#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e7d s THR 12 N 0.00 1.17 -1.11 -5.08 -4.23 -1.04 -4.83 115.64 100.52 2e7d s THR 12 Ca 0.00 -1.70 -0.05 0.00 -1.18 0.00 0.00 61.69 58.76 2e7d s THR 12 Cb 0.00 -1.48 0.01 0.00 1.34 0.00 0.00 72.50 72.37 2e7d s THR 12 CO 0.00 -0.49 0.95 -0.67 -0.54 0.00 0.00 174.62 173.87 2e7d n ASP 13 N 0.50 -4.32 -4.55 3.99 4.64 -1.26 -0.76 116.55 114.79 2e7d n ASP 13 Ca -0.15 -0.49 -0.39 0.00 -1.38 0.00 0.00 54.79 52.38 2e7d n ASP 13 Cb 0.57 -4.40 -0.03 0.00 -1.04 0.00 0.00 41.12 36.23 2e7d n ASP 13 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 2e7d s LEU 14 N -6.13 3.27 0.07 -2.67 1.43 -1.26 -4.37 118.68 109.02 2e7d s LEU 14 Ca 0.31 0.25 0.06 0.00 -1.03 0.00 0.00 54.13 53.72 2e7d s LEU 14 Cb -0.14 -2.53 -0.04 0.00 0.03 0.00 0.00 46.19 43.51 2e7d s LEU 14 CO 0.62 -2.33 -0.10 -1.10 0.23 0.00 0.00 176.35 173.68 2e7d s GLN 15 N 6.91 2.26 0.59 1.70 -1.52 -0.52 -4.94 119.66 124.14 2e7d s GLN 15 Ca 0.64 -0.92 -0.18 0.00 -1.95 0.00 0.00 55.36 52.95 2e7d s GLN 15 Cb -0.12 -2.35 -0.04 0.00 -0.22 0.00 0.00 33.01 30.28 2e7d s GLN 15 CO 0.20 0.54 1.12 -1.21 -0.25 0.00 0.00 175.29 175.69 2e7d s GLU 16 N -1.88 3.14 0.31 2.91 2.02 -1.26 -0.68 118.70 123.27 2e7d s GLU 16 Ca 0.19 1.53 0.05 0.00 0.02 0.00 0.00 54.97 56.76 2e7d s GLU 16 Cb -0.11 -1.98 -0.03 0.00 0.10 0.00 0.00 34.13 32.10 2e7d s GLU 16 CO 0.11 -1.01 0.22 0.00 0.02 0.00 0.00 175.26 174.60 2e7d s ALA 17 N -1.99 1.87 -0.44 5.21 0.00 -0.72 -4.74 121.76 120.94 2e7d s ALA 17 Ca 0.70 -1.88 0.02 0.00 0.00 0.00 0.00 51.96 50.81 2e7d s ALA 17 Cb -0.23 1.35 0.12 0.00 0.00 0.00 0.00 23.12 24.36 2e7d s ALA 17 CO 0.33 -0.60 0.19 -1.01 0.00 0.00 0.00 175.76 174.67 2e7d s HIS 18 N -3.57 3.50 0.13 0.00 3.76 -1.26 -3.88 115.29 113.98 2e7d s HIS 18 Ca 0.38 -2.96 0.08 0.00 -0.15 0.00 0.00 55.06 52.41 2e7d s HIS 18 Cb 0.04 -2.96 -0.04 0.00 1.11 0.00 0.00 32.58 30.72 2e7d s HIS 18 CO 0.22 -0.87 -0.18 -0.06 -0.85 0.00 0.00 174.74 173.01 2e7d s PHE 19 N 0.41 1.69 -0.05 1.40 0.40 -1.26 0.60 117.98 121.18 2e7d s PHE 19 Ca 0.13 -0.47 -0.16 0.00 -0.60 0.00 0.00 56.93 55.83 2e7d s PHE 19 Cb -0.22 -0.88 0.03 0.00 0.51 0.00 0.00 43.02 42.46 2e7d s PHE 19 CO -0.04 0.24 0.36 0.54 0.70 0.00 0.00 175.22 177.02 2e7d s VAL 20 N -1.80 0.04 -0.46 -0.44 0.11 -1.02 -4.71 120.40 112.13 2e7d s VAL 20 Ca 0.11 -0.32 -0.18 0.00 -2.93 0.00 0.00 61.98 58.66 2e7d s VAL 20 Cb -0.07 -0.64 0.04 0.00 -1.53 0.00 0.00 36.38 34.19 2e7d s VAL 20 CO 0.05 -0.18 0.50 -0.69 -3.33 0.00 0.00 175.10 171.45 2e7d s VAL 21 N -0.98 5.04 0.39 2.04 1.01 -1.26 -0.97 120.40 125.67 2e7d s VAL 21 Ca -0.10 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.36 2e7d s VAL 21 Cb -0.04 -4.15 -0.01 0.00 0.00 0.00 0.00 36.38 32.18 2e7d s VAL 21 CO 0.04 -0.59 0.57 -0.36 0.00 0.00 0.00 175.10 174.77 2e7d s PHE 22 N 2.21 3.27 0.70 5.22 0.40 0.74 0.05 117.98 130.56 2e7d s PHE 22 Ca 0.12 0.13 -0.11 0.00 -0.60 0.00 0.00 56.93 56.46 2e7d s PHE 22 Cb -0.19 -2.10 0.01 0.00 0.51 0.00 0.00 43.02 41.25 2e7d s PHE 22 CO 0.12 -0.12 1.06 -1.21 0.70 0.00 0.00 175.22 175.77 2e7d s GLU 23 N -4.37 2.94 0.25 0.44 2.02 -0.36 -1.33 118.70 118.28 2e7d s GLU 23 Ca 0.45 0.81 -0.04 0.00 0.02 0.00 0.00 54.97 56.21 2e7d s GLU 23 Cb -0.10 -2.00 0.45 0.00 0.10 0.00 0.00 34.13 32.58 2e7d s GLU 23 CO 0.35 -1.06 1.76 0.66 0.02 0.00 0.00 175.26 176.99 2e7d h SER 24 N -0.68 0.46 0.00 -0.19 4.64 -1.87 -3.33 113.55 112.57 2e7d h SER 24 Ca -0.44 0.08 -0.08 0.00 -0.47 0.00 0.00 61.79 60.87 2e7d h SER 24 Cb 1.22 0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 63.31 2e7d h SER 24 CO 0.59 0.22 -1.45 -0.62 -0.87 0.00 0.00 176.83 174.70 2e7d n GLU 25 N -4.89 1.86 -4.30 4.77 1.02 -1.26 -4.91 120.64 112.93 2e7d n GLU 25 Ca 0.14 -0.03 -0.34 0.00 -0.02 0.00 0.00 57.16 56.92 2e7d n GLU 25 Cb 0.37 -1.19 -0.09 0.00 -0.02 0.00 0.00 31.44 30.51 2e7d n GLU 25 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2e7d s GLU 26 N -2.31 2.90 -1.38 3.49 2.02 -1.25 -5.01 118.70 117.15 2e7d s GLU 26 Ca -0.03 -0.51 -0.14 0.00 0.02 0.00 0.00 54.97 54.31 2e7d s GLU 26 Cb 0.03 -2.74 -0.02 0.00 0.10 0.00 0.00 34.13 31.50 2e7d s GLU 26 CO 0.31 0.66 2.36 0.09 0.02 0.00 0.00 175.26 178.69 2e7d n ASN 27 N 1.66 4.88 -3.74 -0.19 5.03 -1.26 -3.41 115.26 118.23 2e7d n ASN 27 Ca -0.16 -2.73 -0.11 0.00 0.87 0.00 0.00 54.58 52.45 2e7d n ASN 27 Cb 0.53 -1.54 -0.07 0.00 -1.02 0.00 0.00 39.78 37.68 2e7d n ASN 27 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 2e7d s SER 28 N 3.20 -0.12 0.19 6.41 0.01 -1.26 -5.02 113.70 117.10 2e7d s SER 28 Ca 0.53 -0.24 -0.32 0.00 1.31 0.00 0.00 55.95 57.23 2e7d s SER 28 Cb 0.15 0.38 -0.15 0.00 0.21 0.00 0.00 66.02 66.60 2e7d s SER 28 CO -0.05 -0.66 1.14 -0.62 0.41 0.00 0.00 173.24 173.46 2e7d n GLU 29 N 0.40 1.20 -3.02 12.44 4.71 -1.26 -1.23 120.64 133.88 2e7d n GLU 29 Ca -0.18 0.42 -0.30 0.00 -0.01 0.00 0.00 57.16 57.09 2e7d n GLU 29 Cb 0.60 -1.91 -0.04 0.00 -1.01 0.00 0.00 31.44 29.09 2e7d n GLU 29 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 2e7d s SER 30 N -0.07 6.54 0.59 1.62 0.15 0.11 -4.56 113.70 118.08 2e7d s SER 30 Ca 0.71 1.05 0.34 0.00 0.70 0.00 0.00 55.95 58.75 2e7d s SER 30 Cb -0.83 -2.29 1.85 0.00 -1.71 0.00 0.00 66.02 63.04 2e7d s SER 30 CO 0.53 -0.32 2.21 -0.37 1.20 0.00 0.00 173.24 176.49 2e7d h VAL 31 N 1.30 0.34 0.00 4.45 -1.51 -1.93 -0.60 116.25 118.29 2e7d h VAL 31 Ca -0.47 -0.22 -0.04 0.00 -1.23 0.00 0.00 66.70 64.74 2e7d h VAL 31 Cb 1.19 1.16 -0.01 0.00 -2.13 0.00 0.00 31.29 31.50 2e7d h VAL 31 CO 0.65 0.04 -0.18 0.24 -1.23 0.00 0.00 177.57 177.09 2e7d h MET 32 N 0.00 0.00 0.00 5.19 2.86 -1.91 -1.38 114.93 119.68 2e7d h MET 32 Ca -0.00 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2e7d h MET 32 Cb 0.15 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.81 2e7d h MET 32 CO 0.00 0.18 -0.02 0.22 1.06 0.00 0.00 176.91 178.35 2e7d h ASP 33 N 0.00 0.00 0.75 1.22 3.58 -1.31 0.32 116.42 120.98 2e7d h ASP 33 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2e7d h ASP 33 Cb 0.49 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.54 2e7d h ASP 33 CO 0.02 0.02 0.00 0.61 -2.88 0.00 0.00 179.24 177.02 2e7d n GLY 34 N -1.14 -1.29 1.19 -0.78 0.00 -0.52 -2.98 105.19 99.66 2e7d n GLY 34 Ca -0.03 -0.10 0.09 0.00 0.00 0.00 0.00 46.02 45.98 2e7d n GLY 34 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2e7d n PHE 35 N -1.44 1.02 -4.26 1.61 3.01 0.11 -4.92 117.46 112.60 2e7d n PHE 35 Ca 0.08 -0.59 -0.18 0.00 1.01 0.00 0.00 57.45 57.77 2e7d n PHE 35 Cb 0.27 -0.14 -0.13 0.00 -0.01 0.00 0.00 39.48 39.47 2e7d n PHE 35 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 2e7d s VAL 36 N -1.54 0.85 0.69 -4.37 -7.23 -1.16 -0.61 120.40 107.03 2e7d s VAL 36 Ca 0.42 -0.86 -0.11 0.00 -1.81 0.00 0.00 61.98 59.62 2e7d s VAL 36 Cb 0.26 -0.79 0.01 0.00 0.56 0.00 0.00 36.38 36.41 2e7d s VAL 36 CO 0.22 -0.05 1.07 -1.61 -0.31 0.00 0.00 175.10 174.42 2e7d s GLU 37 N -1.02 2.97 0.03 4.82 2.02 0.20 -4.88 118.70 122.84 2e7d s GLU 37 Ca -0.01 0.72 0.02 0.00 0.02 0.00 0.00 54.97 55.72 2e7d s GLU 37 Cb -0.07 -2.01 -0.02 0.00 0.10 0.00 0.00 34.13 32.12 2e7d s GLU 37 CO 0.01 -1.02 -0.07 -1.01 0.02 0.00 0.00 175.26 173.19 2e7d s HIS 38 N -3.18 0.58 0.78 1.61 3.76 -1.26 -4.50 115.29 113.08 2e7d s HIS 38 Ca 0.58 -0.46 -0.09 0.00 -0.15 0.00 0.00 55.06 54.93 2e7d s HIS 38 Cb -0.12 -0.36 0.10 0.00 1.11 0.00 0.00 32.58 33.31 2e7d s HIS 38 CO 0.54 -0.09 1.10 -1.25 -0.85 0.00 0.00 174.74 174.19 2e7d s PRO 39 N -1.42 1.81 0.97 8.40 0.04 -1.26 -5.16 135.00 138.38 2e7d s PRO 39 Ca -0.10 -0.29 -0.16 0.00 0.04 0.00 0.00 61.00 60.50 2e7d s PRO 39 Cb -0.09 -2.08 0.22 0.00 0.04 0.00 0.00 34.50 32.59 2e7d s PRO 39 CO 0.00 -1.55 1.33 -0.06 0.04 0.00 0.00 177.00 176.76 2e7d s PHE 40 N -3.43 1.32 0.06 0.56 2.99 -1.25 -4.91 117.98 113.32 2e7d s PHE 40 Ca 0.64 0.19 -0.02 0.00 0.00 0.00 0.00 56.93 57.74 2e7d s PHE 40 Cb -0.09 -4.16 -0.04 0.00 0.00 0.00 0.00 43.02 38.74 2e7d s PHE 40 CO 0.47 -2.76 -0.01 0.71 -0.00 0.00 0.00 175.22 173.64 2e7d s TYR 41 N -3.90 0.52 -0.08 0.36 2.02 -0.60 -1.75 117.35 113.92 2e7d s TYR 41 Ca 0.76 -1.05 0.02 0.00 -0.37 0.00 0.00 57.07 56.44 2e7d s TYR 41 Cb -0.02 -0.37 0.01 0.00 -0.40 0.00 0.00 41.96 41.18 2e7d s TYR 41 CO 0.53 -0.40 -0.14 0.95 -1.57 0.00 0.00 175.55 174.92 2e7d s THR 42 N -3.93 1.32 0.33 -0.71 -4.23 0.15 0.18 115.64 108.75 2e7d s THR 42 Ca 0.08 -0.57 0.04 0.00 -1.18 0.00 0.00 61.69 60.06 2e7d s THR 42 Cb 0.08 -1.20 -0.03 0.00 1.34 0.00 0.00 72.50 72.68 2e7d s THR 42 CO -0.09 0.40 0.18 0.00 -0.54 0.00 0.00 174.62 174.56 2e7d s ALA 43 N 0.73 2.14 -0.04 3.99 0.00 -0.36 -1.44 121.76 126.78 2e7d s ALA 43 Ca -0.13 -1.71 0.05 0.00 0.00 0.00 0.00 51.96 50.18 2e7d s ALA 43 Cb -0.16 1.13 -0.02 0.00 0.00 0.00 0.00 23.12 24.07 2e7d s ALA 43 CO 0.03 -0.50 -0.19 0.99 0.00 0.00 0.00 175.76 176.08 2e7d s THR 44 N -3.49 2.60 -0.13 0.00 2.01 0.06 -0.77 115.64 115.92 2e7d s THR 44 Ca 0.34 -0.89 -0.06 0.00 0.31 0.00 0.00 61.69 61.38 2e7d s THR 44 Cb 0.04 -1.98 0.05 0.00 0.01 0.00 0.00 72.50 70.63 2e7d s THR 44 CO 0.19 0.58 0.30 -0.22 -0.69 0.00 0.00 174.62 174.78 2e7d s LEU 45 N -0.60 0.17 -1.41 4.42 0.20 0.64 -2.50 118.68 119.60 2e7d s LEU 45 Ca 0.09 0.65 -0.09 0.00 0.69 0.00 0.00 54.13 55.47 2e7d s LEU 45 Cb -0.11 0.92 0.06 0.00 -0.43 0.00 0.00 46.19 46.63 2e7d s LEU 45 CO 0.00 -0.18 0.62 0.59 -0.29 0.00 0.00 176.35 177.09 2e7d n ASN 46 N 4.39 -4.62 -0.15 3.68 3.02 -1.26 -0.45 115.26 119.87 2e7d n ASN 46 Ca -0.22 -0.43 -0.02 0.00 -0.03 0.00 0.00 54.58 53.88 2e7d n ASN 46 Cb 0.53 -3.76 -0.01 0.00 -0.61 0.00 0.00 39.78 35.93 2e7d n ASN 46 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2e7d n GLY 47 N -1.37 0.45 3.34 7.41 0.00 -1.26 -5.00 105.19 108.75 2e7d n GLY 47 Ca -0.03 -0.12 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 2e7d n GLY 47 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2e7d s GLN 48 N -1.30 1.69 -0.16 1.61 -0.21 0.40 -5.11 119.66 116.59 2e7d s GLN 48 Ca 0.00 -1.13 -0.15 0.00 0.02 0.00 0.00 55.36 54.10 2e7d s GLN 48 Cb 0.00 -1.91 -0.04 0.00 1.00 0.00 0.00 33.01 32.05 2e7d s GLN 48 CO 0.00 0.49 0.34 0.21 -2.12 0.00 0.00 175.29 174.21 2e7d s LYS 49 N -1.37 4.27 0.22 2.91 2.20 -1.26 -0.26 119.74 126.46 2e7d s LYS 49 Ca 0.12 0.18 0.09 0.00 -0.36 0.00 0.00 55.97 55.99 2e7d s LYS 49 Cb -0.10 -3.44 -0.05 0.00 -1.51 0.00 0.00 37.83 32.74 2e7d s LYS 49 CO 0.03 0.20 -0.16 0.71 -0.36 0.00 0.00 175.35 175.76 2e7d s TYR 50 N 0.58 1.87 -0.01 4.03 1.51 0.05 -0.66 117.35 124.71 2e7d s TYR 50 Ca 0.19 -0.50 -0.20 0.00 -1.01 0.00 0.00 57.07 55.54 2e7d s TYR 50 Cb -0.14 -0.85 -0.05 0.00 -0.11 0.00 0.00 41.96 40.81 2e7d s TYR 50 CO 0.05 0.45 0.59 0.08 -1.11 0.00 0.00 175.55 175.61 2e7d s VAL 51 N -2.79 4.93 -0.11 0.71 1.01 0.60 -1.22 120.40 123.54 2e7d s VAL 51 Ca 0.24 1.23 -0.02 0.00 0.00 0.00 0.00 61.98 63.42 2e7d s VAL 51 Cb -0.02 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.40 2e7d s VAL 51 CO 0.09 0.41 -0.03 -0.69 0.00 0.00 0.00 175.10 174.88 2e7d s VAL 52 N -0.14 4.03 -0.02 2.92 1.01 0.47 -2.42 120.40 126.24 2e7d s VAL 52 Ca 0.31 -0.34 -0.03 0.00 0.00 0.00 0.00 61.98 61.92 2e7d s VAL 52 Cb -0.18 -2.71 0.01 0.00 0.00 0.00 0.00 36.38 33.49 2e7d s VAL 52 CO 0.17 0.56 0.07 -0.32 0.00 0.00 0.00 175.10 175.58 2e7d s MET 53 N -0.39 0.12 -0.08 2.72 0.00 -0.57 -1.56 119.30 119.55 2e7d s MET 53 Ca 0.07 0.04 -0.01 0.00 0.00 0.00 0.00 55.69 55.78 2e7d s MET 53 Cb -0.12 0.06 -0.03 0.00 0.00 0.00 0.00 34.83 34.73 2e7d s MET 53 CO 0.02 -0.02 -0.02 0.15 0.00 0.00 0.00 175.02 175.15 2e7d s LYS 54 N -0.13 2.89 0.31 4.11 1.02 -1.26 -1.45 119.74 125.23 2e7d s LYS 54 Ca -0.02 -0.46 0.04 0.00 0.02 0.00 0.00 55.97 55.54 2e7d s LYS 54 Cb -0.02 -2.72 -0.02 0.00 -0.52 0.00 0.00 37.83 34.55 2e7d s LYS 54 CO 0.00 0.69 0.46 0.95 -0.92 0.00 0.00 175.35 176.53 2e7d s THR 55 N -0.87 4.88 0.01 2.17 -4.23 -0.19 -0.63 115.64 116.79 2e7d s THR 55 Ca 0.13 -0.79 0.09 0.00 -1.18 0.00 0.00 61.69 59.94 2e7d s THR 55 Cb -0.11 -3.74 -0.02 0.00 1.34 0.00 0.00 72.50 69.96 2e7d s THR 55 CO 0.02 -0.37 -0.26 -0.54 -0.54 0.00 0.00 174.62 172.93 2e7d s LYS 56 N -4.17 1.94 -1.27 3.99 1.02 0.22 -4.05 119.74 117.41 2e7d s LYS 56 Ca 0.39 -1.02 -0.15 0.00 0.02 0.00 0.00 55.97 55.21 2e7d s LYS 56 Cb -0.09 -2.00 0.01 0.00 -0.52 0.00 0.00 37.83 35.22 2e7d s LYS 56 CO 0.32 0.53 0.59 -3.47 -0.92 0.00 0.00 175.35 172.40 2e7d n ASP 57 N 2.10 -2.93 0.05 2.83 2.03 -0.92 -4.80 116.55 114.92 2e7d n ASP 57 Ca -0.16 -1.09 0.13 0.00 0.52 0.00 0.00 54.79 54.18 2e7d n ASP 57 Cb 0.51 -2.81 0.59 0.00 -0.72 0.00 0.00 41.12 38.70 2e7d n ASP 57 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 2e7d h ASP 58 N -2.02 0.16 -0.02 1.67 1.82 -1.48 0.89 116.42 117.45 2e7d h ASP 58 Ca -0.66 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 55.98 2e7d h ASP 58 Cb 1.38 -0.03 -0.00 0.00 0.68 0.00 0.00 39.33 41.35 2e7d h ASP 58 CO 0.55 0.10 0.02 0.77 -1.61 0.00 0.00 179.24 179.08 2e7d h SER 59 N 0.18 0.00 0.37 2.28 4.64 -1.87 -0.00 113.55 119.15 2e7d h SER 59 Ca 0.18 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.31 2e7d h SER 59 Cb 0.47 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.56 2e7d h SER 59 CO -0.03 0.00 -0.78 0.22 -0.87 0.00 0.00 176.83 175.37 2e7d h TYR 60 N 0.00 0.45 -4.08 4.77 -0.00 -1.09 -3.46 116.97 113.57 2e7d h TYR 60 Ca 0.01 -0.22 -0.52 0.00 -0.00 0.00 0.00 58.73 58.00 2e7d h TYR 60 Cb 0.06 -0.06 0.09 0.00 -0.00 0.00 0.00 36.73 36.82 2e7d h TYR 60 CO 0.00 0.98 0.46 -1.58 -0.00 0.00 0.00 178.16 178.03 2e7d s TRP 61 N -3.47 2.55 -0.03 -3.82 0.52 -0.02 -1.38 118.94 113.30 2e7d s TRP 61 Ca -0.05 1.52 -0.01 0.00 0.02 0.00 0.00 56.10 57.59 2e7d s TRP 61 Cb 0.10 -3.41 -0.01 0.00 -1.15 0.00 0.00 33.47 29.00 2e7d s TRP 61 CO 0.83 -1.91 -0.03 1.17 0.02 0.00 0.00 176.95 177.04 2e7d n LYS 62 N -1.32 0.06 -3.48 4.98 4.81 0.22 -4.73 118.16 118.70 2e7d n LYS 62 Ca 0.12 0.02 -0.10 0.00 -0.87 0.00 0.00 58.31 57.48 2e7d n LYS 62 Cb 0.50 -0.73 -0.02 0.00 0.02 0.00 0.00 35.03 34.80 2e7d n LYS 62 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2e7d s ASP 63 N -4.94 -0.48 -0.11 3.14 2.15 -0.99 -4.99 116.67 110.44 2e7d s ASP 63 Ca -0.04 -0.04 -0.04 0.00 0.43 0.00 0.00 52.55 52.87 2e7d s ASP 63 Cb 0.01 0.53 0.05 0.00 -0.30 0.00 0.00 42.92 43.22 2e7d s ASP 63 CO 0.05 -0.87 0.16 -0.22 -0.17 0.00 0.00 175.17 174.12 2e7d s LEU 64 N -2.67 -0.04 -0.23 -1.34 2.96 -1.26 -1.26 118.68 114.83 2e7d s LEU 64 Ca 0.03 0.16 0.01 0.00 -0.22 0.00 0.00 54.13 54.11 2e7d s LEU 64 Cb -0.01 0.24 0.04 0.00 0.50 0.00 0.00 46.19 46.95 2e7d s LEU 64 CO -0.10 -0.27 -0.12 -0.63 -1.32 0.00 0.00 176.35 173.91 2e7d s ILE 65 N 2.28 2.35 -0.23 6.68 1.01 -0.67 -2.24 121.20 130.38 2e7d s ILE 65 Ca 0.04 -1.23 -0.09 0.00 0.00 0.00 0.00 60.65 59.36 2e7d s ILE 65 Cb -0.13 -2.20 -0.04 0.00 0.01 0.00 0.00 42.46 40.10 2e7d s ILE 65 CO -0.07 0.22 0.12 -0.69 0.00 0.00 0.00 174.94 174.52 2e7d s VAL 66 N 1.23 4.97 -0.99 2.92 1.01 -0.16 -1.13 120.40 128.25 2e7d s VAL 66 Ca -0.02 0.04 -0.00 0.00 0.00 0.00 0.00 61.98 62.00 2e7d s VAL 66 Cb -0.17 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 32.91 2e7d s VAL 66 CO -0.07 0.36 0.02 -0.62 0.00 0.00 0.00 175.10 174.79 2e7d n GLU 67 N 4.37 -2.35 -0.26 2.72 -0.58 0.77 -0.58 120.64 124.73 2e7d n GLU 67 Ca -0.15 0.55 0.00 0.00 -0.42 0.00 0.00 57.16 57.14 2e7d n GLU 67 Cb 0.52 -5.15 0.00 0.00 -0.57 0.00 0.00 31.44 26.24 2e7d n GLU 67 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2e7d n GLY 68 N -0.80 0.91 3.28 0.62 0.00 -1.26 -5.04 105.19 102.90 2e7d n GLY 68 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 2e7d n GLY 68 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2e7d s LYS 69 N -0.58 3.16 0.09 1.61 2.20 0.25 -5.07 119.74 121.40 2e7d s LYS 69 Ca 0.00 -0.80 -0.31 0.00 -0.36 0.00 0.00 55.97 54.50 2e7d s LYS 69 Cb 0.00 -2.43 -0.08 0.00 -1.51 0.00 0.00 37.83 33.82 2e7d s LYS 69 CO 0.00 0.21 1.47 0.50 -0.36 0.00 0.00 175.35 177.17 2e7d s ARG 70 N 0.31 4.27 1.22 4.03 3.52 -1.26 -0.99 118.95 130.06 2e7d s ARG 70 Ca -0.15 2.15 -0.14 0.00 -0.13 0.00 0.00 55.73 57.46 2e7d s ARG 70 Cb -0.17 -3.36 0.31 0.00 -1.56 0.00 0.00 34.95 30.17 2e7d s ARG 70 CO 0.07 -0.55 1.00 0.14 -0.81 0.00 0.00 175.30 175.16 2e7d s VAL 71 N 1.65 1.91 -0.04 7.11 -7.23 -0.95 -4.93 120.40 117.92 2e7d s VAL 71 Ca 0.67 0.00 0.06 0.00 -1.81 0.00 0.00 61.98 60.90 2e7d s VAL 71 Cb -0.37 -2.03 -0.01 0.00 0.56 0.00 0.00 36.38 34.53 2e7d s VAL 71 CO 0.30 0.00 -0.23 0.42 -0.31 0.00 0.00 175.10 175.28 2e7d s THR 72 N -2.39 1.85 0.18 5.32 -4.23 -0.83 -4.95 115.64 110.60 2e7d s THR 72 Ca 0.69 -0.97 -0.19 0.00 -1.18 0.00 0.00 61.69 60.04 2e7d s THR 72 Cb -0.24 -1.56 -0.08 0.00 1.34 0.00 0.00 72.50 71.96 2e7d s THR 72 CO 0.65 0.52 0.68 -0.89 -0.54 0.00 0.00 174.62 175.04 2e7d s THR 73 N -0.23 4.61 -0.02 3.99 2.01 -1.26 -0.57 115.64 124.17 2e7d s THR 73 Ca 0.00 1.25 0.04 0.00 0.31 0.00 0.00 61.69 63.29 2e7d s THR 73 Cb -0.12 -3.88 -0.05 0.00 0.01 0.00 0.00 72.50 68.46 2e7d s THR 73 CO 0.02 0.30 0.05 1.33 -0.69 0.00 0.00 174.62 175.63 2e7d n VAL 74 N 0.98 0.10 -3.51 3.82 0.24 0.20 -4.95 118.33 115.21 2e7d n VAL 74 Ca -0.04 -0.12 -0.16 0.00 -2.04 0.00 0.00 64.34 61.98 2e7d n VAL 74 Cb 0.51 -0.14 -0.05 0.00 -1.47 0.00 0.00 33.84 32.69 2e7d n VAL 74 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2e7d s SER 75 N -2.86 -0.61 -0.05 -1.34 1.04 -1.18 -5.01 113.70 103.68 2e7d s SER 75 Ca -0.02 0.56 0.03 0.00 0.48 0.00 0.00 55.95 57.01 2e7d s SER 75 Cb 0.02 0.53 0.01 0.00 0.10 0.00 0.00 66.02 66.67 2e7d s SER 75 CO 0.16 -0.64 -0.14 -0.54 0.98 0.00 0.00 173.24 173.05 2e7d s LYS 76 N -1.63 1.70 -0.68 4.02 1.02 -1.26 -0.89 119.74 122.01 2e7d s LYS 76 Ca -0.08 -0.49 0.05 0.00 0.02 0.00 0.00 55.97 55.47 2e7d s LYS 76 Cb -0.00 -1.44 0.19 0.00 -0.52 0.00 0.00 37.83 36.06 2e7d s LYS 76 CO 0.05 0.12 0.56 -3.47 -0.92 0.00 0.00 175.35 171.69 2e7d n ASP 77 N 3.49 3.15 0.27 2.83 4.64 -1.05 -4.93 116.55 124.95 2e7d n ASP 77 Ca -0.20 -3.26 0.18 0.00 -1.38 0.00 0.00 54.79 50.13 2e7d n ASP 77 Cb 0.53 -0.73 0.88 0.00 -1.04 0.00 0.00 41.12 40.75 2e7d n ASP 77 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 2e7d h PRO 78 N 5.06 0.00 -0.10 -0.67 0.11 -1.97 -1.25 132.00 133.19 2e7d h PRO 78 Ca 0.16 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.17 2e7d h PRO 78 Cb 0.73 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.83 2e7d h PRO 78 CO 0.74 0.00 -0.42 -0.22 -0.21 0.00 0.00 178.00 177.89 2e7d h LYS 79 N 0.00 0.22 -0.31 1.05 3.11 -1.93 -3.12 116.57 115.60 2e7d h LYS 79 Ca 0.05 -0.11 -0.20 0.00 -2.81 0.00 0.00 60.65 57.58 2e7d h LYS 79 Cb 0.57 -0.00 -0.14 0.00 -1.00 0.00 0.00 32.23 31.66 2e7d h LYS 79 CO -0.00 0.61 -0.43 0.09 -2.81 0.00 0.00 179.45 176.91 2e7d n ASN 80 N -4.02 2.89 -3.79 4.20 4.13 -0.50 -4.97 115.26 113.20 2e7d n ASN 80 Ca -0.02 -3.84 -0.24 0.00 1.68 0.00 0.00 54.58 52.16 2e7d n ASN 80 Cb 0.48 -0.53 -0.02 0.00 -1.54 0.00 0.00 39.78 38.18 2e7d n ASN 80 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2e7d n ASN 81 N -1.01 -1.22 -3.86 6.41 4.05 -1.08 -4.70 115.26 113.85 2e7d n ASN 81 Ca 0.30 -0.76 -0.22 0.00 0.45 0.00 0.00 54.58 54.36 2e7d n ASN 81 Cb 0.84 -0.92 -0.08 0.00 1.23 0.00 0.00 39.78 40.85 2e7d n ASN 81 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 2e7d s SER 82 N -4.01 2.11 -0.19 1.20 0.15 -1.01 -1.32 113.70 110.63 2e7d s SER 82 Ca 0.18 -1.67 -0.28 0.00 0.70 0.00 0.00 55.95 54.88 2e7d s SER 82 Cb -0.10 0.49 0.11 0.00 -1.71 0.00 0.00 66.02 64.81 2e7d s SER 82 CO 0.57 -0.96 0.92 -0.60 1.20 0.00 0.00 173.24 174.38 2e7d s ARG 83 N -3.67 0.68 -0.19 5.44 3.52 -1.26 -2.52 118.95 120.95 2e7d s ARG 83 Ca 0.32 0.39 -0.05 0.00 -0.13 0.00 0.00 55.73 56.26 2e7d s ARG 83 Cb 0.03 0.32 -0.02 0.00 -1.56 0.00 0.00 34.95 33.72 2e7d s ARG 83 CO 0.19 -0.17 -0.00 0.99 -0.81 0.00 0.00 175.30 175.50 2e7d s THR 84 N -0.56 3.97 0.25 4.11 2.01 -0.07 -1.02 115.64 124.33 2e7d s THR 84 Ca -0.02 -0.31 0.03 0.00 0.31 0.00 0.00 61.69 61.70 2e7d s THR 84 Cb -0.02 -2.79 -0.05 0.00 0.01 0.00 0.00 72.50 69.65 2e7d s THR 84 CO 0.01 0.44 0.03 -1.48 -0.69 0.00 0.00 174.62 172.92 2e7d s LEU 85 N 0.91 2.08 0.06 4.42 0.05 -0.53 -0.62 118.68 125.04 2e7d s LEU 85 Ca 0.01 -1.28 -0.05 0.00 0.05 0.00 0.00 54.13 52.86 2e7d s LEU 85 Cb -0.14 -0.23 -0.02 0.00 -2.05 0.00 0.00 46.19 43.74 2e7d s LEU 85 CO 0.02 -0.57 0.08 0.27 -0.55 0.00 0.00 176.35 175.59 2e7d s ILE 86 N -3.46 0.17 -0.02 1.48 -4.36 0.27 -1.51 121.20 113.76 2e7d s ILE 86 Ca 0.32 -1.37 -0.11 0.00 -0.26 0.00 0.00 60.65 59.24 2e7d s ILE 86 Cb 0.07 -1.23 0.01 0.00 1.25 0.00 0.00 42.46 42.56 2e7d s ILE 86 CO 0.11 -0.75 0.23 0.72 0.24 0.00 0.00 174.94 175.48 2e7d s PHE 87 N -3.42 -0.10 0.16 1.37 -0.12 -1.02 -1.96 117.98 112.90 2e7d s PHE 87 Ca 0.02 0.14 -0.34 0.00 -0.05 0.00 0.00 56.93 56.70 2e7d s PHE 87 Cb 0.04 0.03 -0.15 0.00 -0.63 0.00 0.00 43.02 42.31 2e7d s PHE 87 CO -0.08 -0.31 1.31 -0.35 -0.05 0.00 0.00 175.22 175.74 2e7d n PRO 88 N 1.56 1.44 -3.40 1.99 -0.04 -1.26 -0.29 135.00 135.00 2e7d n PRO 88 Ca -0.21 0.52 -0.38 0.00 -0.04 0.00 0.00 63.50 63.38 2e7d n PRO 88 Cb 0.56 -2.12 -0.06 0.00 -0.04 0.00 0.00 33.50 31.84 2e7d n PRO 88 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 2e7d s TYR 89 N 0.18 3.76 -0.14 0.54 6.14 0.17 -4.66 117.35 123.34 2e7d s TYR 89 Ca 0.76 1.12 0.00 0.00 0.64 0.00 0.00 57.07 59.59 2e7d s TYR 89 Cb -0.82 -2.39 0.02 0.00 0.42 0.00 0.00 41.96 39.19 2e7d s TYR 89 CO 0.48 0.61 -0.11 0.42 0.64 0.00 0.00 175.55 177.59 2e7d s ILE 90 N -1.07 1.38 0.16 3.14 1.01 -1.26 -4.83 121.20 119.74 2e7d s ILE 90 Ca 0.26 -0.54 -0.34 0.00 0.00 0.00 0.00 60.65 60.03 2e7d s ILE 90 Cb -0.18 -1.34 -0.14 0.00 0.01 0.00 0.00 42.46 40.81 2e7d s ILE 90 CO 0.16 0.40 1.61 -0.81 0.00 0.00 0.00 174.94 176.30 2e7d n PRO 91 N 4.83 2.24 -1.30 2.79 -0.04 -1.26 -1.84 135.00 140.42 2e7d n PRO 91 Ca -0.15 0.81 -0.10 0.00 -0.04 0.00 0.00 63.50 64.01 2e7d n PRO 91 Cb 0.50 -2.59 -0.04 0.00 -0.04 0.00 0.00 33.50 31.32 2e7d n PRO 91 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2e7d n ASP 92 N 3.59 -4.31 -4.48 3.54 2.03 -1.26 -4.99 116.55 110.67 2e7d n ASP 92 Ca 0.17 0.26 -0.42 0.00 0.52 0.00 0.00 54.79 55.31 2e7d n ASP 92 Cb 0.30 -2.72 -0.10 0.00 -0.72 0.00 0.00 41.12 37.87 2e7d n ASP 92 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 2e7d s LYS 93 N -2.84 3.09 -0.10 -0.67 2.20 -0.77 -4.96 119.74 115.69 2e7d s LYS 93 Ca 0.00 -0.91 -0.24 0.00 -0.36 0.00 0.00 55.97 54.46 2e7d s LYS 93 Cb 0.00 -3.94 -0.28 0.00 -1.51 0.00 0.00 37.83 32.10 2e7d s LYS 93 CO 0.00 -0.70 0.75 0.00 -0.36 0.00 0.00 175.35 175.04 2e7d h ALA 94 N 8.61 0.00 -2.98 3.13 0.00 -1.88 -3.41 119.26 122.74 2e7d h ALA 94 Ca -0.28 -0.70 -0.66 0.00 0.00 0.00 0.00 54.91 53.27 2e7d h ALA 94 Cb 1.13 0.15 -0.25 0.00 0.00 0.00 0.00 17.79 18.82 2e7d h ALA 94 CO 0.72 0.30 -0.65 0.08 0.00 0.00 0.00 179.25 179.70 2e7d s VAL 95 N -2.34 3.99 -0.47 0.00 1.01 -1.26 -0.36 120.40 120.97 2e7d s VAL 95 Ca -0.18 -0.39 -0.10 0.00 0.00 0.00 0.00 61.98 61.32 2e7d s VAL 95 Cb 0.00 -2.91 0.11 0.00 0.00 0.00 0.00 36.38 33.58 2e7d s VAL 95 CO 0.75 0.29 0.34 -0.31 0.00 0.00 0.00 175.10 176.17 2e7d s TYR 96 N 1.55 3.39 0.31 5.22 1.51 0.21 -4.96 117.35 124.59 2e7d s TYR 96 Ca 0.05 -1.73 -0.29 0.00 -1.01 0.00 0.00 57.07 54.09 2e7d s TYR 96 Cb -0.15 -3.40 -0.10 0.00 -0.11 0.00 0.00 41.96 38.19 2e7d s TYR 96 CO 0.02 -0.96 1.37 -0.80 -1.11 0.00 0.00 175.55 174.06 2e7d s ASN 97 N 2.63 6.68 0.22 2.29 0.02 -1.26 -0.89 114.94 124.62 2e7d s ASN 97 Ca 0.05 2.72 -0.09 0.00 -1.02 0.00 0.00 52.86 54.52 2e7d s ASN 97 Cb -0.26 -2.64 -0.01 0.00 0.02 0.00 0.00 41.25 38.36 2e7d s ASN 97 CO 0.00 -0.63 0.36 0.00 0.02 0.00 0.00 177.10 176.86 2e7d s ALA 98 N -0.79 0.11 -0.07 0.60 0.00 0.29 -0.16 121.76 121.73 2e7d s ALA 98 Ca 0.52 -1.04 -0.00 0.00 0.00 0.00 0.00 51.96 51.44 2e7d s ALA 98 Cb -0.41 1.09 0.02 0.00 0.00 0.00 0.00 23.12 23.82 2e7d s ALA 98 CO 0.51 -0.75 -0.04 0.42 0.00 0.00 0.00 175.76 175.90 2e7d s ILE 99 N -4.03 0.62 -0.10 0.00 1.01 -0.28 -0.92 121.20 117.49 2e7d s ILE 99 Ca 0.25 -0.09 -0.02 0.00 0.00 0.00 0.00 60.65 60.79 2e7d s ILE 99 Cb 0.02 -0.68 -0.03 0.00 0.01 0.00 0.00 42.46 41.78 2e7d s ILE 99 CO 0.07 0.28 -0.01 -0.69 0.00 0.00 0.00 174.94 174.59 2e7d s VAL 100 N 1.44 4.17 -0.10 2.92 1.01 -0.06 -1.67 120.40 128.11 2e7d s VAL 100 Ca -0.02 -0.29 0.03 0.00 0.00 0.00 0.00 61.98 61.69 2e7d s VAL 100 Cb -0.13 -2.76 0.01 0.00 0.00 0.00 0.00 36.38 33.49 2e7d s VAL 100 CO -0.03 0.58 -0.19 -0.54 0.00 0.00 0.00 175.10 174.92 2e7d s LYS 101 N -0.63 2.57 0.38 2.72 1.02 -0.39 -0.61 119.74 124.79 2e7d s LYS 101 Ca 0.10 -0.70 0.08 0.00 0.02 0.00 0.00 55.97 55.47 2e7d s LYS 101 Cb -0.12 -2.05 -0.06 0.00 -0.52 0.00 0.00 37.83 35.08 2e7d s LYS 101 CO 0.02 0.04 0.06 0.14 -0.92 0.00 0.00 175.35 174.70 2e7d s VAL 102 N 0.68 2.36 -0.12 3.17 -7.23 -0.16 0.69 120.40 119.79 2e7d s VAL 102 Ca -0.12 -1.89 -0.30 0.00 -1.81 0.00 0.00 61.98 57.85 2e7d s VAL 102 Cb -0.16 -2.91 0.11 0.00 0.56 0.00 0.00 36.38 33.99 2e7d s VAL 102 CO 0.03 -0.09 0.93 0.54 -0.31 0.00 0.00 175.10 176.21 2e7d s VAL 103 N -2.59 0.00 -0.40 1.32 0.11 -0.48 -1.96 120.40 116.40 2e7d s VAL 103 Ca 0.37 0.00 0.07 0.00 -2.93 0.00 0.00 61.98 59.49 2e7d s VAL 103 Cb 0.04 -1.00 0.23 0.00 -1.53 0.00 0.00 36.38 34.12 2e7d s VAL 103 CO 0.20 0.00 0.51 0.52 -3.33 0.00 0.00 175.10 173.00 2e7d n VAL 104 N 0.57 -0.75 -0.39 2.04 0.31 -0.84 -4.69 118.33 114.58 2e7d n VAL 104 Ca -0.11 -3.70 0.39 0.00 -0.01 0.00 0.00 64.34 60.90 2e7d n VAL 104 Cb 0.58 -1.65 0.74 0.00 -0.91 0.00 0.00 33.84 32.60 2e7d n VAL 104 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2e7d h ALA 105 N 4.33 3.25 -0.00 3.52 0.00 -1.95 0.19 119.26 128.60 2e7d h ALA 105 Ca 0.10 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2e7d h ALA 105 Cb 0.90 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 2e7d h ALA 105 CO 0.43 -1.72 0.00 -0.97 0.00 0.00 0.00 179.25 176.99 2e7d h ASN 106 N 0.00 0.00 0.00 0.00 -1.24 -1.93 -2.53 115.58 109.88 2e7d h ASN 106 Ca 0.64 0.00 -0.05 0.00 0.71 0.00 0.00 56.30 57.59 2e7d h ASN 106 Cb 2.68 0.00 -0.12 0.00 0.73 0.00 0.00 38.32 41.62 2e7d h ASN 106 CO -0.01 0.00 -0.57 2.30 -1.29 0.00 0.00 177.43 177.86 2e7d n ILE 107 N -3.12 0.68 -1.77 2.57 -5.35 0.65 -4.99 119.36 108.04 2e7d n ILE 107 Ca -0.03 -1.21 -0.19 0.00 -0.27 0.00 0.00 62.75 61.05 2e7d n ILE 107 Cb 0.07 0.40 -0.07 0.00 -1.74 0.00 0.00 39.64 38.31 2e7d n ILE 107 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2e7d n GLY 108 N -0.28 1.28 3.86 3.28 0.00 -0.95 -4.97 105.19 107.41 2e7d n GLY 108 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 2e7d n GLY 108 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2e7d s TYR 109 N -2.72 3.53 -0.21 1.61 6.14 -1.14 -4.99 117.35 119.58 2e7d s TYR 109 Ca 0.00 0.88 -0.09 0.00 0.64 0.00 0.00 57.07 58.50 2e7d s TYR 109 Cb 0.00 -2.24 0.08 0.00 0.42 0.00 0.00 41.96 40.22 2e7d s TYR 109 CO 0.00 0.40 0.48 -2.00 0.64 0.00 0.00 175.55 175.07 2e7d s GLU 110 N -2.28 0.42 0.15 4.97 2.12 -1.26 -1.98 118.70 120.84 2e7d s GLU 110 Ca 0.40 1.03 0.08 0.00 0.36 0.00 0.00 54.97 56.85 2e7d s GLU 110 Cb -0.13 0.27 -0.04 0.00 0.26 0.00 0.00 34.13 34.49 2e7d s GLU 110 CO 0.20 -0.21 -0.18 0.20 -0.54 0.00 0.00 175.26 174.73 2e7d s GLY 111 N 2.17 1.34 -0.04 -1.50 0.00 -0.83 -5.01 107.32 103.46 2e7d s GLY 111 Ca -0.06 -1.43 -0.01 0.00 0.00 0.00 0.00 44.72 43.22 2e7d s GLY 111 CO -0.14 -1.48 0.08 1.62 0.00 0.00 0.00 173.10 173.17 2e7d s GLN 112 N -2.65 0.02 -0.08 2.90 0.74 -1.26 -0.99 119.66 118.35 2e7d s GLN 112 Ca 0.14 0.24 0.04 0.00 0.05 0.00 0.00 55.36 55.83 2e7d s GLN 112 Cb -0.06 -0.18 0.00 0.00 1.10 0.00 0.00 33.01 33.86 2e7d s GLN 112 CO 0.06 -0.14 -0.20 0.71 -0.55 0.00 0.00 175.29 175.16 2e7d s TYR 113 N 0.96 2.15 -0.22 1.67 2.02 0.22 -4.98 117.35 119.17 2e7d s TYR 113 Ca -0.08 -0.80 -0.19 0.00 -0.37 0.00 0.00 57.07 55.64 2e7d s TYR 113 Cb -0.11 -1.46 -0.03 0.00 -0.40 0.00 0.00 41.96 39.97 2e7d s TYR 113 CO -0.04 -0.32 0.55 -1.01 -1.57 0.00 0.00 175.55 173.17 2e7d s HIS 114 N 0.30 3.33 0.23 2.71 3.76 -1.26 -0.88 115.29 123.48 2e7d s HIS 114 Ca -0.13 0.77 0.02 0.00 -0.15 0.00 0.00 55.06 55.57 2e7d s HIS 114 Cb -0.16 -2.73 -0.05 0.00 1.11 0.00 0.00 32.58 30.75 2e7d s HIS 114 CO 0.06 -0.19 0.04 0.14 -0.85 0.00 0.00 174.74 173.94 2e7d s VAL 115 N 1.97 0.79 -0.23 -0.90 -7.23 -0.10 -3.11 120.40 111.58 2e7d s VAL 115 Ca 0.24 -2.01 0.02 0.00 -1.81 0.00 0.00 61.98 58.43 2e7d s VAL 115 Cb -0.16 -2.41 0.05 0.00 0.56 0.00 0.00 36.38 34.42 2e7d s VAL 115 CO 0.09 -0.23 -0.11 -0.13 -0.31 0.00 0.00 175.10 174.41 2e7d s ARG 116 N -3.94 2.16 -0.40 4.82 0.52 -0.44 -0.55 118.95 121.12 2e7d s ARG 116 Ca 0.31 -1.10 -0.23 0.00 -0.52 0.00 0.00 55.73 54.19 2e7d s ARG 116 Cb 0.07 -2.68 0.02 0.00 0.52 0.00 0.00 34.95 32.87 2e7d s ARG 116 CO 0.10 -0.50 0.77 0.42 0.02 0.00 0.00 175.30 176.11 2e7d s ILE 117 N 1.25 4.71 -0.17 1.52 1.01 -0.07 -0.19 121.20 129.26 2e7d s ILE 117 Ca -0.05 0.67 -0.11 0.00 0.00 0.00 0.00 60.65 61.16 2e7d s ILE 117 Cb -0.18 -4.24 -0.05 0.00 0.01 0.00 0.00 42.46 38.00 2e7d s ILE 117 CO -0.07 -0.54 0.20 -0.63 0.00 0.00 0.00 174.94 173.90 2e7d s ILE 118 N 3.14 5.37 -0.63 2.92 -1.09 -0.14 -0.62 121.20 130.16 2e7d s ILE 118 Ca 0.30 0.34 -0.22 0.00 -2.23 0.00 0.00 60.65 58.85 2e7d s ILE 118 Cb -0.13 -3.53 0.08 0.00 -1.58 0.00 0.00 42.46 37.29 2e7d s ILE 118 CO 0.19 0.44 0.88 0.21 -1.23 0.00 0.00 174.94 175.43 2e7d s ASN 119 N 0.28 6.19 0.62 3.58 3.04 0.51 -2.42 114.94 126.74 2e7d s ASN 119 Ca 0.12 -1.05 0.38 0.00 0.04 0.00 0.00 52.86 52.35 2e7d s ASN 119 Cb -0.12 -2.39 2.10 0.00 -1.54 0.00 0.00 41.25 39.30 2e7d s ASN 119 CO 0.01 -1.32 2.29 1.56 -3.04 0.00 0.00 177.10 176.60 2e7d h GLN 120 N 9.43 0.00 0.00 0.43 4.20 -0.13 -2.60 115.11 126.44 2e7d h GLN 120 Ca -0.29 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.42 2e7d h GLN 120 Cb 1.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.86 2e7d h GLN 120 CO 1.15 0.01 0.00 -0.25 -0.67 0.00 0.00 178.83 179.07 2e7d n ASP 121 N -3.38 0.00 -0.73 1.46 8.00 -1.26 -5.07 116.55 115.57 2e7d n ASP 121 Ca -0.03 -0.71 0.13 0.00 0.71 0.00 0.00 54.79 54.90 2e7d n ASP 121 Cb 0.10 -0.04 0.30 0.00 -0.02 0.00 0.00 41.12 41.47 2e7d n ASP 121 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43