#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r8s s ARG 19 N 0.00 4.71 -0.04 3.17 1.70 -1.26 -0.75 118.95 126.48 1r8s s ARG 19 Ca 0.00 1.47 -0.00 0.00 -0.47 0.00 0.00 55.73 56.73 1r8s s ARG 19 Cb 0.00 -3.08 0.03 0.00 -0.57 0.00 0.00 34.95 31.33 1r8s s ARG 19 CO 0.00 0.37 0.01 0.42 -1.08 0.00 0.00 175.30 175.02 1r8s s ILE 20 N -1.34 0.19 0.02 4.99 -1.09 0.20 -4.64 121.20 119.53 1r8s s ILE 20 Ca 0.45 0.12 -0.23 0.00 -2.23 0.00 0.00 60.65 58.76 1r8s s ILE 20 Cb -0.24 -0.31 -0.05 0.00 -1.58 0.00 0.00 42.46 40.27 1r8s s ILE 20 CO 0.30 0.17 0.71 -0.22 -1.23 0.00 0.00 174.94 174.67 1r8s s LEU 21 N 1.30 4.43 -0.15 2.97 2.96 -1.26 -1.47 118.68 127.46 1r8s s LEU 21 Ca -0.06 1.34 0.01 0.00 -0.22 0.00 0.00 54.13 55.20 1r8s s LEU 21 Cb -0.13 -3.12 0.00 0.00 0.50 0.00 0.00 46.19 43.44 1r8s s LEU 21 CO -0.02 0.04 -0.16 -0.32 -1.32 0.00 0.00 176.35 174.56 1r8s s MET 22 N -0.06 3.19 0.30 1.98 -2.45 -0.47 -1.48 119.30 120.31 1r8s s MET 22 Ca 0.36 -0.76 0.03 0.00 -1.25 0.00 0.00 55.69 54.06 1r8s s MET 22 Cb -0.20 -2.60 -0.05 0.00 1.25 0.00 0.00 34.83 33.23 1r8s s MET 22 CO 0.21 0.01 0.09 0.14 1.05 0.00 0.00 175.02 176.51 1r8s s VAL 23 N 0.82 0.81 0.00 10.11 -7.23 -0.26 -4.33 120.40 120.33 1r8s s VAL 23 Ca -0.05 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.12 1r8s s VAL 23 Cb -0.15 -2.67 0.00 0.00 0.56 0.00 0.00 36.38 34.12 1r8s s VAL 23 CO -0.01 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.39 1r8s n GLY 24 N -0.61 3.17 3.60 2.32 0.00 -1.26 -0.61 105.19 111.80 1r8s n GLY 24 Ca -0.01 -0.96 -0.34 0.00 0.00 0.00 0.00 46.02 44.71 1r8s n GLY 24 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1r8s n LEU 25 N 0.00 2.96 -4.64 0.99 4.77 -1.26 -4.89 117.00 114.93 1r8s n LEU 25 Ca 0.00 0.54 -0.41 0.00 -0.03 0.00 0.00 56.01 56.11 1r8s n LEU 25 Cb 0.00 -1.40 0.01 0.00 -2.33 0.00 0.00 43.42 39.70 1r8s n LEU 25 CO 0.00 -2.29 0.69 -0.90 -1.33 0.00 0.00 177.39 173.56 1r8s n ASP 26 N -2.44 1.69 0.00 -1.43 5.75 -1.26 -2.15 116.55 116.71 1r8s n ASP 26 Ca 0.12 1.06 0.00 0.00 -0.01 0.00 0.00 54.79 55.96 1r8s n ASP 26 Cb 0.51 -1.40 0.00 0.00 -1.03 0.00 0.00 41.12 39.20 1r8s n ASP 26 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1r8s n ALA 27 N -0.41 0.00 0.12 2.12 0.00 -1.26 -4.91 120.51 116.17 1r8s n ALA 27 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1r8s n ALA 27 Cb 0.39 -0.29 0.29 0.00 0.00 0.00 0.00 19.45 19.85 1r8s n ALA 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r8s h ALA 28 N 0.00 1.27 0.00 0.00 0.00 -1.77 -3.46 119.26 115.30 1r8s h ALA 28 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1r8s h ALA 28 Cb 0.16 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1r8s h ALA 28 CO 0.00 0.50 0.00 0.41 0.00 0.00 0.00 179.25 180.16 1r8s n GLY 29 N -0.43 1.30 0.16 0.00 0.00 -1.26 -4.24 105.19 100.72 1r8s n GLY 29 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 1r8s n GLY 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1r8s h LYS 30 N 0.00 0.47 -0.66 1.61 1.57 -1.91 -1.13 116.57 116.52 1r8s h LYS 30 Ca 0.00 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 1r8s h LYS 30 Cb 0.00 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 1r8s h LYS 30 CO 0.00 0.46 0.34 1.15 -0.57 0.00 0.00 179.45 180.83 1r8s h THR 31 N 0.38 1.22 -0.62 -0.16 2.02 -1.99 -1.60 112.91 112.15 1r8s h THR 31 Ca 0.11 -0.57 -0.04 0.00 0.77 0.00 0.00 66.41 66.67 1r8s h THR 31 Cb 0.15 0.38 -0.03 0.00 -1.74 0.00 0.00 68.15 66.92 1r8s h THR 31 CO -0.01 0.24 0.22 0.74 0.37 0.00 0.00 175.52 177.08 1r8s h THR 32 N 0.91 1.24 -0.09 3.16 2.02 -1.89 -1.09 112.91 117.17 1r8s h THR 32 Ca 0.23 -0.78 0.00 0.00 0.77 0.00 0.00 66.41 66.63 1r8s h THR 32 Cb 0.08 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 1r8s h THR 32 CO -0.03 0.30 0.06 0.40 0.37 0.00 0.00 175.52 176.62 1r8s h ILE 33 N 0.87 1.02 -0.71 3.11 2.04 -0.92 -2.01 117.51 120.91 1r8s h ILE 33 Ca 0.20 -0.04 0.01 0.00 1.00 0.00 0.00 64.86 66.03 1r8s h ILE 33 Cb 0.25 0.89 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 1r8s h ILE 33 CO -0.01 0.02 0.47 -0.07 0.00 0.00 0.00 178.15 178.56 1r8s h LEU 34 N 0.12 0.82 -0.56 1.44 3.38 -0.93 -1.22 115.31 118.36 1r8s h LEU 34 Ca 0.03 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1r8s h LEU 34 Cb -0.01 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1r8s h LEU 34 CO -0.01 0.60 -0.22 0.22 0.09 0.00 0.00 178.44 179.12 1r8s h TYR 35 N 0.97 1.05 -0.63 1.13 3.20 -0.96 -1.16 116.97 120.57 1r8s h TYR 35 Ca 0.26 -0.25 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 1r8s h TYR 35 Cb -0.10 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 37.89 1r8s h TYR 35 CO 0.00 1.05 0.28 0.87 -1.64 0.00 0.00 178.16 178.72 1r8s h LYS 36 N 0.80 0.92 -0.64 1.82 1.79 -0.81 -2.44 116.57 118.00 1r8s h LYS 36 Ca 0.10 -0.15 -0.03 0.00 -2.18 0.00 0.00 60.65 58.40 1r8s h LYS 36 Cb 0.78 -0.16 -0.03 0.00 -1.58 0.00 0.00 32.23 31.24 1r8s h LYS 36 CO 0.06 0.75 0.29 -0.07 -1.08 0.00 0.00 179.45 179.40 1r8s h LEU 37 N 0.87 0.83 -0.72 2.94 3.38 -0.95 -2.01 115.31 119.65 1r8s h LEU 37 Ca 0.21 -0.10 0.05 0.00 0.09 0.00 0.00 57.88 58.14 1r8s h LEU 37 Cb 0.15 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.64 1r8s h LEU 37 CO -0.02 0.72 0.42 0.50 0.09 0.00 0.00 178.44 180.15 1r8s h LYS 38 N 0.91 0.76 -0.06 1.13 3.64 -0.83 -2.47 116.57 119.65 1r8s h LYS 38 Ca 0.22 -0.05 -0.07 0.00 -1.27 0.00 0.00 60.65 59.48 1r8s h LYS 38 Cb 0.13 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1r8s h LYS 38 CO -0.03 0.51 -0.29 -0.07 -2.27 0.00 0.00 179.45 177.30 1r8s h LEU 39 N 0.79 0.11 -0.94 5.20 3.38 -0.92 -2.90 115.31 120.03 1r8s h LEU 39 Ca 0.31 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1r8s h LEU 39 Cb 0.15 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1r8s h LEU 39 CO -0.17 0.40 0.00 1.23 0.09 0.00 0.00 178.44 179.99 1r8s h GLY 40 N 0.96 0.00 -2.45 0.83 0.00 -1.00 -3.45 103.07 97.95 1r8s h GLY 40 Ca 0.01 0.00 -0.46 0.00 0.00 0.00 0.00 47.33 46.88 1r8s h GLY 40 CO 0.04 0.00 0.27 -0.54 0.00 0.00 0.00 176.54 176.31 1r8s s GLU 41 N -3.48 4.22 0.14 4.80 0.41 -1.10 -4.98 118.70 118.71 1r8s s GLU 41 Ca 0.03 1.03 0.18 0.00 -0.41 0.00 0.00 54.97 55.80 1r8s s GLU 41 Cb 0.08 -2.35 -0.06 0.00 -1.78 0.00 0.00 34.13 30.02 1r8s s GLU 41 CO 0.55 0.07 0.99 -0.84 -0.49 0.00 0.00 175.26 175.55 1r8s h ILE 42 N 2.05 0.42 -3.52 -1.63 3.07 -1.88 -3.44 117.51 112.58 1r8s h ILE 42 Ca -0.48 -1.77 -0.58 0.00 1.55 0.00 0.00 64.86 63.58 1r8s h ILE 42 Cb 1.18 1.97 -0.08 0.00 -0.27 0.00 0.00 36.82 39.62 1r8s h ILE 42 CO 0.63 0.24 0.79 -0.69 -1.05 0.00 0.00 178.15 178.06 1r8s s VAL 43 N -3.04 4.42 0.23 0.16 1.01 -1.26 -5.03 120.40 116.90 1r8s s VAL 43 Ca -0.01 1.34 -0.13 0.00 0.00 0.00 0.00 61.98 63.18 1r8s s VAL 43 Cb 0.09 -4.46 -0.08 0.00 0.00 0.00 0.00 36.38 31.93 1r8s s VAL 43 CO 0.79 -0.70 0.61 -0.89 0.00 0.00 0.00 175.10 174.91 1r8s s THR 44 N 3.88 4.82 -0.05 3.92 2.01 -1.26 -5.09 115.64 123.88 1r8s s THR 44 Ca 0.44 0.74 0.06 0.00 0.31 0.00 0.00 61.69 63.24 1r8s s THR 44 Cb -0.10 -3.67 -0.01 0.00 0.01 0.00 0.00 72.50 68.73 1r8s s THR 44 CO 0.23 0.01 -0.23 -0.89 -0.69 0.00 0.00 174.62 173.05 1r8s s THR 45 N -1.73 1.88 0.32 -0.82 2.01 -1.26 -5.12 115.64 110.92 1r8s s THR 45 Ca 0.46 -0.98 -0.28 0.00 0.31 0.00 0.00 61.69 61.20 1r8s s THR 45 Cb -0.12 -1.59 -0.10 0.00 0.01 0.00 0.00 72.50 70.70 1r8s s THR 45 CO 0.20 0.53 1.18 -0.63 -0.69 0.00 0.00 174.62 175.20 1r8s s ILE 46 N -0.20 3.19 0.43 1.82 -1.09 -1.26 -4.97 121.20 119.12 1r8s s ILE 46 Ca -0.01 1.15 -0.25 0.00 -2.23 0.00 0.00 60.65 59.31 1r8s s ILE 46 Cb -0.12 -3.71 -0.09 0.00 -1.58 0.00 0.00 42.46 36.95 1r8s s ILE 46 CO 0.02 0.24 1.30 -2.65 -1.23 0.00 0.00 174.94 172.62 1r8s n PRO 47 N 0.82 1.97 -4.22 2.79 -0.02 -1.26 -5.04 135.00 130.05 1r8s n PRO 47 Ca 0.00 0.70 -0.18 0.00 -2.02 0.00 0.00 63.50 62.00 1r8s n PRO 47 Cb 0.44 -2.43 -0.12 0.00 -0.02 0.00 0.00 33.50 31.36 1r8s n PRO 47 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1r8s s THR 48 N -1.20 1.06 0.02 3.45 2.01 -1.26 -5.13 115.64 114.59 1r8s s THR 48 Ca 0.61 -1.17 -0.30 0.00 0.31 0.00 0.00 61.69 61.14 1r8s s THR 48 Cb -0.49 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.97 1r8s s THR 48 CO 0.57 -0.16 0.98 -0.63 -0.69 0.00 0.00 174.62 174.70 1r8s s ILE 49 N -1.13 4.79 -5.00 1.82 -1.09 -1.26 -4.92 121.20 114.41 1r8s s ILE 49 Ca -0.01 2.06 0.00 0.00 -2.23 0.00 0.00 60.65 60.46 1r8s s ILE 49 Cb -0.09 -4.32 0.00 0.00 -1.58 0.00 0.00 42.46 36.47 1r8s s ILE 49 CO 0.02 0.19 0.00 0.61 -1.23 0.00 0.00 174.94 174.53 1r8s n GLY 50 N 2.78 0.75 3.79 6.18 0.00 -1.26 -5.12 105.19 112.30 1r8s n GLY 50 Ca 0.05 -1.75 -0.33 0.00 0.00 0.00 0.00 46.02 44.00 1r8s n GLY 50 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r8s s PHE 51 N -3.08 2.80 -0.14 1.61 0.08 -1.26 -4.99 117.98 113.00 1r8s s PHE 51 Ca 0.00 1.53 -0.29 0.00 0.12 0.00 0.00 56.93 58.28 1r8s s PHE 51 Cb 0.00 -3.08 -0.03 0.00 -0.57 0.00 0.00 43.02 39.34 1r8s s PHE 51 CO 0.00 -1.43 1.39 -0.80 -0.10 0.00 0.00 175.22 174.28 1r8s s ASN 52 N -2.75 6.84 -0.05 1.36 0.01 -1.26 -5.00 114.94 114.10 1r8s s ASN 52 Ca 0.65 1.83 -0.03 0.00 -0.71 0.00 0.00 52.86 54.61 1r8s s ASN 52 Cb -0.18 -2.54 0.03 0.00 0.41 0.00 0.00 41.25 38.97 1r8s s ASN 52 CO 0.41 -0.83 0.11 -0.69 -1.51 0.00 0.00 177.10 174.59 1r8s s VAL 53 N 3.72 -0.03 -0.03 1.60 1.01 -1.26 -2.00 120.40 123.41 1r8s s VAL 53 Ca 0.61 0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.72 1r8s s VAL 53 Cb -0.25 -0.18 0.01 0.00 0.00 0.00 0.00 36.38 35.96 1r8s s VAL 53 CO 0.19 0.05 -0.05 -1.61 0.00 0.00 0.00 175.10 173.68 1r8s s GLU 54 N 0.75 0.76 -0.21 2.72 0.41 -0.65 -4.96 118.70 117.53 1r8s s GLU 54 Ca -0.06 -0.15 -0.10 0.00 -0.41 0.00 0.00 54.97 54.26 1r8s s GLU 54 Cb -0.08 -0.75 -0.05 0.00 -1.78 0.00 0.00 34.13 31.47 1r8s s GLU 54 CO -0.03 -0.01 0.12 0.99 -0.49 0.00 0.00 175.26 175.84 1r8s s THR 55 N 0.60 5.29 -0.30 3.63 2.01 -1.26 -0.74 115.64 124.86 1r8s s THR 55 Ca -0.08 0.15 -0.09 0.00 0.31 0.00 0.00 61.69 61.98 1r8s s THR 55 Cb -0.11 -3.42 -0.01 0.00 0.01 0.00 0.00 72.50 68.97 1r8s s THR 55 CO 0.00 0.42 0.13 -0.69 -0.69 0.00 0.00 174.62 173.80 1r8s s VAL 56 N 0.51 4.47 -0.24 3.82 1.01 0.45 -4.94 120.40 125.47 1r8s s VAL 56 Ca 0.07 -0.42 -0.07 0.00 0.00 0.00 0.00 61.98 61.56 1r8s s VAL 56 Cb -0.12 -3.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 1r8s s VAL 56 CO -0.00 0.11 0.06 -0.70 0.00 0.00 0.00 175.10 174.56 1r8s s GLU 57 N 1.60 3.65 0.49 2.72 2.12 -1.26 -1.46 118.70 126.57 1r8s s GLU 57 Ca 0.05 -0.48 0.05 0.00 0.36 0.00 0.00 54.97 54.95 1r8s s GLU 57 Cb -0.17 -3.29 0.00 0.00 0.26 0.00 0.00 34.13 30.94 1r8s s GLU 57 CO 0.05 -0.15 0.28 0.71 -0.54 0.00 0.00 175.26 175.61 1r8s s TYR 58 N 1.50 2.01 0.19 5.30 2.02 0.01 -5.02 117.35 123.36 1r8s s TYR 58 Ca 0.06 -0.76 -0.12 0.00 -0.37 0.00 0.00 57.07 55.87 1r8s s TYR 58 Cb -0.15 -1.90 0.11 0.00 -0.40 0.00 0.00 41.96 39.61 1r8s s TYR 58 CO 0.03 -0.16 1.86 -0.22 -1.57 0.00 0.00 175.55 175.48 1r8s h LYS 59 N 1.04 0.83 -0.04 -0.62 3.64 -2.05 -3.28 116.57 116.08 1r8s h LYS 59 Ca -0.40 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1r8s h LYS 59 Cb 1.29 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 1r8s h LYS 59 CO 0.63 0.55 0.00 0.09 -2.27 0.00 0.00 179.45 178.45 1r8s n ASN 60 N -4.65 1.83 -3.52 4.20 4.13 -1.26 -5.01 115.26 110.98 1r8s n ASN 60 Ca 0.05 -1.44 -0.17 0.00 1.68 0.00 0.00 54.58 54.70 1r8s n ASN 60 Cb 0.02 -0.02 -0.06 0.00 -1.54 0.00 0.00 39.78 38.18 1r8s n ASN 60 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 1r8s s ILE 61 N -0.74 0.00 0.04 2.41 2.07 -1.24 -5.17 121.20 118.58 1r8s s ILE 61 Ca 0.11 -0.04 0.03 0.00 -1.41 0.00 0.00 60.65 59.34 1r8s s ILE 61 Cb 0.07 -0.98 -0.02 0.00 0.13 0.00 0.00 42.46 41.66 1r8s s ILE 61 CO 0.11 -0.02 -0.09 -0.44 -1.91 0.00 0.00 174.94 172.59 1r8s s SER 62 N -1.46 0.98 -0.12 4.50 0.01 -1.26 -0.81 113.70 115.54 1r8s s SER 62 Ca -0.09 -0.48 0.03 0.00 1.31 0.00 0.00 55.95 56.72 1r8s s SER 62 Cb -0.00 -0.00 0.01 0.00 0.21 0.00 0.00 66.02 66.23 1r8s s SER 62 CO 0.06 -0.13 -0.22 -0.36 0.41 0.00 0.00 173.24 173.00 1r8s s PHE 63 N -1.13 2.57 -0.43 2.43 0.08 -0.53 0.18 117.98 121.15 1r8s s PHE 63 Ca -0.06 -1.21 -0.08 0.00 0.12 0.00 0.00 56.93 55.70 1r8s s PHE 63 Cb -0.09 -1.74 0.10 0.00 -0.57 0.00 0.00 43.02 40.72 1r8s s PHE 63 CO 0.01 -0.54 0.27 0.99 -0.10 0.00 0.00 175.22 175.85 1r8s s THR 64 N 0.67 4.02 -0.23 0.64 2.01 0.07 -0.41 115.64 122.41 1r8s s THR 64 Ca -0.11 -1.66 -0.13 0.00 0.31 0.00 0.00 61.69 60.11 1r8s s THR 64 Cb -0.16 -3.57 -0.05 0.00 0.01 0.00 0.00 72.50 68.73 1r8s s THR 64 CO 0.02 -0.63 0.26 -0.69 -0.69 0.00 0.00 174.62 172.89 1r8s s VAL 65 N 1.35 5.29 -0.10 3.82 1.01 0.08 -0.63 120.40 131.21 1r8s s VAL 65 Ca 0.05 0.39 -0.01 0.00 0.00 0.00 0.00 61.98 62.40 1r8s s VAL 65 Cb -0.24 -3.59 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 1r8s s VAL 65 CO -0.00 0.29 -0.04 0.26 0.00 0.00 0.00 175.10 175.61 1r8s s TRP 66 N 1.27 3.02 -0.72 5.22 0.52 -0.54 -1.63 118.94 126.07 1r8s s TRP 66 Ca 0.12 -0.05 -0.16 0.00 0.02 0.00 0.00 56.10 56.03 1r8s s TRP 66 Cb -0.14 -1.81 0.17 0.00 -1.15 0.00 0.00 33.47 30.53 1r8s s TRP 66 CO 0.06 0.23 0.72 0.34 0.02 0.00 0.00 176.95 178.33 1r8s s ASP 67 N -0.42 6.51 0.00 2.95 2.15 -0.84 -1.36 116.67 125.65 1r8s s ASP 67 Ca 0.07 -2.20 0.00 0.00 0.43 0.00 0.00 52.55 50.85 1r8s s ASP 67 Cb -0.12 -2.24 0.00 0.00 -0.30 0.00 0.00 42.92 40.26 1r8s s ASP 67 CO 0.02 -0.78 0.25 0.55 -0.17 0.00 0.00 175.17 175.04 1r8s n VAL 68 N 4.70 0.00 -2.93 1.11 3.14 -1.26 -4.43 118.33 118.66 1r8s n VAL 68 Ca 0.04 0.00 -0.21 0.00 -2.96 0.00 0.00 64.34 61.21 1r8s n VAL 68 Cb 0.45 1.48 0.08 0.00 -1.06 0.00 0.00 33.84 34.79 1r8s n VAL 68 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1r8s n GLY 69 N 0.00 1.61 0.00 7.55 0.00 -1.26 -4.92 105.19 108.17 1r8s n GLY 69 Ca 0.00 -2.18 0.00 0.00 0.00 0.00 0.00 46.02 43.84 1r8s n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r8s n GLY 70 N -2.43 0.99 3.17 -0.02 0.00 -1.26 -5.03 105.19 100.60 1r8s n GLY 70 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 1r8s n GLY 70 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1r8s s GLN 71 N 0.00 1.16 0.29 1.61 -1.52 -1.26 -5.05 119.66 114.89 1r8s s GLN 71 Ca 0.00 -0.73 -0.02 0.00 -1.95 0.00 0.00 55.36 52.66 1r8s s GLN 71 Cb 0.00 -1.18 0.42 0.00 -0.22 0.00 0.00 33.01 32.03 1r8s s GLN 71 CO 0.00 0.31 1.96 -0.44 -0.25 0.00 0.00 175.29 176.87 1r8s h ASP 72 N 5.22 0.97 0.56 5.90 3.32 -2.02 -2.76 116.42 127.61 1r8s h ASP 72 Ca -0.38 -0.03 -0.03 0.00 0.02 0.00 0.00 57.03 56.61 1r8s h ASP 72 Cb 1.17 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.47 1r8s h ASP 72 CO 0.46 0.71 -0.13 0.11 -1.72 0.00 0.00 179.24 178.66 1r8s h LYS 73 N 1.14 0.00 -0.13 3.56 1.57 -2.06 -2.18 116.57 118.47 1r8s h LYS 73 Ca 0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 1r8s h LYS 73 Cb -0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.19 1r8s h LYS 73 CO -0.07 0.13 0.00 0.44 -0.57 0.00 0.00 179.45 179.39 1r8s n ILE 74 N -3.49 0.14 -0.32 1.86 -6.64 -1.05 -4.42 119.36 105.45 1r8s n ILE 74 Ca -0.01 -0.48 0.06 0.00 -1.77 0.00 0.00 62.75 60.56 1r8s n ILE 74 Cb 0.29 0.99 0.22 0.00 -1.44 0.00 0.00 39.64 39.70 1r8s n ILE 74 CO 0.00 0.00 0.00 0.03 -1.77 0.00 0.00 176.55 174.81 1r8s h ARG 75 N 3.76 0.76 -0.58 6.28 3.08 -1.36 -1.27 114.38 125.06 1r8s h ARG 75 Ca 0.00 -0.05 0.10 0.00 0.07 0.00 0.00 59.98 60.11 1r8s h ARG 75 Cb 0.81 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.65 1r8s h ARG 75 CO 0.00 0.50 0.39 -1.35 -1.07 0.00 0.00 179.97 178.44 1r8s h PRO 76 N 0.79 0.33 -0.12 0.04 0.11 -1.79 0.42 132.00 131.77 1r8s h PRO 76 Ca 0.46 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.53 1r8s h PRO 76 Cb 0.54 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 31.57 1r8s h PRO 76 CO -0.30 0.22 -0.02 -0.07 -0.21 0.00 0.00 178.00 177.61 1r8s h LEU 77 N 0.34 0.24 -0.54 2.35 3.38 -1.55 -1.50 115.31 118.04 1r8s h LEU 77 Ca 0.27 -0.36 -0.12 0.00 0.09 0.00 0.00 57.88 57.76 1r8s h LEU 77 Cb 0.60 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1r8s h LEU 77 CO -0.07 0.54 -0.58 4.11 0.09 0.00 0.00 178.44 182.53 1r8s h TRP 78 N -0.07 0.00 -0.72 1.13 5.08 -1.45 -0.25 115.95 119.68 1r8s h TRP 78 Ca 0.03 0.00 0.01 0.00 1.08 0.00 0.00 58.89 60.01 1r8s h TRP 78 Cb 0.43 0.00 -0.04 0.00 -3.00 0.00 0.00 29.16 26.55 1r8s h TRP 78 CO 0.05 0.58 0.47 0.00 -1.28 0.00 0.00 178.44 178.27 1r8s h ARG 79 N 0.00 0.94 -0.04 0.12 3.08 -0.81 -0.30 114.38 117.38 1r8s h ARG 79 Ca -0.01 -0.06 -0.20 0.00 0.07 0.00 0.00 59.98 59.79 1r8s h ARG 79 Cb 1.21 -0.21 0.01 0.00 0.08 0.00 0.00 29.97 31.06 1r8s h ARG 79 CO 0.08 0.62 -0.76 0.45 -1.07 0.00 0.00 179.97 179.29 1r8s h HIS 80 N 0.97 0.84 -0.35 3.04 3.86 -1.13 -2.21 115.15 120.18 1r8s h HIS 80 Ca 0.26 -0.43 -0.11 0.00 -1.16 0.00 0.00 60.37 58.94 1r8s h HIS 80 Cb -0.11 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 28.24 1r8s h HIS 80 CO -0.02 1.25 -0.23 -0.92 0.86 0.00 0.00 177.93 178.87 1r8s h TYR 81 N 0.19 0.77 -0.69 2.45 3.20 -0.89 -2.87 116.97 119.13 1r8s h TYR 81 Ca -0.08 -0.17 -0.15 0.00 3.14 0.00 0.00 58.73 61.47 1r8s h TYR 81 Cb 1.43 -0.19 -0.09 0.00 1.54 0.00 0.00 36.73 39.43 1r8s h TYR 81 CO 0.12 0.85 0.18 1.19 -1.64 0.00 0.00 178.16 178.86 1r8s n PHE 82 N -4.12 2.34 -1.80 -3.82 3.72 -0.14 -5.00 117.46 108.65 1r8s n PHE 82 Ca 0.00 -1.05 -0.41 0.00 -0.05 0.00 0.00 57.45 55.93 1r8s n PHE 82 Cb 0.42 -0.63 -0.01 0.00 -0.94 0.00 0.00 39.48 38.31 1r8s n PHE 82 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 1r8s s GLN 83 N -2.93 4.13 -2.01 -1.08 0.74 -0.83 -1.87 119.66 115.82 1r8s s GLN 83 Ca 0.55 2.55 0.00 0.00 0.05 0.00 0.00 55.36 58.52 1r8s s GLN 83 Cb 0.43 -3.02 0.00 0.00 1.10 0.00 0.00 33.01 31.53 1r8s s GLN 83 CO 0.14 -0.59 0.00 0.09 -0.55 0.00 0.00 175.29 174.38 1r8s n ASN 84 N 1.83 -5.62 -4.81 6.67 3.02 -0.52 -4.97 115.26 110.86 1r8s n ASN 84 Ca 0.06 0.29 -0.32 0.00 -0.03 0.00 0.00 54.58 54.59 1r8s n ASN 84 Cb 0.38 -4.81 0.04 0.00 -0.61 0.00 0.00 39.78 34.78 1r8s n ASN 84 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1r8s s THR 85 N -2.87 3.83 -0.69 3.41 2.01 -0.78 -4.98 115.64 115.57 1r8s s THR 85 Ca 0.00 0.72 0.22 0.00 0.31 0.00 0.00 61.69 62.94 1r8s s THR 85 Cb 0.00 -3.33 -0.23 0.00 0.01 0.00 0.00 72.50 68.95 1r8s s THR 85 CO 0.00 -0.65 0.83 0.00 -0.69 0.00 0.00 174.62 174.11 1r8s n GLN 86 N -2.66 0.21 -3.73 4.92 6.02 -1.26 -3.61 117.38 117.27 1r8s n GLN 86 Ca 0.08 -0.05 -0.13 0.00 -0.01 0.00 0.00 57.00 56.89 1r8s n GLN 86 Cb 0.53 -1.52 -0.08 0.00 1.02 0.00 0.00 30.24 30.19 1r8s n GLN 86 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1r8s s GLY 87 N -3.48 -0.19 -0.02 1.08 0.00 -1.26 -1.61 107.32 101.83 1r8s s GLY 87 Ca 0.03 0.32 0.02 0.00 0.00 0.00 0.00 44.72 45.09 1r8s s GLY 87 CO 0.86 0.09 -0.06 -2.27 0.00 0.00 0.00 173.10 171.72 1r8s s LEU 88 N -1.59 1.76 -0.17 0.66 2.96 0.01 -4.09 118.68 118.22 1r8s s LEU 88 Ca -0.10 -0.13 -0.03 0.00 -0.22 0.00 0.00 54.13 53.66 1r8s s LEU 88 Cb -0.03 -0.39 -0.02 0.00 0.50 0.00 0.00 46.19 46.25 1r8s s LEU 88 CO 0.02 0.03 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.38 1r8s s ILE 89 N 0.23 3.42 -0.17 6.68 1.01 -0.55 -1.14 121.20 130.68 1r8s s ILE 89 Ca -0.03 -0.51 -0.00 0.00 0.00 0.00 0.00 60.65 60.11 1r8s s ILE 89 Cb -0.07 -2.50 0.00 0.00 0.01 0.00 0.00 42.46 39.90 1r8s s ILE 89 CO -0.00 0.48 -0.15 0.12 0.00 0.00 0.00 174.94 175.39 1r8s s PHE 90 N 0.80 2.81 -0.15 3.97 5.36 -0.22 -1.10 117.98 129.44 1r8s s PHE 90 Ca -0.02 -1.19 -0.05 0.00 -0.96 0.00 0.00 56.93 54.70 1r8s s PHE 90 Cb -0.15 -1.93 -0.04 0.00 -0.34 0.00 0.00 43.02 40.56 1r8s s PHE 90 CO 0.01 -0.58 0.03 0.08 -1.46 0.00 0.00 175.22 173.31 1r8s s VAL 91 N 1.05 4.52 -0.01 3.12 1.01 0.22 -1.17 120.40 129.13 1r8s s VAL 91 Ca -0.01 -0.14 0.05 0.00 0.00 0.00 0.00 61.98 61.88 1r8s s VAL 91 Cb -0.15 -2.99 -0.01 0.00 0.00 0.00 0.00 36.38 33.23 1r8s s VAL 91 CO -0.04 0.50 -0.17 0.54 0.00 0.00 0.00 175.10 175.94 1r8s s VAL 92 N 0.06 1.31 -0.54 2.92 0.11 -0.55 -4.13 120.40 119.58 1r8s s VAL 92 Ca 0.04 -0.71 -0.28 0.00 -2.93 0.00 0.00 61.98 58.09 1r8s s VAL 92 Cb -0.13 -1.09 0.03 0.00 -1.53 0.00 0.00 36.38 33.66 1r8s s VAL 92 CO 0.01 0.37 1.24 -0.62 -3.33 0.00 0.00 175.10 172.77 1r8s s ASP 93 N -0.38 6.42 0.42 3.54 -1.08 -1.26 -0.88 116.67 123.45 1r8s s ASP 93 Ca 0.06 0.26 0.30 0.00 -0.52 0.00 0.00 52.55 52.65 1r8s s ASP 93 Cb -0.07 -2.55 1.37 0.00 -1.46 0.00 0.00 42.92 40.21 1r8s s ASP 93 CO -0.01 -1.47 1.89 0.28 0.52 0.00 0.00 175.17 176.38 1r8s h SER 94 N 9.82 0.00 0.57 -0.34 0.02 -1.36 -2.06 113.55 120.20 1r8s h SER 94 Ca -0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 1r8s h SER 94 Cb 1.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.61 1r8s h SER 94 CO 1.17 0.00 -0.54 -3.20 -1.14 0.00 0.00 176.83 173.11 1r8s n ASN 95 N -2.62 0.53 -4.41 3.07 5.15 -1.26 -0.65 115.26 115.07 1r8s n ASN 95 Ca 0.00 -0.17 -0.44 0.00 -0.60 0.00 0.00 54.58 53.37 1r8s n ASN 95 Cb 0.19 0.25 -0.00 0.00 -0.53 0.00 0.00 39.78 39.69 1r8s n ASN 95 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1r8s s ASP 96 N -3.27 7.13 0.31 1.20 -1.08 -0.78 -4.80 116.67 115.38 1r8s s ASP 96 Ca 0.10 -3.15 0.11 0.00 -0.52 0.00 0.00 52.55 49.09 1r8s s ASP 96 Cb 0.17 -2.32 0.51 0.00 -1.46 0.00 0.00 42.92 39.81 1r8s s ASP 96 CO 0.71 -0.59 1.70 0.03 0.52 0.00 0.00 175.17 177.54 1r8s h ARG 97 N 7.11 0.01 -0.19 4.34 3.08 -1.85 -2.58 114.38 124.30 1r8s h ARG 97 Ca 0.25 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.27 1r8s h ARG 97 Cb 0.89 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.93 1r8s h ARG 97 CO 1.13 0.52 0.03 1.49 -1.07 0.00 0.00 179.97 182.06 1r8s h GLU 98 N 0.01 0.27 -0.28 0.04 4.81 -1.98 -3.12 114.58 114.32 1r8s h GLU 98 Ca -0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1r8s h GLU 98 Cb 0.90 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.23 1r8s h GLU 98 CO 0.07 0.27 0.00 0.54 -0.73 0.00 0.00 179.01 179.16 1r8s n ARG 99 N -4.41 2.76 -0.11 1.92 1.74 -1.09 -4.65 116.66 112.83 1r8s n ARG 99 Ca -0.00 -1.92 -0.03 0.00 -0.77 0.00 0.00 57.85 55.13 1r8s n ARG 99 Cb 0.16 -1.22 0.18 0.00 -1.02 0.00 0.00 32.46 30.56 1r8s n ARG 99 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 1r8s h VAL 100 N 1.71 1.23 -0.63 1.55 3.04 -1.40 -0.80 116.25 120.94 1r8s h VAL 100 Ca 0.00 -0.91 -0.07 0.00 -1.01 0.00 0.00 66.70 64.71 1r8s h VAL 100 Cb 0.68 0.81 -0.03 0.00 -2.01 0.00 0.00 31.29 30.74 1r8s h VAL 100 CO 0.00 0.33 0.12 -1.13 -1.01 0.00 0.00 177.57 175.88 1r8s h ASN 101 N 0.74 0.99 -0.80 3.17 -1.24 -1.82 -0.93 115.58 115.68 1r8s h ASN 101 Ca 0.15 -0.25 -0.01 0.00 0.71 0.00 0.00 56.30 56.90 1r8s h ASN 101 Cb 0.38 -0.26 -0.04 0.00 0.73 0.00 0.00 38.32 39.13 1r8s h ASN 101 CO 0.01 0.99 0.45 -0.08 -1.29 0.00 0.00 177.43 177.51 1r8s h GLU 102 N 0.95 1.11 -0.69 6.67 4.81 -1.77 -1.05 114.58 124.62 1r8s h GLU 102 Ca 0.19 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1r8s h GLU 102 Cb 0.40 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.53 1r8s h GLU 102 CO 0.01 0.82 0.43 0.00 -0.73 0.00 0.00 179.01 179.53 1r8s h ALA 103 N 1.24 0.88 -0.43 2.92 0.00 -0.80 -0.96 119.26 122.11 1r8s h ALA 103 Ca 0.28 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1r8s h ALA 103 Cb 0.02 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1r8s h ALA 103 CO -0.05 0.33 0.28 -0.09 0.00 0.00 0.00 179.25 179.72 1r8s h ARG 104 N 0.94 0.56 -0.80 0.00 2.43 -0.69 0.30 114.38 117.12 1r8s h ARG 104 Ca 0.25 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.36 1r8s h ARG 104 Cb -0.06 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.33 1r8s h ARG 104 CO -0.05 0.37 0.39 0.93 -1.51 0.00 0.00 179.97 180.09 1r8s h GLU 105 N 0.57 1.15 -0.51 0.20 5.08 -0.87 -0.63 114.58 119.57 1r8s h GLU 105 Ca 0.16 -0.17 -0.13 0.00 -1.00 0.00 0.00 59.36 58.22 1r8s h GLU 105 Cb -0.06 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 28.97 1r8s h GLU 105 CO -0.04 0.89 -0.18 0.93 -1.00 0.00 0.00 179.01 179.61 1r8s h GLU 106 N 1.13 1.01 -0.38 2.33 4.39 -0.85 -2.00 114.58 120.21 1r8s h GLU 106 Ca 0.28 -0.41 0.00 0.00 0.34 0.00 0.00 59.36 59.57 1r8s h GLU 106 Cb 0.12 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 1r8s h GLU 106 CO -0.03 1.10 0.25 1.25 -1.16 0.00 0.00 179.01 180.41 1r8s h LEU 107 N 0.88 0.44 -1.30 1.33 5.85 -0.57 -2.22 115.31 119.72 1r8s h LEU 107 Ca 0.12 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 1r8s h LEU 107 Cb 0.76 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.66 1r8s h LEU 107 CO 0.06 0.33 -0.01 0.24 -0.34 0.00 0.00 178.44 178.72 1r8s h MET 108 N 0.52 0.45 -0.66 1.25 2.86 -0.88 -1.47 114.93 117.00 1r8s h MET 108 Ca 0.14 -0.09 -0.03 0.00 -2.06 0.00 0.00 59.70 57.66 1r8s h MET 108 Cb -0.05 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.51 1r8s h MET 108 CO -0.03 0.49 0.30 0.00 1.06 0.00 0.00 176.91 178.73 1r8s h ARG 109 N 0.44 0.96 -0.68 1.72 3.08 -1.03 -1.73 114.38 117.13 1r8s h ARG 109 Ca 0.10 -0.15 0.01 0.00 0.07 0.00 0.00 59.98 60.00 1r8s h ARG 109 Cb 0.31 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.15 1r8s h ARG 109 CO 0.01 0.77 0.45 0.52 -1.07 0.00 0.00 179.97 180.65 1r8s h MET 110 N 0.92 0.90 0.00 0.04 2.86 -0.72 -2.83 114.93 116.10 1r8s h MET 110 Ca 0.22 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 1r8s h MET 110 Cb 0.14 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.60 1r8s h MET 110 CO -0.03 0.59 0.00 1.28 1.06 0.00 0.00 176.91 179.82 1r8s n LEU 111 N -4.61 0.00 0.02 1.22 4.77 -0.64 -2.31 117.00 115.44 1r8s n LEU 111 Ca 0.06 0.46 0.12 0.00 -0.03 0.00 0.00 56.01 56.62 1r8s n LEU 111 Cb 0.02 -0.46 0.20 0.00 -2.33 0.00 0.00 43.42 40.84 1r8s n LEU 111 CO 0.36 -0.08 0.36 0.00 -1.33 0.00 0.00 177.39 176.70 1r8s n ALA 112 N -1.46 3.42 -2.20 -1.18 0.00 -0.70 -4.89 120.51 113.51 1r8s n ALA 112 Ca 0.07 -0.34 -0.42 0.00 0.00 0.00 0.00 53.44 52.75 1r8s n ALA 112 Cb 0.27 -1.10 -0.03 0.00 0.00 0.00 0.00 19.45 18.58 1r8s n ALA 112 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1r8s s GLU 113 N -3.06 4.32 0.38 0.00 0.41 -0.98 -4.91 118.70 114.86 1r8s s GLU 113 Ca 0.09 2.03 0.10 0.00 -0.41 0.00 0.00 54.97 56.78 1r8s s GLU 113 Cb 0.16 -3.33 0.86 0.00 -1.78 0.00 0.00 34.13 30.04 1r8s s GLU 113 CO 0.72 -0.46 1.92 0.22 -0.49 0.00 0.00 175.26 177.17 1r8s h ASP 114 N 7.06 0.57 1.08 -0.19 3.58 -1.91 -2.58 116.42 124.03 1r8s h ASP 114 Ca -0.41 0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.04 1r8s h ASP 114 Cb 1.20 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 42.15 1r8s h ASP 114 CO 0.87 0.33 -0.07 -0.33 -2.88 0.00 0.00 179.24 177.16 1r8s h GLU 115 N 0.63 0.00 -0.27 0.28 3.07 -1.91 -2.63 114.58 113.75 1r8s h GLU 115 Ca 0.37 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.23 1r8s h GLU 115 Cb 0.58 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.49 1r8s h GLU 115 CO -0.14 0.07 0.00 1.28 -1.40 0.00 0.00 179.01 178.82 1r8s n LEU 116 N -3.18 3.38 0.07 1.33 4.77 -0.98 -1.44 117.00 120.94 1r8s n LEU 116 Ca 0.01 -2.62 0.06 0.00 -0.03 0.00 0.00 56.01 53.43 1r8s n LEU 116 Cb 0.36 -0.40 0.49 0.00 -2.33 0.00 0.00 43.42 41.54 1r8s n LEU 116 CO 0.30 0.69 1.14 -0.09 -1.33 0.00 0.00 177.39 178.09 1r8s h ARG 117 N 1.70 0.37 -0.38 3.23 2.43 -1.37 -1.75 114.38 118.62 1r8s h ARG 117 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1r8s h ARG 117 Cb 1.13 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 1r8s h ARG 117 CO 0.12 0.25 0.00 -0.25 -1.51 0.00 0.00 179.97 178.58 1r8s n ASP 118 N -4.49 2.99 -4.73 -3.80 8.00 -1.26 -4.95 116.55 108.31 1r8s n ASP 118 Ca 0.02 -1.93 -0.41 0.00 0.71 0.00 0.00 54.79 53.18 1r8s n ASP 118 Cb 0.09 -0.25 -0.04 0.00 -0.02 0.00 0.00 41.12 40.90 1r8s n ASP 118 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1r8s s ALA 119 N -1.51 3.28 0.59 2.24 0.00 -0.66 -4.74 121.76 120.96 1r8s s ALA 119 Ca 0.37 0.64 -0.15 0.00 0.00 0.00 0.00 51.96 52.83 1r8s s ALA 119 Cb 0.21 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 1r8s s ALA 119 CO 0.30 -0.08 1.03 0.14 0.00 0.00 0.00 175.76 177.15 1r8s s VAL 120 N -0.02 4.17 -0.20 0.00 -7.23 -0.63 -4.76 120.40 111.73 1r8s s VAL 120 Ca 0.48 0.93 -0.01 0.00 -1.81 0.00 0.00 61.98 61.57 1r8s s VAL 120 Cb -0.25 -3.54 0.00 0.00 0.56 0.00 0.00 36.38 33.15 1r8s s VAL 120 CO 0.31 -0.70 -0.12 -0.22 -0.31 0.00 0.00 175.10 174.06 1r8s s LEU 121 N -4.64 2.52 -0.24 1.32 2.96 -0.30 -0.81 118.68 119.50 1r8s s LEU 121 Ca 0.60 -0.51 -0.07 0.00 -0.22 0.00 0.00 54.13 53.93 1r8s s LEU 121 Cb -0.13 -1.61 -0.03 0.00 0.50 0.00 0.00 46.19 44.92 1r8s s LEU 121 CO 0.41 -0.01 0.06 -0.22 -1.32 0.00 0.00 176.35 175.27 1r8s s LEU 122 N 1.36 3.46 -0.24 -0.68 2.96 -0.29 -1.56 118.68 123.69 1r8s s LEU 122 Ca 0.05 -0.18 -0.09 0.00 -0.22 0.00 0.00 54.13 53.69 1r8s s LEU 122 Cb -0.14 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.59 1r8s s LEU 122 CO -0.08 -0.01 0.12 -0.69 -1.32 0.00 0.00 176.35 174.38 1r8s s VAL 123 N 1.45 4.94 -0.42 1.68 1.01 -0.05 -1.06 120.40 127.95 1r8s s VAL 123 Ca 0.05 0.03 -0.19 0.00 0.00 0.00 0.00 61.98 61.88 1r8s s VAL 123 Cb -0.15 -3.29 0.02 0.00 0.00 0.00 0.00 36.38 32.96 1r8s s VAL 123 CO 0.03 0.35 0.53 -0.36 0.00 0.00 0.00 175.10 175.66 1r8s s PHE 124 N 1.16 3.13 -0.97 5.22 0.08 -0.31 -0.48 117.98 125.80 1r8s s PHE 124 Ca 0.06 -0.15 -0.18 0.00 0.12 0.00 0.00 56.93 56.77 1r8s s PHE 124 Cb -0.14 -3.08 0.13 0.00 -0.57 0.00 0.00 43.02 39.35 1r8s s PHE 124 CO 0.05 -0.74 1.20 0.00 -0.10 0.00 0.00 175.22 175.62 1r8s s ALA 125 N 2.46 3.39 0.56 5.36 0.00 -0.07 -1.48 121.76 131.97 1r8s s ALA 125 Ca 0.17 -2.80 -0.03 0.00 0.00 0.00 0.00 51.96 49.30 1r8s s ALA 125 Cb -0.16 -4.10 0.01 0.00 0.00 0.00 0.00 23.12 18.87 1r8s s ALA 125 CO 0.16 -3.01 0.84 1.21 0.00 0.00 0.00 175.76 174.95 1r8s s ASN 126 N 3.65 5.52 -0.94 0.00 2.47 -0.06 -1.26 114.94 124.32 1r8s s ASN 126 Ca 0.35 0.48 -0.02 0.00 0.42 0.00 0.00 52.86 54.09 1r8s s ASN 126 Cb -0.04 -1.48 0.00 0.00 -1.45 0.00 0.00 41.25 38.28 1r8s s ASN 126 CO -0.08 -1.04 0.24 0.29 -3.72 0.00 0.00 177.10 172.79 1r8s n LYS 127 N -2.46 -2.25 0.07 0.43 5.02 -1.00 -0.98 118.16 116.98 1r8s n LYS 127 Ca 0.05 0.54 0.07 0.00 -2.02 0.00 0.00 58.31 56.95 1r8s n LYS 127 Cb 0.58 -4.64 0.34 0.00 -0.02 0.00 0.00 35.03 31.29 1r8s n LYS 127 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1r8s n GLN 128 N -2.49 0.08 0.21 1.97 1.13 -0.87 -1.99 117.38 115.42 1r8s n GLN 128 Ca -0.09 0.45 0.08 0.00 -1.94 0.00 0.00 57.00 55.50 1r8s n GLN 128 Cb 0.58 -1.70 0.42 0.00 0.11 0.00 0.00 30.24 29.65 1r8s n GLN 128 CO 0.00 0.00 0.00 0.38 -1.44 0.00 0.00 177.06 176.00 1r8s h ASP 129 N 0.00 0.00 -3.62 1.08 2.03 -1.91 -3.46 116.42 110.55 1r8s h ASP 129 Ca 0.00 0.00 -0.51 0.00 -0.73 0.00 0.00 57.03 55.79 1r8s h ASP 129 Cb 0.16 0.00 0.01 0.00 -0.83 0.00 0.00 39.33 38.67 1r8s h ASP 129 CO 0.00 0.28 0.49 -0.76 -1.03 0.00 0.00 179.24 178.22 1r8s s LEU 130 N -6.91 4.50 0.42 0.15 1.43 -0.84 -4.92 118.68 112.50 1r8s s LEU 130 Ca 0.00 2.16 0.08 0.00 -1.03 0.00 0.00 54.13 55.34 1r8s s LEU 130 Cb 0.11 -3.61 0.89 0.00 0.03 0.00 0.00 46.19 43.61 1r8s s LEU 130 CO 0.65 -0.22 2.06 1.55 0.23 0.00 0.00 176.35 180.63 1r8s h PRO 131 N 4.77 0.49 -0.64 1.29 0.13 -1.90 -1.66 132.00 134.49 1r8s h PRO 131 Ca -0.45 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1r8s h PRO 131 Cb 1.21 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1r8s h PRO 131 CO 0.71 0.33 0.00 -1.71 -0.23 0.00 0.00 178.00 177.10 1r8s n ASN 132 N -4.48 4.86 -4.77 1.44 5.15 -1.26 -4.99 115.26 111.21 1r8s n ASN 132 Ca 0.03 -2.58 -0.41 0.00 -0.60 0.00 0.00 54.58 51.01 1r8s n ASN 132 Cb 0.06 -0.61 -0.01 0.00 -0.53 0.00 0.00 39.78 38.70 1r8s n ASN 132 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1r8s s ALA 133 N -2.13 3.59 0.29 5.20 0.00 -0.63 -4.82 121.76 123.27 1r8s s ALA 133 Ca 0.49 1.53 -0.30 0.00 0.00 0.00 0.00 51.96 53.69 1r8s s ALA 133 Cb 0.34 -3.60 -0.11 0.00 0.00 0.00 0.00 23.12 19.75 1r8s s ALA 133 CO 0.20 -0.99 1.50 -1.64 0.00 0.00 0.00 175.76 174.83 1r8s s MET 134 N -1.79 4.19 0.94 0.00 -1.94 0.18 -4.94 119.30 115.93 1r8s s MET 134 Ca 0.54 2.45 -0.15 0.00 -1.71 0.00 0.00 55.69 56.82 1r8s s MET 134 Cb -0.46 -3.05 0.17 0.00 2.01 0.00 0.00 34.83 33.50 1r8s s MET 134 CO 0.59 -0.50 1.22 0.54 -0.01 0.00 0.00 175.02 176.86 1r8s s ASN 135 N 0.25 3.28 0.25 3.03 2.20 -1.26 -4.78 114.94 117.91 1r8s s ASN 135 Ca 0.59 0.60 -0.05 0.00 -0.94 0.00 0.00 52.86 53.06 1r8s s ASN 135 Cb -0.45 -0.90 0.35 0.00 -2.00 0.00 0.00 41.25 38.25 1r8s s ASN 135 CO 0.49 -2.66 1.86 0.00 -2.94 0.00 0.00 177.10 173.85 1r8s h ALA 136 N -1.58 1.22 -0.62 3.54 0.00 -1.97 -0.67 119.26 119.19 1r8s h ALA 136 Ca -0.46 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.39 1r8s h ALA 136 Cb 1.29 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1r8s h ALA 136 CO 0.50 0.31 0.20 0.00 0.00 0.00 0.00 179.25 180.26 1r8s h ALA 137 N 1.41 0.81 -0.51 0.00 0.00 -1.99 -0.50 119.26 118.48 1r8s h ALA 137 Ca 0.39 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1r8s h ALA 137 Cb 0.17 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1r8s h ALA 137 CO -0.17 0.46 -0.03 1.49 0.00 0.00 0.00 179.25 181.00 1r8s h GLU 138 N 0.88 0.91 -0.53 0.00 4.81 -1.74 -1.93 114.58 116.98 1r8s h GLU 138 Ca 0.20 -0.30 -0.10 0.00 -0.13 0.00 0.00 59.36 59.03 1r8s h GLU 138 Cb 0.27 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 1r8s h GLU 138 CO -0.01 0.95 -0.06 0.82 -0.73 0.00 0.00 179.01 179.99 1r8s h ILE 139 N 0.78 1.26 -0.70 2.32 1.08 -1.01 -0.20 117.51 121.04 1r8s h ILE 139 Ca 0.14 -1.18 0.02 0.00 -0.39 0.00 0.00 64.86 63.46 1r8s h ILE 139 Cb 0.56 0.91 -0.04 0.00 -3.07 0.00 0.00 36.82 35.18 1r8s h ILE 139 CO 0.03 0.42 0.45 0.74 -0.69 0.00 0.00 178.15 179.09 1r8s h THR 140 N 0.87 1.12 0.08 -0.27 2.02 -0.91 0.11 112.91 115.93 1r8s h THR 140 Ca 0.15 -0.30 -0.00 0.00 0.77 0.00 0.00 66.41 67.02 1r8s h THR 140 Cb 0.59 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 1r8s h THR 140 CO 0.04 0.16 -0.04 -0.78 0.37 0.00 0.00 175.52 175.27 1r8s h ASP 141 N 0.88 -0.10 1.38 4.18 3.58 -1.08 -2.27 116.42 123.00 1r8s h ASP 141 Ca 0.28 -0.22 -0.03 0.00 0.42 0.00 0.00 57.03 57.47 1r8s h ASP 141 Cb -0.01 0.02 -0.00 0.00 1.72 0.00 0.00 39.33 41.06 1r8s h ASP 141 CO -0.09 0.17 -0.14 0.11 -2.88 0.00 0.00 179.24 176.41 1r8s h LYS 142 N -0.37 0.00 -0.02 0.28 1.79 -0.73 -1.82 116.57 115.71 1r8s h LYS 142 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1r8s h LYS 142 Cb 0.31 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.96 1r8s h LYS 142 CO 0.02 0.14 -0.09 1.28 -1.08 0.00 0.00 179.45 179.72 1r8s n LEU 143 N -3.19 1.62 -1.25 2.94 4.77 -0.00 -4.70 117.00 117.18 1r8s n LEU 143 Ca 0.02 -0.52 -0.11 0.00 -0.03 0.00 0.00 56.01 55.36 1r8s n LEU 143 Cb 0.48 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.53 1r8s n LEU 143 CO 0.33 0.28 -0.14 0.61 -1.33 0.00 0.00 177.39 177.14 1r8s n GLY 144 N 1.25 0.04 0.19 -0.72 0.00 -0.68 -4.87 105.19 100.40 1r8s n GLY 144 Ca 0.16 -0.42 0.02 0.00 0.00 0.00 0.00 46.02 45.78 1r8s n GLY 144 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1r8s h LEU 145 N 0.00 0.02 -1.12 0.99 3.38 -1.66 -1.79 115.31 115.12 1r8s h LEU 145 Ca -0.27 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1r8s h LEU 145 Cb 1.15 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1r8s h LEU 145 CO 0.32 0.38 0.00 0.45 0.09 0.00 0.00 178.44 179.68 1r8s h HIS 146 N 0.01 0.00 0.00 1.13 3.86 -1.91 -2.40 115.15 115.84 1r8s h HIS 146 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1r8s h HIS 146 Cb 0.65 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.12 1r8s h HIS 146 CO 0.00 0.00 0.00 0.77 0.86 0.00 0.00 177.93 179.56 1r8s h SER 147 N 0.00 0.00 -3.35 2.45 0.02 -1.71 -3.46 113.55 107.51 1r8s h SER 147 Ca 0.00 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.43 1r8s h SER 147 Cb 0.25 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.82 1r8s h SER 147 CO 0.00 0.00 0.62 -0.76 -1.14 0.00 0.00 176.83 175.55 1r8s s LEU 148 N -4.63 4.42 -0.22 5.07 1.43 -0.91 -4.94 118.68 118.90 1r8s s LEU 148 Ca 0.09 2.29 -0.06 0.00 -1.03 0.00 0.00 54.13 55.42 1r8s s LEU 148 Cb 0.11 -3.60 -0.11 0.00 0.03 0.00 0.00 46.19 42.61 1r8s s LEU 148 CO 0.55 -0.49 -0.25 0.54 0.23 0.00 0.00 176.35 176.93 1r8s n ARG 149 N 2.90 0.50 -1.40 1.70 5.12 -1.26 -4.72 116.66 119.50 1r8s n ARG 149 Ca 0.07 0.18 -0.13 0.00 -1.93 0.00 0.00 57.85 56.04 1r8s n ARG 149 Cb 0.44 -1.36 0.10 0.00 -1.16 0.00 0.00 32.46 30.48 1r8s n ARG 149 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1r8s n HIS 150 N -3.66 1.69 -4.09 -1.55 8.25 -1.26 -4.96 115.22 109.64 1r8s n HIS 150 Ca -0.42 -1.96 -0.22 0.00 -0.26 0.00 0.00 57.72 54.86 1r8s n HIS 150 Cb 0.85 -0.37 -0.17 0.00 1.12 0.00 0.00 29.99 31.43 1r8s n HIS 150 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 1r8s s ARG 151 N -3.46 1.02 -0.06 -0.41 6.06 -1.26 -5.03 118.95 115.81 1r8s s ARG 151 Ca 0.47 -0.12 -0.30 0.00 -2.50 0.00 0.00 55.73 53.27 1r8s s ARG 151 Cb 0.40 -1.08 -0.03 0.00 0.06 0.00 0.00 34.95 34.31 1r8s s ARG 151 CO -0.00 -0.15 1.11 -0.80 -2.50 0.00 0.00 175.30 172.95 1r8s s ASN 152 N 1.26 7.16 0.06 -2.12 -0.87 -1.26 -5.00 114.94 114.17 1r8s s ASN 152 Ca -0.05 1.71 -0.05 0.00 -1.57 0.00 0.00 52.86 52.90 1r8s s ASN 152 Cb -0.14 -2.56 -0.02 0.00 -0.02 0.00 0.00 41.25 38.51 1r8s s ASN 152 CO -0.02 -0.49 0.08 -1.66 -2.57 0.00 0.00 177.10 172.43 1r8s s TRP 153 N 1.94 0.32 -0.15 2.20 1.48 -1.26 -1.15 118.94 122.32 1r8s s TRP 153 Ca 0.53 -0.77 -0.13 0.00 -1.06 0.00 0.00 56.10 54.67 1r8s s TRP 153 Cb -0.22 -0.22 0.04 0.00 -1.16 0.00 0.00 33.47 31.91 1r8s s TRP 153 CO 0.21 -0.44 0.40 -0.47 -4.06 0.00 0.00 176.95 172.60 1r8s s TYR 154 N -3.61 -0.46 -0.21 1.66 5.04 -0.60 -4.98 117.35 114.19 1r8s s TYR 154 Ca 0.04 1.10 -0.05 0.00 -2.44 0.00 0.00 57.07 55.71 1r8s s TYR 154 Cb 0.05 0.17 -0.02 0.00 0.35 0.00 0.00 41.96 42.50 1r8s s TYR 154 CO -0.09 -0.23 -0.00 -1.50 -1.34 0.00 0.00 175.55 172.38 1r8s s ILE 155 N 0.39 3.85 -0.26 3.14 2.07 -1.26 -0.87 121.20 128.26 1r8s s ILE 155 Ca -0.01 -0.34 -0.02 0.00 -1.41 0.00 0.00 60.65 58.86 1r8s s ILE 155 Cb -0.04 -2.75 0.03 0.00 0.13 0.00 0.00 42.46 39.83 1r8s s ILE 155 CO -0.01 0.42 -0.04 -1.58 -1.91 0.00 0.00 174.94 171.82 1r8s s GLN 156 N 1.18 2.82 0.24 3.50 2.00 0.37 -4.98 119.66 124.79 1r8s s GLN 156 Ca 0.03 -1.00 -0.30 0.00 -2.00 0.00 0.00 55.36 52.10 1r8s s GLN 156 Cb -0.14 -3.06 -0.10 0.00 0.80 0.00 0.00 33.01 30.51 1r8s s GLN 156 CO 0.01 -0.43 1.38 0.00 -0.50 0.00 0.00 175.29 175.75 1r8s s ALA 157 N 1.34 3.58 0.06 1.58 0.00 -1.26 -0.90 121.76 126.16 1r8s s ALA 157 Ca -0.00 1.25 -0.03 0.00 0.00 0.00 0.00 51.96 53.17 1r8s s ALA 157 Cb -0.17 -3.52 -0.03 0.00 0.00 0.00 0.00 23.12 19.40 1r8s s ALA 157 CO -0.03 -0.66 0.04 0.95 0.00 0.00 0.00 175.76 176.06 1r8s s THR 158 N -0.11 0.19 -0.24 0.00 -4.23 -0.39 -4.31 115.64 106.55 1r8s s THR 158 Ca 0.57 -1.57 -0.01 0.00 -1.18 0.00 0.00 61.69 59.51 1r8s s THR 158 Cb -0.40 -1.40 0.07 0.00 1.34 0.00 0.00 72.50 72.11 1r8s s THR 158 CO 0.43 -0.87 0.01 0.00 -0.54 0.00 0.00 174.62 173.66 1r8s h ALA 160 N 8.06 1.16 0.00 0.00 0.00 -1.92 0.41 119.26 126.97 1r8s h ALA 160 Ca -0.16 -0.29 -0.11 0.00 0.00 0.00 0.00 54.91 54.36 1r8s h ALA 160 Cb 1.07 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 1r8s h ALA 160 CO 0.41 0.40 -0.50 1.79 0.00 0.00 0.00 179.25 181.34 1r8s h THR 161 N 0.00 1.29 0.00 0.00 1.35 -1.95 -3.08 112.91 110.51 1r8s h THR 161 Ca -0.00 -1.77 -0.14 0.00 -0.55 0.00 0.00 66.41 63.95 1r8s h THR 161 Cb 0.71 1.98 -0.02 0.00 -1.73 0.00 0.00 68.15 69.08 1r8s h THR 161 CO 0.04 0.49 -1.47 -1.54 -0.25 0.00 0.00 175.52 172.79 1r8s n SER 162 N -3.83 0.71 0.00 5.36 3.41 -1.06 -4.99 113.62 113.22 1r8s n SER 162 Ca -0.01 0.30 0.00 0.00 -0.26 0.00 0.00 58.87 58.90 1r8s n SER 162 Cb 0.54 0.46 0.00 0.00 -0.26 0.00 0.00 64.21 64.94 1r8s n SER 162 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1r8s n GLY 163 N 1.37 0.93 3.74 5.00 0.00 0.11 -5.05 105.19 111.30 1r8s n GLY 163 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 1r8s n GLY 163 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1r8s s ASP 164 N -2.86 6.56 0.00 1.61 1.11 -1.06 -2.43 116.67 119.59 1r8s s ASP 164 Ca 0.00 2.73 0.00 0.00 0.18 0.00 0.00 52.55 55.46 1r8s s ASP 164 Cb 0.00 -2.62 0.00 0.00 1.07 0.00 0.00 42.92 41.37 1r8s s ASP 164 CO 0.00 -0.79 0.00 0.61 1.18 0.00 0.00 175.17 176.17 1r8s n GLY 165 N 2.55 3.23 0.15 0.21 0.00 -1.26 -1.50 105.19 108.57 1r8s n GLY 165 Ca 0.09 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.97 1r8s n GLY 165 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1r8s h LEU 166 N 0.00 -0.25 -1.02 0.99 3.38 -1.78 -1.33 115.31 115.30 1r8s h LEU 166 Ca 0.00 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.73 1r8s h LEU 166 Cb 0.00 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1r8s h LEU 166 CO 0.00 0.02 -0.41 1.88 0.09 0.00 0.00 178.44 180.02 1r8s h TYR 167 N -0.53 0.00 -0.65 1.13 0.05 -1.92 -1.99 116.97 113.07 1r8s h TYR 167 Ca -0.03 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.72 1r8s h TYR 167 Cb 0.39 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.10 1r8s h TYR 167 CO 0.00 0.41 0.28 0.93 -1.05 0.00 0.00 178.16 178.73 1r8s h GLU 168 N 0.00 0.96 -0.34 4.88 3.07 -1.90 0.11 114.58 121.36 1r8s h GLU 168 Ca -0.00 -0.16 -0.10 0.00 -0.50 0.00 0.00 59.36 58.59 1r8s h GLU 168 Cb 0.86 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.60 1r8s h GLU 168 CO 0.05 0.79 -0.18 0.78 -1.40 0.00 0.00 179.01 179.05 1r8s h GLY 169 N 0.91 0.79 1.89 -3.84 0.00 -0.94 -2.43 103.07 99.44 1r8s h GLY 169 Ca 0.22 -0.72 -0.06 0.00 0.00 0.00 0.00 47.33 46.77 1r8s h GLY 169 CO -0.02 0.65 -0.22 1.41 0.00 0.00 0.00 176.54 178.36 1r8s h LEU 170 N 0.50 0.13 -0.66 3.11 3.38 -1.20 -1.82 115.31 118.75 1r8s h LEU 170 Ca 0.07 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1r8s h LEU 170 Cb 0.73 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 1r8s h LEU 170 CO 0.05 0.36 0.30 -0.78 0.09 0.00 0.00 178.44 178.47 1r8s h ASP 171 N 0.12 0.87 -0.33 -0.43 3.58 -0.54 0.46 116.42 120.15 1r8s h ASP 171 Ca 0.02 -0.14 -0.01 0.00 0.42 0.00 0.00 57.03 57.32 1r8s h ASP 171 Cb 0.47 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.28 1r8s h ASP 171 CO 0.03 0.77 0.16 -0.25 -2.88 0.00 0.00 179.24 177.08 1r8s h TRP 172 N 0.91 0.47 -0.86 0.28 7.01 -0.92 0.14 115.95 122.98 1r8s h TRP 172 Ca 0.22 -0.02 0.02 0.00 2.11 0.00 0.00 58.89 61.22 1r8s h TRP 172 Cb 0.14 -0.15 -0.05 0.00 -2.10 0.00 0.00 29.16 27.01 1r8s h TRP 172 CO 0.01 0.40 0.57 1.25 -2.79 0.00 0.00 178.44 177.87 1r8s h LEU 173 N 0.40 0.96 -0.37 0.65 5.85 -1.04 0.12 115.31 121.88 1r8s h LEU 173 Ca 0.11 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1r8s h LEU 173 Cb 0.10 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 1r8s h LEU 173 CO -0.02 0.68 0.14 0.28 -0.34 0.00 0.00 178.44 179.19 1r8s h SER 174 N 1.12 0.51 0.21 1.25 0.02 -0.53 -1.37 113.55 114.77 1r8s h SER 174 Ca 0.32 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 1r8s h SER 174 Cb -0.07 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.34 1r8s h SER 174 CO -0.08 0.54 0.00 0.59 -1.14 0.00 0.00 176.83 176.74 1r8s n ASN 175 N -4.67 0.00 -0.01 3.07 3.02 0.45 -1.27 115.26 115.85 1r8s n ASN 175 Ca -0.01 0.08 0.10 0.00 -0.03 0.00 0.00 54.58 54.72 1r8s n ASN 175 Cb 0.15 -0.27 -0.15 0.00 -0.61 0.00 0.00 39.78 38.90 1r8s n ASN 175 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1r8s n GLN 176 N -1.27 0.59 0.00 3.52 1.13 0.20 -5.05 117.38 116.51 1r8s n GLN 176 Ca 0.06 -0.17 0.00 0.00 -1.94 0.00 0.00 57.00 54.95 1r8s n GLN 176 Cb 0.09 -1.46 0.00 0.00 0.11 0.00 0.00 30.24 28.98 1r8s n GLN 176 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90