#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sbr s ILE 10 N 0.00 1.31 0.37 0.55 1.01 -1.26 -4.97 121.20 118.20 1sbr s ILE 10 Ca 0.00 -0.55 -0.22 0.00 0.00 0.00 0.00 60.65 59.88 1sbr s ILE 10 Cb 0.00 -1.20 -0.10 0.00 0.01 0.00 0.00 42.46 41.17 1sbr s ILE 10 CO 0.00 0.40 0.92 0.00 0.00 0.00 0.00 174.94 176.25 1sbr s ALA 11 N 0.84 3.15 0.03 9.38 0.00 -0.36 -4.33 121.76 130.48 1sbr s ALA 11 Ca -0.10 0.40 0.01 0.00 0.00 0.00 0.00 51.96 52.27 1sbr s ALA 11 Cb -0.15 -3.11 -0.02 0.00 0.00 0.00 0.00 23.12 19.83 1sbr s ALA 11 CO 0.01 0.18 -0.06 0.20 0.00 0.00 0.00 175.76 176.09 1sbr s GLY 12 N -1.95 0.39 -0.10 0.00 0.00 0.68 -1.75 107.32 104.59 1sbr s GLY 12 Ca 0.56 -0.69 -0.03 0.00 0.00 0.00 0.00 44.72 44.56 1sbr s GLY 12 CO 0.18 -0.75 0.06 -0.12 0.00 0.00 0.00 173.10 172.47 1sbr s PHE 13 N -1.43 0.32 -0.24 1.90 5.36 0.85 -0.71 117.98 124.02 1sbr s PHE 13 Ca -0.13 -0.12 -0.07 0.00 -0.96 0.00 0.00 56.93 55.65 1sbr s PHE 13 Cb -0.10 -0.67 -0.03 0.00 -0.34 0.00 0.00 43.02 41.89 1sbr s PHE 13 CO -0.00 -0.36 0.06 0.50 -1.46 0.00 0.00 175.22 173.96 1sbr s ARG 14 N 2.09 3.66 0.15 10.12 3.52 -0.60 -0.07 118.95 137.81 1sbr s ARG 14 Ca 0.03 -0.48 -0.09 0.00 -0.13 0.00 0.00 55.73 55.06 1sbr s ARG 14 Cb -0.14 -3.30 -0.01 0.00 -1.56 0.00 0.00 34.95 29.95 1sbr s ARG 14 CO -0.06 -0.16 0.27 -0.59 -0.81 0.00 0.00 175.30 173.95 1sbr s PHE 15 N 1.53 0.33 0.14 5.12 -0.12 0.81 -0.55 117.98 125.23 1sbr s PHE 15 Ca 0.06 -0.71 0.09 0.00 -0.05 0.00 0.00 56.93 56.32 1sbr s PHE 15 Cb -0.15 -0.05 -0.04 0.00 -0.63 0.00 0.00 43.02 42.15 1sbr s PHE 15 CO 0.03 -0.68 -0.20 -1.12 -0.05 0.00 0.00 175.22 173.20 1sbr s SER 16 N -2.94 2.68 -0.15 1.98 0.01 0.78 -0.56 113.70 115.50 1sbr s SER 16 Ca 0.14 -0.78 -0.04 0.00 1.31 0.00 0.00 55.95 56.58 1sbr s SER 16 Cb 0.04 -0.16 -0.03 0.00 0.21 0.00 0.00 66.02 66.08 1sbr s SER 16 CO -0.03 0.02 0.00 -0.76 0.41 0.00 0.00 173.24 172.89 1sbr s LEU 17 N -2.31 3.50 -0.43 2.44 1.43 -1.26 -1.69 118.68 120.36 1sbr s LEU 17 Ca 0.12 -0.01 0.04 0.00 -1.03 0.00 0.00 54.13 53.25 1sbr s LEU 17 Cb -0.08 -1.85 0.12 0.00 0.03 0.00 0.00 46.19 44.41 1sbr s LEU 17 CO 0.06 0.21 0.16 -0.31 0.23 0.00 0.00 176.35 176.70 1sbr s TYR 18 N 0.10 3.30 0.00 0.29 1.51 0.95 -4.96 117.35 118.54 1sbr s TYR 18 Ca 0.02 -2.99 0.00 0.00 -1.01 0.00 0.00 57.07 53.08 1sbr s TYR 18 Cb -0.13 -2.76 0.00 0.00 -0.11 0.00 0.00 41.96 38.96 1sbr s TYR 18 CO 0.02 -0.84 0.00 -2.30 -1.11 0.00 0.00 175.55 171.32 1sbr n PRO 19 N 3.71 2.84 0.00 -1.71 -0.02 -1.26 -1.00 135.00 137.55 1sbr n PRO 19 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1sbr n PRO 19 Cb 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.85 1sbr n PRO 19 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 1sbr n THR 21 N 0.00 0.00 0.18 3.45 5.66 -1.26 -4.76 114.28 117.54 1sbr n THR 21 Ca 0.00 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 61.05 1sbr n THR 21 Cb 0.00 0.00 0.29 0.00 -1.55 0.00 0.00 70.33 69.07 1sbr n THR 21 CO 0.00 0.00 0.00 0.44 -3.05 0.00 0.00 175.07 172.46 1sbr h ASP 22 N 0.00 0.00 -0.29 1.09 5.19 -2.05 -3.30 116.42 117.06 1sbr h ASP 22 Ca 0.00 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.22 1sbr h ASP 22 Cb 0.00 0.00 -0.09 0.00 0.18 0.00 0.00 39.33 39.42 1sbr h ASP 22 CO 0.00 0.41 0.24 -0.67 -3.12 0.00 0.00 179.24 176.11 1sbr n ASP 23 N -3.51 5.45 0.13 6.45 2.03 -1.26 -4.68 116.55 121.17 1sbr n ASP 23 Ca -0.00 -2.74 -0.24 0.00 0.52 0.00 0.00 54.79 52.33 1sbr n ASP 23 Cb 0.55 -0.98 -0.15 0.00 -0.72 0.00 0.00 41.12 39.81 1sbr n ASP 23 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 1sbr h PHE 24 N 1.08 0.99 -0.17 -0.67 -5.15 -1.86 -2.33 116.94 108.83 1sbr h PHE 24 Ca 0.18 -0.69 0.04 0.00 -0.20 0.00 0.00 57.97 57.30 1sbr h PHE 24 Cb 1.07 -0.05 -0.04 0.00 0.22 0.00 0.00 35.95 37.15 1sbr h PHE 24 CO 0.56 1.53 -0.08 0.82 -2.00 0.00 0.00 178.31 179.13 1sbr h ILE 25 N 0.20 0.73 -0.43 0.88 2.04 -1.92 0.15 117.51 119.16 1sbr h ILE 25 Ca -0.23 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.60 1sbr h ILE 25 Cb 2.08 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.87 1sbr h ILE 25 CO 0.26 0.00 0.14 -1.28 0.00 0.00 0.00 178.15 177.27 1sbr h SER 26 N -0.07 0.57 -0.17 1.72 0.87 -1.94 0.70 113.55 115.23 1sbr h SER 26 Ca 0.09 -0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 60.56 1sbr h SER 26 Cb 0.21 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 1sbr h SER 26 CO -0.21 0.54 0.00 0.58 -0.53 0.00 0.00 176.83 177.21 1sbr h VAL 27 N 0.61 1.25 -0.16 2.23 2.07 -0.68 -2.36 116.25 119.21 1sbr h VAL 27 Ca 0.15 -0.83 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 1sbr h VAL 27 Cb 0.18 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.41 1sbr h VAL 27 CO -0.01 0.25 0.10 0.40 0.02 0.00 0.00 177.57 178.33 1sbr h ILE 28 N 0.05 1.07 -0.14 4.57 2.04 -0.08 -2.69 117.51 122.34 1sbr h ILE 28 Ca 0.05 -0.16 0.04 0.00 1.00 0.00 0.00 64.86 65.79 1sbr h ILE 28 Cb 0.37 0.89 -0.05 0.00 -0.74 0.00 0.00 36.82 37.29 1sbr h ILE 28 CO 0.01 0.06 -0.16 0.11 0.00 0.00 0.00 178.15 178.17 1sbr h LYS 29 N 0.19 -0.19 -0.40 2.37 1.57 -0.90 -2.90 116.57 116.31 1sbr h LYS 29 Ca 0.06 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.87 1sbr h LYS 29 Cb 0.02 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 1sbr h LYS 29 CO -0.01 -0.13 0.23 1.03 -0.57 0.00 0.00 179.45 180.00 1sbr h SER 30 N -0.20 0.37 -0.16 0.86 0.87 -1.35 -1.54 113.55 112.41 1sbr h SER 30 Ca 0.10 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.63 1sbr h SER 30 Cb 0.35 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.22 1sbr h SER 30 CO -0.26 0.27 0.03 0.00 -0.53 0.00 0.00 176.83 176.34 1sbr h ALA 31 N 1.18 1.59 0.15 6.23 0.00 -1.28 0.12 119.26 127.24 1sbr h ALA 31 Ca 0.16 -0.13 -0.30 0.00 0.00 0.00 0.00 54.91 54.64 1sbr h ALA 31 Cb 0.01 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.69 1sbr h ALA 31 CO -0.08 0.31 -1.41 -0.07 0.00 0.00 0.00 179.25 178.01 1sbr h LEU 32 N 0.35 0.49 -0.14 0.00 3.38 -1.27 -3.24 115.31 114.89 1sbr h LEU 32 Ca 0.08 -0.58 -0.22 0.00 0.09 0.00 0.00 57.88 57.25 1sbr h LEU 32 Cb 0.20 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1sbr h LEU 32 CO 0.00 1.47 -0.99 0.00 0.09 0.00 0.00 178.44 179.01 1sbr h ALA 33 N 0.46 0.37 0.00 1.53 0.00 -1.12 -3.23 119.26 117.27 1sbr h ALA 33 Ca -0.20 -0.78 -0.04 0.00 0.00 0.00 0.00 54.91 53.89 1sbr h ALA 33 Cb 2.03 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.76 1sbr h ALA 33 CO 0.20 0.94 -0.19 0.00 0.00 0.00 0.00 179.25 180.20 1sbr h ALA 34 N 0.84 1.61 -2.12 0.00 0.00 -0.87 -3.45 119.26 115.28 1sbr h ALA 34 Ca -0.07 -0.18 -0.45 0.00 0.00 0.00 0.00 54.91 54.21 1sbr h ALA 34 Cb 1.65 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.41 1sbr h ALA 34 CO 0.16 0.24 0.35 0.99 0.00 0.00 0.00 179.25 180.99 1sbr s THR 35 N -4.54 4.37 -0.65 0.00 2.01 -1.22 -4.99 115.64 110.61 1sbr s THR 35 Ca -0.04 1.39 -0.24 0.00 0.31 0.00 0.00 61.69 63.11 1sbr s THR 35 Cb 0.15 -3.61 0.05 0.00 0.01 0.00 0.00 72.50 69.10 1sbr s THR 35 CO 0.69 -0.40 1.05 -0.62 -0.69 0.00 0.00 174.62 174.64 1sbr s ASP 36 N -2.39 6.22 -0.34 3.53 -1.08 -1.26 -4.88 116.67 116.47 1sbr s ASP 36 Ca 0.62 -0.67 0.09 0.00 -0.52 0.00 0.00 52.55 52.07 1sbr s ASP 36 Cb -0.10 -2.46 0.72 0.00 -1.46 0.00 0.00 42.92 39.62 1sbr s ASP 36 CO 0.18 -1.50 1.80 0.35 0.52 0.00 0.00 175.17 176.52 1sbr n THR 37 N 6.13 2.94 0.97 1.71 -2.24 -1.26 -4.61 114.28 117.92 1sbr n THR 37 Ca -0.00 -1.74 0.13 0.00 -2.27 0.00 0.00 64.05 60.16 1sbr n THR 37 Cb 0.47 -0.37 0.43 0.00 -2.10 0.00 0.00 70.33 68.76 1sbr n THR 37 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1sbr n SER 38 N -0.34 0.27 -1.07 3.42 3.41 -1.26 -3.45 113.62 114.60 1sbr n SER 38 Ca 0.43 0.15 0.09 0.00 -0.26 0.00 0.00 58.87 59.28 1sbr n SER 38 Cb 1.40 -0.15 0.26 0.00 -0.26 0.00 0.00 64.21 65.45 1sbr n SER 38 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1sbr n LYS 39 N -1.55 2.87 -4.13 4.33 4.76 -1.26 -4.93 118.16 118.25 1sbr n LYS 39 Ca 0.06 -2.44 -0.15 0.00 -2.87 0.00 0.00 58.31 52.91 1sbr n LYS 39 Cb 0.34 -1.48 -0.13 0.00 -1.84 0.00 0.00 35.03 31.92 1sbr n LYS 39 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 1sbr s VAL 40 N -1.11 0.46 0.24 -0.18 -7.23 -1.22 -4.59 120.40 106.76 1sbr s VAL 40 Ca 0.38 -0.50 -0.30 0.00 -1.81 0.00 0.00 61.98 59.76 1sbr s VAL 40 Cb 0.21 -0.44 -0.09 0.00 0.56 0.00 0.00 36.38 36.62 1sbr s VAL 40 CO 0.25 -0.04 1.11 0.86 -0.31 0.00 0.00 175.10 176.97 1sbr s TRP 41 N -0.52 3.56 0.06 2.82 -0.00 -0.20 -4.76 118.94 119.89 1sbr s TRP 41 Ca -0.02 1.63 0.01 0.00 -0.00 0.00 0.00 56.10 57.73 1sbr s TRP 41 Cb -0.05 -3.30 -0.03 0.00 -0.00 0.00 0.00 33.47 30.09 1sbr s TRP 41 CO -0.00 -0.66 -0.06 0.95 -0.00 0.00 0.00 176.95 177.18 1sbr s THR 42 N -0.76 0.48 -0.20 5.86 -4.23 -1.26 -1.17 115.64 114.36 1sbr s THR 42 Ca 0.47 -1.50 -0.08 0.00 -1.18 0.00 0.00 61.69 59.41 1sbr s THR 42 Cb -0.31 -1.11 0.08 0.00 1.34 0.00 0.00 72.50 72.50 1sbr s THR 42 CO 0.39 -0.69 0.43 -0.75 -0.54 0.00 0.00 174.62 173.46 1sbr s LYS 43 N -2.79 0.36 -0.10 3.99 2.20 -1.02 -5.00 119.74 117.38 1sbr s LYS 43 Ca 0.00 0.99 0.00 0.00 -0.36 0.00 0.00 55.97 56.60 1sbr s LYS 43 Cb -0.01 0.25 -0.02 0.00 -1.51 0.00 0.00 37.83 36.53 1sbr s LYS 43 CO -0.04 -0.22 -0.09 0.99 -0.36 0.00 0.00 175.35 175.63 1sbr s THR 44 N 2.27 3.46 0.22 3.43 2.01 -1.26 -1.29 115.64 124.49 1sbr s THR 44 Ca -0.04 -0.55 0.02 0.00 0.31 0.00 0.00 61.69 61.43 1sbr s THR 44 Cb -0.11 -2.43 -0.01 0.00 0.01 0.00 0.00 72.50 69.96 1sbr s THR 44 CO -0.13 0.56 0.07 -0.90 -0.69 0.00 0.00 174.62 173.53 1sbr n ASP 45 N 2.79 1.23 0.00 3.53 5.68 -0.14 -5.00 116.55 124.64 1sbr n ASP 45 Ca -0.18 -2.17 0.04 0.00 -0.50 0.00 0.00 54.79 51.99 1sbr n ASP 45 Cb 0.53 0.52 0.21 0.00 -1.14 0.00 0.00 41.12 41.24 1sbr n ASP 45 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1sbr n HIS 46 N -0.51 0.00 -0.00 2.11 1.44 -1.26 -3.60 115.22 113.40 1sbr n HIS 46 Ca -0.04 0.00 -0.00 0.00 -2.01 0.00 0.00 57.72 55.67 1sbr n HIS 46 Cb 0.33 -0.33 -0.00 0.00 0.12 0.00 0.00 29.99 30.11 1sbr n HIS 46 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 1sbr n ILE 47 N -1.33 0.00 -4.01 0.61 5.41 -1.26 -5.13 119.36 113.66 1sbr n ILE 47 Ca 0.04 -0.00 -0.09 0.00 1.00 0.00 0.00 62.75 63.69 1sbr n ILE 47 Cb 0.08 -1.15 -0.06 0.00 -0.71 0.00 0.00 39.64 37.79 1sbr n ILE 47 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1sbr s SER 48 N -4.66 -0.06 0.01 4.38 1.04 -1.24 -4.73 113.70 108.45 1sbr s SER 48 Ca -0.00 -0.96 0.07 0.00 0.48 0.00 0.00 55.95 55.54 1sbr s SER 48 Cb 0.00 0.56 -0.03 0.00 0.10 0.00 0.00 66.02 66.65 1sbr s SER 48 CO 0.00 -1.09 -0.20 -0.89 0.98 0.00 0.00 173.24 172.03 1sbr s THR 49 N -4.03 2.58 -0.10 2.02 2.01 0.28 -0.97 115.64 117.44 1sbr s THR 49 Ca 0.24 -1.13 0.01 0.00 0.31 0.00 0.00 61.69 61.12 1sbr s THR 49 Cb 0.00 -2.03 -0.02 0.00 0.01 0.00 0.00 72.50 70.47 1sbr s THR 49 CO 0.09 0.43 -0.14 0.54 -0.69 0.00 0.00 174.62 174.85 1sbr s VAL 50 N -0.81 3.05 -0.07 3.82 0.11 -0.41 -0.14 120.40 125.95 1sbr s VAL 50 Ca 0.13 -0.69 0.03 0.00 -2.93 0.00 0.00 61.98 58.51 1sbr s VAL 50 Cb -0.10 -2.24 -0.02 0.00 -1.53 0.00 0.00 36.38 32.48 1sbr s VAL 50 CO 0.03 0.55 -0.14 -0.76 -3.33 0.00 0.00 175.10 171.45 1sbr s LEU 51 N -0.10 2.74 -0.04 2.54 1.43 0.90 -2.42 118.68 123.73 1sbr s LEU 51 Ca -0.02 -0.22 -0.00 0.00 -1.03 0.00 0.00 54.13 52.86 1sbr s LEU 51 Cb -0.14 -1.57 0.03 0.00 0.03 0.00 0.00 46.19 44.54 1sbr s LEU 51 CO 0.04 0.30 0.00 -0.13 0.23 0.00 0.00 176.35 176.79 1sbr s ARG 52 N -0.45 0.40 0.00 1.70 0.52 -0.31 -0.11 118.95 120.69 1sbr s ARG 52 Ca 0.06 0.09 0.00 0.00 -0.52 0.00 0.00 55.73 55.35 1sbr s ARG 52 Cb -0.12 -0.63 0.00 0.00 0.52 0.00 0.00 34.95 34.72 1sbr s ARG 52 CO 0.02 -0.18 0.00 0.41 0.02 0.00 0.00 175.30 175.57 1sbr n GLY 53 N 4.43 -0.76 3.81 -3.53 0.00 -0.72 -1.04 105.19 107.38 1sbr n GLY 53 Ca -0.20 -0.34 -0.30 0.00 0.00 0.00 0.00 46.02 45.18 1sbr n GLY 53 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1sbr s SER 54 N -4.00 4.40 0.15 1.61 1.04 -1.26 -1.22 113.70 114.43 1sbr s SER 54 Ca 0.00 1.24 -0.13 0.00 0.48 0.00 0.00 55.95 57.54 1sbr s SER 54 Cb 0.00 -1.95 0.04 0.00 0.10 0.00 0.00 66.02 64.21 1sbr s SER 54 CO 0.00 -2.02 1.68 0.40 0.98 0.00 0.00 173.24 174.28 1sbr h ILE 55 N -1.12 1.23 -0.74 -1.02 2.04 -1.94 0.17 117.51 116.13 1sbr h ILE 55 Ca -0.47 -0.80 -0.03 0.00 1.00 0.00 0.00 64.86 64.56 1sbr h ILE 55 Cb 1.28 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 38.09 1sbr h ILE 55 CO 0.60 0.29 0.35 0.44 0.00 0.00 0.00 178.15 179.84 1sbr h ASP 56 N 0.71 0.97 -0.09 1.72 3.45 -1.99 -2.08 116.42 119.11 1sbr h ASP 56 Ca 0.17 -0.13 -0.21 0.00 0.43 0.00 0.00 57.03 57.28 1sbr h ASP 56 Cb 0.29 -0.25 0.01 0.00 -0.56 0.00 0.00 39.33 38.82 1sbr h ASP 56 CO -0.00 0.83 -0.72 0.45 -1.57 0.00 0.00 179.24 178.23 1sbr h HIS 57 N 1.04 0.97 -0.21 4.55 3.86 -1.80 -0.93 115.15 122.62 1sbr h HIS 57 Ca 0.25 -0.41 -0.05 0.00 -1.16 0.00 0.00 60.37 59.01 1sbr h HIS 57 Cb 0.12 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.43 1sbr h HIS 57 CO 0.01 1.22 -0.05 0.28 0.86 0.00 0.00 177.93 180.25 1sbr h VAL 58 N 0.51 1.28 -0.23 2.45 2.07 -0.56 -1.72 116.25 120.06 1sbr h VAL 58 Ca -0.03 -1.03 -0.18 0.00 0.82 0.00 0.00 66.70 66.28 1sbr h VAL 58 Cb 1.33 1.52 -0.00 0.00 -1.52 0.00 0.00 31.29 32.62 1sbr h VAL 58 CO 0.15 0.31 -0.58 -0.26 0.02 0.00 0.00 177.57 177.21 1sbr h PHE 59 N 0.14 0.93 0.19 1.57 -1.00 -1.43 0.79 116.94 118.13 1sbr h PHE 59 Ca 0.05 -0.34 0.00 0.00 2.81 0.00 0.00 57.97 60.50 1sbr h PHE 59 Cb 0.50 -0.17 -0.02 0.00 3.61 0.00 0.00 35.95 39.87 1sbr h PHE 59 CO 0.05 1.14 -0.19 0.22 -1.61 0.00 0.00 178.31 177.92 1sbr h ASP 60 N 0.55 -0.49 -0.40 2.17 3.58 -1.20 0.51 116.42 121.13 1sbr h ASP 60 Ca 0.00 0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.49 1sbr h ASP 60 Cb 1.17 0.17 -0.02 0.00 1.72 0.00 0.00 39.33 42.37 1sbr h ASP 60 CO 0.12 -0.28 0.20 0.00 -2.88 0.00 0.00 179.24 176.40 1sbr h ALA 61 N 0.36 0.52 -0.41 -0.78 0.00 -1.27 -2.28 119.26 115.39 1sbr h ALA 61 Ca 0.00 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.86 1sbr h ALA 61 Cb 0.38 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 1sbr h ALA 61 CO -0.05 0.07 0.13 0.00 0.00 0.00 0.00 179.25 179.41 1sbr h ALA 62 N 1.05 0.48 -0.92 0.00 0.00 -0.73 0.12 119.26 119.25 1sbr h ALA 62 Ca 0.14 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1sbr h ALA 62 Cb 0.11 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1sbr h ALA 62 CO -0.02 -0.26 0.55 -0.22 0.00 0.00 0.00 179.25 179.30 1sbr h LYS 63 N 0.29 1.25 -0.32 0.00 3.64 -0.77 -1.19 116.57 119.47 1sbr h LYS 63 Ca 0.19 -0.12 -0.15 0.00 -1.27 0.00 0.00 60.65 59.31 1sbr h LYS 63 Cb 0.19 -0.26 -0.00 0.00 -0.41 0.00 0.00 32.23 31.74 1sbr h LYS 63 CO -0.21 0.88 -0.38 0.00 -2.27 0.00 0.00 179.45 177.47 1sbr h ALA 64 N 1.30 0.48 -0.58 5.00 0.00 -0.91 0.04 119.26 124.59 1sbr h ALA 64 Ca 0.33 -0.45 0.07 0.00 0.00 0.00 0.00 54.91 54.87 1sbr h ALA 64 Cb -0.05 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.58 1sbr h ALA 64 CO -0.06 0.57 0.25 0.82 0.00 0.00 0.00 179.25 180.83 1sbr h ILE 65 N 0.60 0.85 0.44 0.00 2.04 -0.83 -0.66 117.51 119.96 1sbr h ILE 65 Ca 0.04 -0.16 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 1sbr h ILE 65 Cb 0.98 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 1sbr h ILE 65 CO 0.09 0.08 -0.21 0.22 0.00 0.00 0.00 178.15 178.33 1sbr h TYR 66 N 0.46 -0.55 -0.50 1.37 3.20 -0.61 -0.56 116.97 119.78 1sbr h TYR 66 Ca 0.28 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.23 1sbr h TYR 66 Cb 0.28 0.18 -0.09 0.00 1.54 0.00 0.00 36.73 38.64 1sbr h TYR 66 CO -0.14 -0.34 -0.10 -0.07 -1.64 0.00 0.00 178.16 175.87 1sbr h LEU 67 N -0.60 -0.41 -0.21 2.82 3.38 -0.85 0.16 115.31 119.61 1sbr h LEU 67 Ca -0.06 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1sbr h LEU 67 Cb 0.46 0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 1sbr h LEU 67 CO 0.10 -0.15 0.08 0.45 0.09 0.00 0.00 178.44 179.01 1sbr h HIS 68 N 0.02 0.33 -0.85 1.13 3.86 -0.77 -1.42 115.15 117.45 1sbr h HIS 68 Ca 0.25 -0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.44 1sbr h HIS 68 Cb 0.38 -0.10 -0.04 0.00 1.06 0.00 0.00 27.41 28.71 1sbr h HIS 68 CO -0.40 0.38 0.56 0.00 0.86 0.00 0.00 177.93 179.34 1sbr h ALA 69 N 0.91 1.08 -0.89 2.45 0.00 -0.66 -2.24 119.26 119.91 1sbr h ALA 69 Ca 0.07 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1sbr h ALA 69 Cb 0.20 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.60 1sbr h ALA 69 CO -0.00 0.48 0.49 0.00 0.00 0.00 0.00 179.25 180.22 1sbr h ALA 70 N 1.32 1.19 0.00 0.00 0.00 -0.57 -2.68 119.26 118.51 1sbr h ALA 70 Ca 0.31 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1sbr h ALA 70 Cb -0.13 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.31 1sbr h ALA 70 CO -0.07 0.65 0.00 0.09 0.00 0.00 0.00 179.25 179.92 1sbr n ASN 71 N -4.33 0.00 0.01 0.00 3.02 -0.57 -1.43 115.26 111.95 1sbr n ASN 71 Ca 0.09 -0.95 0.01 0.00 -0.03 0.00 0.00 54.58 53.71 1sbr n ASN 71 Cb 0.09 0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.32 1sbr n ASN 71 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1sbr n SER 72 N -0.96 0.03 -0.70 6.41 3.41 -1.01 -4.86 113.62 115.94 1sbr n SER 72 Ca 0.19 0.51 -0.09 0.00 -0.26 0.00 0.00 58.87 59.23 1sbr n SER 72 Cb 0.09 -0.52 -0.04 0.00 -0.26 0.00 0.00 64.21 63.48 1sbr n SER 72 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1sbr n GLU 73 N -1.54 -1.76 -4.01 4.33 1.02 -0.52 -5.00 120.64 113.16 1sbr n GLU 73 Ca 0.00 0.81 -0.27 0.00 -0.02 0.00 0.00 57.16 57.69 1sbr n GLU 73 Cb 0.02 -5.25 -0.04 0.00 -0.02 0.00 0.00 31.44 26.15 1sbr n GLU 73 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1sbr s GLN 74 N -2.75 3.18 -0.20 3.49 -1.52 -1.26 -5.03 119.66 115.58 1sbr s GLN 74 Ca 0.00 -0.71 -0.29 0.00 -1.95 0.00 0.00 55.36 52.41 1sbr s GLN 74 Cb 0.00 -2.82 -0.04 0.00 -0.22 0.00 0.00 33.01 29.93 1sbr s GLN 74 CO 0.00 0.51 1.89 -1.58 -0.25 0.00 0.00 175.29 175.86 1sbr s HIS 75 N -1.72 1.63 0.03 0.91 5.65 -1.25 -4.63 115.29 115.91 1sbr s HIS 75 Ca 0.33 0.38 0.05 0.00 0.25 0.00 0.00 55.06 56.07 1sbr s HIS 75 Cb -0.11 -4.04 -0.02 0.00 -1.18 0.00 0.00 32.58 27.23 1sbr s HIS 75 CO 0.26 -3.73 -0.14 0.96 -0.65 0.00 0.00 174.74 171.43 1sbr s ILE 76 N 6.30 1.13 0.00 0.89 -5.25 -0.97 -4.48 121.20 118.81 1sbr s ILE 76 Ca 0.84 -0.93 0.00 0.00 -0.99 0.00 0.00 60.65 59.57 1sbr s ILE 76 Cb -0.30 -1.01 0.00 0.00 2.95 0.00 0.00 42.46 44.10 1sbr s ILE 76 CO 0.34 0.07 0.00 0.52 -1.79 0.00 0.00 174.94 174.08 1sbr n VAL 77 N 2.05 0.00 0.00 8.37 0.31 -0.17 -1.48 118.33 127.41 1sbr n VAL 77 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 1sbr n VAL 77 Cb 0.55 -0.09 0.00 0.00 -0.91 0.00 0.00 33.84 33.39 1sbr n VAL 77 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1sbr n ASN 79 N 0.00 0.00 -3.21 4.52 4.05 -0.68 -0.03 115.26 119.90 1sbr n ASN 79 Ca 0.00 0.00 -0.02 0.00 0.45 0.00 0.00 54.58 55.01 1sbr n ASN 79 Cb 0.00 0.00 0.02 0.00 1.23 0.00 0.00 39.78 41.03 1sbr n ASN 79 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1sbr n GLY 80 N 0.00 0.61 2.87 8.20 0.00 -0.56 -0.15 105.19 116.16 1sbr n GLY 80 Ca 0.00 -1.13 -0.27 0.00 0.00 0.00 0.00 46.02 44.62 1sbr n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sbr s THR 81 N -2.08 0.97 0.31 2.61 2.01 0.29 -0.31 115.64 119.43 1sbr s THR 81 Ca 0.22 -0.44 -0.25 0.00 0.31 0.00 0.00 61.69 61.54 1sbr s THR 81 Cb -0.03 -1.12 -0.10 0.00 0.01 0.00 0.00 72.50 71.27 1sbr s THR 81 CO 0.05 0.20 0.90 -0.36 -0.69 0.00 0.00 174.62 174.72 1sbr s PHE 82 N 1.71 3.68 -0.09 4.92 0.40 -1.26 -1.55 117.98 125.77 1sbr s PHE 82 Ca 0.02 1.71 -0.05 0.00 -0.60 0.00 0.00 56.93 58.01 1sbr s PHE 82 Cb -0.14 -2.87 0.04 0.00 0.51 0.00 0.00 43.02 40.56 1sbr s PHE 82 CO -0.08 0.23 0.22 0.45 0.70 0.00 0.00 175.22 176.74 1sbr s SER 83 N -1.63 -0.23 0.07 1.36 0.15 0.11 -4.39 113.70 109.13 1sbr s SER 83 Ca 0.49 0.47 0.01 0.00 0.70 0.00 0.00 55.95 57.62 1sbr s SER 83 Cb -0.18 0.38 -0.04 0.00 -1.71 0.00 0.00 66.02 64.47 1sbr s SER 83 CO 0.23 -0.15 -0.05 -0.51 1.20 0.00 0.00 173.24 173.96 1sbr s ILE 84 N 1.05 0.44 -0.15 6.45 2.07 -1.05 -0.23 121.20 129.78 1sbr s ILE 84 Ca -0.08 -1.68 0.00 0.00 -1.41 0.00 0.00 60.65 57.48 1sbr s ILE 84 Cb -0.09 -1.35 0.00 0.00 0.13 0.00 0.00 42.46 41.15 1sbr s ILE 84 CO -0.07 -0.82 0.00 0.61 -1.91 0.00 0.00 174.94 172.75 1sbr n GLY 85 N 0.36 0.52 3.68 1.50 0.00 -1.25 -2.37 105.19 107.62 1sbr n GLY 85 Ca -0.15 -0.50 -0.46 0.00 0.00 0.00 0.00 46.02 44.91 1sbr n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sbr h PRO 87 N 7.57 -0.17 -2.18 0.00 0.13 -1.94 -3.00 132.00 132.40 1sbr h PRO 87 Ca -0.46 0.01 -0.55 0.00 -0.87 0.00 0.00 66.00 64.13 1sbr h PRO 87 Cb 1.25 0.04 -0.15 0.00 0.13 0.00 0.00 31.00 32.26 1sbr h PRO 87 CO 0.92 -0.11 0.93 0.41 -0.23 0.00 0.00 178.00 179.92 1sbr n GLY 88 N -1.30 4.50 3.60 1.56 0.00 -1.26 -4.94 105.19 107.35 1sbr n GLY 88 Ca -0.03 -1.88 -0.40 0.00 0.00 0.00 0.00 46.02 43.71 1sbr n GLY 88 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sbr s ASP 89 N 0.49 6.40 0.69 1.61 -1.08 -1.14 -5.07 116.67 118.57 1sbr s ASP 89 Ca 0.58 0.35 -0.17 0.00 -0.52 0.00 0.00 52.55 52.79 1sbr s ASP 89 Cb 0.32 -2.28 0.00 0.00 -1.46 0.00 0.00 42.92 39.50 1sbr s ASP 89 CO -0.17 -0.37 1.11 0.35 0.52 0.00 0.00 175.17 176.60 1sbr n THR 90 N 5.28 3.63 0.12 1.71 -2.24 -1.26 -4.98 114.28 116.54 1sbr n THR 90 Ca -0.04 -0.42 0.10 0.00 -2.27 0.00 0.00 64.05 61.43 1sbr n THR 90 Cb 0.49 -1.25 0.03 0.00 -2.10 0.00 0.00 70.33 67.50 1sbr n THR 90 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1sbr h GLN 91 N 0.05 0.00 0.00 -0.78 1.08 -2.03 -3.47 115.11 109.96 1sbr h GLN 91 Ca -0.49 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.71 1sbr h GLN 91 Cb 1.34 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.77 1sbr h GLN 91 CO 0.49 0.04 0.00 0.41 -0.95 0.00 0.00 178.83 178.82 1sbr n GLY 92 N 1.18 -0.69 3.71 3.46 0.00 -1.26 -4.65 105.19 106.94 1sbr n GLY 92 Ca 0.00 -1.70 -0.23 0.00 0.00 0.00 0.00 46.02 44.09 1sbr n GLY 92 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sbr n ASP 93 N -1.87 -2.54 -3.73 1.61 8.00 -1.26 -5.01 116.55 111.75 1sbr n ASP 93 Ca 0.00 -0.76 -0.11 0.00 0.71 0.00 0.00 54.79 54.63 1sbr n ASP 93 Cb 0.00 -4.22 -0.06 0.00 -0.02 0.00 0.00 41.12 36.81 1sbr n ASP 93 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1sbr s THR 94 N -3.52 0.09 -0.14 -3.53 -4.23 -1.26 -4.67 115.64 98.37 1sbr s THR 94 Ca 0.21 -0.71 -0.23 0.00 -1.18 0.00 0.00 61.69 59.78 1sbr s THR 94 Cb -0.10 -1.08 -0.03 0.00 1.34 0.00 0.00 72.50 72.64 1sbr s THR 94 CO 0.80 -0.39 0.71 -0.47 -0.54 0.00 0.00 174.62 174.73 1sbr s TYR 95 N -3.13 3.46 -1.77 3.99 5.04 -1.23 -4.71 117.35 119.00 1sbr s TYR 95 Ca -0.01 1.13 0.00 0.00 -2.44 0.00 0.00 57.07 55.75 1sbr s TYR 95 Cb 0.01 -2.86 0.00 0.00 0.35 0.00 0.00 41.96 39.46 1sbr s TYR 95 CO -0.07 -0.09 0.20 1.28 -1.34 0.00 0.00 175.55 175.53 1sbr n LEU 96 N 4.63 0.00 -1.43 6.97 4.77 -1.26 -4.59 117.00 126.09 1sbr n LEU 96 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1sbr n LEU 96 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 1sbr n LEU 96 CO 0.46 0.00 -0.22 1.17 -1.33 0.00 0.00 177.39 177.47 1sbr n LYS 101 N -0.67 -2.41 -2.06 3.23 4.81 -1.26 -5.09 118.16 114.70 1sbr n LYS 101 Ca 0.00 2.01 -0.28 0.00 -0.87 0.00 0.00 58.31 59.17 1sbr n LYS 101 Cb 0.00 -2.18 -0.06 0.00 0.02 0.00 0.00 35.03 32.81 1sbr n LYS 101 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1sbr s ARG 102 N -1.63 2.53 0.55 1.64 0.52 -1.26 -4.82 118.95 116.49 1sbr s ARG 102 Ca 0.00 -0.74 0.37 0.00 -0.52 0.00 0.00 55.73 54.84 1sbr s ARG 102 Cb 0.00 -5.16 1.95 0.00 0.52 0.00 0.00 34.95 32.27 1sbr s ARG 102 CO 0.00 -3.68 2.13 -0.39 0.02 0.00 0.00 175.30 173.38 1sbr h VAL 103 N 6.71 0.00 0.00 3.52 -1.51 -1.95 -2.57 116.25 120.45 1sbr h VAL 103 Ca 0.16 -0.06 0.00 0.00 -1.23 0.00 0.00 66.70 65.57 1sbr h VAL 103 Cb 0.97 0.92 0.00 0.00 -2.13 0.00 0.00 31.29 31.05 1sbr h VAL 103 CO 1.22 0.00 -1.14 0.59 -1.23 0.00 0.00 177.57 177.01 1sbr n ASN 104 N -2.83 0.58 -0.26 4.19 3.02 -1.26 -4.57 115.26 114.12 1sbr n ASN 104 Ca -0.02 -0.18 0.05 0.00 -0.03 0.00 0.00 54.58 54.40 1sbr n ASN 104 Cb 0.09 0.92 0.19 0.00 -0.61 0.00 0.00 39.78 40.37 1sbr n ASN 104 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1sbr h GLU 105 N 0.00 0.46 0.31 3.52 4.39 -1.82 -2.37 114.58 119.07 1sbr h GLU 105 Ca 0.00 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 1sbr h GLU 105 Cb 0.77 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.32 1sbr h GLU 105 CO 0.00 0.31 -0.20 -0.44 -1.16 0.00 0.00 179.01 177.52 1sbr h ASP 106 N 0.48 -0.51 -1.14 1.42 3.45 -1.80 -2.27 116.42 116.04 1sbr h ASP 106 Ca 0.42 0.03 0.33 0.00 0.43 0.00 0.00 57.03 58.24 1sbr h ASP 106 Cb 0.62 0.15 -0.05 0.00 -0.56 0.00 0.00 39.33 39.49 1sbr h ASP 106 CO -0.39 -0.30 1.13 0.00 -1.57 0.00 0.00 179.24 178.11 1sbr h ALA 107 N -1.59 3.04 -0.10 3.45 0.00 -1.71 0.58 119.26 122.92 1sbr h ALA 107 Ca -0.04 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1sbr h ALA 107 Cb 0.39 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1sbr h ALA 107 CO 0.04 -1.72 0.00 1.33 0.00 0.00 0.00 179.25 178.89 1sbr n VAL 108 N -3.49 0.70 -0.29 0.00 0.24 -0.95 -4.55 118.33 109.98 1sbr n VAL 108 Ca 0.25 -0.85 0.09 0.00 -2.04 0.00 0.00 64.34 61.79 1sbr n VAL 108 Cb 1.49 0.68 0.25 0.00 -1.47 0.00 0.00 33.84 34.78 1sbr n VAL 108 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1sbr h ARG 109 N 0.87 0.47 0.00 7.34 2.43 -0.27 -0.46 114.38 124.76 1sbr h ARG 109 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1sbr h ARG 109 Cb 0.48 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 1sbr h ARG 109 CO 0.00 0.31 0.00 0.78 -1.51 0.00 0.00 179.97 179.55 1sbr h GLY 110 N 0.48 0.00 -3.97 2.80 0.00 -1.80 -3.46 103.07 97.13 1sbr h GLY 110 Ca 0.49 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 47.28 1sbr h GLY 110 CO -0.44 0.00 -0.00 1.08 0.00 0.00 0.00 176.54 177.17 1sbr s LEU 111 N -5.47 4.35 0.04 3.11 1.43 -0.18 -5.09 118.68 116.87 1sbr s LEU 111 Ca 0.05 1.23 0.01 0.00 -1.03 0.00 0.00 54.13 54.39 1sbr s LEU 111 Cb 0.09 -3.37 -0.03 0.00 0.03 0.00 0.00 46.19 42.91 1sbr s LEU 111 CO 0.56 0.08 -0.06 -0.54 0.23 0.00 0.00 176.35 176.62 1sbr s LYS 112 N -1.91 0.49 -0.11 1.70 1.02 -1.26 -5.02 119.74 114.64 1sbr s LYS 112 Ca 0.39 -0.78 -0.30 0.00 0.02 0.00 0.00 55.97 55.30 1sbr s LYS 112 Cb -0.16 -0.13 0.08 0.00 -0.52 0.00 0.00 37.83 37.10 1sbr s LYS 112 CO 0.20 0.00 0.75 0.00 -0.92 0.00 0.00 175.35 175.38 1sbr s ALA 113 N -1.73 -1.80 0.29 5.17 0.00 -1.26 -4.85 121.76 117.57 1sbr s ALA 113 Ca -0.09 1.50 -0.29 0.00 0.00 0.00 0.00 51.96 53.08 1sbr s ALA 113 Cb -0.08 -0.36 -0.09 0.00 0.00 0.00 0.00 23.12 22.59 1sbr s ALA 113 CO -0.01 -0.35 1.09 -1.83 0.00 0.00 0.00 175.76 174.66 1sbr s GLU 114 N -0.85 4.60 -0.40 0.00 -1.05 -1.26 -0.28 118.70 119.45 1sbr s GLU 114 Ca -0.07 1.76 0.11 0.00 -0.15 0.00 0.00 54.97 56.62 1sbr s GLU 114 Cb -0.01 -3.12 0.36 0.00 -0.44 0.00 0.00 34.13 30.92 1sbr s GLU 114 CO 0.07 0.19 0.81 0.00 0.95 0.00 0.00 175.26 177.27 1sbr n ALA 115 N 1.06 2.75 -1.66 -0.84 0.00 0.04 -4.44 120.51 117.42 1sbr n ALA 115 Ca -0.00 -3.63 -0.43 0.00 0.00 0.00 0.00 53.44 49.37 1sbr n ALA 115 Cb 0.45 -0.88 -0.01 0.00 0.00 0.00 0.00 19.45 19.01 1sbr n ALA 115 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1sbr n PRO 116 N 0.12 1.90 -3.72 0.00 -0.04 -1.25 -4.47 135.00 127.54 1sbr n PRO 116 Ca 0.25 0.67 -0.12 0.00 -0.04 0.00 0.00 63.50 64.26 1sbr n PRO 116 Cb 0.63 -2.21 -0.11 0.00 -0.04 0.00 0.00 33.50 31.77 1sbr n PRO 116 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1sbr s GLN 118 N 0.94 3.28 0.28 0.00 -0.21 -1.01 -0.37 119.66 122.57 1sbr s GLN 118 Ca -0.06 -0.68 0.07 0.00 0.02 0.00 0.00 55.36 54.71 1sbr s GLN 118 Cb -0.07 -2.88 -0.06 0.00 1.00 0.00 0.00 33.01 31.01 1sbr s GLN 118 CO -0.07 -0.18 -0.07 -0.59 -2.12 0.00 0.00 175.29 172.26 1sbr s PHE 119 N 1.37 1.95 -0.17 0.91 -0.00 0.66 -1.89 117.98 120.82 1sbr s PHE 119 Ca 0.05 -0.68 -0.10 0.00 -0.00 0.00 0.00 56.93 56.20 1sbr s PHE 119 Cb -0.14 -1.09 0.05 0.00 -0.00 0.00 0.00 43.02 41.84 1sbr s PHE 119 CO -0.05 0.30 0.41 0.00 -0.00 0.00 0.00 175.22 175.88 1sbr s ALA 120 N -2.99 -1.04 -0.20 1.99 0.00 -0.84 -0.53 121.76 118.16 1sbr s ALA 120 Ca 0.29 1.45 -0.07 0.00 0.00 0.00 0.00 51.96 53.64 1sbr s ALA 120 Cb 0.03 -0.87 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 1sbr s ALA 120 CO 0.12 -0.25 0.04 -1.17 0.00 0.00 0.00 175.76 174.50 1sbr s LEU 121 N 1.16 3.57 -0.45 0.00 2.96 -1.26 -0.70 118.68 123.96 1sbr s LEU 121 Ca -0.08 -0.06 0.03 0.00 -0.22 0.00 0.00 54.13 53.81 1sbr s LEU 121 Cb -0.07 -1.91 0.12 0.00 0.50 0.00 0.00 46.19 44.83 1sbr s LEU 121 CO -0.10 0.11 0.19 -0.31 -1.32 0.00 0.00 176.35 174.92 1sbr s TYR 122 N 0.76 3.44 0.00 5.38 1.51 0.34 -4.93 117.35 123.85 1sbr s TYR 122 Ca 0.02 -3.05 0.00 0.00 -1.01 0.00 0.00 57.07 53.03 1sbr s TYR 122 Cb -0.14 -2.91 0.00 0.00 -0.11 0.00 0.00 41.96 38.81 1sbr s TYR 122 CO 0.02 -0.84 0.00 -2.30 -1.11 0.00 0.00 175.55 171.32 1sbr n PRO 123 N 3.63 -0.65 -0.01 -1.71 -0.02 -1.26 -0.13 135.00 134.85 1sbr n PRO 123 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1sbr n PRO 123 Cb 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.85 1sbr n PRO 123 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1sbr n ASN 125 N -2.82 0.00 -3.71 2.55 5.15 -1.26 -4.93 115.26 110.24 1sbr n ASN 125 Ca 0.00 0.00 -0.27 0.00 -0.60 0.00 0.00 54.58 53.71 1sbr n ASN 125 Cb 0.00 0.00 -0.17 0.00 -0.53 0.00 0.00 39.78 39.08 1sbr n ASN 125 CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 1sbr s GLU 126 N -0.01 0.52 0.34 1.20 2.56 -1.26 -4.98 118.70 117.07 1sbr s GLU 126 Ca 0.00 -0.29 0.03 0.00 0.00 0.00 0.00 54.97 54.70 1sbr s GLU 126 Cb 0.00 -1.93 0.61 0.00 2.00 0.00 0.00 34.13 34.81 1sbr s GLU 126 CO 0.00 -0.61 1.96 -1.35 -0.56 0.00 0.00 175.26 174.70 1sbr h PRO 127 N 8.29 0.75 -0.56 4.30 0.11 -2.03 -2.26 132.00 140.60 1sbr h PRO 127 Ca -0.16 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1sbr h PRO 127 Cb 1.13 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1sbr h PRO 127 CO 0.32 0.56 0.00 -3.47 -0.21 0.00 0.00 178.00 175.20 1sbr n ASP 128 N -4.39 2.07 -1.59 -2.05 4.64 -1.26 -4.91 116.55 109.07 1sbr n ASP 128 Ca 0.05 -2.17 0.00 0.00 -1.38 0.00 0.00 54.79 51.29 1sbr n ASP 128 Cb 0.11 -0.37 0.00 0.00 -1.04 0.00 0.00 41.12 39.82 1sbr n ASP 128 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1sbr n TYR 129 N 0.26 0.00 0.00 -0.67 0.18 -0.85 -2.10 117.16 113.97 1sbr n TYR 129 Ca 0.09 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.87 1sbr n TYR 129 Cb 0.41 -0.09 0.00 0.00 -0.38 0.00 0.00 39.34 39.28 1sbr n TYR 129 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1sbr n GLY 131 N 1.06 0.00 0.33 -7.48 0.00 -1.26 -0.68 105.19 97.16 1sbr n GLY 131 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 1sbr n GLY 131 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1sbr h LEU 132 N 0.00 0.89 -2.23 0.99 3.38 -1.86 0.25 115.31 116.73 1sbr h LEU 132 Ca 0.00 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1sbr h LEU 132 Cb 0.00 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.52 1sbr h LEU 132 CO 0.00 0.77 0.00 -0.38 0.09 0.00 0.00 178.44 178.92 1sbr n ILE 133 N -4.32 0.66 0.00 1.22 5.41 0.14 -1.58 119.36 120.89 1sbr n ILE 133 Ca 0.06 -0.05 0.00 0.00 1.00 0.00 0.00 62.75 63.77 1sbr n ILE 133 Cb 0.15 -0.87 0.00 0.00 -0.71 0.00 0.00 39.64 38.21 1sbr n ILE 133 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 1sbr n GLU 135 N 0.88 0.00 -0.19 0.38 2.13 0.86 -2.49 120.64 122.21 1sbr n GLU 135 Ca 0.00 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.79 1sbr n GLU 135 Cb 0.29 0.00 0.07 0.00 0.27 0.00 0.00 31.44 32.07 1sbr n GLU 135 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1sbr h ALA 136 N 0.00 0.73 -0.70 4.31 0.00 -1.56 0.31 119.26 122.36 1sbr h ALA 136 Ca 0.00 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1sbr h ALA 136 Cb 0.00 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1sbr h ALA 136 CO 0.00 -0.06 0.44 0.28 0.00 0.00 0.00 179.25 179.91 1sbr h VAL 137 N 0.54 1.12 -0.69 0.00 2.07 -1.77 -2.37 116.25 115.14 1sbr h VAL 137 Ca 0.25 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1sbr h VAL 137 Cb 0.18 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.08 1sbr h VAL 137 CO -0.18 0.16 0.45 0.44 0.02 0.00 0.00 177.57 178.46 1sbr h ASP 138 N 0.88 0.81 -0.29 0.57 3.32 -1.31 -0.69 116.42 119.72 1sbr h ASP 138 Ca 0.27 -0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.34 1sbr h ASP 138 Cb -0.02 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.28 1sbr h ASP 138 CO -0.09 0.60 -0.01 0.40 -1.72 0.00 0.00 179.24 178.42 1sbr h ILE 139 N 0.94 0.78 -0.81 0.35 2.04 -0.97 0.83 117.51 120.69 1sbr h ILE 139 Ca 0.25 -0.03 0.06 0.00 1.00 0.00 0.00 64.86 66.15 1sbr h ILE 139 Cb -0.08 0.70 -0.05 0.00 -0.74 0.00 0.00 36.82 36.65 1sbr h ILE 139 CO -0.05 0.01 0.53 0.00 0.00 0.00 0.00 178.15 178.64 1sbr h ALA 140 N 1.25 1.60 0.17 1.87 0.00 -0.91 0.51 119.26 123.75 1sbr h ALA 140 Ca 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1sbr h ALA 140 Cb 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1sbr h ALA 140 CO -0.24 0.28 -0.08 0.87 0.00 0.00 0.00 179.25 180.08 1sbr h LYS 141 N 0.89 -0.22 -0.81 0.00 1.57 -0.19 0.79 116.57 118.60 1sbr h LYS 141 Ca 0.34 0.01 0.17 0.00 -1.87 0.00 0.00 60.65 59.31 1sbr h LYS 141 Cb 0.21 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.51 1sbr h LYS 141 CO -0.12 0.08 0.54 0.00 -0.57 0.00 0.00 179.45 179.38 1sbr h ALA 142 N 0.26 2.17 -0.11 3.86 0.00 0.16 -0.12 119.26 125.48 1sbr h ALA 142 Ca -0.02 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1sbr h ALA 142 Cb 0.39 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1sbr h ALA 142 CO 0.04 -0.40 0.00 1.04 0.00 0.00 0.00 179.25 179.93 1sbr n GLN 143 N -4.48 2.18 -1.16 0.00 6.02 0.08 -4.96 117.38 115.05 1sbr n GLN 143 Ca 0.16 -1.73 -0.06 0.00 -0.01 0.00 0.00 57.00 55.36 1sbr n GLN 143 Cb 0.60 -1.47 -0.02 0.00 1.02 0.00 0.00 30.24 30.37 1sbr n GLN 143 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1sbr n GLY 144 N 1.33 0.76 0.06 1.08 0.00 -0.06 -4.92 105.19 103.44 1sbr n GLY 144 Ca 0.16 -0.35 0.11 0.00 0.00 0.00 0.00 46.02 45.94 1sbr n GLY 144 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1sbr n THR 145 N -2.65 0.29 -2.05 2.61 -2.24 0.19 -4.92 114.28 105.51 1sbr n THR 145 Ca -0.06 -0.39 -0.42 0.00 -2.27 0.00 0.00 64.05 60.91 1sbr n THR 145 Cb 0.28 -0.02 -0.03 0.00 -2.10 0.00 0.00 70.33 68.46 1sbr n THR 145 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1sbr s PHE 146 N -3.31 3.14 -0.20 4.78 5.36 -0.92 -0.00 117.98 126.83 1sbr s PHE 146 Ca 0.00 0.78 -0.10 0.00 -0.96 0.00 0.00 56.93 56.66 1sbr s PHE 146 Cb 0.13 -3.81 -0.09 0.00 -0.34 0.00 0.00 43.02 38.92 1sbr s PHE 146 CO 0.81 -2.91 -0.26 0.28 -1.46 0.00 0.00 175.22 171.69 1sbr n VAL 147 N 3.98 1.09 -3.62 3.12 0.31 0.14 -4.87 118.33 118.48 1sbr n VAL 147 Ca 0.13 -0.27 -0.00 0.00 -0.01 0.00 0.00 64.34 64.18 1sbr n VAL 147 Cb 0.40 -1.77 -0.01 0.00 -0.91 0.00 0.00 33.84 31.55 1sbr n VAL 147 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1sbr s GLN 148 N -2.37 0.40 -0.07 5.55 -2.07 -1.17 -5.03 119.66 114.91 1sbr s GLN 148 Ca -0.28 -0.20 -0.03 0.00 -1.82 0.00 0.00 55.36 53.03 1sbr s GLN 148 Cb 0.11 0.15 -0.04 0.00 -1.09 0.00 0.00 33.01 32.14 1sbr s GLN 148 CO 0.35 -0.18 0.07 0.20 -1.32 0.00 0.00 175.29 174.41 1sbr s GLY 149 N -2.75 2.00 0.20 2.60 0.00 -1.26 -1.12 107.32 107.00 1sbr s GLY 149 Ca 0.13 -0.78 0.03 0.00 0.00 0.00 0.00 44.72 44.10 1sbr s GLY 149 CO -0.04 -0.57 -0.02 -1.34 0.00 0.00 0.00 173.10 171.13 1sbr s VAL 150 N -1.04 0.98 -0.22 1.40 -7.23 -0.29 -4.96 120.40 109.04 1sbr s VAL 150 Ca 0.17 -2.03 -0.37 0.00 -1.81 0.00 0.00 61.98 57.94 1sbr s VAL 150 Cb -0.12 -2.21 -0.14 0.00 0.56 0.00 0.00 36.38 34.48 1sbr s VAL 150 CO 0.07 -0.43 1.85 1.41 -0.31 0.00 0.00 175.10 177.69 1sbr n HIS 151 N -0.34 2.11 -0.87 2.82 8.25 -1.26 -2.19 115.22 123.74 1sbr n HIS 151 Ca -0.06 0.29 0.00 0.00 -0.26 0.00 0.00 57.72 57.69 1sbr n HIS 151 Cb 0.63 -2.55 0.00 0.00 1.12 0.00 0.00 29.99 29.19 1sbr n HIS 151 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1sbr n TYR 152 N 6.42 0.00 -3.80 4.41 0.53 -1.26 -4.97 117.16 118.50 1sbr n TYR 152 Ca 0.27 0.00 -0.08 0.00 -1.02 0.00 0.00 57.90 57.07 1sbr n TYR 152 Cb 0.20 -0.07 -0.02 0.00 -1.03 0.00 0.00 39.34 38.42 1sbr n TYR 152 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1sbr s ALA 153 N -3.76 -1.26 0.06 -0.72 0.00 -0.93 -4.73 121.76 110.42 1sbr s ALA 153 Ca 0.00 -0.20 0.08 0.00 0.00 0.00 0.00 51.96 51.84 1sbr s ALA 153 Cb 0.00 0.86 -0.03 0.00 0.00 0.00 0.00 23.12 23.94 1sbr s ALA 153 CO 0.00 -1.00 -0.19 -1.12 0.00 0.00 0.00 175.76 173.45 1sbr s SER 154 N -2.90 3.74 -0.26 0.00 0.01 0.31 -1.14 113.70 113.46 1sbr s SER 154 Ca 0.10 -0.49 -0.09 0.00 1.31 0.00 0.00 55.95 56.78 1sbr s SER 154 Cb -0.05 -0.55 -0.04 0.00 0.21 0.00 0.00 66.02 65.59 1sbr s SER 154 CO 0.04 0.24 0.12 -1.61 0.41 0.00 0.00 173.24 172.44 1sbr s GLU 155 N -1.61 3.79 0.30 12.44 2.02 -0.28 -0.24 118.70 135.13 1sbr s GLU 155 Ca 0.15 -0.40 0.06 0.00 0.02 0.00 0.00 54.97 54.80 1sbr s GLU 155 Cb -0.10 -3.48 -0.02 0.00 0.10 0.00 0.00 34.13 30.63 1sbr s GLU 155 CO 0.06 -0.18 0.43 -0.51 0.02 0.00 0.00 175.26 175.08 1sbr s LEU 156 N 1.67 4.11 -0.04 1.80 1.43 0.50 0.23 118.68 128.38 1sbr s LEU 156 Ca 0.07 -0.09 -0.24 0.00 -1.03 0.00 0.00 54.13 52.85 1sbr s LEU 156 Cb -0.15 -2.79 0.05 0.00 0.03 0.00 0.00 46.19 43.32 1sbr s LEU 156 CO 0.07 -0.29 0.51 -0.62 0.23 0.00 0.00 176.35 176.26 1sbr s ASP 157 N -4.10 -0.45 0.00 2.29 2.15 0.99 -1.85 116.67 115.71 1sbr s ASP 157 Ca 0.41 0.45 0.00 0.00 0.43 0.00 0.00 52.55 53.84 1sbr s ASP 157 Cb -0.09 0.46 0.00 0.00 -0.30 0.00 0.00 42.92 42.98 1sbr s ASP 157 CO 0.30 -0.53 0.00 0.61 -0.17 0.00 0.00 175.17 175.39 1sbr n GLY 158 N 1.13 -1.63 3.78 2.66 0.00 -1.26 -4.49 105.19 105.37 1sbr n GLY 158 Ca -0.20 -1.41 -0.32 0.00 0.00 0.00 0.00 46.02 44.08 1sbr n GLY 158 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sbr s ASP 159 N -1.73 5.04 0.34 1.61 2.15 -1.26 -0.78 116.67 122.03 1sbr s ASP 159 Ca 0.00 1.90 0.13 0.00 0.43 0.00 0.00 52.55 55.01 1sbr s ASP 159 Cb 0.00 -2.54 1.07 0.00 -0.30 0.00 0.00 42.92 41.15 1sbr s ASP 159 CO 0.00 -1.68 1.63 0.00 -0.17 0.00 0.00 175.17 174.96 1sbr h ALA 160 N -0.31 1.84 -0.41 3.66 0.00 -0.92 -1.70 119.26 121.42 1sbr h ALA 160 Ca -0.46 0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.72 1sbr h ALA 160 Cb 1.24 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 19.24 1sbr h ALA 160 CO 0.54 -0.65 0.19 1.25 0.00 0.00 0.00 179.25 180.58 1sbr h HIS 161 N 0.20 0.35 0.23 0.00 6.17 -1.93 -0.61 115.15 119.56 1sbr h HIS 161 Ca 0.72 0.02 -0.32 0.00 0.71 0.00 0.00 60.37 61.50 1sbr h HIS 161 Cb 1.69 -0.10 0.03 0.00 2.52 0.00 0.00 27.41 31.56 1sbr h HIS 161 CO -0.09 0.17 -1.46 -0.44 0.71 0.00 0.00 177.93 176.83 1sbr h ASP 162 N 0.38 0.78 0.18 3.26 3.32 -1.82 -1.45 116.42 121.07 1sbr h ASP 162 Ca 0.18 -0.93 -0.01 0.00 0.02 0.00 0.00 57.03 56.29 1sbr h ASP 162 Cb 0.11 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.41 1sbr h ASP 162 CO -0.14 1.69 -0.09 0.58 -1.72 0.00 0.00 179.24 179.57 1sbr h VAL 163 N 0.08 0.85 -0.34 -1.35 2.07 -1.30 0.16 116.25 116.43 1sbr h VAL 163 Ca -0.26 -0.10 -0.07 0.00 0.82 0.00 0.00 66.70 67.10 1sbr h VAL 163 Cb 2.10 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 32.76 1sbr h VAL 163 CO 0.25 0.02 -0.07 -0.26 0.02 0.00 0.00 177.57 177.53 1sbr h PHE 164 N -0.28 0.59 -0.44 1.57 -1.00 -1.23 -1.82 116.94 114.33 1sbr h PHE 164 Ca -0.02 -0.08 0.04 0.00 2.81 0.00 0.00 57.97 60.71 1sbr h PHE 164 Cb 0.22 -0.16 -0.04 0.00 3.61 0.00 0.00 35.95 39.58 1sbr h PHE 164 CO -0.05 0.61 0.21 1.03 -1.61 0.00 0.00 178.31 178.51 1sbr h SER 165 N 0.52 0.30 0.24 2.17 0.87 -0.99 -2.80 113.55 113.86 1sbr h SER 165 Ca 0.10 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.68 1sbr h SER 165 Cb 0.44 -0.03 -0.00 0.00 -0.44 0.00 0.00 62.40 62.36 1sbr h SER 165 CO 0.02 0.22 -0.15 0.74 -0.53 0.00 0.00 176.83 177.13 1sbr h THR 166 N 0.43 0.68 -0.71 2.23 2.02 -0.10 -2.23 112.91 115.23 1sbr h THR 166 Ca 0.19 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.51 1sbr h THR 166 Cb 0.10 0.68 -0.09 0.00 -1.74 0.00 0.00 68.15 67.10 1sbr h THR 166 CO -0.14 0.00 0.23 -0.07 0.37 0.00 0.00 175.52 175.91 1sbr h LEU 167 N -0.38 0.15 -0.26 2.58 3.38 -1.32 0.47 115.31 119.92 1sbr h LEU 167 Ca -0.02 0.12 -0.20 0.00 0.09 0.00 0.00 57.88 57.86 1sbr h LEU 167 Cb 0.32 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1sbr h LEU 167 CO 0.02 0.05 -0.66 -0.08 0.09 0.00 0.00 178.44 177.86 1sbr h GLU 168 N 0.36 0.78 0.13 1.13 4.81 -1.43 0.15 114.58 120.51 1sbr h GLU 168 Ca 0.39 -0.57 0.02 0.00 -0.13 0.00 0.00 59.36 59.07 1sbr h GLU 168 Cb 0.60 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 30.04 1sbr h GLU 168 CO -0.42 1.19 -0.26 0.00 -0.73 0.00 0.00 179.01 178.79 1sbr h ALA 169 N 0.67 -0.44 -0.40 2.92 0.00 -0.76 0.53 119.26 121.78 1sbr h ALA 169 Ca -0.02 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.92 1sbr h ALA 169 Cb 1.27 0.41 -0.06 0.00 0.00 0.00 0.00 17.79 19.42 1sbr h ALA 169 CO 0.14 -0.80 0.05 0.28 0.00 0.00 0.00 179.25 178.92 1sbr h VAL 170 N -0.47 0.75 -0.31 0.00 2.07 0.16 -3.04 116.25 115.40 1sbr h VAL 170 Ca 0.03 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 1sbr h VAL 170 Cb 0.49 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 1sbr h VAL 170 CO -0.14 0.03 0.18 0.15 0.02 0.00 0.00 177.57 177.81 1sbr h PHE 171 N 0.16 0.42 0.00 1.57 3.57 -0.40 -2.21 116.94 120.06 1sbr h PHE 171 Ca 0.20 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.69 1sbr h PHE 171 Cb 0.26 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.86 1sbr h PHE 171 CO -0.23 0.32 0.00 0.54 -2.23 0.00 0.00 178.31 176.71 1sbr n ARG 172 N -4.82 0.00 0.00 1.11 1.74 0.18 -1.58 116.66 113.30 1sbr n ARG 172 Ca -0.01 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 1sbr n ARG 172 Cb 0.06 -1.06 0.00 0.00 -1.02 0.00 0.00 32.46 30.44 1sbr n ARG 172 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1sbr n ALA 174 N 0.57 0.00 0.32 7.54 0.00 -0.83 -1.77 120.51 126.34 1sbr n ALA 174 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.63 1sbr n ALA 174 Cb 0.00 0.00 0.98 0.00 0.00 0.00 0.00 19.45 20.43 1sbr n ALA 174 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1sbr h GLU 175 N 0.00 0.00 0.07 0.00 4.22 -1.48 -0.80 114.58 116.59 1sbr h GLU 175 Ca 0.00 0.00 -0.25 0.00 0.08 0.00 0.00 59.36 59.19 1sbr h GLU 175 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1sbr h GLU 175 CO 0.00 0.00 -1.20 1.96 -2.18 0.00 0.00 179.01 177.59 1sbr h GLN 176 N 0.00 0.15 0.00 1.92 1.08 -1.61 -3.37 115.11 113.28 1sbr h GLN 176 Ca 0.01 -0.25 -0.32 0.00 -1.45 0.00 0.00 58.65 56.63 1sbr h GLN 176 Cb 0.39 0.09 -0.06 0.00 -0.05 0.00 0.00 27.48 27.86 1sbr h GLN 176 CO -0.00 1.09 -1.99 1.04 -0.95 0.00 0.00 178.83 178.01 1sbr n GLN 177 N -3.43 0.66 -4.18 1.46 6.02 -0.42 -4.98 117.38 112.51 1sbr n GLN 177 Ca -0.06 0.18 -0.11 0.00 -0.01 0.00 0.00 57.00 56.99 1sbr n GLN 177 Cb 0.99 -1.68 -0.10 0.00 1.02 0.00 0.00 30.24 30.47 1sbr n GLN 177 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 1sbr s THR 178 N -2.55 0.43 -0.12 5.09 -1.32 -0.56 -5.12 115.64 111.50 1sbr s THR 178 Ca -0.07 -1.93 -0.24 0.00 -1.21 0.00 0.00 61.69 58.24 1sbr s THR 178 Cb 0.07 -1.96 -0.27 0.00 -1.51 0.00 0.00 72.50 68.84 1sbr s THR 178 CO 0.82 -0.60 0.69 -1.13 -2.21 0.00 0.00 174.62 172.20 1sbr h ASN 179 N 2.85 0.21 -3.54 8.08 -1.24 -1.87 -3.38 115.58 116.68 1sbr h ASN 179 Ca -0.36 -0.89 -0.67 0.00 0.71 0.00 0.00 56.30 55.09 1sbr h ASN 179 Cb 1.19 -0.07 -0.33 0.00 0.73 0.00 0.00 38.32 39.84 1sbr h ASN 179 CO 0.62 1.29 -0.77 -2.28 -1.29 0.00 0.00 177.43 175.01 1sbr s HIS 180 N -2.35 3.09 0.08 0.67 2.46 -1.25 -3.86 115.29 114.12 1sbr s HIS 180 Ca -0.19 -1.75 0.09 0.00 0.47 0.00 0.00 55.06 53.68 1sbr s HIS 180 Cb 0.01 -2.02 -0.03 0.00 -0.13 0.00 0.00 32.58 30.41 1sbr s HIS 180 CO 0.73 -0.78 -0.24 0.96 -2.47 0.00 0.00 174.74 172.94 1sbr s ILE 181 N 1.27 1.98 0.00 0.89 -4.36 -1.00 -4.62 121.20 115.36 1sbr s ILE 181 Ca -0.02 -1.47 0.00 0.00 -0.26 0.00 0.00 60.65 58.90 1sbr s ILE 181 Cb -0.17 -1.73 0.00 0.00 1.25 0.00 0.00 42.46 41.81 1sbr s ILE 181 CO -0.05 0.17 0.00 0.35 0.24 0.00 0.00 174.94 175.65 1sbr n THR 182 N 1.43 0.00 -3.80 8.37 -2.24 0.81 -2.53 114.28 116.32 1sbr n THR 182 Ca -0.18 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.49 1sbr n THR 182 Cb 0.53 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.68 1sbr n THR 182 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1sbr s THR 184 N -0.67 0.09 -0.02 4.28 -4.23 0.13 0.13 115.64 115.35 1sbr s THR 184 Ca 0.00 -0.73 -0.05 0.00 -1.18 0.00 0.00 61.69 59.73 1sbr s THR 184 Cb 0.00 -0.84 0.00 0.00 1.34 0.00 0.00 72.50 73.01 1sbr s THR 184 CO 0.00 -0.40 0.11 0.68 -0.54 0.00 0.00 174.62 174.47 1sbr s VAL 185 N -2.27 0.05 -0.28 2.29 -7.23 0.57 -1.98 120.40 111.56 1sbr s VAL 185 Ca -0.07 -0.40 -0.04 0.00 -1.81 0.00 0.00 61.98 59.66 1sbr s VAL 185 Cb -0.02 -0.30 0.09 0.00 0.56 0.00 0.00 36.38 36.72 1sbr s VAL 185 CO -0.02 -0.22 0.12 0.21 -0.31 0.00 0.00 175.10 174.88 1sbr s ASN 186 N -0.73 3.48 -0.14 4.85 3.04 -0.79 -1.49 114.94 123.16 1sbr s ASN 186 Ca -0.08 -1.26 0.00 0.00 0.04 0.00 0.00 52.86 51.56 1sbr s ASN 186 Cb -0.05 -0.42 -0.01 0.00 -1.54 0.00 0.00 41.25 39.23 1sbr s ASN 186 CO 0.01 -0.42 -0.14 -0.76 -3.04 0.00 0.00 177.10 172.74 1sbr s LEU 187 N 2.02 2.62 -0.19 3.21 1.02 -1.26 -2.39 118.68 123.71 1sbr s LEU 187 Ca 0.08 -0.38 -0.01 0.00 0.02 0.00 0.00 54.13 53.83 1sbr s LEU 187 Cb -0.16 -1.59 0.00 0.00 0.02 0.00 0.00 46.19 44.46 1sbr s LEU 187 CO -0.32 0.13 -0.12 -0.55 0.02 0.00 0.00 176.35 175.52 1sbr s SER 188 N 0.53 3.79 0.04 2.29 0.15 -0.74 -4.34 113.70 115.41 1sbr s SER 188 Ca -0.09 -0.49 0.06 0.00 0.70 0.00 0.00 55.95 56.12 1sbr s SER 188 Cb -0.16 -1.62 -0.03 0.00 -1.71 0.00 0.00 66.02 62.50 1sbr s SER 188 CO 0.04 0.01 -0.13 0.00 1.20 0.00 0.00 173.24 174.36 1sbr s ALA 189 N 1.28 2.79 -1.52 5.45 0.00 -0.55 -3.95 121.76 125.26 1sbr s ALA 189 Ca 0.03 -1.14 -0.02 0.00 0.00 0.00 0.00 51.96 50.83 1sbr s ALA 189 Cb -0.14 -0.89 0.01 0.00 0.00 0.00 0.00 23.12 22.10 1sbr s ALA 189 CO -0.06 0.60 0.19 0.09 0.00 0.00 0.00 175.76 176.58 1sbr n ASN 190 N 1.43 -5.34 -4.76 0.00 3.02 -1.26 -2.29 115.26 106.06 1sbr n ASN 190 Ca -0.15 -0.07 -0.41 0.00 -0.03 0.00 0.00 54.58 53.92 1sbr n ASN 190 Cb 0.52 -4.42 -0.02 0.00 -0.61 0.00 0.00 39.78 35.26 1sbr n ASN 190 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1sbr s SER 191 N -2.26 6.58 0.00 6.41 0.15 -1.26 -3.97 113.70 119.35 1sbr s SER 191 Ca 0.11 2.79 0.30 0.00 0.70 0.00 0.00 55.95 59.85 1sbr s SER 191 Cb -0.05 -2.64 1.58 0.00 -1.71 0.00 0.00 66.02 63.20 1sbr s SER 191 CO 0.13 -0.73 2.05 -0.81 1.20 0.00 0.00 173.24 175.08 1sbr n PRO 192 N 1.59 1.16 0.07 5.44 -0.04 -1.26 -2.43 135.00 139.53 1sbr n PRO 192 Ca 0.04 -0.31 -0.06 0.00 -0.04 0.00 0.00 63.50 63.13 1sbr n PRO 192 Cb 0.40 -1.49 -0.07 0.00 -0.04 0.00 0.00 33.50 32.30 1sbr n PRO 192 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 1sbr h SER 193 N 0.76 0.00 0.00 3.54 0.02 -2.03 -3.56 113.55 112.28 1sbr h SER 193 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1sbr h SER 193 Cb 0.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.73 1sbr h SER 193 CO 0.00 0.93 0.00 0.54 -1.14 0.00 0.00 176.83 177.16