#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r9t n ASN 2 N 0.00 1.27 -4.47 6.12 3.02 -1.26 -5.02 115.26 114.93 1r9t n ASN 2 Ca 0.00 -1.14 -0.44 0.00 -0.03 0.00 0.00 54.58 52.98 1r9t n ASN 2 Cb 0.00 0.78 -0.01 0.00 -0.61 0.00 0.00 39.78 39.94 1r9t n ASN 2 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1r9t n ALA 3 N -0.86 -1.57 -2.60 5.41 0.00 -1.26 -5.05 120.51 114.57 1r9t n ALA 3 Ca 0.05 0.28 -0.18 0.00 0.00 0.00 0.00 53.44 53.59 1r9t n ALA 3 Cb 0.34 -1.78 -0.12 0.00 0.00 0.00 0.00 19.45 17.89 1r9t n ALA 3 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1r9t s PRO 4 N -1.41 0.91 0.74 0.00 0.04 -1.26 -5.05 135.00 128.98 1r9t s PRO 4 Ca 0.62 -1.09 -0.14 0.00 0.04 0.00 0.00 61.00 60.43 1r9t s PRO 4 Cb -0.70 -0.87 0.05 0.00 0.04 0.00 0.00 34.50 33.02 1r9t s PRO 4 CO 0.58 0.18 1.18 -0.51 0.04 0.00 0.00 177.00 178.48 1r9t s ASP 5 N -2.07 4.20 0.02 6.66 1.01 -1.26 -4.86 116.67 120.38 1r9t s ASP 5 Ca 0.03 2.26 -0.26 0.00 0.71 0.00 0.00 52.55 55.30 1r9t s ASP 5 Cb -0.08 -2.58 -0.14 0.00 1.01 0.00 0.00 42.92 41.13 1r9t s ASP 5 CO 0.02 -2.25 1.18 0.03 0.21 0.00 0.00 175.17 174.36 1r9t h ARG 6 N -0.45 -0.90 0.00 8.23 3.08 -2.06 -3.11 114.38 119.17 1r9t h ARG 6 Ca -0.47 0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.64 1r9t h ARG 6 Cb 1.28 0.20 0.00 0.00 0.08 0.00 0.00 29.97 31.54 1r9t h ARG 6 CO 0.49 -0.60 0.00 1.97 -1.07 0.00 0.00 179.97 180.76 1r9t n PHE 7 N -5.02 0.00 0.23 3.04 1.16 -1.26 0.52 117.46 116.13 1r9t n PHE 7 Ca -0.12 0.00 0.03 0.00 -1.87 0.00 0.00 57.45 55.49 1r9t n PHE 7 Cb 0.37 -0.45 0.16 0.00 -1.61 0.00 0.00 39.48 37.95 1r9t n PHE 7 CO 0.00 0.00 0.00 0.93 -1.87 0.00 0.00 176.76 175.82 1r9t h GLU 8 N 0.00 0.00 -0.13 3.97 5.08 -1.85 0.42 114.58 122.07 1r9t h GLU 8 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1r9t h GLU 8 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1r9t h GLU 8 CO 0.00 0.00 -0.05 -0.07 -1.00 0.00 0.00 179.01 177.89 1r9t h LEU 9 N 0.00 0.17 -1.08 1.33 3.38 -0.15 -3.40 115.31 115.56 1r9t h LEU 9 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1r9t h LEU 9 Cb 1.37 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.08 1r9t h LEU 9 CO 0.00 0.26 0.00 2.22 0.09 0.00 0.00 178.44 181.01 1r9t n PHE 10 N -4.37 0.00 -4.16 1.13 1.16 0.14 -4.57 117.46 106.79 1r9t n PHE 10 Ca -0.01 -0.09 -0.34 0.00 -1.87 0.00 0.00 57.45 55.14 1r9t n PHE 10 Cb 0.19 -0.01 -0.14 0.00 -1.61 0.00 0.00 39.48 37.91 1r9t n PHE 10 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1r9t s LEU 11 N -0.18 2.92 -0.28 5.98 1.02 -1.05 -4.99 118.68 122.10 1r9t s LEU 11 Ca 0.00 -0.34 -0.28 0.00 0.02 0.00 0.00 54.13 53.53 1r9t s LEU 11 Cb 0.00 -1.72 0.01 0.00 0.02 0.00 0.00 46.19 44.50 1r9t s LEU 11 CO 0.00 0.05 1.03 -0.76 0.02 0.00 0.00 176.35 176.69 1r9t s LEU 12 N 1.07 4.02 0.00 1.79 1.02 -1.26 -4.78 118.68 120.54 1r9t s LEU 12 Ca 0.01 1.17 0.00 0.00 0.02 0.00 0.00 54.13 55.33 1r9t s LEU 12 Cb -0.15 -3.50 0.00 0.00 0.02 0.00 0.00 46.19 42.56 1r9t s LEU 12 CO -0.00 -0.76 0.00 0.61 0.02 0.00 0.00 176.35 176.22 1r9t n GLY 13 N 3.64 -0.94 3.35 -3.19 0.00 -1.26 -4.90 105.19 101.90 1r9t n GLY 13 Ca 0.11 -0.18 -0.46 0.00 0.00 0.00 0.00 46.02 45.49 1r9t n GLY 13 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1r9t s GLU 14 N 0.00 3.81 -0.15 1.61 2.02 -1.26 -4.78 118.70 119.95 1r9t s GLU 14 Ca 0.00 -2.62 -0.06 0.00 0.02 0.00 0.00 54.97 52.31 1r9t s GLU 14 Cb 0.00 -4.55 0.02 0.00 0.10 0.00 0.00 34.13 29.70 1r9t s GLU 14 CO 0.00 -1.35 0.12 0.41 0.02 0.00 0.00 175.26 174.46 1r9t n GLY 15 N 3.76 -3.32 0.00 -1.39 0.00 -1.26 -5.03 105.19 97.95 1r9t n GLY 15 Ca 0.19 0.95 0.00 0.00 0.00 0.00 0.00 46.02 47.17 1r9t n GLY 15 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1r9t n GLU 16 N 1.67 0.00 -3.64 1.61 1.02 -1.26 -5.19 120.64 114.85 1r9t n GLU 16 Ca -0.20 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 56.87 1r9t n GLU 16 Cb 0.36 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.71 1r9t n GLU 16 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1r9t s SER 17 N 0.00 -0.35 0.04 1.62 0.01 -1.26 -4.93 113.70 108.82 1r9t s SER 17 Ca 0.00 0.68 -0.30 0.00 1.31 0.00 0.00 55.95 57.63 1r9t s SER 17 Cb 0.00 0.71 -0.18 0.00 0.21 0.00 0.00 66.02 66.76 1r9t s SER 17 CO 0.00 -0.12 1.38 0.11 0.41 0.00 0.00 173.24 175.02 1r9t h LYS 18 N 4.03 -0.89 -6.22 12.44 1.57 -1.97 -3.34 116.57 122.19 1r9t h LYS 18 Ca -0.28 0.06 -0.55 0.00 -1.87 0.00 0.00 60.65 58.02 1r9t h LYS 18 Cb 1.18 0.20 -0.08 0.00 0.08 0.00 0.00 32.23 33.62 1r9t h LYS 18 CO 0.13 -0.56 -0.59 -0.51 -0.57 0.00 0.00 179.45 177.34 1r9t s LEU 19 N -9.79 3.52 -0.04 2.94 1.43 -1.26 -1.49 118.68 113.99 1r9t s LEU 19 Ca -0.16 -0.39 -0.01 0.00 -1.03 0.00 0.00 54.13 52.54 1r9t s LEU 19 Cb 0.02 -2.08 0.03 0.00 0.03 0.00 0.00 46.19 44.19 1r9t s LEU 19 CO 0.54 0.01 0.02 -0.75 0.23 0.00 0.00 176.35 176.40 1r9t s LYS 20 N -3.55 0.21 -0.20 1.70 2.20 -1.25 -5.00 119.74 113.86 1r9t s LYS 20 Ca 0.31 0.20 -0.00 0.00 -0.36 0.00 0.00 55.97 56.12 1r9t s LYS 20 Cb -0.08 -0.59 0.05 0.00 -1.51 0.00 0.00 37.83 35.70 1r9t s LYS 20 CO 0.22 -0.25 -0.06 0.42 -0.36 0.00 0.00 175.35 175.33 1r9t s ILE 21 N 1.66 1.31 0.41 5.43 1.01 -1.26 0.75 121.20 130.52 1r9t s ILE 21 Ca -0.01 -0.91 0.07 0.00 0.00 0.00 0.00 60.65 59.81 1r9t s ILE 21 Cb -0.13 -1.53 -0.05 0.00 0.01 0.00 0.00 42.46 40.77 1r9t s ILE 21 CO -0.03 0.03 0.22 -1.81 0.00 0.00 0.00 174.94 173.35 1r9t s ASP 22 N 1.52 4.56 -0.23 3.58 1.01 -1.05 -4.98 116.67 121.08 1r9t s ASP 22 Ca -0.02 -1.00 -0.12 0.00 0.71 0.00 0.00 52.55 52.11 1r9t s ASP 22 Cb -0.17 -0.50 -0.05 0.00 1.01 0.00 0.00 42.92 43.21 1r9t s ASP 22 CO -0.07 -0.57 0.23 -2.16 0.21 0.00 0.00 175.17 172.81 1r9t s PRO 23 N -3.95 4.09 0.03 8.23 0.04 -1.26 -0.21 135.00 141.96 1r9t s PRO 23 Ca 0.43 -0.15 -0.30 0.00 0.04 0.00 0.00 61.00 61.02 1r9t s PRO 23 Cb 0.02 -3.55 -0.07 0.00 0.04 0.00 0.00 34.50 30.95 1r9t s PRO 23 CO 0.24 0.01 1.51 0.34 0.04 0.00 0.00 177.00 179.14 1r9t s ASP 24 N 1.12 6.74 -0.08 6.66 -1.08 0.25 -4.90 116.67 125.39 1r9t s ASP 24 Ca 0.11 2.27 -0.26 0.00 -0.52 0.00 0.00 52.55 54.14 1r9t s ASP 24 Cb -0.14 -2.56 -0.22 0.00 -1.46 0.00 0.00 42.92 38.54 1r9t s ASP 24 CO 0.06 -0.79 0.99 0.71 0.52 0.00 0.00 175.17 176.66 1r9t h THR 25 N 4.87 1.49 -0.85 1.71 1.35 -1.94 -3.27 112.91 116.28 1r9t h THR 25 Ca -0.40 -1.66 0.21 0.00 -0.55 0.00 0.00 66.41 64.01 1r9t h THR 25 Cb 1.19 2.60 -0.15 0.00 -1.73 0.00 0.00 68.15 70.06 1r9t h THR 25 CO 0.91 0.42 0.06 0.11 -0.25 0.00 0.00 175.52 176.78 1r9t h LYS 26 N -0.75 0.10 0.00 4.72 1.79 -1.95 -3.42 116.57 117.06 1r9t h LYS 26 Ca -0.00 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1r9t h LYS 26 Cb 0.71 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.33 1r9t h LYS 26 CO 0.00 0.07 0.00 0.00 -1.08 0.00 0.00 179.45 178.44 1r9t n ALA 27 N -2.95 0.00 -2.91 3.86 0.00 -1.23 -5.15 120.51 112.13 1r9t n ALA 27 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.52 1r9t n ALA 27 Cb 0.60 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.99 1r9t n ALA 27 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1r9t s PRO 28 N 4.92 1.18 -0.94 0.00 0.05 -1.26 -4.98 135.00 133.96 1r9t s PRO 28 Ca 0.00 -1.01 -0.05 0.00 0.05 0.00 0.00 61.00 59.99 1r9t s PRO 28 Cb 0.00 0.43 0.04 0.00 0.05 0.00 0.00 34.50 35.02 1r9t s PRO 28 CO 0.00 -0.45 0.23 -1.71 0.05 0.00 0.00 177.00 175.11 1r9t n ASN 29 N -0.24 -2.99 -3.82 6.66 2.85 -1.26 -4.77 115.26 111.70 1r9t n ASN 29 Ca -0.10 -0.05 -0.12 0.00 -0.11 0.00 0.00 54.58 54.20 1r9t n ASN 29 Cb 0.63 -2.55 -0.10 0.00 1.24 0.00 0.00 39.78 39.00 1r9t n ASN 29 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1r9t s ALA 30 N -2.63 -0.50 0.02 5.20 0.00 -1.25 -0.51 121.76 122.10 1r9t s ALA 30 Ca 0.21 0.25 -0.05 0.00 0.00 0.00 0.00 51.96 52.37 1r9t s ALA 30 Cb -0.11 -0.09 -0.01 0.00 0.00 0.00 0.00 23.12 22.91 1r9t s ALA 30 CO 0.26 -0.17 0.08 0.08 0.00 0.00 0.00 175.76 176.00 1r9t s VAL 31 N -0.76 0.11 -0.26 0.00 1.01 -0.10 -0.58 120.40 119.83 1r9t s VAL 31 Ca -0.09 -0.92 -0.04 0.00 0.00 0.00 0.00 61.98 60.94 1r9t s VAL 31 Cb -0.05 -0.59 0.09 0.00 0.00 0.00 0.00 36.38 35.83 1r9t s VAL 31 CO 0.02 -0.50 0.12 -0.69 0.00 0.00 0.00 175.10 174.04 1r9t s VAL 32 N -1.92 -0.02 -0.39 2.92 1.01 0.70 0.76 120.40 123.46 1r9t s VAL 32 Ca -0.11 -0.63 -0.27 0.00 0.00 0.00 0.00 61.98 60.97 1r9t s VAL 32 Cb -0.05 -0.90 0.02 0.00 0.00 0.00 0.00 36.38 35.44 1r9t s VAL 32 CO -0.02 -0.60 1.00 -0.63 0.00 0.00 0.00 175.10 174.85 1r9t s ILE 33 N 2.09 4.48 0.96 2.22 1.01 0.15 -2.53 121.20 129.57 1r9t s ILE 33 Ca 0.07 1.26 -0.14 0.00 0.00 0.00 0.00 60.65 61.84 1r9t s ILE 33 Cb -0.16 -4.42 0.17 0.00 0.01 0.00 0.00 42.46 38.06 1r9t s ILE 33 CO -0.29 -0.65 1.18 -0.89 0.00 0.00 0.00 174.94 174.28 1r9t s THR 34 N 3.74 1.94 -0.17 2.92 2.01 0.23 -1.81 115.64 124.50 1r9t s THR 34 Ca 0.41 0.00 -0.02 0.00 0.31 0.00 0.00 61.69 62.39 1r9t s THR 34 Cb -0.11 -2.79 0.05 0.00 0.01 0.00 0.00 72.50 69.67 1r9t s THR 34 CO 0.21 0.00 0.02 -0.36 -0.69 0.00 0.00 174.62 173.80 1r9t s PHE 35 N -3.39 1.04 0.24 4.92 0.40 -0.70 -3.77 117.98 116.73 1r9t s PHE 35 Ca 0.67 -0.76 -0.07 0.00 -0.60 0.00 0.00 56.93 56.16 1r9t s PHE 35 Cb -0.11 -1.02 -0.06 0.00 0.51 0.00 0.00 43.02 42.33 1r9t s PHE 35 CO 0.53 -0.56 0.53 -1.21 0.70 0.00 0.00 175.22 175.21 1r9t s GLU 36 N 1.85 3.72 -1.58 0.44 2.02 -0.55 -3.66 118.70 120.93 1r9t s GLU 36 Ca 0.00 0.13 -0.02 0.00 0.02 0.00 0.00 54.97 55.10 1r9t s GLU 36 Cb -0.16 -2.67 0.02 0.00 0.10 0.00 0.00 34.13 31.42 1r9t s GLU 36 CO -0.07 0.30 0.06 1.63 0.02 0.00 0.00 175.26 177.19 1r9t n LYS 37 N -0.41 -0.96 -3.82 1.61 4.76 0.27 -4.91 118.16 114.71 1r9t n LYS 37 Ca -0.01 0.10 -0.18 0.00 -2.87 0.00 0.00 58.31 55.36 1r9t n LYS 37 Cb 0.53 -3.70 -0.06 0.00 -1.84 0.00 0.00 35.03 29.96 1r9t n LYS 37 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1r9t n GLU 38 N -4.54 0.48 0.00 1.97 -0.58 -0.86 -4.75 120.64 112.36 1r9t n GLU 38 Ca -0.29 -2.67 0.00 0.00 -0.42 0.00 0.00 57.16 53.78 1r9t n GLU 38 Cb 0.68 1.82 0.00 0.00 -0.57 0.00 0.00 31.44 33.37 1r9t n GLU 38 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 1r9t n ASP 39 N -1.81 0.00 0.08 1.62 5.68 -1.26 -2.71 116.55 118.15 1r9t n ASP 39 Ca 0.01 0.00 -0.12 0.00 -0.50 0.00 0.00 54.79 54.18 1r9t n ASP 39 Cb 0.48 0.00 -0.06 0.00 -1.14 0.00 0.00 41.12 40.40 1r9t n ASP 39 CO 0.00 0.00 0.00 0.45 -1.33 0.00 0.00 177.20 176.32 1r9t h HIS 40 N 0.00 -0.34 -0.37 2.11 3.86 -1.98 0.37 115.15 118.80 1r9t h HIS 40 Ca 0.00 0.01 0.15 0.00 -1.16 0.00 0.00 60.37 59.37 1r9t h HIS 40 Cb 0.00 0.14 -0.06 0.00 1.06 0.00 0.00 27.41 28.55 1r9t h HIS 40 CO 0.00 -0.20 0.21 2.41 0.86 0.00 0.00 177.93 181.21 1r9t n THR 41 N -5.26 -0.14 -0.07 2.45 -1.04 -1.26 -1.63 114.28 107.33 1r9t n THR 41 Ca -0.06 0.72 -0.09 0.00 -2.04 0.00 0.00 64.05 62.58 1r9t n THR 41 Cb 0.18 -1.17 -0.03 0.00 -1.82 0.00 0.00 70.33 67.49 1r9t n THR 41 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 1r9t n LEU 42 N -3.77 1.75 0.00 -4.42 7.94 0.04 -4.13 117.00 114.42 1r9t n LEU 42 Ca 0.14 0.29 0.00 0.00 -1.11 0.00 0.00 56.01 55.33 1r9t n LEU 42 Cb 0.47 -0.66 0.00 0.00 0.53 0.00 0.00 43.42 43.76 1r9t n LEU 42 CO 0.01 -0.28 0.05 0.61 -1.11 0.00 0.00 177.39 176.67 1r9t n GLY 43 N 1.84 -0.30 0.40 -3.96 0.00 -0.71 0.96 105.19 103.43 1r9t n GLY 43 Ca -0.15 0.06 0.19 0.00 0.00 0.00 0.00 46.02 46.12 1r9t n GLY 43 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1r9t h ASN 44 N 0.00 0.38 0.04 1.61 -1.24 -1.54 0.77 115.58 115.61 1r9t h ASN 44 Ca 0.00 0.04 -0.00 0.00 0.71 0.00 0.00 56.30 57.04 1r9t h ASN 44 Cb 0.00 -0.03 0.00 0.00 0.73 0.00 0.00 38.32 39.02 1r9t h ASN 44 CO 0.00 0.16 -0.02 0.25 -1.29 0.00 0.00 177.43 176.53 1r9t h LEU 45 N 0.38 -0.05 -1.31 0.34 5.85 0.44 -2.50 115.31 118.46 1r9t h LEU 45 Ca 0.45 -0.58 0.15 0.00 0.84 0.00 0.00 57.88 58.74 1r9t h LEU 45 Cb 1.14 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 42.11 1r9t h LEU 45 CO -0.16 0.69 0.57 0.40 -0.34 0.00 0.00 178.44 179.61 1r9t h ILE 46 N -0.93 0.82 0.00 4.05 5.03 -1.08 -2.98 117.51 122.42 1r9t h ILE 46 Ca -0.01 -0.23 -0.05 0.00 -0.12 0.00 0.00 64.86 64.46 1r9t h ILE 46 Cb 0.62 0.10 -0.01 0.00 -3.03 0.00 0.00 36.82 34.51 1r9t h ILE 46 CO 0.01 0.12 -0.25 -0.09 -0.68 0.00 0.00 178.15 177.26 1r9t h ARG 47 N 0.66 0.00 0.00 2.37 2.43 0.10 0.87 114.38 120.81 1r9t h ARG 47 Ca 0.45 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.55 1r9t h ARG 47 Cb 0.76 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.30 1r9t h ARG 47 CO -0.20 0.25 -0.34 0.00 -1.51 0.00 0.00 179.97 178.16 1r9t h ALA 48 N 1.75 1.01 0.00 2.80 0.00 -1.39 -3.27 119.26 120.16 1r9t h ALA 48 Ca -0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 1r9t h ALA 48 Cb 0.66 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1r9t h ALA 48 CO 0.03 0.42 -0.16 0.93 0.00 0.00 0.00 179.25 180.48 1r9t h GLU 49 N 0.00 0.00 0.00 0.00 4.39 -0.92 0.29 114.58 118.34 1r9t h GLU 49 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1r9t h GLU 49 Cb 0.86 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 1r9t h GLU 49 CO 0.04 0.57 0.00 1.28 -1.16 0.00 0.00 179.01 179.74 1r9t n LEU 50 N -4.66 0.00 0.00 1.33 4.77 0.12 -1.11 117.00 117.46 1r9t n LEU 50 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1r9t n LEU 50 Cb 0.31 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1r9t n LEU 50 CO 0.19 0.00 0.14 0.18 -1.33 0.00 0.00 177.39 176.56 1r9t n LEU 51 N 0.00 0.00 0.02 2.23 4.32 0.10 -4.61 117.00 119.06 1r9t n LEU 51 Ca 0.00 -0.03 0.12 0.00 -0.02 0.00 0.00 56.01 56.07 1r9t n LEU 51 Cb 0.00 0.00 0.15 0.00 -1.62 0.00 0.00 43.42 41.95 1r9t n LEU 51 CO 0.00 0.04 0.28 0.59 -1.22 0.00 0.00 177.39 177.08 1r9t n ASN 52 N 0.00 0.61 -4.68 -1.43 3.02 -0.26 -4.86 115.26 107.65 1r9t n ASN 52 Ca 0.00 -0.24 -0.43 0.00 -0.03 0.00 0.00 54.58 53.88 1r9t n ASN 52 Cb 0.40 0.44 -0.02 0.00 -0.61 0.00 0.00 39.78 39.99 1r9t n ASN 52 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1r9t s ASP 53 N -3.44 7.09 -0.40 6.41 -1.08 -1.25 -4.90 116.67 119.09 1r9t s ASP 53 Ca 0.08 1.68 -0.01 0.00 -0.52 0.00 0.00 52.55 53.78 1r9t s ASP 53 Cb 0.16 -2.55 0.26 0.00 -1.46 0.00 0.00 42.92 39.33 1r9t s ASP 53 CO 0.74 -0.59 2.05 0.54 0.52 0.00 0.00 175.17 178.43 1r9t n ARG 54 N 5.48 2.02 -0.65 4.34 3.00 -1.26 -3.16 116.66 126.44 1r9t n ARG 54 Ca 0.11 -1.98 0.06 0.00 -0.01 0.00 0.00 57.85 56.03 1r9t n ARG 54 Cb 0.47 -1.78 0.12 0.00 0.00 0.00 0.00 32.46 31.27 1r9t n ARG 54 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1r9t n LYS 55 N 0.08 0.95 -3.57 5.56 4.76 -1.26 -4.94 118.16 119.73 1r9t n LYS 55 Ca 0.38 -2.52 -0.40 0.00 -2.87 0.00 0.00 58.31 52.90 1r9t n LYS 55 Cb 0.59 -1.08 -0.11 0.00 -1.84 0.00 0.00 35.03 32.59 1r9t n LYS 55 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1r9t s VAL 56 N -2.00 5.07 0.05 -0.18 1.01 -1.19 -3.16 120.40 120.01 1r9t s VAL 56 Ca 0.30 -0.28 -0.28 0.00 0.00 0.00 0.00 61.98 61.72 1r9t s VAL 56 Cb 0.30 -3.60 -0.14 0.00 0.00 0.00 0.00 36.38 32.93 1r9t s VAL 56 CO -0.06 0.01 1.42 -0.07 0.00 0.00 0.00 175.10 176.40 1r9t h LEU 57 N 8.45 -0.95 -7.46 3.92 3.38 -1.16 -3.49 115.31 118.00 1r9t h LEU 57 Ca -0.31 0.06 -0.19 0.00 0.09 0.00 0.00 57.88 57.52 1r9t h LEU 57 Cb 1.15 0.28 -0.28 0.00 0.09 0.00 0.00 40.66 41.91 1r9t h LEU 57 CO 0.63 -0.56 -0.49 0.12 0.09 0.00 0.00 178.44 178.23 1r9t s PHE 58 N -5.18 -0.25 -0.00 1.13 5.36 -0.80 -5.09 117.98 113.16 1r9t s PHE 58 Ca -0.14 0.61 -0.28 0.00 -0.96 0.00 0.00 56.93 56.16 1r9t s PHE 58 Cb 0.02 0.05 0.08 0.00 -0.34 0.00 0.00 43.02 42.84 1r9t s PHE 58 CO 0.45 -0.15 0.73 0.00 -1.46 0.00 0.00 175.22 174.79 1r9t s ALA 59 N 0.55 -1.76 0.06 11.12 0.00 -1.25 -2.75 121.76 127.74 1r9t s ALA 59 Ca -0.04 1.10 -0.28 0.00 0.00 0.00 0.00 51.96 52.74 1r9t s ALA 59 Cb -0.05 0.18 0.10 0.00 0.00 0.00 0.00 23.12 23.35 1r9t s ALA 59 CO -0.03 -0.51 1.15 0.00 0.00 0.00 0.00 175.76 176.37 1r9t s ALA 60 N -2.12 -1.99 0.09 0.00 0.00 -0.12 -4.99 121.76 112.63 1r9t s ALA 60 Ca -0.04 0.38 -0.10 0.00 0.00 0.00 0.00 51.96 52.20 1r9t s ALA 60 Cb -0.00 0.51 0.00 0.00 0.00 0.00 0.00 23.12 23.63 1r9t s ALA 60 CO 0.00 -1.06 0.22 1.52 0.00 0.00 0.00 175.76 176.45 1r9t s TYR 61 N -2.72 0.09 -0.05 0.00 -0.85 -1.26 0.20 117.35 112.76 1r9t s TYR 61 Ca 0.15 -0.49 -0.26 0.00 -0.52 0.00 0.00 57.07 55.95 1r9t s TYR 61 Cb 0.02 -0.01 0.06 0.00 0.38 0.00 0.00 41.96 42.40 1r9t s TYR 61 CO -0.01 -0.56 0.57 -1.59 -1.52 0.00 0.00 175.55 172.44 1r9t s LYS 62 N -3.76 0.93 -0.49 -3.49 -2.85 -1.14 -4.99 119.74 103.94 1r9t s LYS 62 Ca 0.04 0.15 -0.05 0.00 -1.00 0.00 0.00 55.97 55.11 1r9t s LYS 62 Cb 0.04 0.43 0.13 0.00 -2.06 0.00 0.00 37.83 36.37 1r9t s LYS 62 CO -0.11 -0.27 0.33 0.14 0.10 0.00 0.00 175.35 175.54 1r9t s VAL 63 N -1.16 3.79 0.04 1.79 -7.23 -1.26 0.44 120.40 116.81 1r9t s VAL 63 Ca -0.11 -2.18 -0.07 0.00 -1.81 0.00 0.00 61.98 57.81 1r9t s VAL 63 Cb -0.02 -3.52 -0.02 0.00 0.56 0.00 0.00 36.38 33.38 1r9t s VAL 63 CO 0.08 -0.78 0.86 1.21 -0.31 0.00 0.00 175.10 176.17 1r9t n GLU 64 N 4.44 -0.10 -4.18 4.82 2.13 -1.26 -4.59 120.64 121.89 1r9t n GLU 64 Ca -0.01 0.85 -0.17 0.00 0.66 0.00 0.00 57.16 58.50 1r9t n GLU 64 Cb 0.41 -1.27 -0.15 0.00 0.27 0.00 0.00 31.44 30.70 1r9t n GLU 64 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 1r9t s HIS 65 N -3.76 0.54 0.38 4.31 5.04 -1.26 -5.07 115.29 115.47 1r9t s HIS 65 Ca -0.03 -0.10 0.17 0.00 -1.54 0.00 0.00 55.06 53.56 1r9t s HIS 65 Cb 0.03 -0.37 0.95 0.00 0.04 0.00 0.00 32.58 33.22 1r9t s HIS 65 CO 0.15 -0.03 1.91 -1.00 -2.34 0.00 0.00 174.74 173.42 1r9t h PRO 66 N 6.17 0.00 -0.46 2.88 0.13 -2.00 -2.85 132.00 135.88 1r9t h PRO 66 Ca -0.30 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 64.93 1r9t h PRO 66 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1r9t h PRO 66 CO 0.50 0.27 0.32 0.74 -0.23 0.00 0.00 178.00 179.60 1r9t h PHE 67 N 0.00 0.20 -2.43 1.56 0.05 -1.99 -3.41 116.94 110.92 1r9t h PHE 67 Ca -0.00 0.01 -0.51 0.00 3.82 0.00 0.00 57.97 61.28 1r9t h PHE 67 Cb 0.53 -0.06 -0.02 0.00 2.00 0.00 0.00 35.95 38.40 1r9t h PHE 67 CO 0.00 0.09 -0.46 -0.06 -0.18 0.00 0.00 178.31 177.71 1r9t s PHE 68 N -5.20 3.47 -0.57 -0.55 2.99 -1.08 -5.05 117.98 111.99 1r9t s PHE 68 Ca -0.06 0.07 -0.03 0.00 0.00 0.00 0.00 56.93 56.90 1r9t s PHE 68 Cb 0.19 -1.63 0.15 0.00 0.00 0.00 0.00 43.02 41.73 1r9t s PHE 68 CO 0.73 0.49 2.54 0.00 -0.00 0.00 0.00 175.22 178.97 1r9t n ALA 69 N -0.84 6.47 -3.51 5.36 0.00 -1.26 -4.78 120.51 121.94 1r9t n ALA 69 Ca -0.08 -3.37 -0.05 0.00 0.00 0.00 0.00 53.44 49.94 1r9t n ALA 69 Cb 0.55 -2.09 -0.01 0.00 0.00 0.00 0.00 19.45 17.90 1r9t n ALA 69 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1r9t n ARG 70 N 0.43 0.44 0.00 0.00 1.85 -1.10 0.96 116.66 119.24 1r9t n ARG 70 Ca 0.50 -1.40 0.00 0.00 -1.00 0.00 0.00 57.85 55.95 1r9t n ARG 70 Cb 0.45 1.45 0.00 0.00 -1.05 0.00 0.00 32.46 33.32 1r9t n ARG 70 CO 0.00 0.00 0.00 1.97 -0.01 0.00 0.00 177.63 179.59 1r9t n PHE 71 N -0.30 0.00 -3.92 2.89 1.16 -1.24 -4.70 117.46 111.35 1r9t n PHE 71 Ca -0.01 0.00 -0.29 0.00 -1.87 0.00 0.00 57.45 55.28 1r9t n PHE 71 Cb 0.31 0.00 -0.16 0.00 -1.61 0.00 0.00 39.48 38.02 1r9t n PHE 71 CO 0.00 0.00 0.00 0.15 -1.87 0.00 0.00 176.76 175.04 1r9t s LYS 72 N -1.16 1.58 0.02 3.97 1.02 0.17 -1.71 119.74 123.62 1r9t s LYS 72 Ca 0.00 -0.68 -0.18 0.00 0.02 0.00 0.00 55.97 55.13 1r9t s LYS 72 Cb 0.00 -2.22 -0.06 0.00 -0.52 0.00 0.00 37.83 35.03 1r9t s LYS 72 CO 0.00 -0.47 0.51 -1.17 -0.92 0.00 0.00 175.35 173.30 1r9t s LEU 73 N 1.54 4.47 -0.13 3.17 2.96 -0.75 -2.86 118.68 127.08 1r9t s LEU 73 Ca -0.01 1.10 -0.01 0.00 -0.22 0.00 0.00 54.13 54.99 1r9t s LEU 73 Cb -0.16 -2.78 0.04 0.00 0.50 0.00 0.00 46.19 43.79 1r9t s LEU 73 CO -0.08 0.24 -0.02 -0.60 -1.32 0.00 0.00 176.35 174.57 1r9t s ARG 74 N -0.78 1.01 -0.12 1.98 3.52 0.13 -0.68 118.95 124.01 1r9t s ARG 74 Ca 0.27 -0.24 0.03 0.00 -0.13 0.00 0.00 55.73 55.66 1r9t s ARG 74 Cb -0.18 -1.60 0.01 0.00 -1.56 0.00 0.00 34.95 31.62 1r9t s ARG 74 CO 0.16 -0.40 -0.21 0.42 -0.81 0.00 0.00 175.30 174.45 1r9t s ILE 75 N 1.81 1.97 -0.09 4.11 1.01 0.23 -0.95 121.20 129.29 1r9t s ILE 75 Ca 0.03 -0.94 0.02 0.00 0.00 0.00 0.00 60.65 59.76 1r9t s ILE 75 Cb -0.14 -1.74 0.01 0.00 0.01 0.00 0.00 42.46 40.60 1r9t s ILE 75 CO -0.07 0.53 -0.15 -1.58 0.00 0.00 0.00 174.94 173.68 1r9t s GLN 76 N 0.72 2.10 0.12 2.79 0.74 -1.11 -0.92 119.66 124.10 1r9t s GLN 76 Ca -0.10 -0.53 0.09 0.00 0.05 0.00 0.00 55.36 54.87 1r9t s GLN 76 Cb -0.16 -1.74 -0.04 0.00 1.10 0.00 0.00 33.01 32.17 1r9t s GLN 76 CO 0.01 -0.00 -0.22 0.95 -0.55 0.00 0.00 175.29 175.47 1r9t s THR 77 N 0.80 1.87 0.40 -0.34 -4.23 0.33 -0.51 115.64 113.96 1r9t s THR 77 Ca -0.11 -1.64 -0.24 0.00 -1.18 0.00 0.00 61.69 58.52 1r9t s THR 77 Cb -0.16 -1.70 -0.12 0.00 1.34 0.00 0.00 72.50 71.87 1r9t s THR 77 CO 0.02 -0.04 0.82 0.41 -0.54 0.00 0.00 174.62 175.28 1r9t n THR 78 N 0.96 2.17 -1.50 3.99 -1.04 -1.19 -4.59 114.28 113.08 1r9t n THR 78 Ca -0.18 -0.50 -0.63 0.00 -2.04 0.00 0.00 64.05 60.69 1r9t n THR 78 Cb 0.54 -0.87 -0.11 0.00 -1.82 0.00 0.00 70.33 68.07 1r9t n THR 78 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1r9t n GLU 79 N 0.37 0.06 0.00 -2.82 2.13 -1.26 -4.12 120.64 114.99 1r9t n GLU 79 Ca 0.11 0.02 0.00 0.00 0.66 0.00 0.00 57.16 57.94 1r9t n GLU 79 Cb 0.38 -1.54 0.00 0.00 0.27 0.00 0.00 31.44 30.55 1r9t n GLU 79 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1r9t n GLY 80 N 5.74 2.49 0.24 8.31 0.00 -1.26 -5.10 105.19 115.60 1r9t n GLY 80 Ca 0.43 -0.72 -0.04 0.00 0.00 0.00 0.00 46.02 45.68 1r9t n GLY 80 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1r9t n TYR 81 N 0.00 0.00 -4.05 1.61 -0.00 -1.26 -5.06 117.16 108.40 1r9t n TYR 81 Ca 0.00 0.07 -0.32 0.00 -0.00 0.00 0.00 57.90 57.65 1r9t n TYR 81 Cb 0.00 -0.14 -0.16 0.00 -0.00 0.00 0.00 39.34 39.04 1r9t n TYR 81 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 1r9t s ASP 82 N -0.04 3.83 0.01 2.98 2.15 -1.26 -4.70 116.67 119.65 1r9t s ASP 82 Ca 0.05 -1.08 -0.01 0.00 0.43 0.00 0.00 52.55 51.95 1r9t s ASP 82 Cb -0.08 -1.42 0.02 0.00 -0.30 0.00 0.00 42.92 41.14 1r9t s ASP 82 CO 0.04 -0.14 0.08 -0.81 -0.17 0.00 0.00 175.17 174.17 1r9t n PRO 83 N 4.56 -0.01 -0.28 4.34 -0.04 -1.26 0.10 135.00 142.41 1r9t n PRO 83 Ca -0.16 0.08 0.19 0.00 -0.04 0.00 0.00 63.50 63.58 1r9t n PRO 83 Cb 0.45 -0.12 0.36 0.00 -0.04 0.00 0.00 33.50 34.15 1r9t n PRO 83 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1r9t n LYS 84 N -4.08 -0.06 -0.06 0.54 5.02 -1.26 0.53 118.16 118.79 1r9t n LYS 84 Ca 0.01 1.23 -0.15 0.00 -2.02 0.00 0.00 58.31 57.37 1r9t n LYS 84 Cb 0.02 -2.06 -0.06 0.00 -0.02 0.00 0.00 35.03 32.92 1r9t n LYS 84 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1r9t h ASP 85 N 0.00 0.88 -0.84 4.39 3.32 0.29 0.42 116.42 124.88 1r9t h ASP 85 Ca 0.61 -0.56 0.21 0.00 0.02 0.00 0.00 57.03 57.30 1r9t h ASP 85 Cb 1.44 -0.25 -0.13 0.00 0.22 0.00 0.00 39.33 40.61 1r9t h ASP 85 CO -0.73 1.28 0.26 0.00 -1.72 0.00 0.00 179.24 178.33 1r9t h ALA 86 N 0.62 1.22 -0.15 3.45 0.00 0.59 1.19 119.26 126.19 1r9t h ALA 86 Ca -0.00 0.19 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 1r9t h ALA 86 Cb 1.15 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 19.18 1r9t h ALA 86 CO 0.12 -0.39 -0.04 1.25 0.00 0.00 0.00 179.25 180.19 1r9t h LEU 87 N 0.29 0.30 0.47 0.00 5.85 1.35 -3.20 115.31 120.37 1r9t h LEU 87 Ca 0.51 -0.37 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 1r9t h LEU 87 Cb 0.97 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.92 1r9t h LEU 87 CO -0.57 0.60 -0.23 0.11 -0.34 0.00 0.00 178.44 178.01 1r9t h LYS 88 N -0.00 -0.61 -0.16 1.25 1.57 0.59 -2.19 116.57 117.02 1r9t h LYS 88 Ca 0.04 0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.88 1r9t h LYS 88 Cb 0.47 0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 1r9t h LYS 88 CO 0.02 -0.41 -0.10 0.09 -0.57 0.00 0.00 179.45 178.48 1r9t n ASN 89 N -3.83 -0.17 0.00 0.86 3.02 0.56 0.95 115.26 116.65 1r9t n ASN 89 Ca -0.08 0.65 0.00 0.00 -0.03 0.00 0.00 54.58 55.12 1r9t n ASN 89 Cb 0.25 -0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.20 1r9t n ASN 89 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1r9t n ALA 90 N -2.87 0.00 -0.35 5.41 0.00 -1.21 0.83 120.51 122.33 1r9t n ALA 90 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.59 1r9t n ALA 90 Cb 0.04 0.00 0.35 0.00 0.00 0.00 0.00 19.45 19.85 1r9t n ALA 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r9t h ASN 92 N 0.68 -0.35 0.00 0.00 2.35 -0.48 -2.28 115.58 115.49 1r9t h ASN 92 Ca 0.61 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 56.22 1r9t h ASN 92 Cb 1.05 0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.52 1r9t h ASN 92 CO -0.42 -0.05 0.61 -1.28 -1.65 0.00 0.00 177.43 174.64 1r9t h SER 93 N -0.68 0.00 0.25 5.81 0.87 0.16 0.93 113.55 120.90 1r9t h SER 93 Ca -0.04 0.00 -0.34 0.00 -1.23 0.00 0.00 61.79 60.18 1r9t h SER 93 Cb 0.47 0.00 0.03 0.00 -0.44 0.00 0.00 62.40 62.46 1r9t h SER 93 CO 0.07 0.00 -1.55 0.40 -0.53 0.00 0.00 176.83 175.22 1r9t h ILE 94 N 0.00 1.20 -0.68 2.23 5.03 -1.28 -3.10 117.51 120.91 1r9t h ILE 94 Ca 0.00 -2.66 0.06 0.00 -0.12 0.00 0.00 64.86 62.13 1r9t h ILE 94 Cb 1.22 2.97 -0.05 0.00 -3.03 0.00 0.00 36.82 37.93 1r9t h ILE 94 CO 0.00 0.83 0.38 0.40 -0.68 0.00 0.00 178.15 179.08 1r9t h ILE 95 N 0.14 0.98 0.16 -0.67 2.04 0.11 0.24 117.51 120.50 1r9t h ILE 95 Ca -0.28 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.34 1r9t h ILE 95 Cb 2.15 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 1r9t h ILE 95 CO 0.25 0.13 -0.15 0.78 0.00 0.00 0.00 178.15 179.16 1r9t h ASN 96 N 0.70 -0.40 -0.97 1.72 2.35 -0.88 0.75 115.58 118.86 1r9t h ASN 96 Ca 0.30 0.04 0.10 0.00 -0.55 0.00 0.00 56.30 56.19 1r9t h ASN 96 Cb 0.18 0.14 -0.08 0.00 0.05 0.00 0.00 38.32 38.61 1r9t h ASN 96 CO -0.18 -0.23 0.61 0.11 -1.65 0.00 0.00 177.43 176.09 1r9t h LYS 97 N -0.33 0.98 -0.10 0.81 1.57 -1.46 1.26 116.57 119.29 1r9t h LYS 97 Ca 0.00 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1r9t h LYS 97 Cb 0.31 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 1r9t h LYS 97 CO -0.03 0.65 0.03 -0.07 -0.57 0.00 0.00 179.45 179.45 1r9t h LEU 98 N 1.01 0.16 0.00 2.94 3.38 0.38 0.49 115.31 123.67 1r9t h LEU 98 Ca 0.46 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1r9t h LEU 98 Cb 0.37 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1r9t h LEU 98 CO -0.24 0.33 0.00 0.61 0.09 0.00 0.00 178.44 179.24 1r9t n GLY 99 N -0.53 -2.31 0.00 0.83 0.00 0.12 -1.08 105.19 102.22 1r9t n GLY 99 Ca -0.06 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1r9t n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r9t n ALA 100 N -2.10 0.00 -0.31 4.61 0.00 0.43 -1.19 120.51 121.95 1r9t n ALA 100 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.61 1r9t n ALA 100 Cb 0.00 0.00 0.35 0.00 0.00 0.00 0.00 19.45 19.80 1r9t n ALA 100 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1r9t h LEU 101 N 0.00 0.06 -0.38 0.00 6.46 -0.73 -0.82 115.31 119.90 1r9t h LEU 101 Ca 0.00 0.21 -0.01 0.00 -0.12 0.00 0.00 57.88 57.96 1r9t h LEU 101 Cb 0.00 0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 40.18 1r9t h LEU 101 CO 0.00 -0.20 0.18 0.50 -0.62 0.00 0.00 178.44 178.30 1r9t h LYS 102 N 0.19 0.54 0.53 1.25 3.64 0.40 1.32 116.57 124.44 1r9t h LYS 102 Ca 0.61 -0.08 -0.02 0.00 -1.27 0.00 0.00 60.65 59.89 1r9t h LYS 102 Cb 1.31 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.03 1r9t h LYS 102 CO -0.69 0.49 -0.37 1.15 -2.27 0.00 0.00 179.45 177.77 1r9t h THR 103 N 0.47 0.00 -0.86 1.00 2.02 -0.97 -3.08 112.91 111.48 1r9t h THR 103 Ca 0.13 0.00 0.21 0.00 0.77 0.00 0.00 66.41 67.52 1r9t h THR 103 Cb 0.12 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 66.48 1r9t h THR 103 CO -0.02 0.00 0.59 0.78 0.37 0.00 0.00 175.52 177.24 1r9t h ASN 104 N -0.85 0.27 0.03 4.18 2.35 -0.03 0.48 115.58 122.01 1r9t h ASN 104 Ca -0.07 0.03 -0.22 0.00 -0.55 0.00 0.00 56.30 55.49 1r9t h ASN 104 Cb 0.69 -0.02 0.01 0.00 0.05 0.00 0.00 38.32 39.05 1r9t h ASN 104 CO 0.04 0.11 -0.80 0.15 -1.65 0.00 0.00 177.43 175.28 1r9t h PHE 105 N 0.27 0.88 0.00 1.19 3.57 0.17 -2.85 116.94 120.16 1r9t h PHE 105 Ca 0.44 -0.40 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1r9t h PHE 105 Cb 1.28 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.89 1r9t h PHE 105 CO -0.00 1.21 0.00 0.39 -2.23 0.00 0.00 178.31 177.68 1r9t n GLU 106 N -3.88 0.05 -0.09 1.11 1.02 0.16 0.56 120.64 119.57 1r9t n GLU 106 Ca -0.07 0.49 -0.13 0.00 -0.02 0.00 0.00 57.16 57.44 1r9t n GLU 106 Cb 0.76 -1.66 -0.08 0.00 -0.02 0.00 0.00 31.44 30.44 1r9t n GLU 106 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1r9t n THR 107 N -1.77 1.05 1.14 2.62 -1.04 -0.45 -3.52 114.28 112.31 1r9t n THR 107 Ca 0.00 -0.40 0.13 0.00 -2.04 0.00 0.00 64.05 61.74 1r9t n THR 107 Cb 0.06 -1.14 0.50 0.00 -1.82 0.00 0.00 70.33 67.93 1r9t n THR 107 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1r9t n GLU 108 N -3.03 0.24 0.06 -2.82 -0.58 0.19 -2.27 120.64 112.44 1r9t n GLU 108 Ca -0.32 -0.09 -0.05 0.00 -0.42 0.00 0.00 57.16 56.28 1r9t n GLU 108 Cb 0.85 -1.50 0.14 0.00 -0.57 0.00 0.00 31.44 30.35 1r9t n GLU 108 CO 0.00 0.00 0.00 2.35 -0.48 0.00 0.00 177.13 179.00 1r9t h TRP 109 N 0.21 0.42 -0.11 -0.32 2.91 -0.20 -2.74 115.95 116.12 1r9t h TRP 109 Ca 0.00 -0.14 -0.09 0.00 1.13 0.00 0.00 58.89 59.80 1r9t h TRP 109 Cb 0.45 -0.08 0.00 0.00 -0.51 0.00 0.00 29.16 29.02 1r9t h TRP 109 CO 0.00 0.78 -0.27 -0.91 -1.03 0.00 0.00 178.44 177.02 1r9t h ASN 110 N 0.27 0.42 0.00 2.65 2.35 -1.49 -3.31 115.58 116.46 1r9t h ASN 110 Ca 0.01 -0.58 0.00 0.00 -0.55 0.00 0.00 56.30 55.18 1r9t h ASN 110 Cb 0.99 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 39.24 1r9t h ASN 110 CO 0.08 0.93 0.00 0.18 -1.65 0.00 0.00 177.43 176.97 1r9t n LEU 111 N -4.45 0.04 -4.63 1.61 4.77 -1.04 -4.77 117.00 108.53 1r9t n LEU 111 Ca -0.07 -0.02 -0.35 0.00 -0.03 0.00 0.00 56.01 55.54 1r9t n LEU 111 Cb 0.46 -0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.43 1r9t n LEU 111 CO 0.41 0.01 -0.29 -1.10 -1.33 0.00 0.00 177.39 175.09 1r9t s GLN 112 N -1.95 3.54 0.81 3.23 -1.52 -1.23 -5.10 119.66 117.44 1r9t s GLN 112 Ca 0.00 -0.40 -0.10 0.00 -1.95 0.00 0.00 55.36 52.90 1r9t s GLN 112 Cb 0.00 -2.99 0.08 0.00 -0.22 0.00 0.00 33.01 29.88 1r9t s GLN 112 CO 0.00 0.43 1.10 0.99 -0.25 0.00 0.00 175.29 177.56 1r9t s THR 113 N -0.12 3.01 0.00 -0.19 2.01 -1.26 -5.05 115.64 114.05 1r9t s THR 113 Ca 0.05 0.33 0.00 0.00 0.31 0.00 0.00 61.69 62.38 1r9t s THR 113 Cb -0.12 -2.71 0.00 0.00 0.01 0.00 0.00 72.50 69.67 1r9t s THR 113 CO 0.02 -0.43 0.00 0.18 -0.69 0.00 0.00 174.62 173.70