#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 6.65 0.32 6.12 2.47 -1.26 -5.02 114.94 124.22 1t6r s ASN 2 Ca 0.00 2.45 0.03 0.00 0.42 0.00 0.00 52.86 55.76 1t6r s ASN 2 Cb 0.00 -2.57 -0.02 0.00 -1.45 0.00 0.00 41.25 37.21 1t6r s ASN 2 CO 0.00 -0.83 0.32 0.21 -3.72 0.00 0.00 177.10 173.08 1t6r s ASN 3 N 1.98 1.28 -0.21 -4.21 2.47 -1.26 -5.04 114.94 109.95 1t6r s ASN 3 Ca 0.71 -1.63 -0.29 0.00 0.42 0.00 0.00 52.86 52.07 1t6r s ASN 3 Cb -0.39 0.57 -0.01 0.00 -1.45 0.00 0.00 41.25 39.97 1t6r s ASN 3 CO 0.31 -1.11 1.27 -0.22 -3.72 0.00 0.00 177.10 173.63 1t6r s LEU 4 N -3.31 4.08 0.27 3.21 1.98 -1.26 -4.35 118.68 119.30 1t6r s LEU 4 Ca 0.37 1.53 0.05 0.00 -2.89 0.00 0.00 54.13 53.19 1t6r s LEU 4 Cb 0.02 -3.54 -0.06 0.00 0.66 0.00 0.00 46.19 43.27 1t6r s LEU 4 CO 0.24 -0.86 -0.03 -0.54 -1.89 0.00 0.00 176.35 173.27 1t6r s LYS 5 N 3.71 1.49 0.04 1.98 -0.14 0.52 -5.01 119.74 122.34 1t6r s LYS 5 Ca 0.55 -1.77 0.02 0.00 -1.36 0.00 0.00 55.97 53.41 1t6r s LYS 5 Cb -0.20 -0.94 -0.03 0.00 -1.68 0.00 0.00 37.83 34.98 1t6r s LYS 5 CO 0.17 -0.03 -0.07 -0.51 -0.76 0.00 0.00 175.35 174.15 1t6r s LEU 6 N -3.40 2.28 -0.49 3.17 1.43 -1.26 -1.55 118.68 118.85 1t6r s LEU 6 Ca 0.30 -0.59 0.03 0.00 -1.03 0.00 0.00 54.13 52.85 1t6r s LEU 6 Cb 0.05 -0.10 0.16 0.00 0.03 0.00 0.00 46.19 46.33 1t6r s LEU 6 CO 0.11 -0.25 0.34 -0.62 0.23 0.00 0.00 176.35 176.16 1t6r s ASP 7 N -1.70 3.07 0.03 2.29 2.15 -0.48 -4.91 116.67 117.11 1t6r s ASP 7 Ca -0.09 -3.09 -0.30 0.00 0.43 0.00 0.00 52.55 49.50 1t6r s ASP 7 Cb -0.08 -0.92 -0.05 0.00 -0.30 0.00 0.00 42.92 41.57 1t6r s ASP 7 CO -0.01 -0.18 1.21 -0.63 -0.17 0.00 0.00 175.17 175.39 1t6r s ILE 8 N -0.18 4.08 -0.02 4.11 1.01 -1.26 -1.22 121.20 127.72 1t6r s ILE 8 Ca 0.25 1.48 0.00 0.00 0.00 0.00 0.00 60.65 62.38 1t6r s ILE 8 Cb -0.08 -3.95 0.03 0.00 0.01 0.00 0.00 42.46 38.47 1t6r s ILE 8 CO -0.12 0.08 0.02 -0.69 0.00 0.00 0.00 174.94 174.23 1t6r s VAL 9 N 1.46 0.01 -0.33 2.92 1.01 0.63 -4.97 120.40 121.14 1t6r s VAL 9 Ca 0.58 0.16 -0.01 0.00 0.00 0.00 0.00 61.98 62.71 1t6r s VAL 9 Cb -0.28 -0.12 0.11 0.00 0.00 0.00 0.00 36.38 36.09 1t6r s VAL 9 CO 0.27 0.09 0.13 -1.61 0.00 0.00 0.00 175.10 173.98 1t6r s GLU 10 N 0.91 0.69 0.00 2.72 2.02 -1.26 -1.10 118.70 122.68 1t6r s GLU 10 Ca -0.08 -1.12 0.00 0.00 0.02 0.00 0.00 54.97 53.79 1t6r s GLU 10 Cb -0.11 -1.85 0.00 0.00 0.10 0.00 0.00 34.13 32.27 1t6r s GLU 10 CO -0.02 -1.03 0.00 1.04 0.02 0.00 0.00 175.26 175.27 1t6r n GLN 11 N 4.70 0.00 -1.32 1.61 6.02 -1.26 -4.93 117.38 122.20 1t6r n GLN 11 Ca -0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.61 1t6r n GLN 11 Cb 0.41 -0.18 -0.04 0.00 1.02 0.00 0.00 30.24 31.45 1t6r n GLN 11 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1t6r n ASP 12 N -2.52 8.55 -0.00 1.08 8.00 -1.26 -4.64 116.55 125.76 1t6r n ASP 12 Ca 0.00 -2.59 -0.00 0.00 0.71 0.00 0.00 54.79 52.91 1t6r n ASP 12 Cb 0.12 -1.54 -0.00 0.00 -0.02 0.00 0.00 41.12 39.68 1t6r n ASP 12 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1t6r n ASP 13 N 3.43 -4.37 -4.09 -2.24 2.03 -1.26 -4.86 116.55 105.18 1t6r n ASP 13 Ca 0.76 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.99 1t6r n ASP 13 Cb 0.27 -2.69 -0.10 0.00 -0.72 0.00 0.00 41.12 37.89 1t6r n ASP 13 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1t6r s LYS 14 N -1.46 0.79 -0.59 -0.67 2.20 -1.26 -4.82 119.74 113.93 1t6r s LYS 14 Ca 0.00 -1.29 -0.03 0.00 -0.36 0.00 0.00 55.97 54.28 1t6r s LYS 14 Cb 0.00 0.24 0.15 0.00 -1.51 0.00 0.00 37.83 36.72 1t6r s LYS 14 CO 0.00 -0.20 0.41 0.00 -0.36 0.00 0.00 175.35 175.20 1t6r s ALA 15 N -3.97 3.53 0.37 3.13 0.00 -0.58 -4.00 121.76 120.23 1t6r s ALA 15 Ca 0.15 -3.14 -0.23 0.00 0.00 0.00 0.00 51.96 48.75 1t6r s ALA 15 Cb 0.07 -2.65 -0.10 0.00 0.00 0.00 0.00 23.12 20.44 1t6r s ALA 15 CO -0.05 -2.06 0.93 0.42 0.00 0.00 0.00 175.76 175.00 1t6r s ILE 16 N 0.16 4.34 -0.21 0.00 1.09 -0.26 -0.60 121.20 125.72 1t6r s ILE 16 Ca 0.15 1.58 -0.04 0.00 -1.10 0.00 0.00 60.65 61.25 1t6r s ILE 16 Cb -0.20 -3.77 0.11 0.00 -1.06 0.00 0.00 42.46 37.54 1t6r s ILE 16 CO -0.04 -0.11 0.32 0.54 -0.10 0.00 0.00 174.94 175.55 1t6r s VAL 17 N -1.93 -0.50 -0.83 2.92 0.11 -0.57 -0.27 120.40 119.34 1t6r s VAL 17 Ca 0.56 -0.02 -0.25 0.00 -2.93 0.00 0.00 61.98 59.34 1t6r s VAL 17 Cb -0.13 -0.72 0.05 0.00 -1.53 0.00 0.00 36.38 34.05 1t6r s VAL 17 CO 0.18 -0.10 1.29 -0.13 -3.33 0.00 0.00 175.10 173.00 1t6r s ARG 18 N 2.47 3.32 -0.05 1.54 0.52 -0.36 -0.63 118.95 125.77 1t6r s ARG 18 Ca 0.08 -0.66 -0.30 0.00 -0.52 0.00 0.00 55.73 54.34 1t6r s ARG 18 Cb -0.15 -4.58 -0.04 0.00 0.52 0.00 0.00 34.95 30.70 1t6r s ARG 18 CO -0.14 -2.11 1.35 0.08 0.02 0.00 0.00 175.30 174.50 1t6r s VAL 19 N 5.16 3.94 -0.13 3.52 1.01 0.70 -1.38 120.40 133.22 1t6r s VAL 19 Ca 0.37 1.27 -0.02 0.00 0.00 0.00 0.00 61.98 63.60 1t6r s VAL 19 Cb -0.06 -3.81 0.04 0.00 0.00 0.00 0.00 36.38 32.54 1t6r s VAL 19 CO 0.06 -0.03 -0.00 -1.10 0.00 0.00 0.00 175.10 174.02 1t6r s GLN 20 N 2.67 0.86 0.00 2.72 -0.21 -0.60 -2.10 119.66 123.00 1t6r s GLN 20 Ca 0.61 -0.21 0.00 0.00 0.02 0.00 0.00 55.36 55.78 1t6r s GLN 20 Cb -0.28 -1.59 0.00 0.00 1.00 0.00 0.00 33.01 32.13 1t6r s GLN 20 CO 0.24 -0.43 0.00 0.41 -2.12 0.00 0.00 175.29 173.38 1t6r n GLY 21 N 5.05 1.79 3.94 3.09 0.00 -0.53 -0.36 105.19 118.16 1t6r n GLY 21 Ca -0.09 -1.99 -0.27 0.00 0.00 0.00 0.00 46.02 43.67 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 0.00 4.17 -0.27 1.61 1.01 -1.26 -4.19 116.67 117.73 1t6r s ASP 22 Ca 0.00 0.32 0.22 0.00 0.71 0.00 0.00 52.55 53.81 1t6r s ASP 22 Cb 0.00 -0.72 0.50 0.00 1.01 0.00 0.00 42.92 43.71 1t6r s ASP 22 CO 0.00 -2.04 1.11 -0.38 0.21 0.00 0.00 175.17 174.07 1t6r n ILE 23 N -3.23 1.21 -2.15 0.77 5.41 -0.44 -4.65 119.36 116.28 1t6r n ILE 23 Ca 0.11 -2.88 -0.07 0.00 1.00 0.00 0.00 62.75 60.91 1t6r n ILE 23 Cb 0.60 1.24 0.04 0.00 -0.71 0.00 0.00 39.64 40.82 1t6r n ILE 23 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1t6r n ASP 24 N -0.58 0.33 0.00 4.38 -0.08 -1.26 -3.45 116.55 115.89 1t6r n ASP 24 Ca 0.07 -1.30 0.00 0.00 -1.51 0.00 0.00 54.79 52.05 1t6r n ASP 24 Cb 0.80 -0.21 0.03 0.00 2.34 0.00 0.00 41.12 44.08 1t6r n ASP 24 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1t6r n ALA 25 N -3.03 1.53 1.05 -1.67 0.00 -1.26 -0.12 120.51 117.01 1t6r n ALA 25 Ca -0.05 -0.01 0.11 0.00 0.00 0.00 0.00 53.44 53.50 1t6r n ALA 25 Cb 0.17 -1.02 0.12 0.00 0.00 0.00 0.00 19.45 18.72 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 -1.01 0.00 0.00 0.00 4.01 -1.26 -4.73 117.16 114.17 1t6r n TYR 26 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 1t6r n TYR 26 Cb 0.00 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 38.94 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 -1.01 0.00 -0.20 7.72 3.02 0.13 -4.76 115.26 120.16 1t6r n ASN 27 Ca 0.07 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.70 1t6r n ASN 27 Cb 0.36 0.03 0.37 0.00 -0.61 0.00 0.00 39.78 39.93 1t6r n ASN 27 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1t6r h SER 28 N 0.00 0.65 0.76 6.41 4.64 -0.71 0.38 113.55 125.67 1t6r h SER 28 Ca 0.00 0.01 -0.05 0.00 -0.47 0.00 0.00 61.79 61.28 1t6r h SER 28 Cb 0.00 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 61.96 1t6r h SER 28 CO 0.00 0.40 -0.24 0.28 -0.87 0.00 0.00 176.83 176.40 1t6r h SER 29 N 0.72 0.00 0.00 4.97 0.02 -1.85 0.12 113.55 117.54 1t6r h SER 29 Ca 0.34 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 1t6r h SER 29 Cb 0.37 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.91 1t6r h SER 29 CO -0.12 0.24 -0.26 -0.33 -1.14 0.00 0.00 176.83 175.22 1t6r h GLU 30 N 0.00 0.00 -1.60 3.45 4.39 -1.00 -3.23 114.58 116.59 1t6r h GLU 30 Ca -0.00 0.00 0.48 0.00 0.34 0.00 0.00 59.36 60.18 1t6r h GLU 30 Cb 0.68 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.24 1t6r h GLU 30 CO 0.03 0.00 1.11 1.25 -1.16 0.00 0.00 179.01 180.24 1t6r h LEU 31 N -0.92 0.10 0.34 1.33 6.46 -0.48 0.26 115.31 122.40 1t6r h LEU 31 Ca 0.00 0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 57.80 1t6r h LEU 31 Cb 0.26 0.05 0.00 0.00 -0.73 0.00 0.00 40.66 40.24 1t6r h LEU 31 CO 0.00 -0.07 -0.17 0.50 -0.62 0.00 0.00 178.44 178.08 1t6r h LYS 32 N 0.04 -0.45 0.00 1.25 3.64 -0.86 -1.11 116.57 119.09 1t6r h LYS 32 Ca 0.83 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 60.24 1t6r h LYS 32 Cb 3.07 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 34.99 1t6r h LYS 32 CO -0.17 -0.16 0.00 -0.85 -2.27 0.00 0.00 179.45 176.00 1t6r n GLU 33 N -5.19 0.21 -0.11 1.90 0.28 0.91 -0.26 120.64 118.38 1t6r n GLU 33 Ca -0.10 0.14 -0.21 0.00 -0.16 0.00 0.00 57.16 56.83 1t6r n GLU 33 Cb 0.26 -1.50 -0.09 0.00 1.43 0.00 0.00 31.44 31.54 1t6r n GLU 33 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1t6r n GLN 34 N -1.31 0.51 -0.02 3.44 6.02 -1.11 -3.83 117.38 121.07 1t6r n GLN 34 Ca 0.08 0.18 -0.03 0.00 -0.01 0.00 0.00 57.00 57.21 1t6r n GLN 34 Cb 0.14 -1.36 0.21 0.00 1.02 0.00 0.00 30.24 30.25 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 -0.50 0.56 -0.48 1.08 3.38 -0.96 0.10 115.31 118.50 1t6r h LEU 35 Ca -0.54 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.27 1t6r h LEU 35 Cb 1.60 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.20 1t6r h LEU 35 CO -0.24 0.73 0.00 -1.14 0.09 0.00 0.00 178.44 177.88 1t6r n ARG 36 N -4.18 0.13 -0.07 1.13 0.63 0.64 -2.17 116.66 112.77 1t6r n ARG 36 Ca 0.01 0.37 -0.09 0.00 -0.92 0.00 0.00 57.85 57.21 1t6r n ARG 36 Cb 0.35 -1.75 -0.05 0.00 0.45 0.00 0.00 32.46 31.45 1t6r n ARG 36 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 1t6r h ASN 37 N 0.00 0.00 -1.00 6.15 2.35 -1.29 -3.38 115.58 118.42 1t6r h ASN 37 Ca 0.00 -0.28 0.15 0.00 -0.55 0.00 0.00 56.30 55.62 1t6r h ASN 37 Cb 0.32 0.00 -0.16 0.00 0.05 0.00 0.00 38.32 38.54 1t6r h ASN 37 CO 0.00 0.93 -0.41 0.15 -1.65 0.00 0.00 177.43 176.44 1t6r h PHE 38 N -1.00 -1.19 0.00 1.19 3.57 -0.72 0.13 116.94 118.93 1t6r h PHE 38 Ca -0.09 0.11 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 1t6r h PHE 38 Cb 0.68 0.66 -0.00 0.00 2.79 0.00 0.00 35.95 40.08 1t6r h PHE 38 CO -0.02 -0.40 -0.02 0.82 -2.23 0.00 0.00 178.31 176.46 1t6r h ILE 39 N -0.00 0.05 0.00 1.41 2.04 -1.67 0.19 117.51 119.52 1t6r h ILE 39 Ca 0.32 -0.67 -0.09 0.00 1.00 0.00 0.00 64.86 65.42 1t6r h ILE 39 Cb 0.58 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1t6r h ILE 39 CO -0.98 0.02 -0.42 0.28 0.00 0.00 0.00 178.15 177.05 1t6r h SER 40 N 0.00 0.00 -1.88 1.72 0.02 -0.96 -3.41 113.55 109.04 1t6r h SER 40 Ca -0.00 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.43 1t6r h SER 40 Cb 0.64 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 62.77 1t6r h SER 40 CO 0.00 0.42 -0.91 1.07 -1.14 0.00 0.00 176.83 176.27 1t6r n THR 41 N -3.29 1.63 0.00 -2.27 5.66 0.03 -4.72 114.28 111.33 1t6r n THR 41 Ca 0.01 -4.79 0.00 0.00 -3.05 0.00 0.00 64.05 56.22 1t6r n THR 41 Cb 0.65 -0.71 0.00 0.00 -1.55 0.00 0.00 70.33 68.71 1t6r n THR 41 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 1t6r n THR 42 N -0.09 0.00 -0.24 1.09 5.66 -1.07 -4.82 114.28 114.80 1t6r n THR 42 Ca 0.27 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.27 1t6r n THR 42 Cb 0.58 -0.17 0.00 0.00 -1.55 0.00 0.00 70.33 69.20 1t6r n THR 42 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1t6r n SER 43 N -1.80 0.00 -4.73 1.09 7.64 -1.26 -4.94 113.62 109.62 1t6r n SER 43 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.47 1t6r n SER 43 Cb 0.16 -1.35 -0.04 0.00 -1.01 0.00 0.00 64.21 61.97 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 -0.48 4.66 0.00 1.43 -0.14 -1.26 -4.93 119.74 119.02 1t6r s LYS 44 Ca 0.00 1.47 0.05 0.00 -1.36 0.00 0.00 55.97 56.13 1t6r s LYS 44 Cb 0.00 -3.39 0.32 0.00 -1.68 0.00 0.00 37.83 33.08 1t6r s LYS 44 CO 0.00 0.14 0.87 1.63 -0.76 0.00 0.00 175.35 177.23 1t6r n LYS 45 N 3.01 0.61 -3.52 1.68 4.01 -1.26 -4.70 118.16 117.98 1t6r n LYS 45 Ca 0.03 0.00 -0.14 0.00 -0.51 0.00 0.00 58.31 57.69 1t6r n LYS 45 Cb 0.49 -1.14 -0.12 0.00 -0.51 0.00 0.00 35.03 33.76 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 -2.00 0.22 -0.14 1.97 0.00 -1.26 -0.97 119.74 117.56 1t6r s LYS 46 Ca 0.08 0.48 -0.03 0.00 0.00 0.00 0.00 55.97 56.50 1t6r s LYS 46 Cb 0.04 -0.62 -0.03 0.00 0.00 0.00 0.00 37.83 37.22 1t6r s LYS 46 CO 0.06 -0.52 -0.03 0.42 0.00 0.00 0.00 175.35 175.28 1t6r s ILE 47 N 2.42 3.97 -0.37 3.79 1.09 -1.07 -1.53 121.20 129.50 1t6r s ILE 47 Ca 0.06 -0.34 0.03 0.00 -1.10 0.00 0.00 60.65 59.31 1t6r s ILE 47 Cb -0.14 -2.72 0.11 0.00 -1.06 0.00 0.00 42.46 38.64 1t6r s ILE 47 CO -0.12 0.52 0.10 -0.69 -0.10 0.00 0.00 174.94 174.65 1t6r s VAL 48 N 0.10 2.16 -0.86 2.92 1.01 0.23 -1.09 120.40 124.87 1t6r s VAL 48 Ca -0.00 -2.44 -0.22 0.00 0.00 0.00 0.00 61.98 59.33 1t6r s VAL 48 Cb -0.13 -2.58 0.09 0.00 0.00 0.00 0.00 36.38 33.75 1t6r s VAL 48 CO 0.03 -0.65 1.18 -0.22 0.00 0.00 0.00 175.10 175.43 1t6r s LEU 49 N 0.74 4.31 -0.23 3.92 2.96 0.09 -1.51 118.68 128.96 1t6r s LEU 49 Ca 0.12 -1.47 -0.20 0.00 -0.22 0.00 0.00 54.13 52.36 1t6r s LEU 49 Cb -0.20 -2.46 -0.02 0.00 0.50 0.00 0.00 46.19 44.00 1t6r s LEU 49 CO -0.08 -1.35 0.61 -0.62 -1.32 0.00 0.00 176.35 173.59 1t6r s ASP 50 N 3.99 6.60 -0.18 3.68 2.15 0.19 -1.06 116.67 132.05 1t6r s ASP 50 Ca 0.34 0.73 0.13 0.00 0.43 0.00 0.00 52.55 54.18 1t6r s ASP 50 Cb -0.07 -2.33 0.41 0.00 -0.30 0.00 0.00 42.92 40.63 1t6r s ASP 50 CO -0.02 -0.31 1.21 0.18 -0.17 0.00 0.00 175.17 176.06 1t6r n LEU 51 N 5.37 2.45 0.00 -1.34 4.77 0.31 -0.21 117.00 128.35 1t6r n LEU 51 Ca -0.02 -3.61 0.07 0.00 -0.03 0.00 0.00 56.01 52.42 1t6r n LEU 51 Cb 0.49 -0.45 0.35 0.00 -2.33 0.00 0.00 43.42 41.48 1t6r n LEU 51 CO 0.43 1.26 0.68 -1.54 -1.33 0.00 0.00 177.39 176.89 1t6r n SER 52 N -0.91 0.00 0.00 -1.43 3.41 -1.12 -3.51 113.62 110.06 1t6r n SER 52 Ca 0.17 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.85 1t6r n SER 52 Cb 0.75 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 1t6r n SER 52 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1t6r n SER 53 N -1.28 0.34 -3.32 4.04 7.64 -1.19 -4.98 113.62 114.87 1t6r n SER 53 Ca 0.07 -0.65 -0.22 0.00 1.01 0.00 0.00 58.87 59.07 1t6r n SER 53 Cb 0.11 0.56 0.18 0.00 -1.01 0.00 0.00 64.21 64.05 1t6r n SER 53 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1t6r n VAL 54 N -0.56 0.00 0.00 0.44 3.14 -0.89 -1.46 118.33 119.00 1t6r n VAL 54 Ca 0.00 -0.45 0.00 0.00 -2.96 0.00 0.00 64.34 60.93 1t6r n VAL 54 Cb 0.01 -1.29 0.00 0.00 -1.06 0.00 0.00 33.84 31.50 1t6r n VAL 54 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1t6r n SER 55 N -4.22 0.00 -4.66 6.55 7.64 -1.26 -4.80 113.62 112.86 1t6r n SER 55 Ca 0.12 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.62 1t6r n SER 55 Cb 0.44 0.03 -0.08 0.00 -1.01 0.00 0.00 64.21 63.58 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 -1.10 3.34 -0.07 1.43 6.14 -1.26 -4.36 117.35 121.47 1t6r s TYR 56 Ca 0.00 0.42 -0.00 0.00 0.64 0.00 0.00 57.07 58.13 1t6r s TYR 56 Cb 0.00 -2.41 0.02 0.00 0.42 0.00 0.00 41.96 40.00 1t6r s TYR 56 CO 0.00 0.02 -0.04 1.41 0.64 0.00 0.00 175.55 177.58 1t6r s MET 57 N 1.22 0.95 0.00 4.97 1.75 -1.26 -1.33 119.30 125.60 1t6r s MET 57 Ca 0.13 -0.08 0.00 0.00 -1.25 0.00 0.00 55.69 54.49 1t6r s MET 57 Cb -0.14 -1.07 0.00 0.00 2.84 0.00 0.00 34.83 36.45 1t6r s MET 57 CO 0.06 -0.19 0.00 -3.47 -0.65 0.00 0.00 175.02 170.78 1t6r n ASP 58 N 4.60 0.00 0.00 1.11 -0.08 -1.26 -4.92 116.55 116.00 1t6r n ASP 58 Ca -0.16 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.12 1t6r n ASP 58 Cb 0.50 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.96 1t6r n ASP 58 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1t6r n ALA 60 N -3.00 0.00 -0.08 -1.67 0.00 -1.26 -1.26 120.51 113.24 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 -0.15 0.00 0.00 0.00 0.00 19.45 19.30 1t6r n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t6r n GLY 61 N 0.00 -0.86 0.12 0.00 0.00 -1.22 -4.64 105.19 98.58 1t6r n GLY 61 Ca 0.00 -0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.65 1t6r n GLY 61 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1t6r h LEU 62 N 0.00 -0.18 0.00 0.99 3.38 -1.48 -2.77 115.31 115.25 1t6r h LEU 62 Ca -0.49 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.25 1t6r h LEU 62 Cb 2.13 0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.92 1t6r h LEU 62 CO 0.02 0.15 0.00 0.61 0.09 0.00 0.00 178.44 179.31 1t6r n GLY 63 N -0.34 -0.75 0.10 0.83 0.00 -1.26 -1.45 105.19 102.32 1t6r n GLY 63 Ca -0.09 -0.03 -0.13 0.00 0.00 0.00 0.00 46.02 45.77 1t6r n GLY 63 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1t6r h THR 64 N 0.00 1.05 -0.16 2.61 2.02 -1.75 -2.55 112.91 114.13 1t6r h THR 64 Ca 0.00 -0.55 0.04 0.00 0.77 0.00 0.00 66.41 66.67 1t6r h THR 64 Cb 0.13 1.40 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 1t6r h THR 64 CO 0.00 0.13 0.11 -0.07 0.37 0.00 0.00 175.52 176.07 1t6r h LEU 65 N -0.38 0.02 -0.59 2.58 3.38 -1.37 0.12 115.31 119.06 1t6r h LEU 65 Ca -0.01 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 1t6r h LEU 65 Cb 0.32 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1t6r h LEU 65 CO 0.02 0.01 -0.29 0.58 0.09 0.00 0.00 178.44 178.85 1t6r h VAL 66 N 0.02 1.28 -0.06 1.22 2.07 -1.61 -0.21 116.25 118.95 1t6r h VAL 66 Ca 0.07 -1.44 0.02 0.00 0.82 0.00 0.00 66.70 66.18 1t6r h VAL 66 Cb 0.26 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1t6r h VAL 66 CO -0.00 0.48 -0.07 0.58 0.02 0.00 0.00 177.57 178.58 1t6r h VAL 67 N 0.69 0.81 -0.84 2.57 2.07 -0.41 -2.12 116.25 119.01 1t6r h VAL 67 Ca 0.08 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.62 1t6r h VAL 67 Cb 0.83 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 31.36 1t6r h VAL 67 CO 0.07 0.00 0.55 0.40 0.02 0.00 0.00 177.57 178.61 1t6r h ILE 68 N -0.09 1.17 0.60 4.57 1.08 -0.62 -1.59 117.51 122.64 1t6r h ILE 68 Ca 0.05 -0.38 -0.03 0.00 -0.39 0.00 0.00 64.86 64.11 1t6r h ILE 68 Cb 0.16 -0.02 0.01 0.00 -3.07 0.00 0.00 36.82 33.89 1t6r h ILE 68 CO -0.12 0.20 -0.29 0.25 -0.69 0.00 0.00 178.15 177.50 1t6r h LEU 69 N 1.10 -0.69 -0.94 1.44 7.12 -0.99 -2.62 115.31 119.73 1t6r h LEU 69 Ca 0.32 0.02 0.25 0.00 0.13 0.00 0.00 57.88 58.61 1t6r h LEU 69 Cb -0.06 0.18 -0.13 0.00 -0.53 0.00 0.00 40.66 40.12 1t6r h LEU 69 CO -0.09 -0.49 0.45 0.50 -0.13 0.00 0.00 178.44 178.67 1t6r h LYS 70 N -0.81 0.38 -0.24 1.25 3.64 -0.77 0.58 116.57 120.60 1t6r h LYS 70 Ca -0.08 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.19 1t6r h LYS 70 Cb 0.62 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 1t6r h LYS 70 CO 0.13 0.25 -0.24 0.22 -2.27 0.00 0.00 179.45 177.55 1t6r h ASP 71 N 0.39 0.44 -0.17 4.20 1.82 -1.04 -0.74 116.42 121.31 1t6r h ASP 71 Ca 0.61 -0.14 0.03 0.00 -0.39 0.00 0.00 57.03 57.14 1t6r h ASP 71 Cb 1.23 -0.12 -0.02 0.00 0.68 0.00 0.00 39.33 41.10 1t6r h ASP 71 CO -0.55 0.68 0.01 0.00 -1.61 0.00 0.00 179.24 177.76 1t6r h ALA 72 N 1.36 0.15 0.00 -0.78 0.00 -0.55 -0.62 119.26 118.82 1t6r h ALA 72 Ca 0.06 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 1t6r h ALA 72 Cb 0.63 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1t6r h ALA 72 CO 0.04 -0.43 -0.56 0.87 0.00 0.00 0.00 179.25 179.17 1t6r h LYS 73 N 0.07 0.00 0.95 0.00 1.79 -0.74 0.25 116.57 118.88 1t6r h LYS 73 Ca 0.08 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.50 1t6r h LYS 73 Cb 0.09 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.75 1t6r h LYS 73 CO -0.12 0.56 -0.46 0.82 -1.08 0.00 0.00 179.45 179.17 1t6r h ILE 74 N 0.00 0.02 0.00 1.86 2.04 -1.08 -3.22 117.51 117.14 1t6r h ILE 74 Ca -0.01 -0.04 0.00 0.00 1.00 0.00 0.00 64.86 65.81 1t6r h ILE 74 Cb 1.12 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.22 1t6r h ILE 74 CO 0.07 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.81 1t6r n ASN 75 N -5.63 0.00 -2.77 1.72 3.02 -0.25 -4.91 115.26 106.44 1t6r n ASN 75 Ca -0.16 -0.04 -0.08 0.00 -0.03 0.00 0.00 54.58 54.27 1t6r n ASN 75 Cb 0.51 -0.26 0.04 0.00 -0.61 0.00 0.00 39.78 39.46 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 0.25 -0.74 3.26 7.41 0.00 0.37 -5.04 105.19 110.70 1t6r n GLY 76 Ca 0.09 0.35 -0.15 0.00 0.00 0.00 0.00 46.02 46.31 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 -3.76 1.49 0.40 1.61 0.00 0.59 -4.89 119.74 115.17 1t6r s LYS 77 Ca 0.25 -1.79 0.01 0.00 0.00 0.00 0.00 55.97 54.43 1t6r s LYS 77 Cb -0.03 0.31 -0.02 0.00 0.00 0.00 0.00 37.83 38.09 1t6r s LYS 77 CO 0.56 -0.53 0.61 -1.21 0.00 0.00 0.00 175.35 174.78 1t6r s GLU 78 N -3.79 3.24 -0.08 1.78 2.02 -0.15 -4.24 118.70 117.48 1t6r s GLU 78 Ca 0.39 -0.44 -0.05 0.00 0.02 0.00 0.00 54.97 54.89 1t6r s GLU 78 Cb 0.04 -2.61 0.03 0.00 0.10 0.00 0.00 34.13 31.70 1t6r s GLU 78 CO 0.19 -0.09 0.20 0.12 0.02 0.00 0.00 175.26 175.71 1t6r s PHE 79 N -2.45 -0.24 -0.04 1.61 5.36 -1.26 -2.59 117.98 118.37 1t6r s PHE 79 Ca 0.45 0.61 -0.20 0.00 -0.96 0.00 0.00 56.93 56.83 1t6r s PHE 79 Cb -0.10 0.02 0.04 0.00 -0.34 0.00 0.00 43.02 42.64 1t6r s PHE 79 CO 0.37 -0.17 0.44 0.42 -1.46 0.00 0.00 175.22 174.82 1t6r s ILE 80 N 0.83 0.03 0.38 3.12 1.01 -0.25 -4.32 121.20 122.01 1t6r s ILE 80 Ca -0.06 -0.28 0.04 0.00 0.00 0.00 0.00 60.65 60.35 1t6r s ILE 80 Cb -0.08 -0.73 -0.05 0.00 0.01 0.00 0.00 42.46 41.61 1t6r s ILE 80 CO -0.05 -0.15 0.05 -0.76 0.00 0.00 0.00 174.94 174.03 1t6r s LEU 81 N -1.10 2.30 0.01 2.97 2.01 -1.24 -0.73 118.68 122.90 1t6r s LEU 81 Ca -0.11 -1.47 -0.23 0.00 0.01 0.00 0.00 54.13 52.34 1t6r s LEU 81 Cb -0.03 -0.48 0.05 0.00 0.01 0.00 0.00 46.19 45.73 1t6r s LEU 81 CO 0.06 -0.67 0.51 -0.55 1.01 0.00 0.00 176.35 176.71 1t6r s SER 82 N -3.60 -0.43 -1.18 2.29 0.15 -0.23 -0.40 113.70 110.29 1t6r s SER 82 Ca 0.30 0.29 -0.08 0.00 0.70 0.00 0.00 55.95 57.15 1t6r s SER 82 Cb 0.07 0.46 -0.02 0.00 -1.71 0.00 0.00 66.02 64.82 1t6r s SER 82 CO 0.14 -0.63 0.80 -1.20 1.20 0.00 0.00 173.24 173.55 1t6r n SER 83 N 0.73 -3.95 -4.66 5.45 7.64 -1.13 -0.53 113.62 117.18 1t6r n SER 83 Ca -0.19 -0.85 -0.42 0.00 1.01 0.00 0.00 58.87 58.42 1t6r n SER 83 Cb 0.58 -4.17 -0.03 0.00 -1.01 0.00 0.00 64.21 59.58 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 -6.27 4.39 0.50 -3.43 2.01 -1.26 -2.79 118.68 111.83 1t6r s LEU 84 Ca 0.27 2.56 -0.07 0.00 0.01 0.00 0.00 54.13 56.90 1t6r s LEU 84 Cb -0.07 -3.53 -0.04 0.00 0.01 0.00 0.00 46.19 42.56 1t6r s LEU 84 CO 0.81 -1.04 0.83 -0.54 1.01 0.00 0.00 176.35 177.42 1t6r s LYS 85 N 4.39 3.59 0.27 1.70 1.02 -1.26 -4.73 119.74 124.73 1t6r s LYS 85 Ca 0.85 0.35 0.22 0.00 0.02 0.00 0.00 55.97 57.41 1t6r s LYS 85 Cb -0.40 -2.32 1.03 0.00 -0.52 0.00 0.00 37.83 35.62 1t6r s LYS 85 CO 0.39 -0.26 1.68 -1.91 -0.92 0.00 0.00 175.35 174.33 1t6r n GLU 86 N -2.23 0.17 0.00 1.68 2.13 -1.26 0.11 120.64 121.24 1t6r n GLU 86 Ca 0.02 0.50 0.00 0.00 0.66 0.00 0.00 57.16 58.34 1t6r n GLU 86 Cb 0.55 -1.89 0.00 0.00 0.27 0.00 0.00 31.44 30.36 1t6r n GLU 86 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1t6r n SER 87 N -2.23 0.00 -0.37 4.31 2.88 -1.26 -4.36 113.62 112.59 1t6r n SER 87 Ca 0.01 0.18 -0.08 0.00 -1.33 0.00 0.00 58.87 57.65 1t6r n SER 87 Cb 0.15 -0.01 -0.06 0.00 -0.75 0.00 0.00 64.21 63.54 1t6r n SER 87 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 1t6r h ILE 88 N 0.00 0.01 -0.45 2.46 1.08 -1.57 -2.52 117.51 116.52 1t6r h ILE 88 Ca 0.00 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.53 1t6r h ILE 88 Cb 0.00 0.01 -0.09 0.00 -3.07 0.00 0.00 36.82 33.67 1t6r h ILE 88 CO 0.00 0.00 -0.53 -1.28 -0.69 0.00 0.00 178.15 175.65 1t6r h SER 89 N -0.05 -1.78 -0.66 1.72 0.87 -0.58 0.11 113.55 113.19 1t6r h SER 89 Ca 0.20 0.24 0.01 0.00 -1.23 0.00 0.00 61.79 61.01 1t6r h SER 89 Cb 0.49 0.74 -0.03 0.00 -0.44 0.00 0.00 62.40 63.16 1t6r h SER 89 CO -0.90 -0.39 0.44 0.03 -0.53 0.00 0.00 176.83 175.47 1t6r h ARG 90 N -0.36 0.87 -0.71 2.24 3.08 -1.65 -2.56 114.38 115.29 1t6r h ARG 90 Ca 0.10 -0.05 0.07 0.00 0.07 0.00 0.00 59.98 60.16 1t6r h ARG 90 Cb 0.59 -0.20 -0.04 0.00 0.08 0.00 0.00 29.97 30.40 1t6r h ARG 90 CO -0.62 0.58 0.47 0.82 -1.07 0.00 0.00 179.97 180.14 1t6r h ILE 91 N 0.89 1.01 -0.23 2.04 2.04 -0.62 0.14 117.51 122.77 1t6r h ILE 91 Ca 0.24 -0.25 -0.06 0.00 1.00 0.00 0.00 64.86 65.80 1t6r h ILE 91 Cb -0.10 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.20 1t6r h ILE 91 CO -0.05 0.13 -0.09 -0.07 0.00 0.00 0.00 178.15 178.07 1t6r h LEU 92 N 0.71 0.48 -1.35 1.44 -0.00 -0.74 -3.13 115.31 112.71 1t6r h LEU 92 Ca 0.31 -0.39 -0.04 0.00 -0.00 0.00 0.00 57.88 57.76 1t6r h LEU 92 Cb 0.29 -0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 40.80 1t6r h LEU 92 CO -0.10 0.76 -0.00 0.11 -0.00 0.00 0.00 178.44 179.21 1t6r h LYS 93 N 0.19 0.42 -0.34 1.13 6.56 -0.85 -2.23 116.57 121.46 1t6r h LYS 93 Ca 0.06 -0.08 0.07 0.00 -1.06 0.00 0.00 60.65 59.63 1t6r h LYS 93 Cb 0.57 -0.07 -0.09 0.00 -0.57 0.00 0.00 32.23 32.07 1t6r h LYS 93 CO 0.03 0.46 -0.39 -0.07 -2.06 0.00 0.00 179.45 177.42 1t6r h LEU 94 N 0.41 -1.27 -0.57 2.94 4.07 -0.73 -0.82 115.31 119.35 1t6r h LEU 94 Ca 0.09 0.20 0.00 0.00 0.08 0.00 0.00 57.88 58.25 1t6r h LEU 94 Cb 0.28 0.56 0.00 0.00 1.08 0.00 0.00 40.66 42.58 1t6r h LEU 94 CO 0.01 -0.36 0.00 0.35 -1.08 0.00 0.00 178.44 177.36 1t6r n THR 95 N -5.42 0.19 -2.17 0.22 -2.24 -1.20 -4.90 114.28 98.76 1t6r n THR 95 Ca -0.01 -0.20 -0.14 0.00 -2.27 0.00 0.00 64.05 61.43 1t6r n THR 95 Cb 0.35 0.09 -0.02 0.00 -2.10 0.00 0.00 70.33 68.64 1t6r n THR 95 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1t6r n HIS 96 N -0.09 -1.09 0.27 4.78 8.25 -0.31 -4.84 115.22 122.18 1t6r n HIS 96 Ca 0.07 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.69 1t6r n HIS 96 Cb 0.15 -2.86 0.50 0.00 1.12 0.00 0.00 29.99 28.90 1t6r n HIS 96 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1t6r h LEU 97 N 0.00 0.00 0.00 2.41 3.38 -1.64 -3.25 115.31 116.21 1t6r h LEU 97 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1t6r h LEU 97 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1t6r h LEU 97 CO 0.39 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.02 1t6r n ASP 98 N -3.06 0.00 0.00 -0.43 5.75 -1.23 -1.24 116.55 116.33 1t6r n ASP 98 Ca 0.02 0.28 0.00 0.00 -0.01 0.00 0.00 54.79 55.07 1t6r n ASP 98 Cb 0.38 -0.33 0.00 0.00 -1.03 0.00 0.00 41.12 40.14 1t6r n ASP 98 CO 0.00 0.00 0.00 2.29 -0.11 0.00 0.00 177.20 179.38 1t6r n LYS 99 N -1.33 1.07 -0.08 0.11 2.85 -1.23 -3.79 118.16 115.75 1t6r n LYS 99 Ca 0.02 -0.90 -0.16 0.00 -1.05 0.00 0.00 58.31 56.23 1t6r n LYS 99 Cb 0.05 -0.86 -0.07 0.00 -0.65 0.00 0.00 35.03 33.50 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 -0.22 0.94 -0.52 0.58 5.41 -0.45 -4.60 119.36 120.50 1t6r n ILE 100 Ca 0.00 -0.29 0.09 0.00 1.00 0.00 0.00 62.75 63.55 1t6r n ILE 100 Cb 0.22 -1.47 0.29 0.00 -0.71 0.00 0.00 39.64 37.97 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 -3.46 1.08 -1.62 1.39 3.72 -0.37 -4.96 117.46 113.24 1t6r n PHE 101 Ca -0.32 -0.60 0.00 0.00 -0.05 0.00 0.00 57.45 56.48 1t6r n PHE 101 Cb 0.77 -0.16 0.00 0.00 -0.94 0.00 0.00 39.48 39.15 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 0.86 0.00 -3.59 -1.08 4.81 -1.25 -3.60 118.16 114.31 1t6r n LYS 102 Ca 0.22 0.00 -0.06 0.00 -0.87 0.00 0.00 58.31 57.59 1t6r n LYS 102 Cb 0.73 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.77 1t6r n LYS 102 CO 0.00 0.00 0.00 -1.50 1.17 0.00 0.00 177.40 177.07 1t6r s ILE 103 N 0.00 0.00 0.01 3.15 2.07 -1.25 -4.31 121.20 120.87 1t6r s ILE 103 Ca 0.00 -0.21 0.00 0.00 -1.41 0.00 0.00 60.65 59.04 1t6r s ILE 103 Cb 0.00 -1.34 -0.01 0.00 0.13 0.00 0.00 42.46 41.24 1t6r s ILE 103 CO 0.00 0.00 -0.02 0.42 -1.91 0.00 0.00 174.94 173.43 1t6r s THR 104 N -3.09 0.14 0.31 4.00 -4.23 0.46 -4.89 115.64 108.33 1t6r s THR 104 Ca 0.08 -0.35 0.06 0.00 -1.18 0.00 0.00 61.69 60.29 1t6r s THR 104 Cb -0.01 -0.18 0.08 0.00 1.34 0.00 0.00 72.50 73.73 1t6r s THR 104 CO -0.05 -0.14 1.76 0.44 -0.54 0.00 0.00 174.62 176.09 1t6r h ASP 105 N 5.62 0.34 -5.43 3.99 5.19 -1.94 -2.99 116.42 121.20 1t6r h ASP 105 Ca -0.28 -0.11 -0.18 0.00 -0.62 0.00 0.00 57.03 55.84 1t6r h ASP 105 Cb 1.21 -0.09 -0.14 0.00 0.18 0.00 0.00 39.33 40.48 1t6r h ASP 105 CO 0.48 0.61 -0.57 0.42 -3.12 0.00 0.00 179.24 177.05 1t6r s THR 106 N -4.43 0.07 0.62 0.35 -4.23 -1.26 -3.32 115.64 103.44 1t6r s THR 106 Ca -0.06 -1.84 0.28 0.00 -1.18 0.00 0.00 61.69 58.89 1t6r s THR 106 Cb 0.14 -2.13 0.34 0.00 1.34 0.00 0.00 72.50 72.19 1t6r s THR 106 CO 0.77 -0.31 1.84 1.62 -0.54 0.00 0.00 174.62 178.00 1t6r h VAL 107 N 2.74 0.21 -0.03 2.29 3.04 -1.92 0.13 116.25 122.70 1t6r h VAL 107 Ca -0.34 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.35 1t6r h VAL 107 Cb 1.22 0.59 0.00 0.00 -2.01 0.00 0.00 31.29 31.08 1t6r h VAL 107 CO 0.55 0.00 0.00 -0.62 -1.01 0.00 0.00 177.57 176.49 1t6r n GLU 108 N -3.35 1.40 -0.23 4.17 1.02 -1.26 -2.48 120.64 119.90 1t6r n GLU 108 Ca 0.05 -0.58 0.10 0.00 -0.02 0.00 0.00 57.16 56.70 1t6r n GLU 108 Cb 0.61 -1.45 0.22 0.00 -0.02 0.00 0.00 31.44 30.80 1t6r n GLU 108 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1t6r n GLU 109 N -0.27 2.50 0.00 3.49 0.00 0.46 -5.13 120.64 121.70 1t6r n GLU 109 Ca 0.19 -2.26 0.12 0.00 0.00 0.00 0.00 57.16 55.22 1t6r n GLU 109 Cb 0.24 -1.45 0.14 0.00 0.00 0.00 0.00 31.44 30.38 1t6r n GLU 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13