#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gnr n THR 2 N 0.00 0.06 -4.98 3.17 -1.04 -1.26 -4.87 114.28 105.36 1gnr n THR 2 Ca 0.00 -0.01 -0.31 0.00 -2.04 0.00 0.00 64.05 61.69 1gnr n THR 2 Cb 0.00 -1.93 -0.14 0.00 -1.82 0.00 0.00 70.33 66.43 1gnr n THR 2 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1gnr s GLU 3 N 1.38 2.12 -0.14 -2.82 2.12 -1.26 -1.22 118.70 118.88 1gnr s GLU 3 Ca 0.77 -0.93 0.00 0.00 0.36 0.00 0.00 54.97 55.17 1gnr s GLU 3 Cb -0.53 -2.14 0.02 0.00 0.26 0.00 0.00 34.13 31.74 1gnr s GLU 3 CO 0.34 0.56 -0.13 0.71 -0.54 0.00 0.00 175.26 176.20 1gnr s TYR 4 N -0.75 2.06 -0.45 5.30 2.02 0.66 -4.92 117.35 121.27 1gnr s TYR 4 Ca 0.12 -1.14 -0.16 0.00 -0.37 0.00 0.00 57.07 55.52 1gnr s TYR 4 Cb -0.10 -1.54 0.05 0.00 -0.40 0.00 0.00 41.96 39.97 1gnr s TYR 4 CO 0.01 -0.64 0.41 0.15 -1.57 0.00 0.00 175.55 173.91 1gnr s LYS 5 N 1.50 3.02 -0.05 -0.62 1.02 -1.26 -1.72 119.74 121.63 1gnr s LYS 5 Ca 0.05 -1.09 0.03 0.00 0.02 0.00 0.00 55.97 54.97 1gnr s LYS 5 Cb -0.13 -4.06 -0.03 0.00 -0.52 0.00 0.00 37.83 33.10 1gnr s LYS 5 CO -0.10 -0.94 -0.12 -0.51 -0.92 0.00 0.00 175.35 172.76 1gnr s LEU 6 N 1.87 2.90 -0.15 3.17 1.43 -0.47 -1.03 118.68 126.40 1gnr s LEU 6 Ca 0.07 -0.15 0.01 0.00 -1.03 0.00 0.00 54.13 53.03 1gnr s LEU 6 Cb -0.21 -1.62 0.02 0.00 0.03 0.00 0.00 46.19 44.42 1gnr s LEU 6 CO 0.09 0.34 -0.17 -0.69 0.23 0.00 0.00 176.35 176.16 1gnr s VAL 7 N -0.79 1.75 -0.18 -1.59 1.01 -0.71 -0.79 120.40 119.11 1gnr s VAL 7 Ca 0.12 -0.76 -0.20 0.00 0.00 0.00 0.00 61.98 61.14 1gnr s VAL 7 Cb -0.11 -1.61 -0.03 0.00 0.00 0.00 0.00 36.38 34.64 1gnr s VAL 7 CO 0.02 0.49 0.60 -0.69 0.00 0.00 0.00 175.10 175.51 1gnr s VAL 8 N 1.28 5.06 0.03 2.92 1.01 -0.14 -1.52 120.40 129.04 1gnr s VAL 8 Ca 0.02 1.14 0.02 0.00 0.00 0.00 0.00 61.98 63.16 1gnr s VAL 8 Cb -0.13 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.31 1gnr s VAL 8 CO -0.09 0.16 -0.06 -0.69 0.00 0.00 0.00 175.10 174.42 1gnr s VAL 9 N 1.63 0.41 0.00 2.92 1.01 -0.54 -2.89 120.40 122.94 1gnr s VAL 9 Ca 0.28 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.35 1gnr s VAL 9 Cb -0.16 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.74 1gnr s VAL 9 CO 0.11 -0.35 0.00 0.61 0.00 0.00 0.00 175.10 175.47 1gnr n GLY 10 N 1.70 0.48 3.81 4.51 0.00 -1.26 -0.59 105.19 113.84 1gnr n GLY 10 Ca -0.22 -1.25 -0.30 0.00 0.00 0.00 0.00 46.02 44.24 1gnr n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gnr s ALA 11 N -1.97 2.41 0.13 4.61 0.00 -1.26 -4.43 121.76 121.24 1gnr s ALA 11 Ca 0.00 -0.08 -0.35 0.00 0.00 0.00 0.00 51.96 51.53 1gnr s ALA 11 Cb 0.00 -3.14 -0.14 0.00 0.00 0.00 0.00 23.12 19.84 1gnr s ALA 11 CO 0.00 -1.54 1.53 0.41 0.00 0.00 0.00 175.76 176.16 1gnr n GLY 12 N -2.03 0.98 0.23 0.00 0.00 -1.26 -2.95 105.19 100.15 1gnr n GLY 12 Ca 0.07 0.68 0.00 0.00 0.00 0.00 0.00 46.02 46.77 1gnr n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gnr n GLY 13 N 3.24 2.13 0.12 -0.02 0.00 -1.26 -4.94 105.19 104.46 1gnr n GLY 13 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 1gnr n GLY 13 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1gnr n VAL 14 N -2.00 0.84 0.00 1.61 0.24 -1.15 -4.83 118.33 113.04 1gnr n VAL 14 Ca 0.00 0.22 0.00 0.00 -2.04 0.00 0.00 64.34 62.52 1gnr n VAL 14 Cb 0.00 -1.14 0.00 0.00 -1.47 0.00 0.00 33.84 31.23 1gnr n VAL 14 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1gnr n GLY 15 N 0.02 1.70 0.15 7.63 0.00 -1.26 -4.60 105.19 108.84 1gnr n GLY 15 Ca 0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 1gnr n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gnr h LYS 16 N 0.00 -0.15 -0.52 1.61 1.57 -1.91 -0.55 116.57 116.62 1gnr h LYS 16 Ca 0.00 0.01 -0.12 0.00 -1.87 0.00 0.00 60.65 58.67 1gnr h LYS 16 Cb 0.00 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 1gnr h LYS 16 CO 0.00 -0.10 -0.16 0.77 -0.57 0.00 0.00 179.45 179.39 1gnr h SER 17 N -0.15 1.04 -0.17 0.86 0.02 -1.96 -2.81 113.55 110.38 1gnr h SER 17 Ca 0.06 -0.37 -0.12 0.00 -0.84 0.00 0.00 61.79 60.51 1gnr h SER 17 Cb 0.24 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 1gnr h SER 17 CO -0.15 1.18 -0.31 0.00 -1.14 0.00 0.00 176.83 176.40 1gnr h ALA 18 N 0.90 0.86 -0.29 3.77 0.00 -1.83 0.24 119.26 122.92 1gnr h ALA 18 Ca 0.13 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 1gnr h ALA 18 Cb 0.74 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1gnr h ALA 18 CO 0.06 0.63 0.18 -0.07 0.00 0.00 0.00 179.25 180.05 1gnr h LEU 19 N 0.57 0.34 -0.52 0.00 3.38 -1.12 -0.10 115.31 117.86 1gnr h LEU 19 Ca 0.07 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 1gnr h LEU 19 Cb 0.82 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1gnr h LEU 19 CO 0.07 0.28 -0.07 0.74 0.09 0.00 0.00 178.44 179.55 1gnr h THR 20 N 0.37 1.27 -0.33 0.22 2.02 -1.15 -1.80 112.91 113.51 1gnr h THR 20 Ca 0.10 -1.19 -0.11 0.00 0.77 0.00 0.00 66.41 65.98 1gnr h THR 20 Cb 0.00 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 1gnr h THR 20 CO -0.02 0.42 -0.24 0.40 0.37 0.00 0.00 175.52 176.45 1gnr h ILE 21 N 0.82 1.27 -0.40 3.11 1.08 -0.40 -1.30 117.51 121.70 1gnr h ILE 21 Ca 0.14 -1.33 -0.08 0.00 -0.39 0.00 0.00 64.86 63.20 1gnr h ILE 21 Cb 0.61 1.28 -0.02 0.00 -3.07 0.00 0.00 36.82 35.63 1gnr h ILE 21 CO 0.04 0.43 -0.10 -0.61 -0.69 0.00 0.00 178.15 177.22 1gnr h GLN 22 N 0.57 0.69 -0.29 2.37 5.75 -0.82 0.48 115.11 123.86 1gnr h GLN 22 Ca 0.08 -0.21 -0.15 0.00 -0.15 0.00 0.00 58.65 58.22 1gnr h GLN 22 Cb 0.72 -0.07 -0.00 0.00 1.07 0.00 0.00 27.48 29.20 1gnr h GLN 22 CO 0.06 0.78 -0.40 1.25 -2.65 0.00 0.00 178.83 177.86 1gnr h LEU 23 N 0.63 0.85 0.06 -2.39 5.85 -1.04 -2.91 115.31 116.37 1gnr h LEU 23 Ca 0.11 -0.50 -0.35 0.00 0.84 0.00 0.00 57.88 57.98 1gnr h LEU 23 Cb 0.54 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 1gnr h LEU 23 CO 0.03 1.19 -2.02 -0.38 -0.34 0.00 0.00 178.44 176.92 1gnr n ILE 24 N -4.15 1.67 0.12 4.05 2.08 -0.52 -4.55 119.36 118.06 1gnr n ILE 24 Ca -0.04 -0.70 0.01 0.00 0.56 0.00 0.00 62.75 62.58 1gnr n ILE 24 Cb 0.54 -1.40 0.01 0.00 -0.75 0.00 0.00 39.64 38.04 1gnr n ILE 24 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1gnr n GLN 25 N -3.28 0.85 -3.56 0.38 6.02 0.12 -5.04 117.38 112.88 1gnr n GLN 25 Ca -0.30 -0.52 -0.25 0.00 -0.01 0.00 0.00 57.00 55.92 1gnr n GLN 25 Cb 1.05 -0.96 0.05 0.00 1.02 0.00 0.00 30.24 31.40 1gnr n GLN 25 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1gnr n ASN 26 N -0.10 -4.87 -3.51 1.08 5.15 -0.99 -4.97 115.26 107.05 1gnr n ASN 26 Ca 0.01 -0.89 -0.08 0.00 -0.60 0.00 0.00 54.58 53.03 1gnr n ASN 26 Cb 0.06 -4.07 -0.02 0.00 -0.53 0.00 0.00 39.78 35.23 1gnr n ASN 26 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 1gnr s HIS 27 N -3.49 -0.34 -0.24 1.20 -3.43 -1.26 -5.02 115.29 102.72 1gnr s HIS 27 Ca 0.37 0.21 -0.18 0.00 -0.80 0.00 0.00 55.06 54.66 1gnr s HIS 27 Cb -0.10 0.54 -0.03 0.00 -1.43 0.00 0.00 32.58 31.56 1gnr s HIS 27 CO 0.82 -0.54 0.53 0.12 -2.00 0.00 0.00 174.74 173.67 1gnr s PHE 28 N -3.11 3.30 -0.50 0.38 5.36 -1.26 -3.60 117.98 118.55 1gnr s PHE 28 Ca 0.05 0.71 -0.26 0.00 -0.96 0.00 0.00 56.93 56.47 1gnr s PHE 28 Cb -0.01 -2.72 0.03 0.00 -0.34 0.00 0.00 43.02 39.98 1gnr s PHE 28 CO -0.09 -0.23 0.97 0.08 -1.46 0.00 0.00 175.22 174.49 1gnr s VAL 29 N 2.12 4.38 -0.46 3.12 1.01 -1.26 -4.88 120.40 124.44 1gnr s VAL 29 Ca 0.23 0.66 -0.01 0.00 0.00 0.00 0.00 61.98 62.86 1gnr s VAL 29 Cb -0.16 -4.51 0.36 0.00 0.00 0.00 0.00 36.38 32.08 1gnr s VAL 29 CO 0.09 -0.98 1.96 0.47 0.00 0.00 0.00 175.10 176.64 1gnr n ASP 30 N 7.43 6.41 0.00 3.32 8.00 -1.26 -4.88 116.55 135.57 1gnr n ASP 30 Ca 0.05 -3.38 0.00 0.00 0.71 0.00 0.00 54.79 52.18 1gnr n ASP 30 Cb 0.48 -0.97 0.00 0.00 -0.02 0.00 0.00 41.12 40.62 1gnr n ASP 30 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1gnr n GLU 31 N -0.36 0.29 0.00 -1.24 4.71 -1.26 -5.09 120.64 117.69 1gnr n GLU 31 Ca 0.46 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.61 1gnr n GLU 31 Cb 0.76 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 31.19 1gnr n GLU 31 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 1gnr n TYR 32 N 0.00 0.00 0.00 -0.32 4.01 -1.26 -5.05 117.16 114.54 1gnr n TYR 32 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1gnr n TYR 32 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 1gnr n TYR 32 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1gnr n ASP 33 N 5.19 0.00 -3.43 7.72 -0.08 -1.26 -5.13 116.55 119.56 1gnr n ASP 33 Ca 0.00 0.00 -0.33 0.00 -1.51 0.00 0.00 54.79 52.95 1gnr n ASP 33 Cb 0.00 0.00 0.03 0.00 2.34 0.00 0.00 41.12 43.49 1gnr n ASP 33 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1gnr n PRO 34 N 0.00 0.00 -3.15 -0.67 -0.02 -1.26 -5.06 135.00 124.84 1gnr n PRO 34 Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.53 1gnr n PRO 34 Cb 0.00 -0.86 -0.01 0.00 -0.02 0.00 0.00 33.50 32.62 1gnr n PRO 34 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1gnr s THR 35 N -1.72 -0.72 0.00 3.45 2.01 -1.26 -5.12 115.64 112.28 1gnr s THR 35 Ca 0.32 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.32 1gnr s THR 35 Cb 0.03 -0.86 0.00 0.00 0.01 0.00 0.00 72.50 71.68 1gnr s THR 35 CO 0.60 0.00 0.00 0.00 -0.69 0.00 0.00 174.62 174.53 1gnr n ILE 36 N 5.38 0.00 -1.58 1.82 0.13 -1.26 -2.02 119.36 121.83 1gnr n ILE 36 Ca 0.02 0.00 -0.42 0.00 -1.10 0.00 0.00 62.75 61.25 1gnr n ILE 36 Cb 0.54 0.00 -0.03 0.00 -0.84 0.00 0.00 39.64 39.31 1gnr n ILE 36 CO 0.00 0.00 0.00 1.21 2.80 0.00 0.00 176.55 180.56 1gnr n GLU 37 N 0.00 2.29 -2.81 9.51 4.07 -1.26 -4.19 120.64 128.24 1gnr n GLU 37 Ca 0.00 -2.35 -0.42 0.00 -0.06 0.00 0.00 57.16 54.33 1gnr n GLU 37 Cb 0.00 -3.18 -0.04 0.00 -0.06 0.00 0.00 31.44 28.16 1gnr n GLU 37 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1gnr s ASP 38 N 4.14 6.82 -0.08 4.31 1.11 -1.22 -5.00 116.67 126.74 1gnr s ASP 38 Ca 0.53 0.92 0.04 0.00 0.18 0.00 0.00 52.55 54.22 1gnr s ASP 38 Cb 0.13 -2.47 -0.01 0.00 1.07 0.00 0.00 42.92 41.64 1gnr s ASP 38 CO 0.01 -0.69 -0.23 -0.44 1.18 0.00 0.00 175.17 175.01 1gnr s SER 39 N 1.54 3.25 -0.04 0.27 0.01 -1.26 -0.42 113.70 117.05 1gnr s SER 39 Ca 0.38 -0.49 0.07 0.00 1.31 0.00 0.00 55.95 57.21 1gnr s SER 39 Cb -0.14 -1.17 -0.01 0.00 0.21 0.00 0.00 66.02 64.90 1gnr s SER 39 CO 0.12 0.20 -0.24 -0.31 0.41 0.00 0.00 173.24 173.42 1gnr s TYR 40 N 0.08 2.24 -0.09 2.43 1.51 -0.30 -4.97 117.35 118.25 1gnr s TYR 40 Ca -0.10 -0.55 0.03 0.00 -1.01 0.00 0.00 57.07 55.44 1gnr s TYR 40 Cb -0.16 -1.46 0.01 0.00 -0.11 0.00 0.00 41.96 40.24 1gnr s TYR 40 CO 0.06 -0.13 -0.18 1.03 -1.11 0.00 0.00 175.55 175.22 1gnr s ARG 41 N -0.34 2.39 -0.09 -0.62 0.52 -1.26 -0.95 118.95 118.61 1gnr s ARG 41 Ca 0.03 -0.65 -0.05 0.00 -0.52 0.00 0.00 55.73 54.53 1gnr s ARG 41 Cb -0.11 -1.88 0.04 0.00 0.52 0.00 0.00 34.95 33.52 1gnr s ARG 41 CO 0.01 0.09 0.22 0.21 0.02 0.00 0.00 175.30 175.86 1gnr s LYS 42 N 0.53 0.19 -0.09 3.54 2.47 -0.39 -4.99 119.74 121.00 1gnr s LYS 42 Ca -0.16 0.47 -0.30 0.00 -1.56 0.00 0.00 55.97 54.42 1gnr s LYS 42 Cb -0.17 -0.10 -0.02 0.00 -1.46 0.00 0.00 37.83 36.09 1gnr s LYS 42 CO 0.06 -0.14 1.05 -1.14 0.16 0.00 0.00 175.35 175.33 1gnr s GLN 43 N 1.08 4.41 0.19 4.03 -0.44 -1.26 -0.23 119.66 127.44 1gnr s GLN 43 Ca -0.08 1.45 0.02 0.00 -2.50 0.00 0.00 55.36 54.25 1gnr s GLN 43 Cb -0.09 -3.54 -0.05 0.00 -1.64 0.00 0.00 33.01 27.69 1gnr s GLN 43 CO -0.07 -0.34 0.02 0.14 0.50 0.00 0.00 175.29 175.54 1gnr s VAL 44 N 2.03 0.65 -0.25 1.34 -7.23 0.37 -4.97 120.40 112.35 1gnr s VAL 44 Ca 0.50 -1.98 -0.01 0.00 -1.81 0.00 0.00 61.98 58.68 1gnr s VAL 44 Cb -0.20 -2.20 0.03 0.00 0.56 0.00 0.00 36.38 34.57 1gnr s VAL 44 CO 0.19 -0.40 -0.07 -0.69 -0.31 0.00 0.00 175.10 173.82 1gnr s VAL 45 N -3.68 2.78 -0.19 1.32 1.01 -1.26 -0.85 120.40 119.54 1gnr s VAL 45 Ca 0.26 -1.09 -0.00 0.00 0.00 0.00 0.00 61.98 61.15 1gnr s VAL 45 Cb 0.06 -2.42 0.01 0.00 0.00 0.00 0.00 36.38 34.03 1gnr s VAL 45 CO 0.06 0.18 -0.16 -0.63 0.00 0.00 0.00 175.10 174.55 1gnr s ILE 46 N 1.30 2.36 -1.75 2.22 1.01 0.01 -4.66 121.20 121.69 1gnr s ILE 46 Ca -0.01 -0.84 -0.20 0.00 0.00 0.00 0.00 60.65 59.60 1gnr s ILE 46 Cb -0.17 -2.02 0.18 0.00 0.01 0.00 0.00 42.46 40.47 1gnr s ILE 46 CO -0.05 0.51 0.73 0.47 0.00 0.00 0.00 174.94 176.60 1gnr n ASP 47 N 4.66 -2.90 0.00 3.58 8.00 -1.26 -0.88 116.55 127.75 1gnr n ASP 47 Ca -0.20 -1.06 0.00 0.00 0.71 0.00 0.00 54.79 54.23 1gnr n ASP 47 Cb 0.50 -2.40 0.00 0.00 -0.02 0.00 0.00 41.12 39.20 1gnr n ASP 47 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gnr n GLY 48 N -1.28 0.93 3.75 0.44 0.00 -1.26 -5.02 105.19 102.75 1gnr n GLY 48 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 1gnr n GLY 48 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1gnr s GLU 49 N -0.35 4.15 -0.16 1.61 2.12 -0.06 -5.06 118.70 120.94 1gnr s GLU 49 Ca 0.00 -0.02 -0.25 0.00 0.36 0.00 0.00 54.97 55.07 1gnr s GLU 49 Cb 0.00 -3.39 -0.02 0.00 0.26 0.00 0.00 34.13 30.98 1gnr s GLU 49 CO 0.00 0.33 0.80 0.95 -0.54 0.00 0.00 175.26 176.79 1gnr s THR 50 N 0.23 4.91 0.14 -1.70 -4.23 -1.26 -0.81 115.64 112.93 1gnr s THR 50 Ca 0.14 1.57 -0.12 0.00 -1.18 0.00 0.00 61.69 62.10 1gnr s THR 50 Cb -0.12 -4.11 0.01 0.00 1.34 0.00 0.00 72.50 69.61 1gnr s THR 50 CO 0.02 0.06 0.32 0.00 -0.54 0.00 0.00 174.62 174.49 1gnr s LEU 52 N -2.90 3.11 -0.30 0.00 1.98 -0.36 -0.48 118.68 119.74 1gnr s LEU 52 Ca 0.10 -0.38 -0.18 0.00 -2.89 0.00 0.00 54.13 50.78 1gnr s LEU 52 Cb 0.03 -1.79 -0.02 0.00 0.66 0.00 0.00 46.19 45.07 1gnr s LEU 52 CO -0.05 -0.04 0.54 -0.76 -1.89 0.00 0.00 176.35 174.15 1gnr s LEU 53 N 1.51 4.17 -0.35 -0.68 1.43 0.69 -0.25 118.68 125.20 1gnr s LEU 53 Ca 0.06 0.31 0.00 0.00 -1.03 0.00 0.00 54.13 53.47 1gnr s LEU 53 Cb -0.15 -2.67 0.09 0.00 0.03 0.00 0.00 46.19 43.49 1gnr s LEU 53 CO -0.01 -0.40 0.08 -0.62 0.23 0.00 0.00 176.35 175.63 1gnr s ASP 54 N 1.65 4.94 -0.12 2.29 -1.08 -0.70 -1.26 116.67 122.39 1gnr s ASP 54 Ca 0.21 -1.84 -0.02 0.00 -0.52 0.00 0.00 52.55 50.39 1gnr s ASP 54 Cb -0.15 -1.71 -0.03 0.00 -1.46 0.00 0.00 42.92 39.57 1gnr s ASP 54 CO 0.11 -0.39 -0.05 -0.63 0.52 0.00 0.00 175.17 174.73 1gnr s ILE 55 N 1.09 3.82 -0.34 4.11 1.01 -0.12 -1.37 121.20 129.40 1gnr s ILE 55 Ca 0.04 -0.41 -0.13 0.00 0.00 0.00 0.00 60.65 60.16 1gnr s ILE 55 Cb -0.21 -2.62 -0.02 0.00 0.01 0.00 0.00 42.46 39.62 1gnr s ILE 55 CO -0.05 0.54 0.24 -0.22 0.00 0.00 0.00 174.94 175.46 1gnr s LEU 56 N -0.17 4.48 -0.42 2.97 2.96 0.03 -1.15 118.68 127.39 1gnr s LEU 56 Ca 0.03 -0.38 -0.19 0.00 -0.22 0.00 0.00 54.13 53.37 1gnr s LEU 56 Cb -0.13 -2.15 0.02 0.00 0.50 0.00 0.00 46.19 44.43 1gnr s LEU 56 CO 0.03 -0.23 0.53 -0.62 -1.32 0.00 0.00 176.35 174.73 1gnr s ASP 57 N 1.73 6.26 0.33 3.68 2.15 0.44 -0.96 116.67 130.29 1gnr s ASP 57 Ca 0.06 -0.45 0.01 0.00 0.43 0.00 0.00 52.55 52.61 1gnr s ASP 57 Cb -0.17 -2.27 -0.03 0.00 -0.30 0.00 0.00 42.92 40.15 1gnr s ASP 57 CO 0.11 -0.64 0.52 0.42 -0.17 0.00 0.00 175.17 175.40 1gnr s THR 58 N 2.43 5.13 0.51 1.71 -4.23 -1.14 -3.42 115.64 116.62 1gnr s THR 58 Ca 0.17 -0.54 -0.20 0.00 -1.18 0.00 0.00 61.69 59.94 1gnr s THR 58 Cb -0.16 -3.86 -0.08 0.00 1.34 0.00 0.00 72.50 69.75 1gnr s THR 58 CO 0.16 -0.51 1.07 0.00 -0.54 0.00 0.00 174.62 174.79 1gnr s ALA 59 N -2.25 2.81 0.00 3.99 0.00 -0.85 -4.86 121.76 120.59 1gnr s ALA 59 Ca 0.39 0.69 0.00 0.00 0.00 0.00 0.00 51.96 53.04 1gnr s ALA 59 Cb -0.10 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.73 1gnr s ALA 59 CO 0.35 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 176.04 1gnr n GLY 60 N -0.09 -0.51 3.29 0.00 0.00 -1.26 -4.86 105.19 101.76 1gnr n GLY 60 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 1gnr n GLY 60 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1gnr n GLN 61 N -2.04 0.13 -0.88 1.61 7.27 -1.26 -4.55 117.38 117.65 1gnr n GLN 61 Ca 0.00 0.06 -0.17 0.00 0.07 0.00 0.00 57.00 56.96 1gnr n GLN 61 Cb 0.00 -1.36 0.05 0.00 2.41 0.00 0.00 30.24 31.34 1gnr n GLN 61 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 1gnr n GLU 62 N 0.74 1.83 0.06 3.69 0.00 -1.26 -3.04 120.64 122.66 1gnr n GLU 62 Ca 0.07 -1.67 0.12 0.00 0.00 0.00 0.00 57.16 55.68 1gnr n GLU 62 Cb 0.50 -1.65 0.46 0.00 0.00 0.00 0.00 31.44 30.75 1gnr n GLU 62 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 1gnr n GLU 63 N 0.16 0.12 -0.32 5.31 -0.00 -1.26 -4.11 120.64 120.54 1gnr n GLU 63 Ca 0.32 0.22 0.00 0.00 -0.00 0.00 0.00 57.16 57.71 1gnr n GLU 63 Cb 0.67 -1.67 0.00 0.00 -0.00 0.00 0.00 31.44 30.43 1gnr n GLU 63 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1gnr n TYR 64 N -1.88 0.00 0.00 -1.84 4.02 -1.17 -4.81 117.16 111.48 1gnr n TYR 64 Ca 0.05 -0.66 0.00 0.00 -0.01 0.00 0.00 57.90 57.27 1gnr n TYR 64 Cb 0.29 -0.40 0.00 0.00 -0.02 0.00 0.00 39.34 39.21 1gnr n TYR 64 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1gnr n SER 65 N 1.57 0.00 -0.74 7.72 3.41 -1.26 -1.80 113.62 122.52 1gnr n SER 65 Ca 0.00 0.28 0.10 0.00 -0.26 0.00 0.00 58.87 58.99 1gnr n SER 65 Cb 0.35 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.37 1gnr n SER 65 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gnr n ALA 66 N -1.80 2.60 0.43 7.33 0.00 -1.26 -3.89 120.51 123.91 1gnr n ALA 66 Ca 0.00 -0.65 0.12 0.00 0.00 0.00 0.00 53.44 52.91 1gnr n ALA 66 Cb 0.00 -0.67 0.48 0.00 0.00 0.00 0.00 19.45 19.26 1gnr n ALA 66 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1gnr n MET 67 N 0.94 0.20 -0.05 0.00 2.00 -1.22 -2.00 117.12 117.00 1gnr n MET 67 Ca 0.11 0.40 -0.13 0.00 0.00 0.00 0.00 57.70 58.07 1gnr n MET 67 Cb 0.48 -1.86 -0.08 0.00 0.00 0.00 0.00 33.22 31.76 1gnr n MET 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1gnr h ARG 68 N 0.00 0.30 -0.97 0.03 3.08 -1.47 -3.23 114.38 112.12 1gnr h ARG 68 Ca 0.00 -0.17 0.11 0.00 0.07 0.00 0.00 59.98 60.00 1gnr h ARG 68 Cb 0.41 0.01 -0.08 0.00 0.08 0.00 0.00 29.97 30.40 1gnr h ARG 68 CO 0.00 0.73 0.62 -0.44 -1.07 0.00 0.00 179.97 179.81 1gnr h ASP 69 N -0.12 0.88 0.77 7.04 5.19 -1.62 0.19 116.42 128.75 1gnr h ASP 69 Ca 0.01 0.04 -0.03 0.00 -0.62 0.00 0.00 57.03 56.43 1gnr h ASP 69 Cb 0.69 -0.14 -0.00 0.00 0.18 0.00 0.00 39.33 40.06 1gnr h ASP 69 CO 0.03 0.48 -0.47 -0.61 -3.12 0.00 0.00 179.24 175.56 1gnr h GLN 70 N 0.95 -1.12 0.00 3.56 4.15 -1.60 -0.73 115.11 120.32 1gnr h GLN 70 Ca 0.47 0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.96 1gnr h GLN 70 Cb 0.48 0.25 0.00 0.00 0.21 0.00 0.00 27.48 28.42 1gnr h GLN 70 CO -0.23 -0.74 0.00 0.10 -1.93 0.00 0.00 178.83 176.03 1gnr h TYR 71 N -1.16 0.00 0.02 3.99 -0.00 -1.30 -2.80 116.97 115.72 1gnr h TYR 71 Ca -0.10 0.00 -0.20 0.00 0.00 0.00 0.00 58.73 58.43 1gnr h TYR 71 Cb 0.93 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.64 1gnr h TYR 71 CO -0.10 0.00 -0.92 0.52 -0.00 0.00 0.00 178.16 177.65 1gnr h MET 72 N 0.00 0.14 -0.48 0.10 2.86 -0.53 -3.01 114.93 114.01 1gnr h MET 72 Ca 0.00 -0.17 0.03 0.00 -2.06 0.00 0.00 59.70 57.50 1gnr h MET 72 Cb 0.74 0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.42 1gnr h MET 72 CO 0.00 0.96 0.27 -0.09 1.06 0.00 0.00 176.91 179.11 1gnr h ARG 73 N 0.07 0.52 0.00 1.72 9.65 -0.85 -3.09 114.38 122.40 1gnr h ARG 73 Ca -0.04 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.81 1gnr h ARG 73 Cb 1.58 -0.12 0.00 0.00 -1.39 0.00 0.00 29.97 30.05 1gnr h ARG 73 CO 0.14 0.35 -0.18 0.25 2.80 0.00 0.00 179.97 183.32 1gnr n THR 74 N -4.84 0.46 -2.72 0.20 -2.24 -1.21 -4.87 114.28 99.07 1gnr n THR 74 Ca 0.03 -0.25 -0.41 0.00 -2.27 0.00 0.00 64.05 61.16 1gnr n THR 74 Cb 0.09 -0.43 -0.05 0.00 -2.10 0.00 0.00 70.33 67.84 1gnr n THR 74 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1gnr s GLY 75 N -3.53 3.05 -0.06 3.38 0.00 -1.14 -4.94 107.32 104.08 1gnr s GLY 75 Ca 0.10 0.62 -0.07 0.00 0.00 0.00 0.00 44.72 45.36 1gnr s GLY 75 CO 0.63 1.36 0.59 0.83 0.00 0.00 0.00 173.10 176.51 1gnr h GLU 76 N 4.91 0.31 -3.68 2.90 5.08 -1.42 -3.48 114.58 119.21 1gnr h GLU 76 Ca -0.44 -0.53 -0.16 0.00 -1.00 0.00 0.00 59.36 57.23 1gnr h GLU 76 Cb 1.21 0.20 -0.22 0.00 0.50 0.00 0.00 28.75 30.44 1gnr h GLU 76 CO 0.70 1.21 -0.58 0.20 -1.00 0.00 0.00 179.01 179.54 1gnr s GLY 77 N -5.25 0.10 -0.04 -3.84 0.00 -1.13 -4.21 107.32 92.94 1gnr s GLY 77 Ca -0.16 -0.24 0.06 0.00 0.00 0.00 0.00 44.72 44.37 1gnr s GLY 77 CO 0.82 -0.34 -0.21 -1.36 0.00 0.00 0.00 173.10 172.01 1gnr s PHE 78 N -1.21 2.06 -0.19 1.90 0.40 -0.44 -1.74 117.98 118.76 1gnr s PHE 78 Ca -0.13 -0.56 -0.18 0.00 -0.60 0.00 0.00 56.93 55.46 1gnr s PHE 78 Cb -0.07 -1.36 -0.03 0.00 0.51 0.00 0.00 43.02 42.06 1gnr s PHE 78 CO 0.00 -0.16 0.48 -0.51 0.70 0.00 0.00 175.22 175.73 1gnr s LEU 79 N -0.16 4.16 -0.34 -0.37 1.43 -0.58 -1.35 118.68 121.47 1gnr s LEU 79 Ca -0.01 0.63 -0.05 0.00 -1.03 0.00 0.00 54.13 53.67 1gnr s LEU 79 Cb -0.12 -2.65 0.05 0.00 0.03 0.00 0.00 46.19 43.50 1gnr s LEU 79 CO 0.02 -0.14 0.09 0.00 0.23 0.00 0.00 176.35 176.55 1gnr s VAL 81 N 1.35 3.62 0.41 0.00 1.01 0.25 -1.21 120.40 125.83 1gnr s VAL 81 Ca -0.02 -0.44 0.05 0.00 0.00 0.00 0.00 61.98 61.58 1gnr s VAL 81 Cb -0.20 -2.60 -0.07 0.00 0.00 0.00 0.00 36.38 33.52 1gnr s VAL 81 CO 0.01 0.47 0.02 0.72 0.00 0.00 0.00 175.10 176.32 1gnr s PHE 82 N 0.76 2.31 -0.12 5.22 -0.12 -0.51 -4.00 117.98 121.52 1gnr s PHE 82 Ca -0.02 -0.78 -0.00 0.00 -0.05 0.00 0.00 56.93 56.07 1gnr s PHE 82 Cb -0.15 -1.65 -0.02 0.00 -0.63 0.00 0.00 43.02 40.58 1gnr s PHE 82 CO 0.02 0.32 -0.10 0.00 -0.05 0.00 0.00 175.22 175.40 1gnr s ALA 83 N -2.86 2.76 -1.41 1.99 0.00 -1.26 0.03 121.76 121.01 1gnr s ALA 83 Ca 0.31 -0.88 0.15 0.00 0.00 0.00 0.00 51.96 51.54 1gnr s ALA 83 Cb 0.08 -1.26 0.76 0.00 0.00 0.00 0.00 23.12 22.70 1gnr s ALA 83 CO 0.15 0.32 1.43 0.44 0.00 0.00 0.00 175.76 178.10 1gnr n ILE 84 N 3.22 0.59 -1.31 0.00 -6.64 -0.54 -1.28 119.36 113.39 1gnr n ILE 84 Ca -0.18 0.15 -0.03 0.00 -1.77 0.00 0.00 62.75 60.92 1gnr n ILE 84 Cb 0.53 -0.89 0.21 0.00 -1.44 0.00 0.00 39.64 38.05 1gnr n ILE 84 CO 0.00 0.00 0.00 -0.46 -1.77 0.00 0.00 176.55 174.32 1gnr n ASN 85 N -1.30 2.98 -3.31 7.28 2.04 -1.26 -0.26 115.26 121.44 1gnr n ASN 85 Ca 0.07 -3.57 -0.07 0.00 -0.44 0.00 0.00 54.58 50.57 1gnr n ASN 85 Cb 0.12 -0.64 -0.06 0.00 -2.53 0.00 0.00 39.78 36.68 1gnr n ASN 85 CO 0.00 0.00 0.00 0.21 -0.44 0.00 0.00 177.26 177.03 1gnr s ASN 86 N -2.24 0.06 0.38 0.53 3.04 -0.41 -4.68 114.94 111.62 1gnr s ASN 86 Ca 0.45 0.06 0.20 0.00 0.04 0.00 0.00 52.86 53.61 1gnr s ASN 86 Cb 0.40 1.25 0.68 0.00 -1.54 0.00 0.00 41.25 42.04 1gnr s ASN 86 CO 0.03 -0.32 1.73 0.74 -3.04 0.00 0.00 177.10 176.24 1gnr h THR 87 N 6.15 0.79 -0.40 -5.21 2.02 -1.88 -2.90 112.91 111.48 1gnr h THR 87 Ca -0.15 -1.48 -0.08 0.00 0.77 0.00 0.00 66.41 65.47 1gnr h THR 87 Cb 1.14 1.94 -0.01 0.00 -1.74 0.00 0.00 68.15 69.48 1gnr h THR 87 CO 0.26 0.34 -0.06 0.50 0.37 0.00 0.00 175.52 176.94 1gnr h LYS 88 N 0.00 0.74 0.00 6.66 3.11 -1.95 0.89 116.57 126.02 1gnr h LYS 88 Ca -0.00 -0.26 -0.03 0.00 -2.81 0.00 0.00 60.65 57.54 1gnr h LYS 88 Cb 0.91 -0.05 -0.00 0.00 -1.00 0.00 0.00 32.23 32.08 1gnr h LYS 88 CO 0.04 0.86 -0.16 0.66 -2.81 0.00 0.00 179.45 178.04 1gnr h SER 89 N 0.55 0.00 0.16 4.20 4.64 -1.86 0.17 113.55 121.40 1gnr h SER 89 Ca 0.10 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.42 1gnr h SER 89 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1gnr h SER 89 CO 0.03 0.16 -0.08 0.15 -0.87 0.00 0.00 176.83 176.22 1gnr h PHE 90 N 0.00 -0.19 -0.87 4.77 3.57 -1.26 -3.17 116.94 119.78 1gnr h PHE 90 Ca -0.00 -0.00 0.20 0.00 3.53 0.00 0.00 57.97 61.70 1gnr h PHE 90 Cb 0.28 0.06 -0.12 0.00 2.79 0.00 0.00 35.95 38.97 1gnr h PHE 90 CO 0.00 0.23 0.38 0.93 -2.23 0.00 0.00 178.31 177.62 1gnr h GLU 91 N -0.73 0.41 0.00 1.11 5.08 -0.66 -1.58 114.58 118.22 1gnr h GLU 91 Ca -0.02 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1gnr h GLU 91 Cb 0.51 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 1gnr h GLU 91 CO 0.04 0.27 -0.04 -0.44 -1.00 0.00 0.00 179.01 177.84 1gnr h ASP 92 N 0.42 0.00 -0.98 1.42 3.32 -0.96 -3.11 116.42 116.53 1gnr h ASP 92 Ca 0.53 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.66 1gnr h ASP 92 Cb 0.96 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.44 1gnr h ASP 92 CO -0.50 0.04 0.62 0.40 -1.72 0.00 0.00 179.24 178.08 1gnr h ILE 93 N 0.00 1.04 -0.74 0.35 1.08 -1.26 -0.73 117.51 117.25 1gnr h ILE 93 Ca -0.00 -0.38 0.12 0.00 -0.39 0.00 0.00 64.86 64.22 1gnr h ILE 93 Cb 0.30 -0.15 -0.05 0.00 -3.07 0.00 0.00 36.82 33.85 1gnr h ILE 93 CO 0.00 0.20 0.49 -0.74 -0.69 0.00 0.00 178.15 177.41 1gnr h HIS 94 N 1.10 0.57 -0.20 1.37 2.76 -1.73 -0.17 115.15 118.85 1gnr h HIS 94 Ca 0.44 0.02 -0.20 0.00 -2.20 0.00 0.00 60.37 58.43 1gnr h HIS 94 Cb 0.24 -0.18 0.00 0.00 1.55 0.00 0.00 27.41 29.02 1gnr h HIS 94 CO -0.01 0.24 -0.65 1.96 -1.30 0.00 0.00 177.93 178.17 1gnr h GLN 95 N 0.51 0.74 -0.28 5.26 4.20 -1.35 -2.23 115.11 121.96 1gnr h GLN 95 Ca 0.35 -0.53 -0.09 0.00 0.06 0.00 0.00 58.65 58.45 1gnr h GLN 95 Cb 0.67 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 1gnr h GLN 95 CO -0.12 1.15 -0.19 1.88 -0.67 0.00 0.00 178.83 180.88 1gnr h TYR 96 N 0.54 0.56 -0.08 2.96 0.05 -0.87 -2.58 116.97 117.54 1gnr h TYR 96 Ca -0.02 -0.10 -0.11 0.00 0.05 0.00 0.00 58.73 58.55 1gnr h TYR 96 Cb 1.26 -0.14 0.00 0.00 1.01 0.00 0.00 36.73 38.86 1gnr h TYR 96 CO 0.07 0.67 -0.36 -0.09 -1.05 0.00 0.00 178.16 177.40 1gnr h ARG 97 N 0.46 0.39 -0.57 4.88 2.43 -1.09 -2.20 114.38 118.69 1gnr h ARG 97 Ca 0.08 -0.31 0.03 0.00 -0.81 0.00 0.00 59.98 58.97 1gnr h ARG 97 Cb 0.59 0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.16 1gnr h ARG 97 CO 0.04 0.95 0.33 1.49 -1.51 0.00 0.00 179.97 181.27 1gnr h GLU 98 N -0.07 0.63 -0.89 0.20 4.57 -1.44 0.04 114.58 117.62 1gnr h GLU 98 Ca -0.02 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.10 1gnr h GLU 98 Cb 1.01 -0.14 -0.04 0.00 -0.16 0.00 0.00 28.75 29.41 1gnr h GLU 98 CO 0.08 0.42 0.50 0.37 -1.18 0.00 0.00 179.01 179.19 1gnr h GLN 99 N 0.65 1.24 -0.17 1.92 4.15 -1.40 0.38 115.11 121.88 1gnr h GLN 99 Ca 0.23 -0.14 -0.01 0.00 0.77 0.00 0.00 58.65 59.51 1gnr h GLN 99 Cb 0.06 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 27.50 1gnr h GLN 99 CO -0.12 0.90 0.08 0.82 -1.93 0.00 0.00 178.83 178.59 1gnr h ILE 100 N 1.25 1.12 -0.95 2.39 2.04 -1.22 -1.59 117.51 120.54 1gnr h ILE 100 Ca 0.32 -0.33 -0.00 0.00 1.00 0.00 0.00 64.86 65.84 1gnr h ILE 100 Cb 0.02 1.03 -0.05 0.00 -0.74 0.00 0.00 36.82 37.09 1gnr h ILE 100 CO -0.05 0.11 0.58 0.11 0.00 0.00 0.00 178.15 178.89 1gnr h LYS 101 N 0.15 1.29 -0.32 2.37 1.57 -0.24 0.13 116.57 121.52 1gnr h LYS 101 Ca 0.06 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1gnr h LYS 101 Cb 0.10 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 1gnr h LYS 101 CO -0.01 0.90 0.20 -0.09 -0.57 0.00 0.00 179.45 179.87 1gnr h ARG 102 N 1.31 0.43 0.06 3.15 2.43 -0.12 0.57 114.38 122.21 1gnr h ARG 102 Ca 0.34 -0.04 -0.24 0.00 -0.81 0.00 0.00 59.98 59.24 1gnr h ARG 102 Cb -0.06 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.39 1gnr h ARG 102 CO -0.06 0.32 -1.06 -0.39 -1.51 0.00 0.00 179.97 177.26 1gnr h VAL 103 N 0.41 1.50 0.00 0.20 -1.51 -0.91 -3.24 116.25 112.70 1gnr h VAL 103 Ca 0.11 -2.86 0.00 0.00 -1.23 0.00 0.00 66.70 62.72 1gnr h VAL 103 Cb -0.00 2.71 0.00 0.00 -2.13 0.00 0.00 31.29 31.87 1gnr h VAL 103 CO -0.02 0.84 -0.22 0.29 -1.23 0.00 0.00 177.57 177.22 1gnr n LYS 104 N -3.59 0.02 -3.79 5.19 4.76 -0.00 -4.87 118.16 115.87 1gnr n LYS 104 Ca -0.06 0.01 -0.23 0.00 -2.87 0.00 0.00 58.31 55.16 1gnr n LYS 104 Cb 0.92 -1.52 0.01 0.00 -1.84 0.00 0.00 35.03 32.61 1gnr n LYS 104 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1gnr n ASP 105 N -1.55 -1.16 -3.65 4.39 9.92 0.17 -4.95 116.55 119.72 1gnr n ASP 105 Ca 0.06 -0.91 -0.15 0.00 -0.53 0.00 0.00 54.79 53.27 1gnr n ASP 105 Cb 0.34 -3.63 -0.08 0.00 -0.64 0.00 0.00 41.12 37.12 1gnr n ASP 105 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 1gnr s SER 106 N -4.30 -0.49 0.33 -2.24 0.15 -1.09 -5.04 113.70 101.02 1gnr s SER 106 Ca 0.04 0.70 0.22 0.00 0.70 0.00 0.00 55.95 57.60 1gnr s SER 106 Cb -0.01 0.71 0.18 0.00 -1.71 0.00 0.00 66.02 65.18 1gnr s SER 106 CO 0.84 -0.40 1.37 0.44 1.20 0.00 0.00 173.24 176.70 1gnr h ASP 107 N 4.15 0.00 -3.48 5.45 5.19 -1.92 -3.41 116.42 122.40 1gnr h ASP 107 Ca -0.28 0.00 -0.57 0.00 -0.62 0.00 0.00 57.03 55.56 1gnr h ASP 107 Cb 1.16 0.00 -0.39 0.00 0.18 0.00 0.00 39.33 40.28 1gnr h ASP 107 CO 0.30 0.08 -0.78 -0.62 -3.12 0.00 0.00 179.24 175.10 1gnr s ASP 108 N -5.94 3.51 -0.05 6.45 2.15 -1.26 -5.06 116.67 116.48 1gnr s ASP 108 Ca 0.04 -1.07 0.05 0.00 0.43 0.00 0.00 52.55 51.99 1gnr s ASP 108 Cb 0.07 -0.95 -0.02 0.00 -0.30 0.00 0.00 42.92 41.72 1gnr s ASP 108 CO 0.72 -0.27 -0.20 -0.69 -0.17 0.00 0.00 175.17 174.56 1gnr s VAL 109 N 1.57 2.56 -0.22 1.11 1.01 -1.26 -5.08 120.40 120.09 1gnr s VAL 109 Ca -0.03 -0.90 -0.41 0.00 0.00 0.00 0.00 61.98 60.63 1gnr s VAL 109 Cb -0.18 -1.97 -0.18 0.00 0.00 0.00 0.00 36.38 34.06 1gnr s VAL 109 CO -0.08 0.58 1.52 -2.65 0.00 0.00 0.00 175.10 174.47 1gnr n PRO 110 N 2.58 0.66 -3.63 2.72 -0.02 -1.26 -4.93 135.00 131.12 1gnr n PRO 110 Ca -0.17 0.24 -0.12 0.00 -2.02 0.00 0.00 63.50 61.43 1gnr n PRO 110 Cb 0.52 -1.84 -0.07 0.00 -0.02 0.00 0.00 33.50 32.09 1gnr n PRO 110 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 1gnr s MET 111 N 2.25 0.73 -0.00 -0.52 1.75 -1.26 -1.32 119.30 120.93 1gnr s MET 111 Ca 0.96 0.88 0.07 0.00 -1.25 0.00 0.00 55.69 56.35 1gnr s MET 111 Cb -1.19 0.35 -0.02 0.00 2.84 0.00 0.00 34.83 36.81 1gnr s MET 111 CO 0.65 -0.09 -0.22 0.08 -0.65 0.00 0.00 175.02 174.79 1gnr s VAL 112 N 0.37 1.78 -0.20 10.11 1.01 -0.46 -4.35 120.40 128.68 1gnr s VAL 112 Ca 0.01 -1.04 -0.17 0.00 0.00 0.00 0.00 61.98 60.78 1gnr s VAL 112 Cb -0.05 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 1gnr s VAL 112 CO -0.02 0.44 0.45 -0.22 0.00 0.00 0.00 175.10 175.75 1gnr s LEU 113 N -0.70 4.16 -0.14 3.92 0.20 -0.56 -0.42 118.68 125.13 1gnr s LEU 113 Ca 0.09 0.60 0.00 0.00 0.69 0.00 0.00 54.13 55.51 1gnr s LEU 113 Cb -0.09 -2.61 0.02 0.00 -0.43 0.00 0.00 46.19 43.09 1gnr s LEU 113 CO -0.00 -0.12 -0.14 -0.69 -0.29 0.00 0.00 176.35 175.11 1gnr s VAL 114 N 1.42 1.52 -0.51 1.68 1.01 -0.35 -0.72 120.40 124.46 1gnr s VAL 114 Ca 0.21 -0.60 -0.15 0.00 0.00 0.00 0.00 61.98 61.44 1gnr s VAL 114 Cb -0.15 -1.44 0.11 0.00 0.00 0.00 0.00 36.38 34.90 1gnr s VAL 114 CO 0.09 0.45 0.45 -0.83 0.00 0.00 0.00 175.10 175.26 1gnr s GLY 115 N 1.50 2.07 0.51 4.51 0.00 -0.85 -1.43 107.32 113.64 1gnr s GLY 115 Ca 0.05 -2.41 -0.01 0.00 0.00 0.00 0.00 44.72 42.35 1gnr s GLY 115 CO -0.10 1.14 0.75 0.21 0.00 0.00 0.00 173.10 175.10 1gnr s ASN 116 N 3.18 5.60 -0.60 1.64 3.04 0.10 -1.54 114.94 126.35 1gnr s ASN 116 Ca 0.04 0.28 -0.03 0.00 0.04 0.00 0.00 52.86 53.18 1gnr s ASN 116 Cb -0.28 -1.36 0.00 0.00 -1.54 0.00 0.00 41.25 38.08 1gnr s ASN 116 CO 0.04 -0.92 0.43 0.29 -3.04 0.00 0.00 177.10 173.90 1gnr n LYS 117 N -2.27 -3.02 0.00 0.43 5.02 -0.53 -1.47 118.16 116.33 1gnr n LYS 117 Ca 0.04 0.36 0.11 0.00 -2.02 0.00 0.00 58.31 56.80 1gnr n LYS 117 Cb 0.58 -4.01 0.65 0.00 -0.02 0.00 0.00 35.03 32.24 1gnr n LYS 117 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1gnr h ASP 119 N 0.00 0.00 -3.90 0.00 2.03 -1.91 -3.46 116.42 109.17 1gnr h ASP 119 Ca 0.00 0.00 -0.51 0.00 -0.73 0.00 0.00 57.03 55.79 1gnr h ASP 119 Cb 0.03 0.00 0.04 0.00 -0.83 0.00 0.00 39.33 38.57 1gnr h ASP 119 CO 0.00 0.00 0.52 -0.76 -1.03 0.00 0.00 179.24 177.97 1gnr s LEU 120 N -5.90 4.31 0.15 0.15 1.43 -0.92 -4.97 118.68 112.93 1gnr s LEU 120 Ca 0.06 2.37 -0.11 0.00 -1.03 0.00 0.00 54.13 55.42 1gnr s LEU 120 Cb 0.07 -3.87 -0.02 0.00 0.03 0.00 0.00 46.19 42.39 1gnr s LEU 120 CO 0.62 -0.52 1.51 0.00 0.23 0.00 0.00 176.35 178.19 1gnr h ALA 121 N 3.03 0.61 -1.85 4.21 0.00 -1.90 -3.39 119.26 119.98 1gnr h ALA 121 Ca -0.48 -0.42 -0.81 0.00 0.00 0.00 0.00 54.91 53.20 1gnr h ALA 121 Cb 1.23 -0.14 -0.28 0.00 0.00 0.00 0.00 17.79 18.59 1gnr h ALA 121 CO 0.64 0.66 0.78 0.00 0.00 0.00 0.00 179.25 181.33 1gnr n ALA 122 N -2.53 5.27 -1.78 0.00 0.00 -1.26 -5.02 120.51 115.19 1gnr n ALA 122 Ca -0.01 -4.79 -0.37 0.00 0.00 0.00 0.00 53.44 48.27 1gnr n ALA 122 Cb 0.50 -2.30 -0.06 0.00 0.00 0.00 0.00 19.45 17.59 1gnr n ALA 122 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1gnr s ARG 123 N -2.97 4.61 0.00 0.00 1.70 -1.26 -4.58 118.95 116.44 1gnr s ARG 123 Ca 0.32 1.36 0.08 0.00 -0.47 0.00 0.00 55.73 57.02 1gnr s ARG 123 Cb 0.07 -2.85 -0.03 0.00 -0.57 0.00 0.00 34.95 31.56 1gnr s ARG 123 CO 0.08 0.29 0.47 0.25 -1.08 0.00 0.00 175.30 175.32 1gnr n THR 124 N 0.66 0.00 -3.95 4.99 -2.24 0.64 -4.90 114.28 109.49 1gnr n THR 124 Ca 0.02 -0.39 -0.30 0.00 -2.27 0.00 0.00 64.05 61.10 1gnr n THR 124 Cb 0.50 1.06 -0.16 0.00 -2.10 0.00 0.00 70.33 69.63 1gnr n THR 124 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1gnr s VAL 125 N -1.35 1.56 0.51 2.28 1.01 -0.78 -4.82 120.40 118.80 1gnr s VAL 125 Ca 0.05 -1.23 -0.22 0.00 0.00 0.00 0.00 61.98 60.58 1gnr s VAL 125 Cb 0.06 -1.81 -0.06 0.00 0.00 0.00 0.00 36.38 34.57 1gnr s VAL 125 CO 0.23 -0.09 1.24 -1.61 0.00 0.00 0.00 175.10 174.87 1gnr s GLU 126 N 1.38 3.42 0.25 2.72 0.41 -1.26 -4.91 118.70 120.71 1gnr s GLU 126 Ca -0.06 1.94 -0.03 0.00 -0.41 0.00 0.00 54.97 56.41 1gnr s GLU 126 Cb -0.19 -2.27 0.48 0.00 -1.78 0.00 0.00 34.13 30.37 1gnr s GLU 126 CO -0.06 -0.88 1.75 1.03 -0.49 0.00 0.00 175.26 176.61 1gnr h SER 127 N 1.65 0.41 -1.01 -0.19 0.87 -1.99 -0.64 113.55 112.65 1gnr h SER 127 Ca -0.50 0.10 0.12 0.00 -1.23 0.00 0.00 61.79 60.28 1gnr h SER 127 Cb 1.27 0.04 -0.09 0.00 -0.44 0.00 0.00 62.40 63.19 1gnr h SER 127 CO 0.58 0.17 0.63 -0.09 -0.53 0.00 0.00 176.83 177.60 1gnr h ARG 128 N 0.54 0.96 0.00 2.24 9.65 -1.98 0.38 114.38 126.17 1gnr h ARG 128 Ca 0.43 -0.06 0.01 0.00 -1.10 0.00 0.00 59.98 59.27 1gnr h ARG 128 Cb 0.62 -0.22 -0.02 0.00 -1.39 0.00 0.00 29.97 28.97 1gnr h ARG 128 CO -0.37 0.63 -0.08 0.37 2.80 0.00 0.00 179.97 183.32 1gnr h GLN 129 N 0.99 -0.14 -0.07 0.20 4.15 -1.49 -1.62 115.11 117.13 1gnr h GLN 129 Ca 0.50 0.01 -0.23 0.00 0.77 0.00 0.00 58.65 59.70 1gnr h GLN 129 Cb 0.51 0.03 0.01 0.00 0.21 0.00 0.00 27.48 28.24 1gnr h GLN 129 CO -0.27 -0.09 -0.88 0.00 -1.93 0.00 0.00 178.83 175.65 1gnr h ALA 130 N 0.83 0.31 -0.77 3.38 0.00 -1.10 -2.50 119.26 119.41 1gnr h ALA 130 Ca 0.03 -0.65 0.14 0.00 0.00 0.00 0.00 54.91 54.43 1gnr h ALA 130 Cb 0.19 -0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.88 1gnr h ALA 130 CO -0.09 0.72 0.34 0.37 0.00 0.00 0.00 179.25 180.59 1gnr h GLN 131 N 0.40 0.48 -0.00 0.00 5.75 -0.09 0.11 115.11 121.74 1gnr h GLN 131 Ca -0.08 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.39 1gnr h GLN 131 Cb 1.51 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 29.95 1gnr h GLN 131 CO 0.17 0.32 -0.33 -0.25 -2.65 0.00 0.00 178.83 176.08 1gnr n ASP 132 N -4.96 0.77 -0.01 -0.69 9.92 -0.63 -1.02 116.55 119.93 1gnr n ASP 132 Ca 0.15 -0.60 -0.16 0.00 -0.53 0.00 0.00 54.79 53.64 1gnr n ASP 132 Cb 0.41 0.15 -0.12 0.00 -0.64 0.00 0.00 41.12 40.92 1gnr n ASP 132 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 1gnr h LEU 133 N 0.69 0.30 -0.23 0.64 5.85 -0.61 -2.27 115.31 119.68 1gnr h LEU 133 Ca 0.00 -0.84 0.04 0.00 0.84 0.00 0.00 57.88 57.93 1gnr h LEU 133 Cb 0.49 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 1gnr h LEU 133 CO 0.00 1.10 -0.03 0.00 -0.34 0.00 0.00 178.44 179.17 1gnr h ALA 134 N 0.20 0.17 -0.67 1.25 0.00 -0.80 0.41 119.26 119.82 1gnr h ALA 134 Ca -0.06 0.08 0.13 0.00 0.00 0.00 0.00 54.91 55.06 1gnr h ALA 134 Cb 1.18 0.14 -0.09 0.00 0.00 0.00 0.00 17.79 19.03 1gnr h ALA 134 CO 0.08 -0.45 0.20 -0.09 0.00 0.00 0.00 179.25 178.98 1gnr h ARG 135 N 0.03 0.33 0.00 0.00 9.65 -1.17 0.35 114.38 123.57 1gnr h ARG 135 Ca 0.11 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.96 1gnr h ARG 135 Cb 0.15 -0.07 -0.00 0.00 -1.39 0.00 0.00 29.97 28.66 1gnr h ARG 135 CO -0.21 0.22 -0.04 1.03 2.80 0.00 0.00 179.97 183.77 1gnr h SER 136 N 0.34 0.00 0.48 -3.80 0.87 -0.49 -0.41 113.55 110.55 1gnr h SER 136 Ca 0.36 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.92 1gnr h SER 136 Cb 0.54 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 1gnr h SER 136 CO -0.41 0.04 -1.00 -1.22 -0.53 0.00 0.00 176.83 173.71 1gnr n TYR 137 N -4.26 0.31 -2.93 2.24 4.01 -0.03 -4.99 117.16 111.52 1gnr n TYR 137 Ca -0.03 0.09 -0.10 0.00 -0.16 0.00 0.00 57.90 57.70 1gnr n TYR 137 Cb 0.12 -0.47 0.04 0.00 -0.31 0.00 0.00 39.34 38.72 1gnr n TYR 137 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gnr n GLY 138 N 1.36 0.19 3.13 2.72 0.00 0.11 -5.06 105.19 107.64 1gnr n GLY 138 Ca 0.02 -0.22 -0.12 0.00 0.00 0.00 0.00 46.02 45.69 1gnr n GLY 138 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1gnr s ILE 139 N -3.16 0.69 0.62 -0.61 -4.36 -0.64 -5.03 121.20 108.71 1gnr s ILE 139 Ca 0.20 -1.54 -0.18 0.00 -0.26 0.00 0.00 60.65 58.87 1gnr s ILE 139 Cb -0.09 -1.20 -0.02 0.00 1.25 0.00 0.00 42.46 42.40 1gnr s ILE 139 CO 0.35 -0.62 1.22 -2.84 0.24 0.00 0.00 174.94 173.29 1gnr s PRO 140 N -2.74 2.79 -0.15 0.37 0.02 -1.26 -4.28 135.00 129.74 1gnr s PRO 140 Ca 0.02 1.85 0.01 0.00 0.02 0.00 0.00 61.00 62.90 1gnr s PRO 140 Cb -0.02 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.60 1gnr s PRO 140 CO -0.02 -1.36 -0.18 -0.47 -0.33 0.00 0.00 177.00 174.65 1gnr s TYR 141 N -1.63 2.75 -0.06 6.54 5.04 -1.26 -1.49 117.35 127.24 1gnr s TYR 141 Ca 0.78 -1.20 0.01 0.00 -2.44 0.00 0.00 57.07 54.22 1gnr s TYR 141 Cb -0.31 -1.87 0.02 0.00 0.35 0.00 0.00 41.96 40.14 1gnr s TYR 141 CO 0.36 -0.56 -0.08 0.42 -1.34 0.00 0.00 175.55 174.36 1gnr s ILE 142 N 0.89 0.81 -0.04 3.14 1.01 0.10 -4.99 121.20 122.12 1gnr s ILE 142 Ca -0.04 -0.27 -0.17 0.00 0.00 0.00 0.00 60.65 60.16 1gnr s ILE 142 Cb -0.15 -0.79 -0.05 0.00 0.01 0.00 0.00 42.46 41.48 1gnr s ILE 142 CO -0.02 0.29 0.48 -1.61 0.00 0.00 0.00 174.94 174.08 1gnr s GLU 143 N 0.90 4.18 0.32 2.79 2.02 -1.26 -2.00 118.70 125.65 1gnr s GLU 143 Ca -0.11 0.50 0.06 0.00 0.02 0.00 0.00 54.97 55.44 1gnr s GLU 143 Cb -0.15 -3.33 -0.06 0.00 0.10 0.00 0.00 34.13 30.69 1gnr s GLU 143 CO 0.01 0.42 -0.02 0.95 0.02 0.00 0.00 175.26 176.65 1gnr s THR 144 N -0.26 1.61 -0.12 3.63 -4.23 -0.59 -4.38 115.64 111.30 1gnr s THR 144 Ca 0.26 -2.07 -0.04 0.00 -1.18 0.00 0.00 61.69 58.66 1gnr s THR 144 Cb -0.17 -2.66 0.06 0.00 1.34 0.00 0.00 72.50 71.08 1gnr s THR 144 CO 0.13 -0.16 0.16 -0.55 -0.54 0.00 0.00 174.62 173.66 1gnr s SER 145 N -3.51 1.11 0.45 3.99 0.15 0.53 -1.12 113.70 115.31 1gnr s SER 145 Ca 0.33 0.08 0.18 0.00 0.70 0.00 0.00 55.95 57.23 1gnr s SER 145 Cb 0.06 0.20 1.06 0.00 -1.71 0.00 0.00 66.02 65.64 1gnr s SER 145 CO 0.14 -0.28 1.98 0.00 1.20 0.00 0.00 173.24 176.28 1gnr h ALA 146 N 8.37 1.51 -0.14 5.45 0.00 -1.90 -0.29 119.26 132.26 1gnr h ALA 146 Ca -0.14 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 1gnr h ALA 146 Cb 1.13 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1gnr h ALA 146 CO 0.19 0.26 -0.09 -0.22 0.00 0.00 0.00 179.25 179.39 1gnr h LYS 147 N 0.00 0.31 -0.01 0.00 3.64 -1.94 -3.35 116.57 115.21 1gnr h LYS 147 Ca -0.00 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 59.24 1gnr h LYS 147 Cb 0.40 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1gnr h LYS 147 CO 0.03 0.65 -0.71 0.25 -2.27 0.00 0.00 179.45 177.40 1gnr n THR 148 N -4.63 0.00 -0.97 1.00 -2.24 -1.22 -4.88 114.28 101.33 1gnr n THR 148 Ca -0.06 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1gnr n THR 148 Cb 0.31 1.12 0.00 0.00 -2.10 0.00 0.00 70.33 69.66 1gnr n THR 148 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1gnr n ARG 149 N -0.79 0.00 -1.71 -0.78 3.00 -0.14 -5.00 116.66 111.25 1gnr n ARG 149 Ca 0.06 0.00 -0.43 0.00 -0.00 0.00 0.00 57.85 57.48 1gnr n ARG 149 Cb 0.38 -2.45 -0.03 0.00 0.00 0.00 0.00 32.46 30.35 1gnr n ARG 149 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1gnr n GLN 150 N -2.00 2.61 -0.15 -0.14 3.00 -1.09 -2.20 117.38 117.40 1gnr n GLN 150 Ca 0.00 0.94 0.00 0.00 -0.01 0.00 0.00 57.00 57.93 1gnr n GLN 150 Cb 0.00 -2.76 0.00 0.00 0.00 0.00 0.00 30.24 27.48 1gnr n GLN 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1gnr n GLY 151 N 3.78 1.74 0.13 1.08 0.00 -1.26 -0.34 105.19 110.33 1gnr n GLY 151 Ca 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 1gnr n GLY 151 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1gnr h VAL 152 N 0.00 0.90 -0.06 1.61 2.07 -1.72 -0.31 116.25 118.73 1gnr h VAL 152 Ca 0.00 -0.38 -0.16 0.00 0.82 0.00 0.00 66.70 66.98 1gnr h VAL 152 Cb 0.00 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1gnr h VAL 152 CO 0.00 0.09 -0.68 -0.33 0.02 0.00 0.00 177.57 176.66 1gnr h GLU 153 N -0.43 0.27 -0.29 1.57 5.08 -1.90 -2.73 114.58 116.15 1gnr h GLU 153 Ca -0.02 -0.21 0.04 0.00 -1.00 0.00 0.00 59.36 58.16 1gnr h GLU 153 Cb 0.33 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.56 1gnr h GLU 153 CO 0.04 0.85 -0.45 -0.44 -1.00 0.00 0.00 179.01 178.02 1gnr h ASP 154 N 0.19 -1.48 -0.38 1.42 5.19 -1.92 0.26 116.42 119.70 1gnr h ASP 154 Ca -0.02 0.19 0.06 0.00 -0.62 0.00 0.00 57.03 56.65 1gnr h ASP 154 Cb 1.23 0.60 -0.06 0.00 0.18 0.00 0.00 39.33 41.28 1gnr h ASP 154 CO 0.11 -0.33 0.04 0.00 -3.12 0.00 0.00 179.24 175.93 1gnr h ALA 155 N -0.33 0.38 -0.29 3.45 0.00 -0.95 0.73 119.26 122.25 1gnr h ALA 155 Ca 0.05 0.09 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 1gnr h ALA 155 Cb 0.49 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1gnr h ALA 155 CO -0.46 -0.36 -0.49 0.74 0.00 0.00 0.00 179.25 178.68 1gnr h PHE 156 N 0.15 0.96 0.04 0.00 0.04 -1.17 -2.56 116.94 114.39 1gnr h PHE 156 Ca 0.19 -0.32 -0.24 0.00 2.80 0.00 0.00 57.97 60.39 1gnr h PHE 156 Cb 0.24 -0.19 0.01 0.00 2.20 0.00 0.00 35.95 38.21 1gnr h PHE 156 CO -0.23 1.11 -1.03 1.88 -0.60 0.00 0.00 178.31 179.44 1gnr h TYR 157 N 0.61 0.65 -0.45 -0.55 -1.99 -0.35 -2.63 116.97 112.26 1gnr h TYR 157 Ca 0.03 -0.38 0.01 0.00 2.00 0.00 0.00 58.73 60.39 1gnr h TYR 157 Cb 1.06 -0.06 -0.02 0.00 2.00 0.00 0.00 36.73 39.70 1gnr h TYR 157 CO 0.06 1.22 0.29 1.15 -0.00 0.00 0.00 178.16 180.88 1gnr h THR 158 N 0.21 1.09 -0.74 -2.88 2.02 -0.83 -1.53 112.91 110.26 1gnr h THR 158 Ca -0.10 -0.20 0.03 0.00 0.77 0.00 0.00 66.41 66.91 1gnr h THR 158 Cb 1.69 0.45 -0.05 0.00 -1.74 0.00 0.00 68.15 68.51 1gnr h THR 158 CO 0.18 0.11 0.46 0.25 0.37 0.00 0.00 175.52 176.89 1gnr h LEU 159 N 0.59 0.76 -1.29 2.58 5.85 -1.40 -0.17 115.31 122.22 1gnr h LEU 159 Ca 0.17 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.93 1gnr h LEU 159 Cb -0.04 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.78 1gnr h LEU 159 CO -0.05 0.52 0.50 0.58 -0.34 0.00 0.00 178.44 179.65 1gnr h VAL 160 N 0.90 1.11 -0.02 1.05 2.07 -1.01 -1.72 116.25 118.63 1gnr h VAL 160 Ca 0.30 -0.32 -0.16 0.00 0.82 0.00 0.00 66.70 67.35 1gnr h VAL 160 Cb 0.04 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 29.90 1gnr h VAL 160 CO -0.12 0.17 -0.72 0.03 0.02 0.00 0.00 177.57 176.95 1gnr h ARG 161 N 0.92 0.12 -0.64 1.57 3.08 -0.68 -2.02 114.38 116.74 1gnr h ARG 161 Ca 0.30 -0.10 0.05 0.00 0.07 0.00 0.00 59.98 60.30 1gnr h ARG 161 Cb 0.05 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.08 1gnr h ARG 161 CO -0.09 0.78 0.36 0.93 -1.07 0.00 0.00 179.97 180.88 1gnr h GLU 162 N 0.08 0.65 -0.36 0.04 4.39 -0.38 -1.59 114.58 117.42 1gnr h GLU 162 Ca -0.02 -0.04 -0.11 0.00 0.34 0.00 0.00 59.36 59.53 1gnr h GLU 162 Cb 1.27 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.75 1gnr h GLU 162 CO 0.10 0.43 -0.24 0.82 -1.16 0.00 0.00 179.01 178.97 1gnr h ILE 163 N 0.67 1.27 -0.90 3.13 2.04 -1.19 -2.96 117.51 119.58 1gnr h ILE 163 Ca 0.28 -1.34 0.00 0.00 1.00 0.00 0.00 64.86 64.80 1gnr h ILE 163 Cb 0.15 1.26 -0.04 0.00 -0.74 0.00 0.00 36.82 37.44 1gnr h ILE 163 CO -0.16 0.44 0.57 0.03 0.00 0.00 0.00 178.15 179.03 1gnr h ARG 164 N 0.62 1.20 -0.00 2.37 3.08 -0.55 -2.02 114.38 119.08 1gnr h ARG 164 Ca 0.08 -0.09 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1gnr h ARG 164 Cb 0.73 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 30.52 1gnr h ARG 164 CO 0.06 0.82 -0.08 1.04 -1.07 0.00 0.00 179.97 180.73 1gnr n GLN 165 N -4.38 0.32 0.00 0.04 6.02 -0.85 -5.11 117.38 113.43 1gnr n GLN 165 Ca 0.10 -0.06 0.15 0.00 -0.01 0.00 0.00 57.00 57.18 1gnr n GLN 165 Cb 0.04 -1.50 0.88 0.00 1.02 0.00 0.00 30.24 30.68 1gnr n GLN 165 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63