#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t6r s ASN 2 N 0.00 -0.15 -0.01 6.12 2.47 -1.26 -5.05 114.94 117.07 1t6r s ASN 2 Ca 0.00 0.35 -0.15 0.00 0.42 0.00 0.00 52.86 53.48 1t6r s ASN 2 Cb 0.00 0.24 -0.33 0.00 -1.45 0.00 0.00 41.25 39.70 1t6r s ASN 2 CO 0.00 -0.15 0.87 -1.13 -3.72 0.00 0.00 177.10 172.96 1t6r h ASN 3 N 7.22 0.71 -3.80 -4.21 -1.24 -1.99 -3.49 115.58 108.77 1t6r h ASN 3 Ca -0.42 -0.93 -0.49 0.00 0.71 0.00 0.00 56.30 55.17 1t6r h ASN 3 Cb 1.14 -0.23 0.05 0.00 0.73 0.00 0.00 38.32 40.01 1t6r h ASN 3 CO 0.41 1.69 0.21 -1.48 -1.29 0.00 0.00 177.43 176.97 1t6r s LEU 4 N -7.55 3.35 0.27 0.34 0.05 -1.26 -4.91 118.68 108.97 1t6r s LEU 4 Ca -0.12 0.94 -0.11 0.00 0.05 0.00 0.00 54.13 54.89 1t6r s LEU 4 Cb 0.04 -3.85 -0.00 0.00 -2.05 0.00 0.00 46.19 40.33 1t6r s LEU 4 CO 0.90 -0.88 0.49 -0.75 -0.55 0.00 0.00 176.35 175.56 1t6r s LYS 5 N -4.96 1.64 0.02 1.48 2.36 -0.10 -5.00 119.74 115.19 1t6r s LYS 5 Ca 0.52 -1.36 0.02 0.00 -2.55 0.00 0.00 55.97 52.60 1t6r s LYS 5 Cb -0.11 0.47 -0.02 0.00 -1.05 0.00 0.00 37.83 37.13 1t6r s LYS 5 CO 0.47 -0.68 -0.06 -0.51 1.55 0.00 0.00 175.35 176.11 1t6r s LEU 6 N -3.06 2.15 -0.58 5.43 1.43 -1.26 -0.53 118.68 122.26 1t6r s LEU 6 Ca 0.24 -0.36 0.05 0.00 -1.03 0.00 0.00 54.13 53.03 1t6r s LEU 6 Cb -0.01 -0.19 0.18 0.00 0.03 0.00 0.00 46.19 46.20 1t6r s LEU 6 CO 0.11 -0.10 0.46 -0.67 0.23 0.00 0.00 176.35 176.38 1t6r n ASP 7 N 2.09 1.69 -4.67 2.29 2.03 -0.29 -4.94 116.55 114.74 1t6r n ASP 7 Ca -0.19 -2.90 -0.42 0.00 0.52 0.00 0.00 54.79 51.80 1t6r n ASP 7 Cb 0.56 -0.67 -0.03 0.00 -0.72 0.00 0.00 41.12 40.25 1t6r n ASP 7 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1t6r s ILE 8 N -0.97 4.84 0.04 5.18 1.01 -1.26 -1.91 121.20 128.12 1t6r s ILE 8 Ca 0.29 1.77 0.05 0.00 0.00 0.00 0.00 60.65 62.76 1t6r s ILE 8 Cb 0.01 -4.20 -0.02 0.00 0.01 0.00 0.00 42.46 38.26 1t6r s ILE 8 CO -0.17 -0.00 -0.14 -0.69 0.00 0.00 0.00 174.94 173.94 1t6r s VAL 9 N 2.23 1.11 -0.12 2.92 1.01 -0.21 -5.00 120.40 122.35 1t6r s VAL 9 Ca 0.41 -1.01 0.17 0.00 0.00 0.00 0.00 61.98 61.55 1t6r s VAL 9 Cb -0.17 -1.01 0.26 0.00 0.00 0.00 0.00 36.38 35.46 1t6r s VAL 9 CO 0.13 -0.01 1.13 -0.62 0.00 0.00 0.00 175.10 175.74 1t6r n GLU 10 N 1.87 1.17 0.00 2.72 1.02 -1.26 -0.58 120.64 125.59 1t6r n GLU 10 Ca -0.18 -2.41 0.00 0.00 -0.02 0.00 0.00 57.16 54.55 1t6r n GLU 10 Cb 0.55 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.57 1t6r n GLU 10 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 1t6r n GLN 11 N -1.29 0.00 0.16 3.49 7.27 -1.25 -4.02 117.38 121.73 1t6r n GLN 11 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.21 1t6r n GLN 11 Cb 0.64 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.29 1t6r n GLN 11 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1t6r n ASP 12 N 0.00 -2.19 -0.02 1.69 2.03 -1.26 -5.01 116.55 111.79 1t6r n ASP 12 Ca 0.00 0.59 0.06 0.00 0.52 0.00 0.00 54.79 55.96 1t6r n ASP 12 Cb 0.00 2.18 -0.14 0.00 -0.72 0.00 0.00 41.12 42.44 1t6r n ASP 12 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1t6r n ASP 13 N -3.23 0.96 -4.87 1.67 5.75 -1.26 -4.98 116.55 110.59 1t6r n ASP 13 Ca 0.00 0.00 -0.22 0.00 -0.01 0.00 0.00 54.79 54.56 1t6r n ASP 13 Cb 0.00 1.67 -0.03 0.00 -1.03 0.00 0.00 41.12 41.73 1t6r n ASP 13 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1t6r s LYS 14 N -3.10 2.45 0.02 0.11 1.02 -1.26 -4.77 119.74 114.21 1t6r s LYS 14 Ca -0.07 -1.65 0.08 0.00 0.02 0.00 0.00 55.97 54.35 1t6r s LYS 14 Cb 0.10 -2.30 -0.02 0.00 -0.52 0.00 0.00 37.83 35.09 1t6r s LYS 14 CO 0.72 -0.28 -0.22 0.00 -0.92 0.00 0.00 175.35 174.65 1t6r s ALA 15 N -2.54 1.90 -0.07 5.17 0.00 -1.14 -3.93 121.76 121.14 1t6r s ALA 15 Ca 0.46 -1.07 -0.03 0.00 0.00 0.00 0.00 51.96 51.32 1t6r s ALA 15 Cb -0.02 -0.42 0.04 0.00 0.00 0.00 0.00 23.12 22.72 1t6r s ALA 15 CO 0.27 0.45 0.13 0.42 0.00 0.00 0.00 175.76 177.02 1t6r s ILE 16 N -0.70 -0.20 -0.26 0.00 1.01 0.26 -1.31 121.20 120.01 1t6r s ILE 16 Ca 0.09 0.35 -0.01 0.00 0.00 0.00 0.00 60.65 61.08 1t6r s ILE 16 Cb -0.09 -0.25 0.08 0.00 0.01 0.00 0.00 42.46 42.21 1t6r s ILE 16 CO 0.01 0.15 0.03 0.54 0.00 0.00 0.00 174.94 175.67 1t6r s VAL 17 N 2.10 1.06 -0.74 2.92 0.11 -0.90 -1.04 120.40 123.91 1t6r s VAL 17 Ca 0.02 -1.17 -0.26 0.00 -2.93 0.00 0.00 61.98 57.63 1t6r s VAL 17 Cb -0.12 -1.59 0.02 0.00 -1.53 0.00 0.00 36.38 33.15 1t6r s VAL 17 CO -0.05 -0.37 1.48 -0.13 -3.33 0.00 0.00 175.10 172.69 1t6r s ARG 18 N 1.57 3.06 0.35 1.54 0.52 -0.80 -1.10 118.95 124.09 1t6r s ARG 18 Ca 0.02 -0.11 -0.28 0.00 -0.52 0.00 0.00 55.73 54.84 1t6r s ARG 18 Cb -0.18 -4.39 -0.11 0.00 0.52 0.00 0.00 34.95 30.80 1t6r s ARG 18 CO -0.14 -2.36 1.43 0.08 0.02 0.00 0.00 175.30 174.34 1t6r s VAL 19 N 6.72 2.30 -0.06 3.52 1.01 -0.08 -1.13 120.40 132.67 1t6r s VAL 19 Ca 0.46 0.29 0.03 0.00 0.00 0.00 0.00 61.98 62.76 1t6r s VAL 19 Cb -0.08 -3.19 0.01 0.00 0.00 0.00 0.00 36.38 33.12 1t6r s VAL 19 CO 0.13 0.07 -0.14 -1.10 0.00 0.00 0.00 175.10 174.06 1t6r s GLN 20 N -1.81 1.80 0.00 2.72 -0.21 0.31 -4.00 119.66 118.47 1t6r s GLN 20 Ca 0.52 -0.50 0.00 0.00 0.02 0.00 0.00 55.36 55.41 1t6r s GLN 20 Cb -0.44 -1.49 0.00 0.00 1.00 0.00 0.00 33.01 32.08 1t6r s GLN 20 CO 0.58 0.10 0.00 0.41 -2.12 0.00 0.00 175.29 174.26 1t6r n GLY 21 N 3.58 0.19 3.32 3.09 0.00 -1.26 -0.92 105.19 113.19 1t6r n GLY 21 Ca -0.21 -1.62 -0.19 0.00 0.00 0.00 0.00 46.02 44.00 1t6r n GLY 21 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1t6r s ASP 22 N -4.00 1.60 -0.37 1.61 1.01 -1.26 -3.61 116.67 111.64 1t6r s ASP 22 Ca 0.00 -1.73 0.01 0.00 0.71 0.00 0.00 52.55 51.54 1t6r s ASP 22 Cb 0.00 0.58 0.12 0.00 1.01 0.00 0.00 42.92 44.64 1t6r s ASP 22 CO 0.00 -1.12 0.18 -0.63 0.21 0.00 0.00 175.17 173.81 1t6r s ILE 23 N -3.33 1.03 0.00 0.77 1.01 -0.90 -4.70 121.20 115.07 1t6r s ILE 23 Ca 0.39 -1.97 0.00 0.00 0.00 0.00 0.00 60.65 59.07 1t6r s ILE 23 Cb 0.02 -1.75 0.00 0.00 0.01 0.00 0.00 42.46 40.74 1t6r s ILE 23 CO 0.27 -0.82 0.00 -0.90 0.00 0.00 0.00 174.94 173.49 1t6r n ASP 24 N 4.15 0.00 0.00 3.58 5.75 -1.26 -0.98 116.55 127.78 1t6r n ASP 24 Ca 0.05 -0.84 0.03 0.00 -0.01 0.00 0.00 54.79 54.02 1t6r n ASP 24 Cb 0.38 0.00 0.18 0.00 -1.03 0.00 0.00 41.12 40.65 1t6r n ASP 24 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1t6r n ALA 25 N -3.00 1.54 1.15 2.12 0.00 -1.26 0.23 120.51 121.29 1t6r n ALA 25 Ca 0.00 -0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.54 1t6r n ALA 25 Cb 0.00 -1.12 0.46 0.00 0.00 0.00 0.00 19.45 18.80 1t6r n ALA 25 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1t6r n TYR 26 N -1.25 0.00 0.06 0.00 4.01 -1.26 -4.77 117.16 113.94 1t6r n TYR 26 Ca 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.78 1t6r n TYR 26 Cb 0.05 -0.27 0.00 0.00 -0.31 0.00 0.00 39.34 38.81 1t6r n TYR 26 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1t6r n ASN 27 N -1.24 -0.68 -0.34 7.72 3.02 0.37 -4.82 115.26 119.29 1t6r n ASN 27 Ca 0.09 0.21 0.12 0.00 -0.03 0.00 0.00 54.58 54.98 1t6r n ASN 27 Cb 0.32 0.84 0.25 0.00 -0.61 0.00 0.00 39.78 40.58 1t6r n ASN 27 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1t6r n SER 28 N -2.78 -0.17 -0.28 6.41 2.88 0.14 0.25 113.62 120.06 1t6r n SER 28 Ca 0.00 1.66 0.00 0.00 -1.33 0.00 0.00 58.87 59.20 1t6r n SER 28 Cb 0.00 -0.58 0.13 0.00 -0.75 0.00 0.00 64.21 63.01 1t6r n SER 28 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 1t6r h SER 29 N 0.00 0.71 0.00 -3.46 0.87 -1.86 0.34 113.55 110.15 1t6r h SER 29 Ca 0.56 0.03 -0.22 0.00 -1.23 0.00 0.00 61.79 60.93 1t6r h SER 29 Cb 1.09 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.91 1t6r h SER 29 CO -0.94 0.44 -1.48 -0.62 -0.53 0.00 0.00 176.83 173.71 1t6r n GLU 30 N -4.70 0.54 -0.46 2.24 -0.58 0.46 -3.36 120.64 114.77 1t6r n GLU 30 Ca 0.11 0.40 0.39 0.00 -0.42 0.00 0.00 57.16 57.65 1t6r n GLU 30 Cb 0.20 -1.60 0.67 0.00 -0.57 0.00 0.00 31.44 30.14 1t6r n GLU 30 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1t6r h LEU 31 N -1.00 0.22 0.22 -4.62 5.85 -0.31 0.26 115.31 115.92 1t6r h LEU 31 Ca -0.33 0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 1t6r h LEU 31 Cb 1.20 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.37 1t6r h LEU 31 CO -0.20 -0.22 -0.11 0.50 -0.34 0.00 0.00 178.44 178.07 1t6r h LYS 32 N 0.04 -0.29 0.00 1.25 3.64 -1.02 -0.60 116.57 119.60 1t6r h LYS 32 Ca 0.86 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 60.26 1t6r h LYS 32 Cb 2.74 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 34.62 1t6r h LYS 32 CO -0.44 0.01 -0.00 1.49 -2.27 0.00 0.00 179.45 178.24 1t6r h GLU 33 N -0.60 0.00 0.00 1.90 4.81 -0.54 0.18 114.58 120.34 1t6r h GLU 33 Ca -0.03 0.00 -0.43 0.00 -0.13 0.00 0.00 59.36 58.77 1t6r h GLU 33 Cb 0.44 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.75 1t6r h GLU 33 CO 0.05 0.00 -2.47 1.04 -0.73 0.00 0.00 179.01 176.90 1t6r n GLN 34 N -3.10 0.61 0.25 1.92 6.02 -0.58 -3.35 117.38 119.14 1t6r n GLN 34 Ca -0.02 0.24 0.11 0.00 -0.01 0.00 0.00 57.00 57.32 1t6r n GLN 34 Cb 0.11 -1.51 0.63 0.00 1.02 0.00 0.00 30.24 30.48 1t6r n GLN 34 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1t6r h LEU 35 N -0.68 0.00 0.53 1.08 3.38 -1.04 -1.49 115.31 117.08 1t6r h LEU 35 Ca -0.65 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.30 1t6r h LEU 35 Cb 1.70 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.43 1t6r h LEU 35 CO -0.31 0.17 -0.48 -0.09 0.09 0.00 0.00 178.44 177.82 1t6r h ARG 36 N 0.00 -0.96 -0.88 1.13 2.43 -0.77 -2.76 114.38 112.57 1t6r h ARG 36 Ca -0.00 0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1t6r h ARG 36 Cb 0.46 0.22 -0.04 0.00 -0.42 0.00 0.00 29.97 30.19 1t6r h ARG 36 CO 0.02 -0.64 0.56 -0.97 -1.51 0.00 0.00 179.97 177.43 1t6r h ASN 37 N -1.00 1.02 -0.55 -3.80 -0.73 -1.47 -2.69 115.58 106.36 1t6r h ASN 37 Ca -0.06 -0.04 0.10 0.00 1.87 0.00 0.00 56.30 58.17 1t6r h ASN 37 Cb 0.86 -0.26 -0.08 0.00 0.27 0.00 0.00 38.32 39.12 1t6r h ASN 37 CO -0.04 0.75 0.10 0.15 -0.37 0.00 0.00 177.43 178.03 1t6r h PHE 38 N 1.19 0.16 -0.60 0.67 3.57 -1.23 -0.21 116.94 120.49 1t6r h PHE 38 Ca 0.32 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.83 1t6r h PHE 38 Cb -0.11 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.62 1t6r h PHE 38 CO -0.01 -0.03 0.27 0.82 -2.23 0.00 0.00 178.31 177.13 1t6r h ILE 39 N 0.23 1.20 -0.12 1.41 1.08 -1.18 -1.78 117.51 118.36 1t6r h ILE 39 Ca 0.28 -0.60 -0.06 0.00 -0.39 0.00 0.00 64.86 64.09 1t6r h ILE 39 Cb 0.40 0.46 -0.00 0.00 -3.07 0.00 0.00 36.82 34.61 1t6r h ILE 39 CO -0.37 0.24 -0.16 0.77 -0.69 0.00 0.00 178.15 177.94 1t6r h SER 40 N 0.85 0.35 -0.25 1.72 4.64 -1.24 -3.36 113.55 116.25 1t6r h SER 40 Ca 0.21 -0.51 -0.11 0.00 -0.47 0.00 0.00 61.79 60.90 1t6r h SER 40 Cb 0.12 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1t6r h SER 40 CO -0.02 0.80 -0.27 0.71 -0.87 0.00 0.00 176.83 177.17 1t6r h THR 41 N -0.08 1.31 -3.93 2.95 1.35 -0.80 -3.45 112.91 110.27 1t6r h THR 41 Ca 0.01 -1.44 -0.53 0.00 -0.55 0.00 0.00 66.41 63.90 1t6r h THR 41 Cb 0.71 1.66 0.09 0.00 -1.73 0.00 0.00 68.15 68.88 1t6r h THR 41 CO 0.04 0.45 0.67 0.28 -0.25 0.00 0.00 175.52 176.72 1t6r s THR 42 N -4.32 2.45 -2.38 6.82 -1.32 -0.69 -4.95 115.64 111.25 1t6r s THR 42 Ca -0.13 0.43 0.20 0.00 -1.21 0.00 0.00 61.69 60.98 1t6r s THR 42 Cb 0.08 -3.27 0.13 0.00 -1.51 0.00 0.00 72.50 67.93 1t6r s THR 42 CO 0.82 0.09 1.11 -1.20 -2.21 0.00 0.00 174.62 173.22 1t6r n SER 43 N 0.41 2.53 -4.77 8.08 7.64 -1.26 -4.91 113.62 121.34 1t6r n SER 43 Ca 0.02 -1.76 -0.39 0.00 1.01 0.00 0.00 58.87 57.75 1t6r n SER 43 Cb 0.42 0.08 -0.06 0.00 -1.01 0.00 0.00 64.21 63.64 1t6r n SER 43 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1t6r s LYS 44 N -1.75 4.69 0.02 1.43 -0.14 -1.26 -4.97 119.74 117.76 1t6r s LYS 44 Ca 0.22 1.44 0.24 0.00 -1.36 0.00 0.00 55.97 56.52 1t6r s LYS 44 Cb 0.16 -3.03 0.39 0.00 -1.68 0.00 0.00 37.83 33.67 1t6r s LYS 44 CO 0.29 0.36 1.33 1.63 -0.76 0.00 0.00 175.35 178.20 1t6r n LYS 45 N 0.99 0.06 -3.84 1.68 4.01 -1.26 -4.82 118.16 114.98 1t6r n LYS 45 Ca 0.00 0.01 -0.36 0.00 -0.51 0.00 0.00 58.31 57.45 1t6r n LYS 45 Cb 0.48 -1.53 -0.11 0.00 -0.51 0.00 0.00 35.03 33.36 1t6r n LYS 45 CO 0.00 0.00 0.00 -1.59 -1.11 0.00 0.00 177.40 174.70 1t6r s LYS 46 N -3.04 3.81 -0.26 1.97 0.00 -1.26 -0.56 119.74 120.40 1t6r s LYS 46 Ca 0.10 -0.41 -0.00 0.00 0.00 0.00 0.00 55.97 55.65 1t6r s LYS 46 Cb 0.17 -3.32 0.07 0.00 0.00 0.00 0.00 37.83 34.75 1t6r s LYS 46 CO 0.73 -0.01 0.02 0.42 0.00 0.00 0.00 175.35 176.50 1t6r s ILE 47 N 1.17 1.22 -0.40 3.79 -1.09 -1.26 -2.87 121.20 121.75 1t6r s ILE 47 Ca 0.05 -1.24 -0.11 0.00 -2.23 0.00 0.00 60.65 57.11 1t6r s ILE 47 Cb -0.14 -1.69 0.04 0.00 -1.58 0.00 0.00 42.46 39.09 1t6r s ILE 47 CO 0.04 -0.33 0.24 -0.69 -1.23 0.00 0.00 174.94 172.97 1t6r s VAL 48 N 1.50 4.62 -0.23 2.92 1.01 -0.42 -0.61 120.40 129.20 1t6r s VAL 48 Ca 0.01 -0.98 -0.23 0.00 0.00 0.00 0.00 61.98 60.78 1t6r s VAL 48 Cb -0.18 -3.65 -0.01 0.00 0.00 0.00 0.00 36.38 32.54 1t6r s VAL 48 CO -0.12 -0.33 0.74 -0.22 0.00 0.00 0.00 175.10 175.17 1t6r s LEU 49 N 1.55 4.10 -0.39 3.92 2.96 0.13 -2.11 118.68 128.84 1t6r s LEU 49 Ca 0.02 0.93 -0.09 0.00 -0.22 0.00 0.00 54.13 54.77 1t6r s LEU 49 Cb -0.20 -3.05 0.06 0.00 0.50 0.00 0.00 46.19 43.50 1t6r s LEU 49 CO 0.06 -0.41 0.22 -0.62 -1.32 0.00 0.00 176.35 174.27 1t6r s ASP 50 N 1.32 5.59 -0.04 3.68 -1.08 -0.25 -1.34 116.67 124.54 1t6r s ASP 50 Ca 0.32 -1.33 0.17 0.00 -0.52 0.00 0.00 52.55 51.19 1t6r s ASP 50 Cb -0.16 -1.97 0.56 0.00 -1.46 0.00 0.00 42.92 39.90 1t6r s ASP 50 CO 0.09 -0.46 1.46 0.18 0.52 0.00 0.00 175.17 176.96 1t6r n LEU 51 N 4.91 3.58 0.06 -1.34 7.99 -0.98 -0.91 117.00 130.32 1t6r n LEU 51 Ca -0.11 -1.80 0.21 0.00 -0.01 0.00 0.00 56.01 54.30 1t6r n LEU 51 Cb 0.44 -0.46 0.73 0.00 -0.11 0.00 0.00 43.42 44.02 1t6r n LEU 51 CO 0.37 0.76 1.19 0.77 -1.51 0.00 0.00 177.39 178.96 1t6r h SER 52 N 3.48 0.00 0.03 -1.43 4.64 -1.77 -0.94 113.55 117.56 1t6r h SER 52 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1t6r h SER 52 Cb 1.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1t6r h SER 52 CO 0.08 0.00 -0.42 -1.28 -0.87 0.00 0.00 176.83 174.34 1t6r h SER 53 N 0.00 0.11 -2.46 4.97 0.87 -1.84 -3.47 113.55 111.73 1t6r h SER 53 Ca 0.22 -0.91 -0.53 0.00 -1.23 0.00 0.00 61.79 59.34 1t6r h SER 53 Cb 1.18 -0.04 0.04 0.00 -0.44 0.00 0.00 62.40 63.14 1t6r h SER 53 CO -0.00 1.18 1.14 0.52 -0.53 0.00 0.00 176.83 179.14 1t6r n VAL 54 N -4.45 0.46 -0.05 2.23 0.31 -0.36 -4.77 118.33 111.70 1t6r n VAL 54 Ca -0.15 -0.08 0.01 0.00 -0.01 0.00 0.00 64.34 64.11 1t6r n VAL 54 Cb 0.60 -2.17 -0.14 0.00 -0.91 0.00 0.00 33.84 31.22 1t6r n VAL 54 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1t6r n SER 55 N 6.08 0.73 -4.05 4.52 7.64 -1.26 -4.62 113.62 122.66 1t6r n SER 55 Ca 0.19 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.91 1t6r n SER 55 Cb 0.38 1.41 -0.13 0.00 -1.01 0.00 0.00 64.21 64.86 1t6r n SER 55 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1t6r s TYR 56 N -2.87 0.74 -0.12 1.43 5.04 -1.26 -4.57 117.35 115.73 1t6r s TYR 56 Ca -0.08 -0.32 -0.02 0.00 -2.44 0.00 0.00 57.07 54.21 1t6r s TYR 56 Cb 0.09 -0.45 0.04 0.00 0.35 0.00 0.00 41.96 41.99 1t6r s TYR 56 CO 0.74 -0.03 0.02 1.41 -1.34 0.00 0.00 175.55 176.36 1t6r s MET 57 N -0.95 0.55 0.00 4.97 -2.45 -1.25 -2.13 119.30 118.03 1t6r s MET 57 Ca -0.03 -0.10 0.00 0.00 -1.25 0.00 0.00 55.69 54.32 1t6r s MET 57 Cb -0.07 -1.46 0.00 0.00 1.25 0.00 0.00 34.83 34.55 1t6r s MET 57 CO 0.00 -0.46 0.00 -3.47 1.05 0.00 0.00 175.02 172.14 1t6r n ASP 58 N 5.13 0.00 0.00 1.11 2.03 -0.15 -4.89 116.55 119.78 1t6r n ASP 58 Ca -0.08 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.23 1t6r n ASP 58 Cb 0.49 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.89 1t6r n ASP 58 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1t6r n ALA 60 N -3.00 0.00 -0.03 -1.67 0.00 -1.26 -2.81 120.51 111.74 1t6r n ALA 60 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 1t6r n ALA 60 Cb 0.00 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.46 1t6r n ALA 60 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1t6r h GLY 61 N 0.00 0.75 0.92 0.00 0.00 -1.90 -3.17 103.07 99.67 1t6r h GLY 61 Ca 0.00 -0.89 -0.01 0.00 0.00 0.00 0.00 47.33 46.43 1t6r h GLY 61 CO 0.00 0.80 -0.20 1.41 0.00 0.00 0.00 176.54 178.55 1t6r h LEU 62 N 0.52 -0.50 -2.03 3.11 3.38 -1.88 -2.61 115.31 115.30 1t6r h LEU 62 Ca 0.00 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1t6r h LEU 62 Cb 1.15 0.15 -0.00 0.00 0.09 0.00 0.00 40.66 42.04 1t6r h LEU 62 CO 0.12 -0.32 -0.05 1.23 0.09 0.00 0.00 178.44 179.50 1t6r h GLY 63 N -0.51 0.00 0.89 0.83 0.00 -1.89 -1.82 103.07 100.57 1t6r h GLY 63 Ca -0.04 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.21 1t6r h GLY 63 CO 0.04 0.00 -0.14 -0.84 0.00 0.00 0.00 176.54 175.60 1t6r h THR 64 N 0.00 1.30 -0.42 4.70 2.02 -1.44 -2.92 112.91 116.15 1t6r h THR 64 Ca -0.00 -1.24 0.02 0.00 0.77 0.00 0.00 66.41 65.96 1t6r h THR 64 Cb 0.32 1.51 -0.02 0.00 -1.74 0.00 0.00 68.15 68.22 1t6r h THR 64 CO 0.01 0.39 0.28 -0.07 0.37 0.00 0.00 175.52 176.50 1t6r h LEU 65 N 0.32 0.44 -1.86 2.58 3.38 -1.15 0.13 115.31 119.16 1t6r h LEU 65 Ca 0.06 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1t6r h LEU 65 Cb 0.66 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 1t6r h LEU 65 CO 0.04 0.31 -0.08 0.58 0.09 0.00 0.00 178.44 179.39 1t6r h VAL 66 N 0.52 0.29 -0.01 1.22 2.07 -1.48 -1.37 116.25 117.48 1t6r h VAL 66 Ca 0.16 -0.51 -0.10 0.00 0.82 0.00 0.00 66.70 67.07 1t6r h VAL 66 Cb 0.02 1.39 0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1t6r h VAL 66 CO -0.04 0.08 -0.38 0.58 0.02 0.00 0.00 177.57 177.83 1t6r h VAL 67 N 0.00 1.49 -0.55 2.57 2.07 -0.57 -2.61 116.25 118.64 1t6r h VAL 67 Ca -0.00 -1.96 -0.03 0.00 0.82 0.00 0.00 66.70 65.54 1t6r h VAL 67 Cb 0.39 2.64 -0.03 0.00 -1.52 0.00 0.00 31.29 32.77 1t6r h VAL 67 CO 0.01 0.55 0.23 0.40 0.02 0.00 0.00 177.57 178.78 1t6r h ILE 68 N -0.32 1.20 0.20 4.57 1.08 -0.70 0.40 117.51 123.94 1t6r h ILE 68 Ca -0.04 -0.59 -0.00 0.00 -0.39 0.00 0.00 64.86 63.83 1t6r h ILE 68 Cb 1.10 0.53 -0.01 0.00 -3.07 0.00 0.00 36.82 35.37 1t6r h ILE 68 CO 0.07 0.24 -0.16 0.25 -0.69 0.00 0.00 178.15 177.86 1t6r h LEU 69 N 0.78 -0.41 -0.92 1.44 5.85 -1.38 -2.06 115.31 118.62 1t6r h LEU 69 Ca 0.19 0.03 0.17 0.00 0.84 0.00 0.00 57.88 59.11 1t6r h LEU 69 Cb 0.14 0.13 -0.10 0.00 0.37 0.00 0.00 40.66 41.20 1t6r h LEU 69 CO -0.02 -0.25 0.50 0.50 -0.34 0.00 0.00 178.44 178.84 1t6r h LYS 70 N -0.37 0.65 -0.45 1.25 3.64 -0.57 0.27 116.57 120.99 1t6r h LYS 70 Ca -0.01 -0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.20 1t6r h LYS 70 Cb 0.33 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 1t6r h LYS 70 CO -0.01 0.43 -0.25 -0.44 -2.27 0.00 0.00 179.45 176.91 1t6r h ASP 71 N 0.67 0.99 -0.67 4.20 3.32 -1.15 -1.97 116.42 121.81 1t6r h ASP 71 Ca 0.52 -0.39 0.09 0.00 0.02 0.00 0.00 57.03 57.27 1t6r h ASP 71 Cb 0.78 -0.27 -0.07 0.00 0.22 0.00 0.00 39.33 39.99 1t6r h ASP 71 CO -0.38 1.18 0.32 0.00 -1.72 0.00 0.00 179.24 178.63 1t6r h ALA 72 N 0.89 0.91 -0.50 3.45 0.00 -0.24 0.18 119.26 123.95 1t6r h ALA 72 Ca 0.10 0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 1t6r h ALA 72 Cb 0.82 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1t6r h ALA 72 CO 0.07 -0.08 -0.19 0.87 0.00 0.00 0.00 179.25 179.93 1t6r h LYS 73 N 0.56 1.00 -0.07 0.00 1.79 -1.12 0.28 116.57 119.01 1t6r h LYS 73 Ca 0.33 -0.41 -0.03 0.00 -2.18 0.00 0.00 60.65 58.36 1t6r h LYS 73 Cb 0.34 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.94 1t6r h LYS 73 CO -0.26 1.09 -0.10 0.82 -1.08 0.00 0.00 179.45 179.91 1t6r h ILE 74 N 0.87 1.11 -0.01 1.86 2.04 -0.70 -1.60 117.51 121.08 1t6r h ILE 74 Ca 0.12 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1t6r h ILE 74 Cb 0.76 1.17 0.00 0.00 -0.74 0.00 0.00 36.82 38.02 1t6r h ILE 74 CO 0.06 0.15 -0.54 0.59 0.00 0.00 0.00 178.15 178.41 1t6r n ASN 75 N -4.37 1.30 -2.81 1.72 3.02 -0.01 -5.01 115.26 109.11 1t6r n ASN 75 Ca -0.02 -1.04 -0.07 0.00 -0.03 0.00 0.00 54.58 53.42 1t6r n ASN 75 Cb 0.21 0.47 0.03 0.00 -0.61 0.00 0.00 39.78 39.88 1t6r n ASN 75 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1t6r n GLY 76 N 1.43 -0.85 3.41 7.41 0.00 0.67 -5.05 105.19 112.21 1t6r n GLY 76 Ca 0.08 0.37 -0.10 0.00 0.00 0.00 0.00 46.02 46.37 1t6r n GLY 76 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1t6r s LYS 77 N -3.63 1.37 0.81 1.61 -2.85 0.59 -4.99 119.74 112.65 1t6r s LYS 77 Ca 0.21 -1.40 -0.12 0.00 -1.00 0.00 0.00 55.97 53.66 1t6r s LYS 77 Cb -0.03 0.38 0.09 0.00 -2.06 0.00 0.00 37.83 36.21 1t6r s LYS 77 CO 0.58 -0.52 1.18 -1.21 0.10 0.00 0.00 175.35 175.48 1t6r s GLU 78 N -4.07 1.87 -0.28 1.78 2.02 0.28 -4.28 118.70 116.03 1t6r s GLU 78 Ca 0.29 0.03 -0.03 0.00 0.02 0.00 0.00 54.97 55.28 1t6r s GLU 78 Cb 0.03 -1.96 0.16 0.00 0.10 0.00 0.00 34.13 32.46 1t6r s GLU 78 CO 0.09 -1.63 0.53 0.12 0.02 0.00 0.00 175.26 174.39 1t6r s PHE 79 N -3.58 -1.31 0.17 1.61 5.36 -1.26 -4.22 117.98 114.75 1t6r s PHE 79 Ca 0.63 1.52 0.09 0.00 -0.96 0.00 0.00 56.93 58.21 1t6r s PHE 79 Cb -0.10 0.42 -0.04 0.00 -0.34 0.00 0.00 43.02 42.96 1t6r s PHE 79 CO 0.49 -0.79 -0.18 0.42 -1.46 0.00 0.00 175.22 173.70 1t6r s ILE 80 N 2.76 1.84 0.35 3.12 1.01 0.22 -4.53 121.20 125.97 1t6r s ILE 80 Ca 0.15 -1.96 0.05 0.00 0.00 0.00 0.00 60.65 58.89 1t6r s ILE 80 Cb -0.15 -1.88 -0.07 0.00 0.01 0.00 0.00 42.46 40.38 1t6r s ILE 80 CO -0.19 -0.34 0.03 -0.76 0.00 0.00 0.00 174.94 173.68 1t6r s LEU 81 N -2.74 2.45 0.09 2.97 1.43 -1.24 -0.69 118.68 120.95 1t6r s LEU 81 Ca 0.17 -1.36 -0.26 0.00 -1.03 0.00 0.00 54.13 51.65 1t6r s LEU 81 Cb -0.05 -0.59 0.08 0.00 0.03 0.00 0.00 46.19 45.66 1t6r s LEU 81 CO 0.07 -0.53 0.82 -0.55 0.23 0.00 0.00 176.35 176.40 1t6r s SER 82 N -3.56 -0.36 -0.96 2.29 0.15 -0.45 -0.88 113.70 109.92 1t6r s SER 82 Ca 0.35 -0.14 -0.10 0.00 0.70 0.00 0.00 55.95 56.76 1t6r s SER 82 Cb 0.09 0.49 -0.00 0.00 -1.71 0.00 0.00 66.02 64.88 1t6r s SER 82 CO 0.16 -0.82 0.72 -1.20 1.20 0.00 0.00 173.24 173.30 1t6r n SER 83 N -0.34 -5.84 -4.55 5.45 7.64 -1.22 -2.33 113.62 112.43 1t6r n SER 83 Ca -0.10 -0.77 -0.39 0.00 1.01 0.00 0.00 58.87 58.63 1t6r n SER 83 Cb 0.62 -3.42 -0.03 0.00 -1.01 0.00 0.00 64.21 60.37 1t6r n SER 83 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1t6r s LEU 84 N -5.46 3.28 -1.14 -3.43 1.02 -1.26 -3.38 118.68 108.31 1t6r s LEU 84 Ca 0.23 -0.62 -0.22 0.00 0.02 0.00 0.00 54.13 53.54 1t6r s LEU 84 Cb -0.08 -2.56 -0.03 0.00 0.02 0.00 0.00 46.19 43.54 1t6r s LEU 84 CO 0.84 -1.96 1.83 -0.54 0.02 0.00 0.00 176.35 176.55 1t6r s LYS 85 N 5.92 2.99 0.00 1.70 -0.14 -1.26 -4.35 119.74 124.59 1t6r s LYS 85 Ca 0.48 -1.18 0.00 0.00 -1.36 0.00 0.00 55.97 53.91 1t6r s LYS 85 Cb -0.06 -5.29 0.00 0.00 -1.68 0.00 0.00 37.83 30.80 1t6r s LYS 85 CO 0.07 -3.25 0.00 0.39 -0.76 0.00 0.00 175.35 171.80 1t6r n GLU 86 N 8.50 0.00 -0.04 1.68 1.02 -1.26 -0.56 120.64 129.98 1t6r n GLU 86 Ca 0.43 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.57 1t6r n GLU 86 Cb 0.47 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.88 1t6r n GLU 86 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1t6r n SER 87 N 0.00 -0.09 -0.13 1.62 7.64 -1.26 -1.07 113.62 120.32 1t6r n SER 87 Ca 0.00 1.04 -0.05 0.00 1.01 0.00 0.00 58.87 60.87 1t6r n SER 87 Cb 0.00 -0.46 0.01 0.00 -1.01 0.00 0.00 64.21 62.75 1t6r n SER 87 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1t6r h ILE 88 N 0.00 0.34 -0.29 0.44 5.03 -1.08 -1.40 117.51 120.56 1t6r h ILE 88 Ca 0.01 0.00 0.03 0.00 -0.12 0.00 0.00 64.86 64.78 1t6r h ILE 88 Cb 0.04 0.34 -0.04 0.00 -3.03 0.00 0.00 36.82 34.13 1t6r h ILE 88 CO -0.08 0.00 -0.26 -1.28 -0.68 0.00 0.00 178.15 175.85 1t6r h SER 89 N -0.15 -0.89 -0.83 1.72 0.87 -1.56 -2.69 113.55 110.02 1t6r h SER 89 Ca 0.20 0.12 -0.02 0.00 -1.23 0.00 0.00 61.79 60.87 1t6r h SER 89 Cb 0.47 0.38 -0.04 0.00 -0.44 0.00 0.00 62.40 62.77 1t6r h SER 89 CO -0.53 -0.15 0.44 0.08 -0.53 0.00 0.00 176.83 176.15 1t6r h ARG 90 N -0.11 1.17 -1.00 2.24 0.11 -0.00 -0.61 114.38 116.17 1t6r h ARG 90 Ca 0.05 -0.14 0.17 0.00 0.10 0.00 0.00 59.98 60.16 1t6r h ARG 90 Cb 0.23 -0.22 -0.10 0.00 1.11 0.00 0.00 29.97 30.99 1t6r h ARG 90 CO -0.33 0.87 0.62 0.82 0.10 0.00 0.00 179.97 182.05 1t6r h ILE 91 N 1.16 0.76 -0.40 0.08 2.04 -1.32 0.27 117.51 120.11 1t6r h ILE 91 Ca 0.29 -0.27 -0.15 0.00 1.00 0.00 0.00 64.86 65.73 1t6r h ILE 91 Cb 0.05 -0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.01 1t6r h ILE 91 CO -0.04 0.15 -0.35 -0.07 0.00 0.00 0.00 178.15 177.83 1t6r h LEU 92 N 0.80 0.98 -0.31 1.44 3.38 -0.78 -2.66 115.31 118.15 1t6r h LEU 92 Ca 0.55 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1t6r h LEU 92 Cb 0.81 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1t6r h LEU 92 CO -0.33 1.22 0.00 0.29 0.09 0.00 0.00 178.44 179.71 1t6r n LYS 93 N -4.07 0.24 0.00 1.13 4.01 -0.03 -0.23 118.16 119.21 1t6r n LYS 93 Ca -0.02 0.31 0.00 0.00 -0.51 0.00 0.00 58.31 58.09 1t6r n LYS 93 Cb 0.52 -1.84 0.00 0.00 -0.51 0.00 0.00 35.03 33.20 1t6r n LYS 93 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 1t6r n LEU 94 N -2.27 0.03 -0.16 -0.35 4.32 0.77 -3.29 117.00 116.05 1t6r n LEU 94 Ca 0.04 0.89 0.01 0.00 -0.02 0.00 0.00 56.01 56.93 1t6r n LEU 94 Cb 0.35 -0.44 0.02 0.00 -1.62 0.00 0.00 43.42 41.73 1t6r n LEU 94 CO 0.26 -0.44 0.49 0.41 -1.22 0.00 0.00 177.39 176.89 1t6r n THR 95 N -1.82 0.09 -2.01 -5.08 -1.04 -1.22 -4.85 114.28 98.34 1t6r n THR 95 Ca 0.00 -0.07 -0.19 0.00 -2.04 0.00 0.00 64.05 61.74 1t6r n THR 95 Cb 0.00 -0.03 -0.04 0.00 -1.82 0.00 0.00 70.33 68.44 1t6r n THR 95 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1t6r n HIS 96 N -0.30 -0.51 0.32 -1.42 -0.00 -1.12 -4.89 115.22 107.30 1t6r n HIS 96 Ca 0.02 0.00 0.20 0.00 -0.00 0.00 0.00 57.72 57.94 1t6r n HIS 96 Cb 0.08 -3.56 1.11 0.00 -0.00 0.00 0.00 29.99 27.62 1t6r n HIS 96 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 1t6r h LEU 97 N 0.00 0.00 0.00 2.41 3.38 -0.90 0.77 115.31 120.97 1t6r h LEU 97 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1t6r h LEU 97 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 1t6r h LEU 97 CO 0.56 0.00 0.00 -0.67 0.09 0.00 0.00 178.44 178.43 1t6r n ASP 98 N -3.30 0.00 -0.59 -0.43 2.03 -1.11 -0.57 116.55 112.58 1t6r n ASP 98 Ca -0.03 0.33 0.07 0.00 0.52 0.00 0.00 54.79 55.69 1t6r n ASP 98 Cb 0.09 -0.35 0.06 0.00 -0.72 0.00 0.00 41.12 40.20 1t6r n ASP 98 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1t6r n LYS 99 N -1.35 1.08 -0.08 -0.67 2.85 0.26 -3.29 118.16 116.97 1t6r n LYS 99 Ca 0.01 -1.38 -0.09 0.00 -1.05 0.00 0.00 58.31 55.80 1t6r n LYS 99 Cb 0.01 -1.28 -0.11 0.00 -0.65 0.00 0.00 35.03 33.00 1t6r n LYS 99 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 1t6r n ILE 100 N 0.82 1.03 -0.13 0.58 5.41 0.27 -4.61 119.36 122.73 1t6r n ILE 100 Ca 0.09 -0.56 0.00 0.00 1.00 0.00 0.00 62.75 63.28 1t6r n ILE 100 Cb 0.37 -0.79 0.00 0.00 -0.71 0.00 0.00 39.64 38.51 1t6r n ILE 100 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 1t6r n PHE 101 N -2.71 0.00 -2.08 1.39 3.72 0.19 -5.01 117.46 112.96 1t6r n PHE 101 Ca -0.27 -0.33 0.00 0.00 -0.05 0.00 0.00 57.45 56.80 1t6r n PHE 101 Cb 0.94 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 39.45 1t6r n PHE 101 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1t6r n LYS 102 N -0.33 0.00 -3.60 -1.08 4.81 -1.21 -3.66 118.16 113.10 1t6r n LYS 102 Ca 0.00 0.00 -0.05 0.00 -0.87 0.00 0.00 58.31 57.39 1t6r n LYS 102 Cb 0.22 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.24 1t6r n LYS 102 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1t6r s ILE 103 N 0.00 0.00 0.01 3.15 1.01 -1.26 -4.23 121.20 119.88 1t6r s ILE 103 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 60.65 60.66 1t6r s ILE 103 Cb 0.00 -1.00 -0.01 0.00 0.01 0.00 0.00 42.46 41.46 1t6r s ILE 103 CO 0.00 0.00 -0.04 0.42 0.00 0.00 0.00 174.94 175.32 1t6r s THR 104 N -2.01 0.28 0.14 2.92 -4.23 -0.06 -4.93 115.64 107.75 1t6r s THR 104 Ca 0.08 -0.33 -0.12 0.00 -1.18 0.00 0.00 61.69 60.14 1t6r s THR 104 Cb -0.01 -0.28 -0.02 0.00 1.34 0.00 0.00 72.50 73.53 1t6r s THR 104 CO -0.05 -0.03 1.52 -0.78 -0.54 0.00 0.00 174.62 174.74 1t6r h ASP 105 N 5.74 0.92 -5.30 3.99 3.58 -1.93 -3.23 116.42 120.20 1t6r h ASP 105 Ca -0.28 -0.41 -0.17 0.00 0.42 0.00 0.00 57.03 56.59 1t6r h ASP 105 Cb 1.20 -0.26 -0.15 0.00 1.72 0.00 0.00 39.33 41.84 1t6r h ASP 105 CO 0.48 1.13 -0.66 0.42 -2.88 0.00 0.00 179.24 177.73 1t6r s THR 106 N -4.63 0.18 0.55 2.25 -4.23 -1.26 -3.76 115.64 104.74 1t6r s THR 106 Ca -0.12 -1.89 0.26 0.00 -1.18 0.00 0.00 61.69 58.77 1t6r s THR 106 Cb 0.11 -1.89 0.39 0.00 1.34 0.00 0.00 72.50 72.45 1t6r s THR 106 CO 0.85 -0.63 2.00 1.62 -0.54 0.00 0.00 174.62 177.93 1t6r h VAL 107 N 2.94 0.66 0.00 2.29 3.04 -1.99 0.66 116.25 123.86 1t6r h VAL 107 Ca -0.35 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.34 1t6r h VAL 107 Cb 1.18 0.74 0.00 0.00 -2.01 0.00 0.00 31.29 31.21 1t6r h VAL 107 CO 0.61 0.00 0.00 -0.62 -1.01 0.00 0.00 177.57 176.55 1t6r n GLU 108 N -4.23 0.03 -0.12 4.17 -0.58 -1.26 -2.53 120.64 116.11 1t6r n GLU 108 Ca 0.08 0.19 0.10 0.00 -0.42 0.00 0.00 57.16 57.11 1t6r n GLU 108 Cb 0.56 -1.50 0.16 0.00 -0.57 0.00 0.00 31.44 30.09 1t6r n GLU 108 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1t6r n GLU 109 N -1.48 2.20 0.00 3.49 0.00 0.22 -5.14 120.64 119.93 1t6r n GLU 109 Ca 0.05 -2.03 0.09 0.00 0.00 0.00 0.00 57.16 55.27 1t6r n GLU 109 Cb 0.20 -1.43 0.07 0.00 0.00 0.00 0.00 31.44 30.28 1t6r n GLU 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13