.71 -0.30 0.00 -0.01 0.00 0.00 64.34 61.14 2q3s n VAL 24 Cb 0.50 -2.44 0.13 0.00 -0.91 0.00 0.00 33.84 31.12 2q3s n VAL 24 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2q3s s GLY 25 N 4.23 1.62 0.56 2.92 0.00 -1.26 -3.57 107.32 111.82 2q3s s GLY 25 Ca 0.53 -0.09 0.37 0.00 0.00 0.00 0.00 44.72 45.54 2q3s s GLY 25 CO 0.02 0.39 1.73 1.48 0.00 0.00 0.00 173.10 176.72 2q3s h SER 26 N -1.44 0.00 0.00 1.64 4.64 -2.00 -1.80 113.55 114.60 2q3s h SER 26 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 2q3s h SER 26 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2q3s h SER 26 CO 0.55 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.97 2q3s n SER 27 N -3.99 0.26 -4.67 4.97 3.41 -1.26 -4.66 113.62 107.69 2q3s n SER 27 Ca 0.27 -0.60 -0.56 0.00 -0.26 0.00 0.00 58.87 57.72 2q3s n SER 27 Cb 1.34 0.49 -0.07 0.00 -0.26 0.00 0.00 64.21 65.72 2q3s n SER 27 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2q3s n THR 28 N -0.49 0.19 -3.12 6.66 -1.04 -0.68 -4.87 114.28 110.93 2q3s n THR 28 Ca 0.00 -0.03 -0.45 0.00 -2.04 0.00 0.00 64.05 61.53 2q3s n THR 28 Cb 0.02 -1.03 -0.05 0.00 -1.82 0.00 0.00 70.33 67.46 2q3s n THR 28 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2q3s s ASP 29 N 2.46 6.19 0.00 8.00 3.68 -1.26 -4.63 116.67 131.11 2q3s s ASP 29 Ca 0.94 -1.40 0.28 0.00 2.13 0.00 0.00 52.55 54.50 2q3s s ASP 29 Cb -1.06 -2.30 1.09 0.00 -1.45 0.00 0.00 42.92 39.20 2q3s s ASP 29 CO 0.60 -1.10 1.78 2.30 0.13 0.00 0.00 175.17 178.89 2q3s n ILE 30 N 5.55 0.00 -0.32 4.11 -5.35 -1.26 -3.95 119.36 118.13 2q3s n ILE 30 Ca -0.09 -0.07 0.10 0.00 -0.27 0.00 0.00 62.75 62.42 2q3s n ILE 30 Cb 0.43 0.00 0.31 0.00 -1.74 0.00 0.00 39.64 38.64 2q3s n ILE 30 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 2q3s h SER 31 N 0.64 0.80 0.10 7.28 4.64 -1.94 -0.60 113.55 124.47 2q3s h SER 31 Ca 0.00 0.05 -0.02 0.00 -0.47 0.00 0.00 61.79 61.35 2q3s h SER 31 Cb 0.40 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.38 2q3s h SER 31 CO 0.00 0.40 -0.09 -0.65 -0.87 0.00 0.00 176.83 175.62 2q3s h PRO 32 N 0.84 0.00 0.10 4.77 0.11 -2.01 -2.43 132.00 133.38 2q3s h PRO 32 Ca 0.49 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 66.36 2q3s h PRO 32 Cb 0.64 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.75 2q3s h PRO 32 CO -0.26 0.09 -1.19 1.88 -0.21 0.00 0.00 178.00 178.32 2q3s h TYR 33 N 0.00 0.37 -0.93 0.65 0.05 -1.43 -2.88 116.97 112.81 2q3s h TYR 33 Ca -0.00 -0.27 0.18 0.00 0.05 0.00 0.00 58.73 58.69 2q3s h TYR 33 Cb 0.17 -0.01 -0.08 0.00 1.01 0.00 0.00 36.73 37.82 2q3s h TYR 33 CO 0.00 1.46 0.59 -0.07 -1.05 0.00 0.00 178.16 179.10 2q3s h LEU 34 N -0.45 0.60 -0.69 3.88 3.38 -1.27 0.22 115.31 120.98 2q3s h LEU 34 Ca -0.26 0.05 -0.14 0.00 0.09 0.00 0.00 57.88 57.63 2q3s h LEU 34 Cb 1.63 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.30 2q3s h LEU 34 CO 0.04 0.26 -0.56 0.28 0.09 0.00 0.00 178.44 178.55 2q3s h SER 35 N 0.62 0.30 -0.69 -0.43 0.02 -1.52 0.48 113.55 112.32 2q3s h SER 35 Ca 0.49 -0.16 -0.08 0.00 -0.84 0.00 0.00 61.79 61.20 2q3s h SER 35 Cb 0.92 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.35 2q3s h SER 35 CO -0.24 0.80 0.14 -0.07 -1.14 0.00 0.00 176.83 176.32 2q3s h LEU 36 N 0.21 1.08 0.04 5.07 3.38 -0.43 0.41 115.31 125.06 2q3s h LEU 36 Ca 0.00 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.72 2q3s h LEU 36 Cb 1.05 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.52 2q3s h LEU 36 CO 0.09 1.05 -0.02 0.40 0.09 0.00 0.00 178.44 180.05 2q3s h ILE 37 N 1.06 1.19 -0.17 1.22 1.08 -0.46 -0.79 117.51 120.65 2q3s h ILE 37 Ca 0.21 -0.75 0.02 0.00 -0.39 0.00 0.00 64.86 63.96 2q3s h ILE 37 Cb 0.41 1.69 -0.02 0.00 -3.07 0.00 0.00 36.82 35.83 2q3s h ILE 37 CO 0.01 0.19 0.02 -0.09 -0.69 0.00 0.00 178.15 177.58 2q3s h ARG 38 N -0.39 0.08 -0.82 2.37 2.43 0.07 0.74 114.38 118.85 2q3s h ARG 38 Ca -0.01 -0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 2q3s h ARG 38 Cb 0.35 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.85 2q3s h ARG 38 CO 0.01 0.05 0.35 1.49 -1.51 0.00 0.00 179.97 180.36 2q3s h GLU 39 N 0.08 1.21 -0.35 0.20 4.81 -0.16 0.25 114.58 120.62 2q3s h GLU 39 Ca 0.08 -0.21 -0.09 0.00 -0.13 0.00 0.00 59.36 59.02 2q3s h GLU 39 Cb 0.08 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 2q3s h GLU 39 CO -0.12 0.96 -0.14 0.22 -0.73 0.00 0.00 179.01 179.20 2q3s h ASP 40 N 1.19 0.61 0.55 1.04 1.82 -0.54 -2.35 116.42 118.74 2q3s h ASP 40 Ca 0.28 -0.18 -0.14 0.00 -0.39 0.00 0.00 57.03 56.60 2q3s h ASP 40 Cb 0.18 -0.16 -0.02 0.00 0.68 0.00 0.00 39.33 40.01 2q3s h ASP 40 CO -0.03 0.78 -0.64 -1.28 -1.61 0.00 0.00 179.24 176.46 2q3s h SER 41 N 0.56 0.10 -0.04 2.28 0.87 -0.10 0.21 113.55 117.44 2q3s h SER 41 Ca 0.10 -0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.58 2q3s h SER 41 Cb 0.57 -0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 62.50 2q3s h SER 41 CO 0.04 0.71 -0.05 0.40 -0.53 0.00 0.00 176.83 177.39 2q3s h ILE 42 N 0.06 1.41 0.00 2.23 5.03 -0.13 2.81 117.51 128.92 2q3s h ILE 42 Ca -0.01 -1.30 -0.31 0.00 -0.12 0.00 0.00 64.86 63.12 2q3s h ILE 42 Cb 1.13 2.20 -0.05 0.00 -3.03 0.00 0.00 36.82 37.07 2q3s h ILE 42 CO 0.09 0.35 -1.88 0.18 -0.68 0.00 0.00 178.15 176.21 2q3s n LEU 43 N -4.74 0.72 -0.03 1.44 4.77 -0.92 -4.53 117.00 113.71 2q3s n LEU 43 Ca -0.08 0.31 -0.04 0.00 -0.03 0.00 0.00 56.01 56.17 2q3s n LEU 43 Cb 0.31 0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 2q3s n LEU 43 CO 0.35 0.43 -0.71 0.59 -1.33 0.00 0.00 177.39 176.72 2q3s n ASN 44 N -2.99 3.51 -2.55 -1.43 3.02 0.57 -4.80 115.26 110.60 2q3s n ASN 44 Ca -0.21 -0.03 -0.36 0.00 -0.03 0.00 0.00 54.58 53.95 2q3s n ASN 44 Cb 1.08 0.04 0.05 0.00 -0.61 0.00 0.00 39.78 40.34 2q3s n ASN 44 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2q3s n GLY 45 N 3.07 5.78 3.26 7.41 0.00 -0.22 -4.91 105.19 119.59 2q3s n GLY 45 Ca -0.11 -2.43 -0.23 0.00 0.00 0.00 0.00 46.02 43.24 2q3s n GLY 45 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2q3s n ASN 46 N -0.73 -0.76 -3.22 1.61 4.13 -1.19 -1.17 115.26 113.93 2q3s n ASN 46 Ca 0.57 -0.70 -0.23 0.00 1.68 0.00 0.00 54.58 55.89 2q3s n ASN 46 Cb 0.51 -0.90 0.05 0.00 -1.54 0.00 0.00 39.78 37.90 2q3s n ASN 46 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2q3s n ARG 47 N -2.59 -5.89 -5.04 3.52 1.74 0.94 -4.95 116.66 104.40 2q3s n ARG 47 Ca 0.02 0.88 -0.32 0.00 -0.77 0.00 0.00 57.85 57.67 2q3s n ARG 47 Cb 0.28 -5.81 -0.14 0.00 -1.02 0.00 0.00 32.46 25.76 2q3s n ARG 47 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2q3s s ALA 48 N -3.23 2.48 -0.16 7.54 0.00 -0.32 -1.59 121.76 126.48 2q3s s ALA 48 Ca 0.40 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 51.32 2q3s s ALA 48 Cb -0.18 -0.81 0.03 0.00 0.00 0.00 0.00 23.12 22.17 2q3s s ALA 48 CO 0.49 0.55 -0.11 0.08 0.00 0.00 0.00 175.76 176.78 2q3s s VAL 49 N -0.69 1.42 0.18 0.00 1.01 0.14 -4.81 120.40 117.64 2q3s s VAL 49 Ca 0.11 -0.66 -0.20 0.00 0.00 0.00 0.00 61.98 61.23 2q3s s VAL 49 Cb -0.10 -1.43 -0.08 0.00 0.00 0.00 0.00 36.38 34.77 2q3s s VAL 49 CO 0.00 0.32 0.69 -0.63 0.00 0.00 0.00 175.10 175.48 2q3s s ILE 50 N 1.53 4.59 0.06 2.22 1.09 -0.20 0.39 121.20 130.88 2q3s s ILE 50 Ca 0.03 1.30 -0.09 0.00 -1.10 0.00 0.00 60.65 60.79 2q3s s ILE 50 Cb -0.14 -3.90 0.00 0.00 -1.06 0.00 0.00 42.46 37.36 2q3s s ILE 50 CO -0.09 0.33 0.19 0.72 -0.10 0.00 0.00 174.94 175.99 2q3s s PHE 51 N -1.37 0.10 0.14 3.97 -0.12 0.16 0.22 117.98 121.07 2q3s s PHE 51 Ca 0.39 -0.42 -0.08 0.00 -0.05 0.00 0.00 56.93 56.76 2q3s s PHE 51 Cb -0.18 -0.04 -0.01 0.00 -0.63 0.00 0.00 43.02 42.16 2q3s s PHE 51 CO 0.21 -0.49 0.23 0.34 -0.05 0.00 0.00 175.22 175.47 2q3s s ASP 52 N -2.48 0.09 0.10 1.98 -1.08 -1.07 -3.78 116.67 110.43 2q3s s ASP 52 Ca -0.00 -0.84 -0.00 0.00 -0.52 0.00 0.00 52.55 51.19 2q3s s ASP 52 Cb 0.02 0.39 -0.04 0.00 -1.46 0.00 0.00 42.92 41.83 2q3s s ASP 52 CO -0.07 -0.83 -0.01 0.68 0.52 0.00 0.00 175.17 175.46 2q3s s VAL 53 N -3.94 0.35 -0.03 1.11 -7.23 -1.26 -0.30 120.40 109.09 2q3s s VAL 53 Ca 0.14 -1.88 0.03 0.00 -1.81 0.00 0.00 61.98 58.46 2q3s s VAL 53 Cb 0.04 -1.76 -0.00 0.00 0.56 0.00 0.00 36.38 35.22 2q3s s VAL 53 CO -0.03 -0.77 -0.12 -0.31 -0.31 0.00 0.00 175.10 173.55 2q3s s TYR 54 N -3.86 1.20 -0.07 2.82 1.51 0.16 -4.96 117.35 114.15 2q3s s TYR 54 Ca 0.14 -0.29 0.03 0.00 -1.01 0.00 0.00 57.07 55.94 2q3s s TYR 54 Cb 0.07 -0.82 -0.02 0.00 -0.11 0.00 0.00 41.96 41.08 2q3s s TYR 54 CO -0.04 -0.10 -0.17 -1.58 -1.11 0.00 0.00 175.55 172.56 2q3s s TRP 55 N 0.03 2.66 -0.22 2.71 0.52 -1.26 0.17 118.94 123.55 2q3s s TRP 55 Ca -0.01 -0.39 -0.14 0.00 0.02 0.00 0.00 56.10 55.58 2q3s s TRP 55 Cb -0.08 -1.67 -0.04 0.00 -1.15 0.00 0.00 33.47 30.52 2q3s s TRP 55 CO 0.01 0.00 0.31 0.34 0.02 0.00 0.00 176.95 177.63 2q3s s ASP 56 N -0.36 6.32 -0.10 2.95 3.68 0.50 -4.85 116.67 124.82 2q3s s ASP 56 Ca 0.03 0.37 -0.20 0.00 2.13 0.00 0.00 52.55 54.87 2q3s s ASP 56 Cb -0.12 -2.18 -0.04 0.00 -1.45 0.00 0.00 42.92 39.12 2q3s s ASP 56 CO 0.02 -0.02 0.58 -0.69 0.13 0.00 0.00 175.17 175.19 2q3s s VAL 57 N 1.21 5.12 0.39 1.11 1.01 -1.26 0.20 120.40 128.18 2q3s s VAL 57 Ca 0.15 1.17 0.08 0.00 0.00 0.00 0.00 61.98 63.37 2q3s s VAL 57 Cb -0.14 -3.92 -0.07 0.00 0.00 0.00 0.00 36.38 32.26 2q3s s VAL 57 CO 0.07 0.29 0.04 -0.83 0.00 0.00 0.00 175.10 174.67 2q3s s GLY 58 N 0.72 2.35 -0.26 4.51 0.00 -1.17 -4.95 107.32 108.52 2q3s s GLY 58 Ca 0.31 -2.17 0.01 0.00 0.00 0.00 0.00 44.72 42.86 2q3s s GLY 58 CO 0.14 -2.01 -0.01 -1.36 0.00 0.00 0.00 173.10 169.85 2q3s s PHE 59 N -2.64 2.47 0.00 1.90 2.99 -1.26 -4.71 117.98 116.73 2q3s s PHE 59 Ca 0.36 -1.92 0.00 0.00 0.00 0.00 0.00 56.93 55.37 2q3s s PHE 59 Cb 0.06 -1.79 0.00 0.00 0.00 0.00 0.00 43.02 41.29 2q3s s PHE 59 CO 0.19 -0.81 0.00 -2.37 -0.00 0.00 0.00 175.22 172.23 2q3s n THR 66 N 4.64 0.00 -0.37 0.64 5.66 -1.26 -4.94 114.28 118.65 2q3s n THR 66 Ca -0.08 0.00 0.35 0.00 -3.05 0.00 0.00 64.05 61.27 2q3s n THR 66 Cb 0.43 0.00 0.62 0.00 -1.55 0.00 0.00 70.33 69.83 2q3s n THR 66 CO 0.00 0.00 0.00 0.11 -3.05 0.00 0.00 175.07 172.13 2q3s h LYS 67 N 0.19 0.00 -0.00 1.09 6.56 -2.05 0.31 116.57 122.67 2q3s h LYS 67 Ca 0.00 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2q3s h LYS 67 Cb 0.00 -0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 2q3s h LYS 67 CO 0.00 0.00 -0.02 0.25 -2.06 0.00 0.00 179.45 177.62 2q3s n THR 68 N -5.09 0.00 1.01 -0.16 -2.24 -1.26 -3.69 114.28 102.85 2q3s n THR 68 Ca 0.39 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 62.14 2q3s n THR 68 Cb 1.38 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.25 2q3s n THR 68 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2q3s n SER 69 N -1.04 0.71 -0.00 3.42 3.41 0.11 -2.72 113.62 117.50 2q3s n SER 69 Ca 0.18 -1.72 0.07 0.00 -0.26 0.00 0.00 58.87 57.14 2q3s n SER 69 Cb 0.21 -0.35 -0.08 0.00 -0.26 0.00 0.00 64.21 63.72 2q3s n SER 69 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2q3s n GLY 70 N 0.12 -0.37 3.52 5.00 0.00 -1.24 -5.01 105.19 107.20 2q3s n GLY 70 Ca 0.00 -0.39 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 2q3s n GLY 70 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2q3s n TRP 71 N -1.41 -0.43 -3.46 1.61 7.02 -1.10 -3.03 117.44 116.64 2q3s n TRP 71 Ca 0.02 0.20 -0.21 0.00 -1.02 0.00 0.00 57.50 56.48 2q3s n TRP 71 Cb 0.24 -1.83 -0.12 0.00 -2.42 0.00 0.00 31.31 27.18 2q3s n TRP 71 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2q3s s SER 72 N -2.35 2.31 -0.28 -0.99 0.15 0.53 -4.82 113.70 108.25 2q3s s SER 72 Ca 0.64 -0.90 -0.35 0.00 0.70 0.00 0.00 55.95 56.04 2q3s s SER 72 Cb -0.22 0.19 -0.11 0.00 -1.71 0.00 0.00 66.02 64.17 2q3s s SER 72 CO 0.63 -0.40 2.08 -0.11 1.20 0.00 0.00 173.24 176.63 2q3s n LEU 73 N 5.29 2.53 -0.04 3.45 7.94 -1.26 -0.37 117.00 134.54 2q3s n LEU 73 Ca -0.04 0.59 -0.12 0.00 -1.11 0.00 0.00 56.01 55.33 2q3s n LEU 73 Cb 0.45 -1.30 -0.14 0.00 0.53 0.00 0.00 43.42 42.96 2q3s n LEU 73 CO 0.02 -0.55 -0.78 -0.24 -1.11 0.00 0.00 177.39 174.73 2q3s n SER 74 N 8.83 0.94 -3.61 1.96 2.88 0.13 -4.78 113.62 119.97 2q3s n SER 74 Ca 0.35 0.24 -0.04 0.00 -1.33 0.00 0.00 58.87 58.09 2q3s n SER 74 Cb 0.25 0.05 -0.02 0.00 -0.75 0.00 0.00 64.21 63.74 2q3s n SER 74 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2q3s s SER 75 N -6.12 -0.10 0.39 -3.46 1.04 -1.21 -1.83 113.70 102.41 2q3s s SER 75 Ca -0.11 -0.00 0.05 0.00 0.48 0.00 0.00 55.95 56.36 2q3s s SER 75 Cb 0.07 0.11 -0.06 0.00 0.10 0.00 0.00 66.02 66.24 2q3s s SER 75 CO 0.80 -0.17 0.04 0.68 0.98 0.00 0.00 173.24 175.57 2q3s s VAL 76 N -2.31 1.42 -0.06 5.02 -7.23 -1.23 0.38 120.40 116.40 2q3s s VAL 76 Ca 0.10 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.29 2q3s s VAL 76 Cb -0.01 -2.74 0.01 0.00 0.56 0.00 0.00 36.38 34.21 2q3s s VAL 76 CO -0.04 0.00 -0.10 -0.75 -0.31 0.00 0.00 175.10 173.90 2q3s s LYS 77 N -3.80 1.48 -0.30 4.82 2.20 0.58 -3.50 119.74 121.23 2q3s s LYS 77 Ca 0.30 -0.34 0.02 0.00 -0.36 0.00 0.00 55.97 55.60 2q3s s LYS 77 Cb 0.08 -1.26 0.07 0.00 -1.51 0.00 0.00 37.83 35.21 2q3s s LYS 77 CO 0.15 0.01 -0.03 -0.51 -0.36 0.00 0.00 175.35 174.60 2q3s s LEU 78 N 0.69 4.00 0.08 5.43 1.43 -0.18 -2.60 118.68 127.52 2q3s s LEU 78 Ca -0.14 -1.65 0.06 0.00 -1.03 0.00 0.00 54.13 51.37 2q3s s LEU 78 Cb -0.15 -1.61 -0.04 0.00 0.03 0.00 0.00 46.19 44.42 2q3s s LEU 78 CO 0.03 -0.27 -0.09 -0.44 0.23 0.00 0.00 176.35 175.80 2q3s s SER 79 N 1.09 4.43 0.16 2.29 0.01 0.13 0.47 113.70 122.29 2q3s s SER 79 Ca -0.02 -0.33 0.04 0.00 1.31 0.00 0.00 55.95 56.95 2q3s s SER 79 Cb -0.20 -0.89 -0.05 0.00 0.21 0.00 0.00 66.02 65.10 2q3s s SER 79 CO -0.05 0.20 -0.08 0.42 0.41 0.00 0.00 173.24 174.14 2q3s s THR 80 N -1.16 1.07 0.31 1.44 -4.23 0.22 -1.04 115.64 112.27 2q3s s THR 80 Ca 0.20 -2.04 0.08 0.00 -1.18 0.00 0.00 61.69 58.75 2q3s s THR 80 Cb -0.11 -1.93 0.31 0.00 1.34 0.00 0.00 72.50 72.11 2q3s s THR 80 CO 0.12 -0.67 1.77 -0.09 -0.54 0.00 0.00 174.62 175.21 2q3s h ARG 81 N 2.74 0.68 0.04 3.99 2.43 -1.91 -2.25 114.38 120.10 2q3s h ARG 81 Ca -0.37 -0.04 -0.26 0.00 -0.81 0.00 0.00 59.98 58.50 2q3s h ARG 81 Cb 1.19 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.56 2q3s h ARG 81 CO 0.64 0.45 -1.36 -0.91 -1.51 0.00 0.00 179.97 177.27 2q3s h ASN 82 N 0.70 0.12 -3.68 -3.80 2.35 -1.96 -3.46 115.58 105.85 2q3s h ASN 82 Ca 0.59 -0.16 -0.41 0.00 -0.55 0.00 0.00 56.30 55.76 2q3s h ASN 82 Cb 1.00 -0.04 -0.14 0.00 0.05 0.00 0.00 38.32 39.19 2q3s h ASN 82 CO -0.39 1.14 -0.64 -0.76 -1.65 0.00 0.00 177.43 175.13 2q3s s LEU 83 N -6.62 2.14 -0.14 1.61 1.43 -0.85 -2.80 118.68 113.47 2q3s s LEU 83 Ca -0.04 -1.28 -0.06 0.00 -1.03 0.00 0.00 54.13 51.72 2q3s s LEU 83 Cb 0.08 -0.30 0.06 0.00 0.03 0.00 0.00 46.19 46.06 2q3s s LEU 83 CO 0.83 -0.55 0.30 0.00 0.23 0.00 0.00 176.35 177.16 2q3s s LEU 85 N 1.77 2.04 -0.23 0.00 2.96 0.18 -2.94 118.68 122.46 2q3s s LEU 85 Ca -0.05 -0.59 -0.10 0.00 -0.22 0.00 0.00 54.13 53.16 2q3s s LEU 85 Cb -0.11 -1.40 -0.05 0.00 0.50 0.00 0.00 46.19 45.14 2q3s s LEU 85 CO -0.10 0.03 0.13 -0.36 -1.32 0.00 0.00 176.35 174.74 2q3s s PHE 86 N 1.07 3.29 -0.21 5.38 0.08 -0.33 -1.02 117.98 126.26 2q3s s PHE 86 Ca -0.01 0.15 -0.00 0.00 0.12 0.00 0.00 56.93 57.19 2q3s s PHE 86 Cb -0.14 -2.23 0.02 0.00 -0.57 0.00 0.00 43.02 40.10 2q3s s PHE 86 CO -0.07 0.06 -0.14 -0.51 -0.10 0.00 0.00 175.22 174.46 2q3s s LEU 87 N 0.93 2.55 -0.51 -0.37 1.43 -1.23 -0.45 118.68 121.04 2q3s s LEU 87 Ca 0.07 -0.72 -0.17 0.00 -1.03 0.00 0.00 54.13 52.28 2q3s s LEU 87 Cb -0.13 -1.56 0.08 0.00 0.03 0.00 0.00 46.19 44.61 2q3s s LEU 87 CO 0.03 -0.04 0.51 -0.13 0.23 0.00 0.00 176.35 176.95 2q3s s ARG 88 N 1.31 3.03 0.54 1.70 0.52 1.00 -3.54 118.95 123.50 2q3s s ARG 88 Ca 0.03 -1.28 -0.21 0.00 -0.52 0.00 0.00 55.73 53.75 2q3s s ARG 88 Cb -0.14 -4.16 -0.05 0.00 0.52 0.00 0.00 34.95 31.11 2q3s s ARG 88 CO -0.09 -1.19 1.31 -0.51 0.02 0.00 0.00 175.30 174.84 2q3s s LEU 89 N 2.03 3.84 0.99 2.53 1.43 -0.76 -2.69 118.68 126.05 2q3s s LEU 89 Ca 0.08 2.66 -0.16 0.00 -1.03 0.00 0.00 54.13 55.67 2q3s s LEU 89 Cb -0.24 -4.32 0.21 0.00 0.03 0.00 0.00 46.19 41.88 2q3s s LEU 89 CO 0.07 -1.51 1.29 -2.16 0.23 0.00 0.00 176.35 174.28 2q3s s PRO 90 N -2.94 0.39 0.00 1.29 0.04 -1.23 -4.84 135.00 127.70 2q3s s PRO 90 Ca 0.72 -0.35 0.00 0.00 0.04 0.00 0.00 61.00 61.40 2q3s s PRO 90 Cb -0.38 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.35 2q3s s PRO 90 CO 0.44 -2.59 0.00 1.17 0.04 0.00 0.00 177.00 176.06 2q3s n LYS 91 N -3.91 0.00 -0.29 4.56 3.00 -1.26 -4.37 118.16 115.89 2q3s n LYS 91 Ca 0.15 0.00 -0.07 0.00 -0.00 0.00 0.00 58.31 58.39 2q3s n LYS 91 Cb 0.59 -0.10 -0.02 0.00 0.00 0.00 0.00 35.03 35.51 2q3s n LYS 91 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 2q3s n PRO 92 N -0.24 0.75 0.00 1.64 -0.04 -1.26 -4.82 135.00 131.02 2q3s n PRO 92 Ca 0.00 -0.66 0.00 0.00 -0.04 0.00 0.00 63.50 62.80 2q3s n PRO 92 Cb 0.00 -1.97 0.00 0.00 -0.04 0.00 0.00 33.50 31.49 2q3s n PRO 92 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2q3s n PHE 93 N 3.97 0.00 -3.32 0.54 3.01 -1.26 -4.91 117.46 115.48 2q3s n PHE 93 Ca 0.16 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.41 2q3s n PHE 93 Cb 0.12 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 39.61 2q3s n PHE 93 CO 0.00 0.00 0.00 -1.01 1.01 0.00 0.00 176.76 176.76 2q3s s HIS 94 N 0.00 2.03 0.57 1.38 3.76 -1.26 -4.97 115.29 116.81 2q3s s HIS 94 Ca 0.00 -0.63 0.41 0.00 -0.15 0.00 0.00 55.06 54.68 2q3s s HIS 94 Cb 0.00 -2.18 1.45 0.00 1.11 0.00 0.00 32.58 32.97 2q3s s HIS 94 CO 0.00 -0.63 1.53 -0.44 -0.85 0.00 0.00 174.74 174.35 2q3s h ASP 95 N 0.58 0.00 0.00 1.40 3.32 -1.92 0.22 116.42 120.02 2q3s h ASP 95 Ca -0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.69 2q3s h ASP 95 Cb 1.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.83 2q3s h ASP 95 CO 0.49 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.55 2q3s n ASN 96 N -3.74 0.00 -0.65 6.45 6.94 -1.26 -1.03 115.26 121.97 2q3s n ASN 96 Ca 0.34 -0.43 0.08 0.00 -0.02 0.00 0.00 54.58 54.55 2q3s n ASN 96 Cb 1.71 0.00 0.07 0.00 -2.36 0.00 0.00 39.78 39.21 2q3s n ASN 96 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 2q3s n LEU 97 N -0.82 2.36 0.22 -4.53 4.77 0.78 -4.43 117.00 115.35 2q3s n LEU 97 Ca 0.05 -1.04 0.05 0.00 -0.03 0.00 0.00 56.01 55.04 2q3s n LEU 97 Cb 0.02 -0.01 0.49 0.00 -2.33 0.00 0.00 43.42 41.59 2q3s n LEU 97 CO 0.04 0.43 0.88 0.11 -1.33 0.00 0.00 177.39 177.51 2q3s h LYS 98 N 3.11 0.00 -0.79 3.23 1.57 -1.28 -0.86 116.57 121.55 2q3s h LYS 98 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2q3s h LYS 98 Cb 0.67 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.94 2q3s h LYS 98 CO 0.00 0.21 0.45 -0.44 -0.57 0.00 0.00 179.45 179.10 2q3s h ASP 99 N 0.00 0.97 -0.47 0.86 3.32 -1.79 0.22 116.42 119.54 2q3s h ASP 99 Ca -0.00 -0.08 -0.11 0.00 0.02 0.00 0.00 57.03 56.85 2q3s h ASP 99 Cb 0.37 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2q3s h ASP 99 CO 0.03 0.77 -0.14 0.25 -1.72 0.00 0.00 179.24 178.43 2q3s h LEU 100 N 1.09 0.93 -0.53 1.55 5.85 -1.50 0.28 115.31 122.99 2q3s h LEU 100 Ca 0.28 -0.37 -0.08 0.00 0.84 0.00 0.00 57.88 58.55 2q3s h LEU 100 Cb -0.00 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.75 2q3s h LEU 100 CO -0.05 1.09 0.03 1.88 -0.34 0.00 0.00 178.44 181.06 2q3s h TYR 101 N 0.76 1.00 -0.23 1.25 -1.99 -0.84 -1.16 116.97 115.77 2q3s h TYR 101 Ca 0.11 -0.16 -0.10 0.00 2.00 0.00 0.00 58.73 60.59 2q3s h TYR 101 Cb 0.70 -0.26 -0.01 0.00 2.00 0.00 0.00 36.73 39.15 2q3s h TYR 101 CO 0.05 0.91 -0.28 0.00 -0.00 0.00 0.00 178.16 178.84 2q3s h ARG 102 N 0.80 0.44 -0.37 4.88 3.08 -0.30 -0.87 114.38 122.04 2q3s h ARG 102 Ca 0.16 -0.17 -0.06 0.00 0.07 0.00 0.00 59.98 59.97 2q3s h ARG 102 Cb 0.49 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 2q3s h ARG 102 CO 0.02 0.69 -0.02 0.35 -1.07 0.00 0.00 179.97 179.94 2q3s h PHE 103 N 0.39 0.73 0.00 3.04 3.57 -0.11 -1.93 116.94 122.62 2q3s h PHE 103 Ca 0.05 -0.13 -0.04 0.00 3.53 0.00 0.00 57.97 61.38 2q3s h PHE 103 Cb 0.69 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.24 2q3s h PHE 103 CO 0.02 0.77 -0.21 0.74 -2.23 0.00 0.00 178.31 177.40 2q3s h PHE 104 N 0.47 0.00 0.00 0.41 0.05 -1.02 -2.53 116.94 114.33 2q3s h PHE 104 Ca 0.10 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.89 2q3s h PHE 104 Cb 0.49 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.44 2q3s h PHE 104 CO 0.04 0.21 -0.12 0.00 -0.18 0.00 0.00 178.31 178.27 2q3s h ALA 105 N 1.79 0.93 -2.11 2.45 0.00 -0.89 -3.31 119.26 118.12 2q3s h ALA 105 Ca -0.00 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.30 2q3s h ALA 105 Cb 0.71 0.00 0.07 0.00 0.00 0.00 0.00 17.79 18.56 2q3s h ALA 105 CO 0.03 0.00 0.62 0.45 0.00 0.00 0.00 179.25 180.35 2q3s n SER 106 N -2.45 2.51 -1.10 0.00 2.88 -0.75 -4.57 113.62 110.14 2q3s n SER 106 Ca 0.05 1.11 0.10 0.00 -1.33 0.00 0.00 58.87 58.80 2q3s n SER 106 Cb 0.46 -1.36 0.27 0.00 -0.75 0.00 0.00 64.21 62.83 2q3s n SER 106 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2q3s n LYS 107 N 2.68 2.40 -0.06 -1.46 5.02 -1.26 -4.24 118.16 121.24 2q3s n LYS 107 Ca 0.16 -2.16 -0.12 0.00 -2.02 0.00 0.00 58.31 54.17 2q3s n LYS 107 Cb 0.27 -1.48 0.01 0.00 -0.02 0.00 0.00 35.03 33.81 2q3s n LYS 107 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 2q3s h PHE 108 N 3.65 0.94 -2.40 2.13 -1.00 -1.96 -3.46 116.94 114.84 2q3s h PHE 108 Ca 0.00 -0.31 -0.56 0.00 2.81 0.00 0.00 57.97 59.90 2q3s h PHE 108 Cb 0.83 -0.19 -0.13 0.00 3.61 0.00 0.00 35.95 40.07 2q3s h PHE 108 CO 0.37 1.10 -0.53 0.14 -1.61 0.00 0.00 178.31 177.78 2q3s s VAL 109 N -4.17 0.74 -0.13 -0.55 -7.23 -1.26 -4.91 120.40 102.90 2q3s s VAL 109 Ca -0.09 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.08 2q3s s VAL 109 Cb 0.11 -2.39 -0.01 0.00 0.56 0.00 0.00 36.38 34.65 2q3s s VAL 109 CO 0.87 0.00 -0.14 -0.89 -0.31 0.00 0.00 175.10 174.63 2q3s s THR 110 N -3.18 2.98 -0.35 5.32 2.01 -0.62 -4.79 115.64 117.00 2q3s s THR 110 Ca 0.23 -0.69 -0.18 0.00 0.31 0.00 0.00 61.69 61.37 2q3s s THR 110 Cb 0.03 -2.24 -0.00 0.00 0.01 0.00 0.00 72.50 70.29 2q3s s THR 110 CO 0.13 0.53 0.50 -0.36 -0.69 0.00 0.00 174.62 174.73 2q3s s PHE 111 N 0.35 3.18 -0.42 4.92 0.08 0.13 0.25 117.98 126.46 2q3s s PHE 111 Ca -0.12 0.14 -0.10 0.00 0.12 0.00 0.00 56.93 56.97 2q3s s PHE 111 Cb -0.16 -2.90 0.07 0.00 -0.57 0.00 0.00 43.02 39.46 2q3s s PHE 111 CO 0.06 -0.53 0.28 0.08 -0.10 0.00 0.00 175.22 175.00 2q3s s VAL 112 N 2.35 4.41 0.46 -0.44 1.01 0.16 -2.20 120.40 126.15 2q3s s VAL 112 Ca 0.18 -1.31 0.05 0.00 0.00 0.00 0.00 61.98 60.90 2q3s s VAL 112 Cb -0.16 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 2q3s s VAL 112 CO 0.13 -0.50 0.14 -0.83 0.00 0.00 0.00 175.10 174.04 2q3s s GLY 113 N 2.16 2.55 -0.10 4.51 0.00 -1.18 0.36 107.32 115.61 2q3s s GLY 113 Ca 0.03 -1.57 0.04 0.00 0.00 0.00 0.00 44.72 43.22 2q3s s GLY 113 CO 0.03 -2.03 -0.23 0.14 0.00 0.00 0.00 173.10 171.01 2q3s s VAL 114 N -2.72 2.03 -1.27 1.40 1.01 -1.26 -3.17 120.40 116.42 2q3s s VAL 114 Ca 0.30 -1.00 -0.08 0.00 0.00 0.00 0.00 61.98 61.20 2q3s s VAL 114 Cb 0.03 -1.76 -0.01 0.00 0.00 0.00 0.00 36.38 34.65 2q3s s VAL 114 CO 0.17 0.55 0.64 0.00 0.00 0.00 0.00 175.10 176.46 2q3s n GLN 115 N 3.60 -2.94 -0.18 2.72 1.13 -1.26 -4.92 117.38 115.52 2q3s n GLN 115 Ca -0.19 0.49 0.09 0.00 -1.94 0.00 0.00 57.00 55.45 2q3s n GLN 115 Cb 0.53 -4.59 0.19 0.00 0.11 0.00 0.00 30.24 26.48 2q3s n GLN 115 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 2q3s n ILE 116 N -4.26 0.61 0.02 5.09 -5.35 -1.26 -4.64 119.36 109.56 2q3s n ILE 116 Ca -0.22 -0.81 -0.12 0.00 -0.27 0.00 0.00 62.75 61.33 2q3s n ILE 116 Cb 0.65 0.84 -0.07 0.00 -1.74 0.00 0.00 39.64 39.32 2q3s n ILE 116 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 2q3s h GLU 117 N 3.47 0.04 -0.29 6.28 4.81 -1.99 0.10 114.58 127.01 2q3s h GLU 117 Ca 0.00 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 2q3s h GLU 117 Cb 0.84 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 2q3s h GLU 117 CO 0.00 0.16 0.12 0.93 -0.73 0.00 0.00 179.01 179.49 2q3s h GLU 118 N -0.10 0.42 -0.55 1.92 4.39 -2.01 -2.41 114.58 116.25 2q3s h GLU 118 Ca 0.01 -0.07 0.11 0.00 0.34 0.00 0.00 59.36 59.75 2q3s h GLU 118 Cb 0.14 -0.07 -0.10 0.00 -0.10 0.00 0.00 28.75 28.62 2q3s h GLU 118 CO -0.00 0.43 -0.06 -0.44 -1.16 0.00 0.00 179.01 177.77 2q3s h ASP 119 N 0.32 -0.37 -0.81 1.42 3.32 -1.76 -1.77 116.42 116.78 2q3s h ASP 119 Ca 0.10 0.15 0.13 0.00 0.02 0.00 0.00 57.03 57.42 2q3s h ASP 119 Cb 0.16 0.29 -0.09 0.00 0.22 0.00 0.00 39.33 39.90 2q3s h ASP 119 CO -0.01 -0.14 0.40 -0.07 -1.72 0.00 0.00 179.24 177.71 2q3s h LEU 120 N 0.06 0.49 -0.81 1.55 3.38 -0.30 0.22 115.31 119.90 2q3s h LEU 120 Ca 0.27 0.08 -0.11 0.00 0.09 0.00 0.00 57.88 58.21 2q3s h LEU 120 Cb 0.43 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2q3s h LEU 120 CO -0.51 0.23 -0.33 0.44 0.09 0.00 0.00 178.44 178.36 2q3s h ASP 121 N 0.61 0.53 -0.18 -0.43 3.32 -1.12 -1.54 116.42 117.61 2q3s h ASP 121 Ca 0.43 -0.21 -0.07 0.00 0.02 0.00 0.00 57.03 57.20 2q3s h ASP 121 Cb 0.56 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.96 2q3s h ASP 121 CO -0.34 0.82 -0.15 -0.07 -1.72 0.00 0.00 179.24 177.78 2q3s h LEU 122 N 0.44 0.45 -0.58 1.55 3.38 -0.38 0.43 115.31 120.60 2q3s h LEU 122 Ca 0.05 -0.46 0.04 0.00 0.09 0.00 0.00 57.88 57.61 2q3s h LEU 122 Cb 0.78 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.36 2q3s h LEU 122 CO 0.06 0.82 0.32 -0.07 0.09 0.00 0.00 178.44 179.67 2q3s h LEU 123 N 0.09 0.49 0.34 1.67 3.38 -0.55 0.30 115.31 121.03 2q3s h LEU 123 Ca 0.03 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2q3s h LEU 123 Cb 0.68 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2q3s h LEU 123 CO 0.04 0.33 -0.16 -0.09 0.09 0.00 0.00 178.44 178.65 2q3s h ARG 124 N 0.62 -0.43 0.00 1.13 2.43 -1.10 -1.02 114.38 116.01 2q3s h ARG 124 Ca 0.25 0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.39 2q3s h ARG 124 Cb 0.12 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 2q3s h ARG 124 CO -0.15 -0.12 -0.28 0.93 -1.51 0.00 0.00 179.97 178.84 2q3s h GLU 125 N -0.97 0.00 0.00 0.20 5.08 -0.92 -2.51 114.58 115.47 2q3s h GLU 125 Ca -0.05 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.02 2q3s h GLU 125 Cb 0.51 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.71 2q3s h GLU 125 CO 0.08 0.28 -2.14 0.09 -1.00 0.00 0.00 179.01 176.31 2q3s n ASN 126 N -3.90 0.83 0.00 1.42 4.13 0.11 -4.71 115.26 113.13 2q3s n ASN 126 Ca -0.02 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.24 2q3s n ASN 126 Cb 0.36 0.97 0.00 0.00 -1.54 0.00 0.00 39.78 39.57 2q3s n ASN 126 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2q3s n HIS 127 N -2.60 0.00 -1.96 3.10 8.25 -0.43 -5.01 115.22 116.58 2q3s n HIS 127 Ca -0.26 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.05 2q3s n HIS 127 Cb 1.02 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 32.10 2q3s n HIS 127 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2q3s n GLY 128 N 0.00 0.44 3.55 -1.41 0.00 -0.94 -4.98 105.19 101.85 2q3s n GLY 128 Ca 0.00 -0.28 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 2q3s n GLY 128 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2q3s s LEU 129 N -3.95 3.45 -0.06 0.99 0.20 -0.96 -4.98 118.68 113.36 2q3s s LEU 129 Ca 0.00 -0.05 0.06 0.00 0.69 0.00 0.00 54.13 54.83 2q3s s LEU 129 Cb 0.00 -1.85 -0.01 0.00 -0.43 0.00 0.00 46.19 43.90 2q3s s LEU 129 CO 0.00 0.18 -0.24 -0.69 -0.29 0.00 0.00 176.35 175.31 2q3s s VAL 130 N 0.34 2.15 -0.37 1.68 1.01 -1.26 -2.77 120.40 121.17 2q3s s VAL 130 Ca -0.01 -1.03 -0.06 0.00 0.00 0.00 0.00 61.98 60.88 2q3s s VAL 130 Cb -0.13 -1.79 0.07 0.00 0.00 0.00 0.00 36.38 34.52 2q3s s VAL 130 CO 0.02 0.57 0.16 -0.63 0.00 0.00 0.00 175.10 175.22 2q3s s ILE 131 N -0.12 3.74 -0.01 2.22 1.01 -1.26 -3.85 121.20 122.93 2q3s s ILE 131 Ca -0.05 -1.42 0.21 0.00 0.00 0.00 0.00 60.65 59.40 2q3s s ILE 131 Cb -0.14 -3.26 0.19 0.00 0.01 0.00 0.00 42.46 39.26 2q3s s ILE 131 CO 0.04 -0.37 1.68 0.03 0.00 0.00 0.00 174.94 176.32 2q3s h ARG 132 N 8.22 0.00 -2.80 2.79 3.08 -1.81 -3.38 114.38 120.49 2q3s h ARG 132 Ca -0.21 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.23 2q3s h ARG 132 Cb 1.07 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.72 2q3s h ARG 132 CO 0.66 0.30 -0.73 -1.71 -1.07 0.00 0.00 179.97 177.42 2q3s n ASN 133 N -3.31 1.68 -4.40 7.04 4.05 -1.26 -5.09 115.26 113.96 2q3s n ASN 133 Ca 0.01 -2.89 -0.30 0.00 0.45 0.00 0.00 54.58 51.85 2q3s n ASN 133 Cb 0.54 -0.68 -0.13 0.00 1.23 0.00 0.00 39.78 40.74 2q3s n ASN 133 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2q3s s ALA 134 N -0.89 2.41 -0.17 5.20 0.00 -1.26 0.18 121.76 127.22 2q3s s ALA 134 Ca 0.28 -1.36 -0.03 0.00 0.00 0.00 0.00 51.96 50.86 2q3s s ALA 134 Cb -0.01 -0.49 0.06 0.00 0.00 0.00 0.00 23.12 22.68 2q3s s ALA 134 CO -0.18 0.55 0.04 -1.50 0.00 0.00 0.00 175.76 174.66 2q3s s ILE 135 N -0.97 0.43 -0.91 0.00 1.10 -0.93 -4.95 121.20 114.96 2q3s s ILE 135 Ca 0.14 -0.41 -0.24 0.00 -0.51 0.00 0.00 60.65 59.62 2q3s s ILE 135 Cb -0.10 -0.91 0.03 0.00 0.15 0.00 0.00 42.46 41.63 2q3s s ILE 135 CO 0.05 -0.15 1.51 0.21 -2.11 0.00 0.00 174.94 174.45 2q3s s ASN 136 N 1.91 6.15 0.55 4.50 3.04 -1.26 -3.09 114.94 126.73 2q3s s ASN 136 Ca 0.00 -1.00 0.22 0.00 0.04 0.00 0.00 52.86 52.12 2q3s s ASN 136 Cb -0.16 -2.56 1.51 0.00 -1.54 0.00 0.00 41.25 38.49 2q3s s ASN 136 CO -0.08 -1.82 2.19 1.62 -3.04 0.00 0.00 177.10 175.98 2q3s h VAL 137 N 6.70 0.80 -0.63 -5.21 3.04 -1.94 -3.24 116.25 115.76 2q3s h VAL 137 Ca 0.05 -0.02 0.06 0.00 -1.01 0.00 0.00 66.70 65.78 2q3s h VAL 137 Cb 1.03 1.01 -0.08 0.00 -2.01 0.00 0.00 31.29 31.24 2q3s h VAL 137 CO 1.35 0.00 -0.37 0.61 -1.01 0.00 0.00 177.57 178.15 2q3s n GLY 138 N -1.43 -2.13 0.09 3.17 0.00 -1.26 -0.62 105.19 103.01 2q3s n GLY 138 Ca -0.03 0.84 -0.11 0.00 0.00 0.00 0.00 46.02 46.72 2q3s n GLY 138 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2q3s h LYS 139 N 0.00 0.17 -0.44 1.61 3.64 -1.79 0.96 116.57 120.73 2q3s h LYS 139 Ca 0.10 -0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.54 2q3s h LYS 139 Cb 0.26 -0.03 -0.10 0.00 -0.41 0.00 0.00 32.23 31.95 2q3s h LYS 139 CO -0.59 0.25 -0.29 1.25 -2.27 0.00 0.00 179.45 177.80 2q3s h LEU 140 N 0.05 -0.99 -1.82 5.20 5.85 -1.11 2.07 115.31 124.56 2q3s h LEU 140 Ca 0.04 0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 2q3s h LEU 140 Cb 0.14 0.48 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 2q3s h LEU 140 CO -0.00 -0.30 0.05 0.00 -0.34 0.00 0.00 178.44 177.85 2q3s h ALA 141 N 0.91 1.86 -3.00 1.25 0.00 -0.72 -0.38 119.26 119.18 2q3s h ALA 141 Ca 0.19 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2q3s h ALA 141 Cb 0.52 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2q3s h ALA 141 CO -0.55 0.12 0.00 0.00 0.00 0.00 0.00 179.25 178.81 2q3s n ALA 142 N -2.52 0.00 -0.14 0.00 0.00 0.64 -2.28 120.51 116.21 2q3s n ALA 142 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.39 2q3s n ALA 142 Cb 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.52 2q3s n ALA 142 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2q3s n GLU 143 N -0.34 -0.15 -0.51 0.00 1.02 0.23 0.18 120.64 121.07 2q3s n GLU 143 Ca 0.00 0.91 0.42 0.00 -0.02 0.00 0.00 57.16 58.47 2q3s n GLU 143 Cb 0.00 -1.34 0.71 0.00 -0.02 0.00 0.00 31.44 30.78 2q3s n GLU 143 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2q3s h ALA 144 N -0.22 3.07 0.00 0.62 0.00 -1.20 1.65 119.26 123.19 2q3s h ALA 144 Ca 0.05 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2q3s h ALA 144 Cb 0.14 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2q3s h ALA 144 CO -0.32 -1.69 -1.01 0.54 0.00 0.00 0.00 179.25 176.77 2q3s n ARG 145 N -4.49 0.11 -3.70 0.00 5.12 0.49 -4.98 116.66 109.20 2q3s n ARG 145 Ca 0.39 -0.02 -0.22 0.00 -1.93 0.00 0.00 57.85 56.07 2q3s n ARG 145 Cb 1.61 -1.52 0.04 0.00 -1.16 0.00 0.00 32.46 31.43 2q3s n ARG 145 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2q3s n GLY 146 N 1.46 -0.33 2.61 -0.13 0.00 0.56 -4.96 105.19 104.40 2q3s n GLY 146 Ca 0.03 0.13 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 2q3s n GLY 146 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2q3s s THR 147 N -3.59 -0.12 0.46 2.61 2.01 -1.24 -5.04 115.64 110.73 2q3s s THR 147 Ca 0.10 -1.15 0.27 0.00 0.31 0.00 0.00 61.69 61.21 2q3s s THR 147 Cb -0.05 -0.94 0.46 0.00 0.01 0.00 0.00 72.50 71.98 2q3s s THR 147 CO 0.81 -0.75 1.78 -0.07 -0.69 0.00 0.00 174.62 175.69 2q3s h LEU 148 N 7.46 0.25 -1.76 4.42 3.38 -1.93 -2.57 115.31 124.56 2q3s h LEU 148 Ca -0.02 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 2q3s h LEU 148 Cb 1.02 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 2q3s h LEU 148 CO 0.29 0.03 -0.14 1.62 0.09 0.00 0.00 178.44 180.33 2q3s h VAL 149 N 0.21 0.58 -0.89 1.22 3.04 -1.96 -3.19 116.25 115.27 2q3s h VAL 149 Ca 0.59 -0.65 0.26 0.00 -1.01 0.00 0.00 66.70 65.89 2q3s h VAL 149 Cb 1.87 1.42 -0.04 0.00 -2.01 0.00 0.00 31.29 32.53 2q3s h VAL 149 CO -0.18 0.14 0.69 -0.07 -1.01 0.00 0.00 177.57 177.14 2q3s h LEU 150 N 0.00 0.00 -0.13 3.16 3.38 -1.74 -0.35 115.31 119.63 2q3s h LEU 150 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2q3s h LEU 150 Cb 0.41 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2q3s h LEU 150 CO 0.02 0.00 0.07 -0.08 0.09 0.00 0.00 178.44 178.54 2q3s h GLU 151 N 0.00 0.18 -1.26 1.13 4.81 -1.52 -3.23 114.58 114.69 2q3s h GLU 151 Ca 0.42 -0.02 -0.26 0.00 -0.13 0.00 0.00 59.36 59.38 2q3s h GLU 151 Cb 1.80 -0.04 -0.13 0.00 0.63 0.00 0.00 28.75 31.01 2q3s h GLU 151 CO -0.00 0.19 0.33 1.19 -0.73 0.00 0.00 179.01 179.99 2q3s n PHE 152 N -4.95 1.36 -4.51 0.92 3.72 -0.14 -4.57 117.46 109.29 2q3s n PHE 152 Ca -0.05 -1.44 -0.34 0.00 -0.05 0.00 0.00 57.45 55.57 2q3s n PHE 152 Cb 0.07 -0.72 -0.11 0.00 -0.94 0.00 0.00 39.48 37.79 2q3s n PHE 152 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2q3s s LEU 153 N -1.53 3.34 1.02 4.37 1.43 -1.22 -5.11 118.68 120.99 2q3s s LEU 153 Ca 0.26 0.04 -0.13 0.00 -1.03 0.00 0.00 54.13 53.27 2q3s s LEU 153 Cb 0.21 -1.75 0.20 0.00 0.03 0.00 0.00 46.19 44.89 2q3s s LEU 153 CO 0.02 0.36 1.10 -0.83 0.23 0.00 0.00 176.35 177.23 2q3s s GLY 154 N -0.77 1.57 0.11 -3.19 0.00 -1.26 -4.71 107.32 99.06 2q3s s GLY 154 Ca 0.12 -0.48 -0.24 0.00 0.00 0.00 0.00 44.72 44.12 2q3s s GLY 154 CO 0.02 0.17 1.68 -0.84 0.00 0.00 0.00 173.10 174.14 2q3s h THR 155 N -1.97 0.68 0.09 0.90 2.02 -2.00 -0.71 112.91 111.92 2q3s h THR 155 Ca -0.53 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.64 2q3s h THR 155 Cb 1.33 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 68.42 2q3s h THR 155 CO 0.55 0.00 -0.04 -0.09 0.37 0.00 0.00 175.52 176.31 2q3s h ARG 156 N -0.23 -0.12 -0.82 6.66 1.12 -1.97 -2.52 114.38 116.50 2q3s h ARG 156 Ca 0.04 0.01 0.00 0.00 -1.11 0.00 0.00 59.98 58.92 2q3s h ARG 156 Cb 0.28 0.03 -0.04 0.00 -0.01 0.00 0.00 29.97 30.22 2q3s h ARG 156 CO -0.11 -0.08 0.52 1.49 -3.11 0.00 0.00 179.97 178.68 2q3s h GLU 157 N -0.12 1.09 0.02 0.20 4.57 -1.91 0.13 114.58 118.55 2q3s h GLU 157 Ca -0.01 -0.08 0.01 0.00 -1.18 0.00 0.00 59.36 58.10 2q3s h GLU 157 Cb 0.09 -0.24 -0.02 0.00 -0.16 0.00 0.00 28.75 28.43 2q3s h GLU 157 CO 0.02 0.74 -0.09 1.25 -1.18 0.00 0.00 179.01 179.75 2q3s h LEU 158 N 1.11 -0.24 -0.88 1.64 5.85 -0.95 -0.42 115.31 121.41 2q3s h LEU 158 Ca 0.30 0.03 0.17 0.00 0.84 0.00 0.00 57.88 59.22 2q3s h LEU 158 Cb -0.10 0.10 -0.10 0.00 0.37 0.00 0.00 40.66 40.93 2q3s h LEU 158 CO -0.06 -0.13 0.46 0.00 -0.34 0.00 0.00 178.44 178.37 2q3s h ALA 159 N 0.81 1.37 0.45 1.25 0.00 -0.97 -1.81 119.26 120.36 2q3s h ALA 159 Ca 0.03 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2q3s h ALA 159 Cb 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2q3s h ALA 159 CO -0.07 -0.13 -0.35 1.25 0.00 0.00 0.00 179.25 179.95 2q3s h HIS 160 N 0.60 -0.94 0.00 0.00 -0.00 0.32 0.06 115.15 115.19 2q3s h HIS 160 Ca 0.50 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.87 2q3s h HIS 160 Cb 0.77 0.35 0.00 0.00 -0.00 0.00 0.00 27.41 28.53 2q3s h HIS 160 CO -0.09 -0.49 0.00 0.00 -0.00 0.00 0.00 177.93 177.36 2q3s h ARG 161 N -0.76 0.00 0.00 5.26 2.47 -0.78 -1.46 114.38 119.11 2q3s h ARG 161 Ca -0.06 0.00 -0.37 0.00 -1.26 0.00 0.00 59.98 58.29 2q3s h ARG 161 Cb 0.64 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 28.89 2q3s h ARG 161 CO 0.01 0.00 -2.41 0.28 0.56 0.00 0.00 179.97 178.42 2q3s n VAL 162 N -2.64 1.41 -0.11 2.04 0.31 -0.71 -4.86 118.33 113.77 2q3s n VAL 162 Ca -0.01 -0.60 -0.22 0.00 -0.01 0.00 0.00 64.34 63.50 2q3s n VAL 162 Cb 0.12 -1.22 -0.08 0.00 -0.91 0.00 0.00 33.84 31.75 2q3s n VAL 162 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2q3s n LEU 163 N -3.14 1.85 -2.42 7.52 4.77 0.00 -5.08 117.00 120.51 2q3s n LEU 163 Ca -0.42 0.20 -0.09 0.00 -0.03 0.00 0.00 56.01 55.67 2q3s n LEU 163 Cb 1.00 -0.67 0.05 0.00 -2.33 0.00 0.00 43.42 41.46 2q3s n LEU 163 CO 0.28 0.54 0.04 0.79 -1.33 0.00 0.00 177.39 177.71 2q3s n TRP 164 N -3.82 -1.31 -1.65 -1.77 7.02 -0.56 -5.06 117.44 110.29 2q3s n TRP 164 Ca -0.43 0.51 0.00 0.00 -1.02 0.00 0.00 57.50 56.56 2q3s n TRP 164 Cb 0.83 -3.59 0.00 0.00 -2.42 0.00 0.00 31.31 26.13 2q3s n TRP 164 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 2q3s n SER 165 N -2.33 0.21 -4.29 -0.99 3.41 -1.26 -5.07 113.62 103.31 2q3s n SER 165 Ca -0.11 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.07 2q3s n SER 165 Cb 0.58 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.46 2q3s n SER 165 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2q3s s ASP 166 N -0.27 5.96 -0.13 4.04 3.68 -1.26 -4.84 116.67 123.84 2q3s s ASP 166 Ca 0.00 -1.72 0.15 0.00 2.13 0.00 0.00 52.55 53.11 2q3s s ASP 166 Cb 0.00 -2.12 0.57 0.00 -1.45 0.00 0.00 42.92 39.92 2q3s s ASP 166 CO 0.00 -0.73 1.48 0.18 0.13 0.00 0.00 175.17 176.22 2q3s n LEU 167 N 5.09 4.13 -0.04 -1.34 4.77 -1.26 -4.61 117.00 123.74 2q3s n LEU 167 Ca -0.11 -2.67 0.01 0.00 -0.03 0.00 0.00 56.01 53.21 2q3s n LEU 167 Cb 0.41 -0.51 0.31 0.00 -2.33 0.00 0.00 43.42 41.30 2q3s n LEU 167 CO 0.48 0.71 1.03 1.23 -1.33 0.00 0.00 177.39 179.51 2q3s h GLY 168 N 2.65 0.67 0.81 -0.72 0.00 -2.00 -1.58 103.07 102.91 2q3s h GLY 168 Ca 0.00 -0.34 -0.12 0.00 0.00 0.00 0.00 47.33 46.88 2q3s h GLY 168 CO 0.21 0.32 -0.39 -1.61 0.00 0.00 0.00 176.54 175.08 2q3s h GLN 169 N 0.62 0.47 0.67 4.80 5.75 -2.01 -2.80 115.11 122.60 2q3s h GLN 169 Ca 0.15 -0.35 -0.03 0.00 -0.15 0.00 0.00 58.65 58.27 2q3s h GLN 169 Cb 0.17 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.77 2q3s h GLN 169 CO -0.01 0.97 -0.51 1.25 -2.65 0.00 0.00 178.83 177.88 2q3s h LEU 170 N 0.06 -1.33 -0.77 -2.39 5.85 -1.87 -3.09 115.31 111.76 2q3s h LEU 170 Ca -0.02 0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.87 2q3s h LEU 170 Cb 1.01 0.41 -0.10 0.00 0.37 0.00 0.00 40.66 42.35 2q3s h LEU 170 CO 0.08 -0.73 -0.57 0.44 -0.34 0.00 0.00 178.44 177.32 2q3s h ASP 171 N -1.13 -2.04 -1.00 1.25 3.32 -1.34 0.12 116.42 115.59 2q3s h ASP 171 Ca -0.09 0.30 0.31 0.00 0.02 0.00 0.00 57.03 57.56 2q3s h ASP 171 Cb 0.94 0.88 -0.14 0.00 0.22 0.00 0.00 39.33 41.22 2q3s h ASP 171 CO 0.03 -0.29 0.56 -1.28 -1.72 0.00 0.00 179.24 176.54 2q3s h SER 172 N -0.15 0.53 0.20 6.45 0.87 -1.50 0.79 113.55 120.75 2q3s h SER 172 Ca 0.13 0.18 -0.01 0.00 -1.23 0.00 0.00 61.79 60.86 2q3s h SER 172 Cb 0.47 0.12 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2q3s h SER 172 CO -0.80 -0.10 -0.10 0.40 -0.53 0.00 0.00 176.83 175.70 2q3s h ILE 173 N 0.36 0.78 -0.45 2.23 2.04 -0.77 -3.27 117.51 118.43 2q3s h ILE 173 Ca 0.72 -0.99 -0.05 0.00 1.00 0.00 0.00 64.86 65.54 2q3s h ILE 173 Cb 1.59 1.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.92 2q3s h ILE 173 CO -0.59 0.19 0.07 -0.33 0.00 0.00 0.00 178.15 177.49 2q3s h GLU 174 N -0.84 0.70 0.00 2.37 5.08 0.62 0.38 114.58 122.88 2q3s h GLU 174 Ca -0.03 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.19 2q3s h GLU 174 Cb 0.52 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2q3s h GLU 174 CO 0.05 0.66 0.00 0.00 -1.00 0.00 0.00 179.01 178.72 2q3s h ALA 175 N 1.41 1.00 0.00 3.43 0.00 0.40 -2.32 119.26 123.18 2q3s h ALA 175 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2q3s h ALA 175 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2q3s h ALA 175 CO 0.00 0.00 -0.05 0.36 0.00 0.00 0.00 179.25 179.57 2q3s n LYS 176 N -2.34 1.42 -0.17 0.00 2.85 -0.67 -4.92 118.16 114.32 2q3s n LYS 176 Ca 0.01 -2.20 -0.05 0.00 -1.05 0.00 0.00 58.31 55.02 2q3s n LYS 176 Cb 0.19 -1.30 -0.04 0.00 -0.65 0.00 0.00 35.03 33.23 2q3s n LYS 176 CO 0.00 0.00 0.00 1.87 -0.05 0.00 0.00 177.40 179.22 2q3s n TRP 177 N -1.11 -0.18 -0.38 5.58 -0.00 0.03 -0.98 117.44 120.40 2q3s n TRP 177 Ca 0.11 0.51 0.33 0.00 -0.00 0.00 0.00 57.50 58.46 2q3s n TRP 177 Cb 0.58 -0.47 0.66 0.00 -0.00 0.00 0.00 31.31 32.08 2q3s n TRP 177 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 177.69 178.74 2q3s h GLU 178 N 0.00 0.14 -0.06 5.87 9.09 -1.88 2.26 114.58 130.01 2q3s h GLU 178 Ca 0.07 -0.01 0.00 0.00 0.05 0.00 0.00 59.36 59.47 2q3s h GLU 178 Cb 0.17 -0.03 0.00 0.00 -1.65 0.00 0.00 28.75 27.24 2q3s h GLU 178 CO -0.39 0.09 0.00 1.63 0.05 0.00 0.00 179.01 180.40 2q3s n LYS 179 N -4.39 2.19 -2.70 1.06 5.02 -0.16 -4.92 118.16 114.25 2q3s n LYS 179 Ca 0.29 -1.74 -0.42 0.00 -2.02 0.00 0.00 58.31 54.43 2q3s n LYS 179 Cb 1.23 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 34.73 2q3s n LYS 179 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2q3s s ALA 180 N -1.96 3.20 0.97 7.82 0.00 0.76 -5.05 121.76 127.51 2q3s s ALA 180 Ca 0.31 0.57 -0.14 0.00 0.00 0.00 0.00 51.96 52.69 2q3s s ALA 180 Cb 0.20 -3.32 0.18 0.00 0.00 0.00 0.00 23.12 20.18 2q3s s ALA 180 CO 0.31 -0.17 1.17 0.20 0.00 0.00 0.00 175.76 177.26 2q3s s GLY 181 N 0.67 1.61 0.08 0.00 0.00 -1.26 -4.74 107.32 103.69 2q3s s GLY 181 Ca 0.51 -0.73 -0.26 0.00 0.00 0.00 0.00 44.72 44.24 2q3s s GLY 181 CO 0.29 -0.07 1.42 -0.56 0.00 0.00 0.00 173.10 174.18 2q3s h PRO 182 N -1.72 -0.49 -0.92 2.90 0.13 -1.98 -1.12 132.00 128.80 2q3s h PRO 182 Ca -0.48 0.03 0.22 0.00 -0.87 0.00 0.00 66.00 64.90 2q3s h PRO 182 Cb 1.31 0.11 -0.12 0.00 0.13 0.00 0.00 31.00 32.43 2q3s h PRO 182 CO 0.52 -0.32 0.46 1.49 -0.23 0.00 0.00 178.00 179.92 2q3s h GLU 183 N -0.50 0.46 -0.16 0.86 4.57 -1.97 1.65 114.58 119.49 2q3s h GLU 183 Ca 0.01 -0.03 -0.03 0.00 -1.18 0.00 0.00 59.36 58.13 2q3s h GLU 183 Cb 0.55 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 2q3s h GLU 183 CO -0.28 0.30 -0.02 0.93 -1.18 0.00 0.00 179.01 178.76 2q3s h GLU 184 N 0.47 0.29 -0.04 1.92 5.08 -1.85 0.84 114.58 121.29 2q3s h GLU 184 Ca 0.58 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.79 2q3s h GLU 184 Cb 1.07 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 2q3s h GLU 184 CO -0.50 0.55 -0.17 1.96 -1.00 0.00 0.00 179.01 179.85 2q3s h GLN 185 N 0.01 0.06 -0.31 2.33 4.20 0.30 0.11 115.11 121.82 2q3s h GLN 185 Ca 0.04 -0.01 -0.11 0.00 0.06 0.00 0.00 58.65 58.63 2q3s h GLN 185 Cb 0.43 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 2q3s h GLN 185 CO 0.01 0.23 -0.25 1.25 -0.67 0.00 0.00 178.83 179.41 2q3s h LEU 186 N 0.06 0.75 -0.29 1.46 6.46 0.30 -1.13 115.31 122.93 2q3s h LEU 186 Ca 0.01 -0.45 -0.00 0.00 -0.12 0.00 0.00 57.88 57.32 2q3s h LEU 186 Cb 0.34 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 40.04 2q3s h LEU 186 CO 0.02 1.04 0.17 -0.08 -0.62 0.00 0.00 178.44 178.98 2q3s h GLU 187 N 0.47 0.40 -0.65 1.25 4.81 0.18 -1.05 114.58 119.98 2q3s h GLU 187 Ca 0.06 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.29 2q3s h GLU 187 Cb 0.81 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 30.06 2q3s h GLU 187 CO 0.06 0.32 0.38 0.00 -0.73 0.00 0.00 179.01 179.05 2q3s h ALA 188 N 1.06 0.86 -0.20 2.92 0.00 -0.75 0.16 119.26 123.30 2q3s h ALA 188 Ca 0.10 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2q3s h ALA 188 Cb 0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2q3s h ALA 188 CO -0.02 0.11 -0.04 0.00 0.00 0.00 0.00 179.25 179.29 2q3s h ALA 189 N 1.31 1.56 0.02 0.00 0.00 -0.62 -0.46 119.26 121.07 2q3s h ALA 189 Ca 0.27 -0.16 -0.27 0.00 0.00 0.00 0.00 54.91 54.75 2q3s h ALA 189 Cb 0.09 -0.10 0.02 0.00 0.00 0.00 0.00 17.79 17.80 2q3s h ALA 189 CO -0.14 0.32 -1.08 0.00 0.00 0.00 0.00 179.25 178.35 2q3s h ALA 190 N 1.67 0.11 -0.16 0.00 0.00 -0.11 -1.80 119.26 118.97 2q3s h ALA 190 Ca 0.07 -0.71 0.05 0.00 0.00 0.00 0.00 54.91 54.31 2q3s h ALA 190 Cb 0.27 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.07 2q3s h ALA 190 CO 0.01 0.69 -0.18 0.82 0.00 0.00 0.00 179.25 180.59 2q3s h ILE 191 N 0.37 0.53 0.00 0.00 2.04 -0.25 0.41 117.51 120.61 2q3s h ILE 191 Ca -0.14 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.68 2q3s h ILE 191 Cb 1.74 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.34 2q3s h ILE 191 CO 0.21 0.00 -0.20 -0.33 0.00 0.00 0.00 178.15 177.83 2q3s h GLU 192 N -0.21 0.00 0.37 2.37 5.08 -1.13 0.12 114.58 121.18 2q3s h GLU 192 Ca 0.11 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 2q3s h GLU 192 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2q3s h GLU 192 CO -0.29 0.20 -0.18 0.78 -1.00 0.00 0.00 179.01 178.52 2q3s h GLY 193 N 1.77 -0.52 0.46 -3.84 0.00 -0.15 -2.41 103.07 98.37 2q3s h GLY 193 Ca -0.00 0.19 0.11 0.00 0.00 0.00 0.00 47.33 47.63 2q3s h GLY 193 CO 0.03 -0.19 0.52 -0.25 0.00 0.00 0.00 176.54 176.65 2q3s h TRP 194 N -0.87 0.94 0.40 5.60 7.01 -0.09 -2.67 115.95 126.27 2q3s h TRP 194 Ca -0.05 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 60.96 2q3s h TRP 194 Cb 0.54 -0.29 0.00 0.00 -2.10 0.00 0.00 29.16 27.31 2q3s h TRP 194 CO 0.02 0.36 -0.21 -0.07 -2.79 0.00 0.00 178.44 175.75 2q3s h LEU 195 N 0.84 -0.51 -2.47 0.65 3.38 -0.67 -2.44 115.31 114.09 2q3s h LEU 195 Ca 0.44 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.43 2q3s h LEU 195 Cb 0.45 0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 2q3s h LEU 195 CO -0.27 -0.35 -0.02 0.40 0.09 0.00 0.00 178.44 178.30 2q3s h ILE 196 N -0.56 0.43 0.03 1.22 1.08 -1.17 0.27 117.51 118.81 2q3s h ILE 196 Ca -0.05 -0.09 -0.00 0.00 -0.39 0.00 0.00 64.86 64.33 2q3s h ILE 196 Cb 0.44 1.06 0.00 0.00 -3.07 0.00 0.00 36.82 35.25 2q3s h ILE 196 CO 0.08 0.02 -0.02 0.58 -0.69 0.00 0.00 178.15 178.12 2q3s h VAL 197 N 0.00 1.04 -0.89 1.67 2.07 -1.15 -0.68 116.25 118.31 2q3s h VAL 197 Ca -0.00 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 2q3s h VAL 197 Cb 0.06 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 2q3s h VAL 197 CO 0.00 0.06 0.55 0.78 0.02 0.00 0.00 177.57 178.98 2q3s h ASN 198 N -0.14 1.05 -0.37 0.57 2.35 -0.05 -0.70 115.58 118.29 2q3s h ASN 198 Ca -0.00 -0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 55.63 2q3s h ASN 198 Cb 0.13 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.22 2q3s h ASN 198 CO 0.01 0.80 0.02 0.58 -1.65 0.00 0.00 177.43 177.18 2q3s h VAL 199 N 1.21 1.25 -0.62 2.81 2.07 -1.15 -2.72 116.25 119.10 2q3s h VAL 199 Ca 0.32 -0.95 0.04 0.00 0.82 0.00 0.00 66.70 66.92 2q3s h VAL 199 Cb -0.07 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 2q3s h VAL 199 CO -0.06 0.32 0.37 -0.25 0.02 0.00 0.00 177.57 177.96 2q3s h TRP 200 N 0.46 0.68 -1.15 1.57 2.91 -0.75 -1.91 115.95 117.76 2q3s h TRP 200 Ca 0.11 0.02 0.32 0.00 1.13 0.00 0.00 58.89 60.47 2q3s h TRP 200 Cb 0.44 -0.22 -0.08 0.00 -0.51 0.00 0.00 29.16 28.80 2q3s h TRP 200 CO 0.03 0.36 0.78 -0.44 -1.03 0.00 0.00 178.44 178.15 2q3s h ASP 201 N 0.71 0.22 0.17 2.65 3.32 -0.80 0.79 116.42 123.47 2q3s h ASP 201 Ca 0.26 0.05 -0.14 0.00 0.02 0.00 0.00 57.03 57.22 2q3s h ASP 201 Cb 0.08 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 2q3s h ASP 201 CO -0.13 0.02 -0.53 1.56 -1.72 0.00 0.00 179.24 178.44 2q3s h GLN 202 N 0.18 0.39 -0.02 3.56 4.20 -1.32 -3.24 115.11 118.87 2q3s h GLN 202 Ca 0.61 -0.24 0.00 0.00 0.06 0.00 0.00 58.65 59.08 2q3s h GLN 202 Cb 1.99 0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.80 2q3s h GLN 202 CO -0.18 0.83 -0.08 1.28 -0.67 0.00 0.00 178.83 180.01 2q3s n LEU 203 N -3.95 1.68 0.00 1.46 4.77 0.26 -4.79 117.00 116.44 2q3s n LEU 203 Ca -0.02 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.41 2q3s n LEU 203 Cb 0.58 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 2q3s n LEU 203 CO 0.45 0.29 0.00 -0.24 -1.33 0.00 0.00 177.39 176.56 2q3s n SER 204 N 0.19 0.00 -1.83 -1.43 2.88 -0.16 -4.69 113.62 108.58 2q3s n SER 204 Ca 0.16 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 2q3s n SER 204 Cb 0.40 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.86 2q3s n SER 204 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2q3s n ASP 205 N 0.00 1.75 0.00 -3.46 5.68 -1.26 -5.11 116.55 114.15 2q3s n ASP 205 Ca 0.00 -1.46 0.00 0.00 -0.50 0.00 0.00 54.79 52.83 2q3s n ASP 205 Cb 0.00 -0.37 0.00 0.00 -1.14 0.00 0.00 41.12 39.61 2q3s n ASP 205 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03