#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rlb s ARG 2 N 0.00 3.44 -1.27 3.49 1.70 -1.26 -5.01 118.95 120.03 1rlb s ARG 2 Ca 0.00 -0.18 -0.10 0.00 -0.47 0.00 0.00 55.73 54.98 1rlb s ARG 2 Cb 0.00 -3.15 0.16 0.00 -0.57 0.00 0.00 34.95 31.39 1rlb s ARG 2 CO 0.00 0.72 1.80 -3.47 -1.08 0.00 0.00 175.30 173.28 1rlb n ASP 3 N 2.14 5.06 -3.56 -2.89 -0.08 -1.26 -4.92 116.55 111.05 1rlb n ASP 3 Ca -0.19 -3.07 -0.41 0.00 -1.51 0.00 0.00 54.79 49.61 1rlb n ASP 3 Cb 0.55 -1.51 0.00 0.00 2.34 0.00 0.00 41.12 42.50 1rlb n ASP 3 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1rlb s ARG 5 N -2.17 2.51 0.00 0.00 3.00 -1.26 -4.07 118.95 116.96 1rlb s ARG 5 Ca 0.48 -0.74 0.00 0.00 0.00 0.00 0.00 55.73 55.47 1rlb s ARG 5 Cb 0.18 -2.48 0.00 0.00 0.00 0.00 0.00 34.95 32.65 1rlb s ARG 5 CO -0.10 0.60 0.56 0.28 0.00 0.00 0.00 175.30 176.64 1rlb n VAL 6 N 1.57 0.00 -0.07 3.52 0.31 -0.56 -0.49 118.33 122.60 1rlb n VAL 6 Ca -0.15 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.08 1rlb n VAL 6 Cb 0.52 -0.26 -0.09 0.00 -0.91 0.00 0.00 33.84 33.11 1rlb n VAL 6 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1rlb n SER 7 N -0.17 2.25 0.23 4.52 7.64 -1.26 -4.73 113.62 122.10 1rlb n SER 7 Ca 0.00 -0.05 0.06 0.00 1.01 0.00 0.00 58.87 59.90 1rlb n SER 7 Cb 0.10 0.26 0.54 0.00 -1.01 0.00 0.00 64.21 64.11 1rlb n SER 7 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1rlb h SER 8 N 0.00 0.00 -0.78 6.43 0.02 -1.08 -3.45 113.55 114.69 1rlb h SER 8 Ca -0.36 0.00 -0.65 0.00 -0.84 0.00 0.00 61.79 59.94 1rlb h SER 8 Cb 1.69 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 64.20 1rlb h SER 8 CO -0.02 0.17 1.47 0.49 -1.14 0.00 0.00 176.83 177.79 1rlb n PHE 9 N -4.22 1.36 -2.59 3.45 3.72 -1.18 -5.01 117.46 112.99 1rlb n PHE 9 Ca -0.02 0.37 -0.42 0.00 -0.05 0.00 0.00 57.45 57.33 1rlb n PHE 9 Cb 0.24 -2.47 -0.03 0.00 -0.94 0.00 0.00 39.48 36.28 1rlb n PHE 9 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1rlb s ARG 10 N 6.74 4.48 0.00 -1.08 1.81 -1.26 -5.04 118.95 124.60 1rlb s ARG 10 Ca 1.14 1.55 0.00 0.00 -1.72 0.00 0.00 55.73 56.70 1rlb s ARG 10 Cb -0.98 -3.45 0.00 0.00 -0.45 0.00 0.00 34.95 30.07 1rlb s ARG 10 CO 0.50 -0.20 0.00 1.33 -0.68 0.00 0.00 175.30 176.26 1rlb n VAL 11 N 4.09 0.00 -1.95 3.52 0.24 -1.26 -4.90 118.33 118.07 1rlb n VAL 11 Ca 0.08 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.95 1rlb n VAL 11 Cb 0.49 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.83 1rlb n VAL 11 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1rlb s LYS 12 N -0.26 3.85 -0.03 7.34 2.47 -1.08 -4.90 119.74 127.13 1rlb s LYS 12 Ca 0.00 1.98 -0.30 0.00 -1.56 0.00 0.00 55.97 56.10 1rlb s LYS 12 Cb 0.00 -4.09 -0.08 0.00 -1.46 0.00 0.00 37.83 32.20 1rlb s LYS 12 CO 0.00 -1.25 2.05 -1.91 0.16 0.00 0.00 175.35 174.40 1rlb n GLU 13 N 7.66 2.62 -2.34 4.03 0.00 -1.26 -3.88 120.64 127.48 1rlb n GLU 13 Ca 0.20 0.91 -0.14 0.00 0.00 0.00 0.00 57.16 58.13 1rlb n GLU 13 Cb 0.44 -3.08 -0.01 0.00 0.00 0.00 0.00 31.44 28.79 1rlb n GLU 13 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1rlb n ASN 14 N 8.72 -4.27 0.00 4.31 3.02 -1.26 -4.83 115.26 120.95 1rlb n ASN 14 Ca 0.23 0.17 0.00 0.00 -0.03 0.00 0.00 54.58 54.95 1rlb n ASN 14 Cb 0.42 -3.64 0.00 0.00 -0.61 0.00 0.00 39.78 35.95 1rlb n ASN 14 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1rlb n PHE 15 N -3.37 0.00 -2.66 3.10 7.35 -1.25 -4.89 117.46 115.73 1rlb n PHE 15 Ca -0.17 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.10 1rlb n PHE 15 Cb 0.61 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.42 1rlb n PHE 15 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1rlb s ASP 16 N 0.00 7.24 -0.02 -2.13 -1.08 -1.26 -4.92 116.67 114.50 1rlb s ASP 16 Ca 0.00 1.60 -0.21 0.00 -0.52 0.00 0.00 52.55 53.42 1rlb s ASP 16 Cb 0.00 -2.56 -0.13 0.00 -1.46 0.00 0.00 42.92 38.77 1rlb s ASP 16 CO 0.00 -0.43 0.92 0.50 0.52 0.00 0.00 175.17 176.67 1rlb h LYS 17 N 7.08 -0.54 -1.61 4.34 3.64 -1.95 -2.89 116.57 124.63 1rlb h LYS 17 Ca -0.33 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1rlb h LYS 17 Cb 1.16 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 1rlb h LYS 17 CO 0.84 -0.26 0.00 0.00 -2.27 0.00 0.00 179.45 177.76 1rlb n ALA 18 N -2.64 1.89 0.04 5.00 0.00 -1.26 -1.28 120.51 122.26 1rlb n ALA 18 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1rlb n ALA 18 Cb 0.27 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.72 1rlb n ALA 18 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1rlb n ARG 19 N 0.81 0.00 -0.12 0.00 0.63 -1.10 -4.72 116.66 112.16 1rlb n ARG 19 Ca 0.00 0.00 0.27 0.00 -0.92 0.00 0.00 57.85 57.20 1rlb n ARG 19 Cb 0.19 -0.49 0.60 0.00 0.45 0.00 0.00 32.46 33.21 1rlb n ARG 19 CO 0.00 0.00 0.00 0.35 -2.51 0.00 0.00 177.63 175.47 1rlb h PHE 20 N 0.00 0.00 -1.10 -0.14 3.57 -1.13 -3.43 116.94 114.71 1rlb h PHE 20 Ca 0.00 0.00 -0.78 0.00 3.53 0.00 0.00 57.97 60.72 1rlb h PHE 20 Cb 0.14 0.00 0.05 0.00 2.79 0.00 0.00 35.95 38.93 1rlb h PHE 20 CO 0.00 0.00 0.16 0.00 -2.23 0.00 0.00 178.31 176.24 1rlb n ALA 21 N -2.35 -3.12 0.00 2.41 0.00 -1.14 -4.75 120.51 111.56 1rlb n ALA 21 Ca 0.18 0.58 0.00 0.00 0.00 0.00 0.00 53.44 54.20 1rlb n ALA 21 Cb 1.17 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 18.81 1rlb n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rlb n GLY 22 N 1.82 2.18 3.74 0.00 0.00 -0.49 -4.87 105.19 107.58 1rlb n GLY 22 Ca 0.21 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.83 1rlb n GLY 22 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rlb s THR 23 N -1.62 4.08 -0.08 2.61 2.01 -1.26 -1.35 115.64 120.04 1rlb s THR 23 Ca 0.00 1.80 -0.02 0.00 0.31 0.00 0.00 61.69 63.78 1rlb s THR 23 Cb 0.00 -4.15 0.03 0.00 0.01 0.00 0.00 72.50 68.39 1rlb s THR 23 CO 0.00 0.31 0.02 0.26 -0.69 0.00 0.00 174.62 174.52 1rlb s TRP 24 N -0.25 0.58 -0.20 4.92 0.52 -1.16 -4.85 118.94 118.50 1rlb s TRP 24 Ca 0.48 -0.15 -0.26 0.00 0.02 0.00 0.00 56.10 56.19 1rlb s TRP 24 Cb -0.27 -0.76 -0.01 0.00 -1.15 0.00 0.00 33.47 31.28 1rlb s TRP 24 CO 0.33 -0.33 0.89 0.71 0.02 0.00 0.00 176.95 178.57 1rlb s TYR 25 N 2.00 3.37 0.47 -1.98 1.51 -0.83 -2.50 117.35 119.40 1rlb s TYR 25 Ca 0.05 1.28 -0.24 0.00 -1.01 0.00 0.00 57.07 57.14 1rlb s TYR 25 Cb -0.13 -3.09 -0.08 0.00 -0.11 0.00 0.00 41.96 38.55 1rlb s TYR 25 CO -0.05 -0.35 1.39 0.00 -1.11 0.00 0.00 175.55 175.43 1rlb n ALA 26 N 5.72 1.80 -0.02 3.71 0.00 -0.70 -2.18 120.51 128.85 1rlb n ALA 26 Ca 0.07 0.22 -0.03 0.00 0.00 0.00 0.00 53.44 53.70 1rlb n ALA 26 Cb 0.48 -2.36 -0.01 0.00 0.00 0.00 0.00 19.45 17.55 1rlb n ALA 26 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1rlb n MET 27 N -0.38 0.08 -3.85 0.00 2.81 0.34 -4.83 117.12 111.29 1rlb n MET 27 Ca 0.07 0.02 -0.12 0.00 -1.81 0.00 0.00 57.70 55.86 1rlb n MET 27 Cb 0.42 -0.95 -0.11 0.00 -0.71 0.00 0.00 33.22 31.86 1rlb n MET 27 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1rlb s ALA 28 N -2.07 -0.32 0.07 3.04 0.00 -1.21 -1.52 121.76 119.76 1rlb s ALA 28 Ca -0.05 0.13 0.07 0.00 0.00 0.00 0.00 51.96 52.11 1rlb s ALA 28 Cb 0.01 -0.08 -0.03 0.00 0.00 0.00 0.00 23.12 23.03 1rlb s ALA 28 CO 0.07 -0.13 -0.18 -1.59 0.00 0.00 0.00 175.76 173.93 1rlb s LYS 29 N -0.59 1.08 -0.32 0.00 -2.85 -1.16 0.20 119.74 116.10 1rlb s LYS 29 Ca -0.07 -1.00 -0.09 0.00 -1.00 0.00 0.00 55.97 53.82 1rlb s LYS 29 Cb -0.04 -1.21 0.01 0.00 -2.06 0.00 0.00 37.83 34.52 1rlb s LYS 29 CO 0.01 0.29 0.13 0.21 0.10 0.00 0.00 175.35 176.09 1rlb s LYS 30 N -1.59 3.14 0.46 1.78 2.36 0.16 -3.12 119.74 122.94 1rlb s LYS 30 Ca 0.04 -0.84 -0.23 0.00 -2.55 0.00 0.00 55.97 52.39 1rlb s LYS 30 Cb -0.09 -3.51 -0.10 0.00 -1.05 0.00 0.00 37.83 33.08 1rlb s LYS 30 CO 0.03 -0.48 0.94 -0.25 1.55 0.00 0.00 175.35 177.14 1rlb n ASP 31 N 4.93 0.89 -1.84 1.43 9.92 -1.26 -3.01 116.55 127.62 1rlb n ASP 31 Ca -0.14 0.97 0.00 0.00 -0.53 0.00 0.00 54.79 55.09 1rlb n ASP 31 Cb 0.48 -1.33 0.00 0.00 -0.64 0.00 0.00 41.12 39.63 1rlb n ASP 31 CO 0.00 0.00 0.00 -0.81 0.13 0.00 0.00 177.20 176.52 1rlb n PRO 32 N -0.04 3.35 -4.01 -0.24 -0.04 -1.24 -4.68 135.00 128.09 1rlb n PRO 32 Ca 0.10 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.22 1rlb n PRO 32 Cb 0.41 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.73 1rlb n PRO 32 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 1rlb s GLU 33 N 1.17 3.36 0.00 0.54 -1.05 -1.26 -5.02 118.70 116.44 1rlb s GLU 33 Ca 0.00 -0.64 0.00 0.00 -0.15 0.00 0.00 54.97 54.18 1rlb s GLU 33 Cb 0.00 -2.94 0.00 0.00 -0.44 0.00 0.00 34.13 30.75 1rlb s GLU 33 CO 0.00 -0.15 0.00 0.41 0.95 0.00 0.00 175.26 176.47 1rlb n GLY 34 N 4.63 0.83 3.72 -3.83 0.00 -1.26 -5.00 105.19 104.29 1rlb n GLY 34 Ca -0.18 -2.00 -0.40 0.00 0.00 0.00 0.00 46.02 43.44 1rlb n GLY 34 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1rlb s LEU 35 N 0.00 4.33 0.30 0.99 2.96 -1.26 -5.00 118.68 120.99 1rlb s LEU 35 Ca 0.00 1.18 0.03 0.00 -0.22 0.00 0.00 54.13 55.12 1rlb s LEU 35 Cb 0.00 -3.06 -0.04 0.00 0.50 0.00 0.00 46.19 43.60 1rlb s LEU 35 CO 0.00 -0.09 0.15 0.12 -1.32 0.00 0.00 176.35 175.22 1rlb s PHE 36 N 0.68 1.58 0.02 5.38 5.36 -1.26 -5.03 117.98 124.71 1rlb s PHE 36 Ca 0.36 -1.36 -0.30 0.00 -0.96 0.00 0.00 56.93 54.67 1rlb s PHE 36 Cb -0.18 -0.85 -0.05 0.00 -0.34 0.00 0.00 43.02 41.60 1rlb s PHE 36 CO 0.18 -0.51 1.22 -0.51 -1.46 0.00 0.00 175.22 174.14 1rlb s LEU 37 N -3.36 4.34 0.02 6.12 1.43 -1.26 -4.69 118.68 121.26 1rlb s LEU 37 Ca 0.36 1.96 -0.19 0.00 -1.03 0.00 0.00 54.13 55.23 1rlb s LEU 37 Cb 0.05 -3.57 -0.22 0.00 0.03 0.00 0.00 46.19 42.48 1rlb s LEU 37 CO 0.17 -0.53 1.13 1.56 0.23 0.00 0.00 176.35 178.91 1rlb h GLN 38 N 7.12 0.45 0.00 1.70 7.50 -0.41 -3.49 115.11 127.98 1rlb h GLN 38 Ca -0.39 -0.46 0.00 0.00 0.50 0.00 0.00 58.65 58.31 1rlb h GLN 38 Cb 1.19 0.12 0.00 0.00 0.05 0.00 0.00 27.48 28.85 1rlb h GLN 38 CO 0.84 1.11 0.00 -0.40 -1.50 0.00 0.00 178.83 178.88 1rlb n ASP 39 N -4.20 0.00 -1.95 1.46 5.68 -1.21 -4.97 116.55 111.36 1rlb n ASP 39 Ca -0.10 -0.82 -0.16 0.00 -0.50 0.00 0.00 54.79 53.21 1rlb n ASP 39 Cb 0.67 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.61 1rlb n ASP 39 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1rlb n ASN 40 N -0.37 -4.56 -4.71 -1.12 3.02 -1.12 -1.88 115.26 104.52 1rlb n ASN 40 Ca 0.00 0.25 -0.42 0.00 -0.03 0.00 0.00 54.58 54.38 1rlb n ASN 40 Cb 0.00 -3.98 -0.03 0.00 -0.61 0.00 0.00 39.78 35.16 1rlb n ASN 40 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1rlb s ILE 41 N -2.60 4.84 -0.06 2.41 1.01 -1.26 -4.43 121.20 121.12 1rlb s ILE 41 Ca 0.00 2.05 -0.03 0.00 0.00 0.00 0.00 60.65 62.67 1rlb s ILE 41 Cb 0.00 -4.31 0.03 0.00 0.01 0.00 0.00 42.46 38.19 1rlb s ILE 41 CO 0.00 0.13 0.13 -0.69 0.00 0.00 0.00 174.94 174.51 1rlb s VAL 42 N 1.22 -0.04 0.47 2.92 1.01 -1.13 -1.71 120.40 123.12 1rlb s VAL 42 Ca 0.51 0.16 0.07 0.00 0.00 0.00 0.00 61.98 62.73 1rlb s VAL 42 Cb -0.21 -0.21 0.01 0.00 0.00 0.00 0.00 36.38 35.97 1rlb s VAL 42 CO 0.26 0.07 0.44 0.00 0.00 0.00 0.00 175.10 175.87 1rlb s ALA 43 N 1.01 4.26 -0.22 5.51 0.00 -1.04 -2.42 121.76 128.85 1rlb s ALA 43 Ca -0.08 -1.75 -0.07 0.00 0.00 0.00 0.00 51.96 50.06 1rlb s ALA 43 Cb -0.10 -1.01 0.11 0.00 0.00 0.00 0.00 23.12 22.11 1rlb s ALA 43 CO -0.05 -0.37 0.46 -2.00 0.00 0.00 0.00 175.76 173.80 1rlb s GLU 44 N -4.25 0.38 -0.13 0.00 2.12 -1.09 -2.97 118.70 112.76 1rlb s GLU 44 Ca 0.46 1.06 -0.07 0.00 0.36 0.00 0.00 54.97 56.78 1rlb s GLU 44 Cb -0.03 0.35 -0.04 0.00 0.26 0.00 0.00 34.13 34.67 1rlb s GLU 44 CO 0.28 -0.29 0.11 -0.06 -0.54 0.00 0.00 175.26 174.76 1rlb s PHE 45 N 2.66 3.49 0.04 5.30 0.40 -0.46 -1.25 117.98 128.17 1rlb s PHE 45 Ca -0.00 0.43 -0.07 0.00 -0.60 0.00 0.00 56.93 56.68 1rlb s PHE 45 Cb -0.12 -1.96 -0.00 0.00 0.51 0.00 0.00 43.02 41.44 1rlb s PHE 45 CO -0.14 0.60 0.14 -1.54 0.70 0.00 0.00 175.22 174.98 1rlb s SER 46 N -0.73 0.11 -0.25 1.36 1.04 0.25 -1.39 113.70 114.08 1rlb s SER 46 Ca 0.13 -0.46 -0.04 0.00 0.48 0.00 0.00 55.95 56.07 1rlb s SER 46 Cb -0.12 0.26 0.09 0.00 0.10 0.00 0.00 66.02 66.34 1rlb s SER 46 CO 0.03 -0.53 0.11 0.54 0.98 0.00 0.00 173.24 174.36 1rlb s VAL 47 N -2.61 0.11 0.74 5.02 0.11 -1.25 -0.65 120.40 121.87 1rlb s VAL 47 Ca -0.05 -0.66 -0.12 0.00 -2.93 0.00 0.00 61.98 58.22 1rlb s VAL 47 Cb -0.01 -0.96 0.04 0.00 -1.53 0.00 0.00 36.38 33.92 1rlb s VAL 47 CO -0.04 -0.55 1.10 1.51 -3.33 0.00 0.00 175.10 173.79 1rlb s ASP 48 N 2.02 4.65 0.25 3.54 1.47 -0.87 -4.83 116.67 122.90 1rlb s ASP 48 Ca 0.06 1.88 0.07 0.00 1.18 0.00 0.00 52.55 55.74 1rlb s ASP 48 Cb -0.16 -2.53 0.73 0.00 -0.34 0.00 0.00 42.92 40.62 1rlb s ASP 48 CO -0.25 -1.94 1.18 -0.62 0.68 0.00 0.00 175.17 174.22 1rlb n GLU 49 N -3.23 -0.05 -0.84 2.11 1.02 -1.26 -0.16 120.64 118.23 1rlb n GLU 49 Ca 0.09 1.10 -0.09 0.00 -0.02 0.00 0.00 57.16 58.24 1rlb n GLU 49 Cb 0.53 -1.82 -0.08 0.00 -0.02 0.00 0.00 31.44 30.05 1rlb n GLU 49 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1rlb n ASN 50 N -4.92 5.46 -3.41 1.62 5.03 -1.26 -4.84 115.26 112.94 1rlb n ASN 50 Ca 0.22 -2.55 -0.16 0.00 0.87 0.00 0.00 54.58 52.96 1rlb n ASN 50 Cb 0.72 -1.27 -0.05 0.00 -1.02 0.00 0.00 39.78 38.16 1rlb n ASN 50 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1rlb n GLY 51 N 1.85 -0.07 3.42 7.41 0.00 0.77 -4.91 105.19 113.66 1rlb n GLY 51 Ca 0.26 0.09 -0.33 0.00 0.00 0.00 0.00 46.02 46.04 1rlb n GLY 51 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1rlb s HIS 52 N -3.61 2.78 -0.17 1.61 3.76 -1.19 -4.95 115.29 113.53 1rlb s HIS 52 Ca 0.03 -0.44 -0.13 0.00 -0.15 0.00 0.00 55.06 54.37 1rlb s HIS 52 Cb -0.02 -1.77 -0.05 0.00 1.11 0.00 0.00 32.58 31.86 1rlb s HIS 52 CO 0.52 -0.05 0.25 1.41 -0.85 0.00 0.00 174.74 176.02 1rlb s MET 53 N -0.07 4.23 0.11 1.40 1.75 -1.26 -2.05 119.30 123.41 1rlb s MET 53 Ca -0.02 0.01 0.08 0.00 -1.25 0.00 0.00 55.69 54.51 1rlb s MET 53 Cb -0.14 -3.42 -0.04 0.00 2.84 0.00 0.00 34.83 34.07 1rlb s MET 53 CO 0.04 0.26 -0.21 -1.54 -0.65 0.00 0.00 175.02 172.92 1rlb s SER 54 N 0.42 2.57 0.06 1.11 1.04 0.17 -2.04 113.70 117.03 1rlb s SER 54 Ca 0.14 -0.70 -0.01 0.00 0.48 0.00 0.00 55.95 55.86 1rlb s SER 54 Cb -0.12 -0.14 -0.04 0.00 0.10 0.00 0.00 66.02 65.81 1rlb s SER 54 CO 0.02 0.06 -0.02 0.00 0.98 0.00 0.00 173.24 174.28 1rlb s ALA 55 N -1.21 0.57 -0.21 5.32 0.00 -0.46 -0.58 121.76 125.18 1rlb s ALA 55 Ca 0.07 -1.24 -0.03 0.00 0.00 0.00 0.00 51.96 50.76 1rlb s ALA 55 Cb -0.10 0.32 0.07 0.00 0.00 0.00 0.00 23.12 23.41 1rlb s ALA 55 CO 0.04 -0.37 0.06 0.95 0.00 0.00 0.00 175.76 176.44 1rlb s THR 56 N -3.92 0.40 0.14 0.00 -4.23 -0.38 -0.24 115.64 107.41 1rlb s THR 56 Ca 0.09 -0.58 0.00 0.00 -1.18 0.00 0.00 61.69 60.03 1rlb s THR 56 Cb 0.08 -1.00 -0.04 0.00 1.34 0.00 0.00 72.50 72.88 1rlb s THR 56 CO -0.09 -0.30 0.30 0.00 -0.54 0.00 0.00 174.62 173.99 1rlb s ALA 57 N 1.91 3.93 0.28 3.99 0.00 -1.26 -2.68 121.76 127.92 1rlb s ALA 57 Ca 0.01 -0.89 0.11 0.00 0.00 0.00 0.00 51.96 51.19 1rlb s ALA 57 Cb -0.17 -1.88 -0.05 0.00 0.00 0.00 0.00 23.12 21.03 1rlb s ALA 57 CO -0.12 0.60 -0.13 0.21 0.00 0.00 0.00 175.76 176.32 1rlb s LYS 58 N -3.02 1.90 0.00 0.00 2.47 -1.01 -1.02 119.74 119.05 1rlb s LYS 58 Ca 0.36 -1.65 0.00 0.00 -1.56 0.00 0.00 55.97 53.12 1rlb s LYS 58 Cb -0.12 -1.91 0.00 0.00 -1.46 0.00 0.00 37.83 34.35 1rlb s LYS 58 CO 0.28 0.34 0.00 0.41 0.16 0.00 0.00 175.35 176.54 1rlb n GLY 59 N -0.72 2.88 3.68 5.54 0.00 -0.99 -2.86 105.19 112.72 1rlb n GLY 59 Ca -0.05 -0.31 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 1rlb n GLY 59 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1rlb s ARG 60 N -1.55 4.38 -0.08 1.61 3.52 -0.79 -0.29 118.95 125.76 1rlb s ARG 60 Ca 0.00 1.21 0.00 0.00 -0.13 0.00 0.00 55.73 56.82 1rlb s ARG 60 Cb 0.00 -3.54 0.02 0.00 -1.56 0.00 0.00 34.95 29.87 1rlb s ARG 60 CO 0.00 -0.28 -0.07 0.14 -0.81 0.00 0.00 175.30 174.29 1rlb s VAL 61 N 1.91 0.84 -0.79 7.11 -7.23 -0.20 0.41 120.40 122.46 1rlb s VAL 61 Ca 0.44 -0.23 -0.20 0.00 -1.81 0.00 0.00 61.98 60.18 1rlb s VAL 61 Cb -0.18 -0.85 0.11 0.00 0.56 0.00 0.00 36.38 36.02 1rlb s VAL 61 CO 0.16 0.31 1.01 -0.60 -0.31 0.00 0.00 175.10 175.67 1rlb s ARG 62 N 1.30 3.35 0.16 4.82 3.52 -1.26 -2.01 118.95 128.83 1rlb s ARG 62 Ca -0.04 -1.38 -0.31 0.00 -0.13 0.00 0.00 55.73 53.87 1rlb s ARG 62 Cb -0.14 -4.57 -0.09 0.00 -1.56 0.00 0.00 34.95 28.59 1rlb s ARG 62 CO -0.03 -1.75 1.44 -0.51 -0.81 0.00 0.00 175.30 173.65 1rlb s LEU 63 N 3.13 4.38 0.19 -0.88 1.02 -0.64 -4.87 118.68 121.00 1rlb s LEU 63 Ca 0.26 2.48 0.02 0.00 0.02 0.00 0.00 54.13 56.91 1rlb s LEU 63 Cb -0.12 -3.60 0.48 0.00 0.02 0.00 0.00 46.19 42.98 1rlb s LEU 63 CO -0.00 -0.70 0.94 0.18 0.02 0.00 0.00 176.35 176.78 1rlb n LEU 64 N 3.53 -0.05 -0.22 1.79 4.32 -1.26 -1.25 117.00 123.86 1rlb n LEU 64 Ca 0.11 1.01 0.00 0.00 -0.02 0.00 0.00 56.01 57.11 1rlb n LEU 64 Cb 0.41 -0.38 0.00 0.00 -1.62 0.00 0.00 43.42 41.83 1rlb n LEU 64 CO 0.60 -1.03 0.23 -0.46 -1.22 0.00 0.00 177.39 175.50 1rlb n ASN 65 N -4.73 0.25 -1.27 -1.43 6.94 -1.26 -4.68 115.26 109.08 1rlb n ASN 65 Ca 0.15 -1.16 -0.04 0.00 -0.02 0.00 0.00 54.58 53.50 1rlb n ASN 65 Cb 0.48 -0.13 0.02 0.00 -2.36 0.00 0.00 39.78 37.79 1rlb n ASN 65 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1rlb n ASN 66 N -0.19 -2.45 -4.48 0.53 4.13 -0.38 -5.05 115.26 107.35 1rlb n ASN 66 Ca 0.00 -0.11 -0.34 0.00 1.68 0.00 0.00 54.58 55.80 1rlb n ASN 66 Cb 0.06 -1.38 -0.12 0.00 -1.54 0.00 0.00 39.78 36.80 1rlb n ASN 66 CO 0.00 0.00 0.00 -1.66 0.28 0.00 0.00 177.26 175.88 1rlb s TRP 67 N -3.07 3.06 -1.16 3.10 1.48 -0.66 -4.97 118.94 116.73 1rlb s TRP 67 Ca 0.06 -0.35 -0.19 0.00 -1.06 0.00 0.00 56.10 54.56 1rlb s TRP 67 Cb -0.03 -2.04 0.09 0.00 -1.16 0.00 0.00 33.47 30.33 1rlb s TRP 67 CO 0.14 -0.13 1.54 -0.51 -4.06 0.00 0.00 176.95 173.93 1rlb s ASP 68 N 0.72 6.75 0.44 -2.66 1.01 -1.26 -1.62 116.67 120.04 1rlb s ASP 68 Ca -0.00 -2.19 -0.21 0.00 0.71 0.00 0.00 52.55 50.86 1rlb s ASP 68 Cb -0.14 -2.53 -0.11 0.00 1.01 0.00 0.00 42.92 41.15 1rlb s ASP 68 CO 0.02 -1.20 0.96 -0.69 0.21 0.00 0.00 175.17 174.48 1rlb s VAL 69 N 3.88 4.32 -0.85 -1.27 1.01 -0.85 -4.87 120.40 121.77 1rlb s VAL 69 Ca 0.48 1.44 -0.11 0.00 0.00 0.00 0.00 61.98 63.79 1rlb s VAL 69 Cb 0.01 -3.58 0.22 0.00 0.00 0.00 0.00 36.38 33.03 1rlb s VAL 69 CO -0.01 -0.31 0.78 0.00 0.00 0.00 0.00 175.10 175.56 1rlb s ALA 71 N -0.21 3.43 -0.31 0.00 0.00 0.60 -4.69 121.76 120.59 1rlb s ALA 71 Ca 0.20 0.97 -0.16 0.00 0.00 0.00 0.00 51.96 52.98 1rlb s ALA 71 Cb -0.11 -3.84 -0.02 0.00 0.00 0.00 0.00 23.12 19.14 1rlb s ALA 71 CO -0.08 -1.74 0.41 -0.51 0.00 0.00 0.00 175.76 173.84 1rlb s ASP 72 N 4.53 6.26 0.52 0.00 1.11 -1.26 -2.35 116.67 125.49 1rlb s ASP 72 Ca 0.82 0.09 0.02 0.00 0.18 0.00 0.00 52.55 53.66 1rlb s ASP 72 Cb -0.35 -2.23 0.08 0.00 1.07 0.00 0.00 42.92 41.49 1rlb s ASP 72 CO 0.35 -0.30 0.59 0.23 1.18 0.00 0.00 175.17 177.21 1rlb n MET 73 N 5.46 0.37 -3.69 8.23 2.81 -0.19 -1.52 117.12 128.59 1rlb n MET 73 Ca -0.07 -1.83 -0.14 0.00 -1.81 0.00 0.00 57.70 53.84 1rlb n MET 73 Cb 0.50 -0.32 -0.09 0.00 -0.71 0.00 0.00 33.22 32.60 1rlb n MET 73 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1rlb s VAL 74 N -1.67 0.01 -0.04 2.03 1.01 -0.65 -4.16 120.40 116.93 1rlb s VAL 74 Ca 0.41 -0.10 0.02 0.00 0.00 0.00 0.00 61.98 62.31 1rlb s VAL 74 Cb -0.03 -0.72 0.01 0.00 0.00 0.00 0.00 36.38 35.64 1rlb s VAL 74 CO 0.27 -0.05 -0.08 -0.83 0.00 0.00 0.00 175.10 174.40 1rlb s GLY 75 N -0.26 0.55 -0.12 4.51 0.00 0.67 -2.70 107.32 109.97 1rlb s GLY 75 Ca -0.04 -0.26 0.01 0.00 0.00 0.00 0.00 44.72 44.42 1rlb s GLY 75 CO 0.03 0.10 -0.12 -1.59 0.00 0.00 0.00 173.10 171.52 1rlb s THR 76 N 0.48 1.30 0.15 0.90 2.01 0.15 -1.36 115.64 119.27 1rlb s THR 76 Ca -0.08 -0.49 -0.06 0.00 0.31 0.00 0.00 61.69 61.38 1rlb s THR 76 Cb -0.12 -1.24 -0.06 0.00 0.01 0.00 0.00 72.50 71.10 1rlb s THR 76 CO 0.01 0.41 0.40 -0.36 -0.69 0.00 0.00 174.62 174.39 1rlb s PHE 77 N 1.34 3.47 -0.04 4.92 0.40 -0.87 -0.43 117.98 126.78 1rlb s PHE 77 Ca -0.00 0.61 0.04 0.00 -0.60 0.00 0.00 56.93 56.98 1rlb s PHE 77 Cb -0.14 -2.05 -0.00 0.00 0.51 0.00 0.00 43.02 41.35 1rlb s PHE 77 CO -0.06 0.42 -0.15 0.99 0.70 0.00 0.00 175.22 177.12 1rlb s THR 78 N -1.67 1.26 0.88 0.64 2.01 0.18 -4.64 115.64 114.29 1rlb s THR 78 Ca 0.41 -0.62 -0.12 0.00 0.31 0.00 0.00 61.69 61.68 1rlb s THR 78 Cb -0.12 -1.09 0.12 0.00 0.01 0.00 0.00 72.50 71.42 1rlb s THR 78 CO 0.24 0.37 1.09 -1.81 -0.69 0.00 0.00 174.62 173.82 1rlb s ASP 79 N 0.09 3.69 0.00 3.53 1.11 -1.26 -0.20 116.67 123.62 1rlb s ASP 79 Ca -0.04 1.41 0.00 0.00 0.18 0.00 0.00 52.55 54.10 1rlb s ASP 79 Cb -0.11 -2.10 0.00 0.00 1.07 0.00 0.00 42.92 41.78 1rlb s ASP 79 CO 0.02 -2.49 0.00 0.35 1.18 0.00 0.00 175.17 174.23 1rlb n THR 80 N -3.78 0.00 -0.03 -1.27 -2.24 -1.24 -4.75 114.28 100.97 1rlb n THR 80 Ca 0.07 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.71 1rlb n THR 80 Cb 0.56 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.69 1rlb n THR 80 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1rlb h GLU 81 N 0.00 0.20 -6.78 -0.78 4.81 -2.00 -3.43 114.58 106.60 1rlb h GLU 81 Ca 0.00 -0.13 -0.49 0.00 -0.13 0.00 0.00 59.36 58.61 1rlb h GLU 81 Cb 0.00 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 1rlb h GLU 81 CO 0.00 0.72 0.39 0.34 -0.73 0.00 0.00 179.01 179.73 1rlb s ASP 82 N -6.06 7.50 0.44 1.04 -1.08 -1.26 -4.99 116.67 112.26 1rlb s ASP 82 Ca -0.15 2.05 0.30 0.00 -0.52 0.00 0.00 52.55 54.23 1rlb s ASP 82 Cb 0.03 -2.61 1.24 0.00 -1.46 0.00 0.00 42.92 40.11 1rlb s ASP 82 CO 0.73 0.04 1.89 1.55 0.52 0.00 0.00 175.17 179.89 1rlb h PRO 83 N 3.96 0.00 -0.25 4.34 0.13 -1.91 -3.32 132.00 134.96 1rlb h PRO 83 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1rlb h PRO 83 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1rlb h PRO 83 CO 0.67 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.44 1rlb n ALA 84 N -1.97 2.33 -3.69 -0.56 0.00 -1.26 -4.78 120.51 110.59 1rlb n ALA 84 Ca 0.01 -0.93 -0.31 0.00 0.00 0.00 0.00 53.44 52.21 1rlb n ALA 84 Cb 0.27 -0.51 -0.17 0.00 0.00 0.00 0.00 19.45 19.05 1rlb n ALA 84 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1rlb s LYS 85 N -1.06 2.73 0.25 0.00 1.02 -1.25 -1.41 119.74 120.02 1rlb s LYS 85 Ca 0.23 -0.75 0.01 0.00 0.02 0.00 0.00 55.97 55.49 1rlb s LYS 85 Cb 0.13 -2.25 -0.04 0.00 -0.52 0.00 0.00 37.83 35.16 1rlb s LYS 85 CO 0.18 -0.04 0.13 -0.06 -0.92 0.00 0.00 175.35 174.65 1rlb s PHE 86 N 0.90 1.43 -0.21 3.18 0.40 -1.00 -3.63 117.98 119.06 1rlb s PHE 86 Ca -0.06 -1.33 -0.06 0.00 -0.60 0.00 0.00 56.93 54.88 1rlb s PHE 86 Cb -0.15 -0.76 -0.03 0.00 0.51 0.00 0.00 43.02 42.59 1rlb s PHE 86 CO -0.02 -0.52 0.03 0.15 0.70 0.00 0.00 175.22 175.56 1rlb s LYS 87 N -3.99 3.68 -0.17 0.44 1.02 0.72 -2.09 119.74 119.34 1rlb s LYS 87 Ca 0.38 -0.48 0.01 0.00 0.02 0.00 0.00 55.97 55.89 1rlb s LYS 87 Cb 0.07 -3.18 0.01 0.00 -0.52 0.00 0.00 37.83 34.21 1rlb s LYS 87 CO 0.15 -0.02 -0.18 1.41 -0.92 0.00 0.00 175.35 175.79 1rlb s MET 88 N 1.11 3.08 -0.13 1.68 -2.45 0.06 0.47 119.30 123.13 1rlb s MET 88 Ca 0.03 -0.80 -0.19 0.00 -1.25 0.00 0.00 55.69 53.49 1rlb s MET 88 Cb -0.14 -2.60 -0.04 0.00 1.25 0.00 0.00 34.83 33.30 1rlb s MET 88 CO 0.02 -0.12 0.51 0.21 1.05 0.00 0.00 175.02 176.69 1rlb s LYS 89 N 1.11 4.32 0.17 4.11 2.20 0.42 0.34 119.74 132.41 1rlb s LYS 89 Ca 0.00 0.48 0.05 0.00 -0.36 0.00 0.00 55.97 56.14 1rlb s LYS 89 Cb -0.14 -3.46 -0.05 0.00 -1.51 0.00 0.00 37.83 32.67 1rlb s LYS 89 CO -0.07 0.08 -0.10 1.52 -0.36 0.00 0.00 175.35 176.43 1rlb s TYR 90 N 0.85 1.38 0.14 4.03 -0.85 -0.88 0.33 117.35 122.35 1rlb s TYR 90 Ca 0.27 -0.74 -0.25 0.00 -0.52 0.00 0.00 57.07 55.82 1rlb s TYR 90 Cb -0.15 -0.70 0.07 0.00 0.38 0.00 0.00 41.96 41.56 1rlb s TYR 90 CO 0.11 0.12 1.02 1.67 -1.52 0.00 0.00 175.55 176.94 1rlb s TRP 91 N -3.27 -0.09 0.51 -3.49 -2.14 -1.10 -0.76 118.94 108.61 1rlb s TRP 91 Ca 0.19 -0.20 0.04 0.00 2.66 0.00 0.00 56.10 58.79 1rlb s TRP 91 Cb 0.02 0.64 0.03 0.00 -3.10 0.00 0.00 33.47 31.06 1rlb s TRP 91 CO 0.03 -0.77 0.71 0.20 -2.66 0.00 0.00 176.95 174.46 1rlb s GLY 92 N -3.01 1.87 0.44 3.67 0.00 -1.22 -1.64 107.32 107.43 1rlb s GLY 92 Ca 0.14 -1.55 0.23 0.00 0.00 0.00 0.00 44.72 43.54 1rlb s GLY 92 CO 0.02 -1.28 1.87 -0.39 0.00 0.00 0.00 173.10 173.32 1rlb h VAL 93 N 0.27 0.65 -3.06 1.40 -1.51 -1.55 -3.42 116.25 109.03 1rlb h VAL 93 Ca -0.40 -1.06 -0.62 0.00 -1.23 0.00 0.00 66.70 63.39 1rlb h VAL 93 Cb 1.29 1.69 -0.09 0.00 -2.13 0.00 0.00 31.29 32.05 1rlb h VAL 93 CO 0.48 0.23 -0.37 0.00 -1.23 0.00 0.00 177.57 176.68 1rlb s ALA 94 N -3.80 3.70 0.26 5.19 0.00 -1.26 -4.98 121.76 120.87 1rlb s ALA 94 Ca -0.01 -0.49 -0.02 0.00 0.00 0.00 0.00 51.96 51.44 1rlb s ALA 94 Cb 0.11 -2.25 0.53 0.00 0.00 0.00 0.00 23.12 21.52 1rlb s ALA 94 CO 0.64 0.31 1.72 0.77 0.00 0.00 0.00 175.76 179.20 1rlb h SER 95 N 5.86 0.28 0.21 0.00 0.02 -2.00 -1.51 113.55 116.41 1rlb h SER 95 Ca -0.47 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 1rlb h SER 95 Cb 1.19 0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.83 1rlb h SER 95 CO 0.68 0.07 0.00 2.22 -1.14 0.00 0.00 176.83 178.67 1rlb n PHE 96 N -5.02 0.00 -3.66 3.45 -1.74 -1.26 -4.78 117.46 104.46 1rlb n PHE 96 Ca 0.16 0.00 -0.30 0.00 -0.56 0.00 0.00 57.45 56.75 1rlb n PHE 96 Cb 0.48 -0.32 -0.04 0.00 1.52 0.00 0.00 39.48 41.12 1rlb n PHE 96 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1rlb s LEU 97 N -2.63 4.24 0.70 5.98 1.43 -0.57 -5.05 118.68 122.77 1rlb s LEU 97 Ca 0.09 0.55 -0.16 0.00 -1.03 0.00 0.00 54.13 53.58 1rlb s LEU 97 Cb 0.07 -3.30 -0.14 0.00 0.03 0.00 0.00 46.19 42.85 1rlb s LEU 97 CO 0.16 0.02 -0.42 1.67 0.23 0.00 0.00 176.35 178.00 1rlb n GLN 98 N -0.14 0.00 -3.92 1.70 7.27 -1.26 -4.15 117.38 116.88 1rlb n GLN 98 Ca -0.03 0.00 -0.10 0.00 0.07 0.00 0.00 57.00 56.94 1rlb n GLN 98 Cb 0.52 -0.94 -0.12 0.00 2.41 0.00 0.00 30.24 32.11 1rlb n GLN 98 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 1rlb s LYS 99 N -1.39 0.24 0.11 3.69 1.02 -1.26 -3.38 119.74 118.78 1rlb s LYS 99 Ca 0.46 -0.34 -0.20 0.00 0.02 0.00 0.00 55.97 55.91 1rlb s LYS 99 Cb -0.33 0.09 0.07 0.00 -0.52 0.00 0.00 37.83 37.15 1rlb s LYS 99 CO 0.70 -0.04 0.96 0.41 -0.92 0.00 0.00 175.35 176.45 1rlb n GLY 100 N 2.10 0.57 2.78 -3.33 0.00 0.06 -4.96 105.19 102.42 1rlb n GLY 100 Ca -0.20 -1.09 -0.30 0.00 0.00 0.00 0.00 46.02 44.43 1rlb n GLY 100 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1rlb s ASN 101 N -3.22 4.09 0.29 1.61 3.04 -1.26 -2.06 114.94 117.43 1rlb s ASN 101 Ca 0.22 -1.88 0.08 0.00 0.04 0.00 0.00 52.86 51.32 1rlb s ASN 101 Cb -0.02 -1.01 -0.04 0.00 -1.54 0.00 0.00 41.25 38.64 1rlb s ASN 101 CO 0.03 -0.39 0.17 -0.62 -3.04 0.00 0.00 177.10 173.26 1rlb s ASP 102 N 1.30 5.12 0.34 -4.21 2.15 0.15 -4.90 116.67 116.63 1rlb s ASP 102 Ca 0.11 -0.48 -0.26 0.00 0.43 0.00 0.00 52.55 52.36 1rlb s ASP 102 Cb -0.19 -1.07 -0.10 0.00 -0.30 0.00 0.00 42.92 41.27 1rlb s ASP 102 CO -0.18 -0.16 0.95 -1.81 -0.17 0.00 0.00 175.17 173.80 1rlb s ASP 103 N -3.85 7.28 -0.39 -0.34 1.01 -1.26 -0.76 116.67 118.36 1rlb s ASP 103 Ca 0.35 1.84 0.04 0.00 0.71 0.00 0.00 52.55 55.50 1rlb s ASP 103 Cb -0.06 -2.58 0.16 0.00 1.01 0.00 0.00 42.92 41.46 1rlb s ASP 103 CO 0.24 -0.11 0.45 -2.28 0.21 0.00 0.00 175.17 173.68 1rlb s HIS 104 N -1.66 -0.57 -0.27 4.23 5.65 -0.89 -4.42 115.29 117.37 1rlb s HIS 104 Ca 0.51 -0.73 -0.19 0.00 0.25 0.00 0.00 55.06 54.91 1rlb s HIS 104 Cb -0.18 -0.25 -0.02 0.00 -1.18 0.00 0.00 32.58 30.95 1rlb s HIS 104 CO 0.23 -1.02 0.55 -1.58 -0.65 0.00 0.00 174.74 172.27 1rlb s TRP 105 N 1.34 3.26 -0.22 3.88 0.52 0.33 -2.37 118.94 125.68 1rlb s TRP 105 Ca 0.19 0.64 -0.23 0.00 0.02 0.00 0.00 56.10 56.73 1rlb s TRP 105 Cb -0.11 -2.79 -0.01 0.00 -1.15 0.00 0.00 33.47 29.41 1rlb s TRP 105 CO -0.05 -0.33 0.73 0.42 0.02 0.00 0.00 176.95 177.74 1rlb s ILE 106 N 2.39 4.93 0.07 2.03 -1.09 -0.50 -0.28 121.20 128.76 1rlb s ILE 106 Ca 0.23 1.37 0.09 0.00 -2.23 0.00 0.00 60.65 60.10 1rlb s ILE 106 Cb -0.15 -4.03 -0.21 0.00 -1.58 0.00 0.00 42.46 36.48 1rlb s ILE 106 CO 0.10 0.01 1.12 0.40 -1.23 0.00 0.00 174.94 175.34 1rlb h ILE 107 N 5.33 1.48 -1.17 2.92 1.08 -1.46 -2.85 117.51 122.84 1rlb h ILE 107 Ca -0.27 -3.22 0.20 0.00 -0.39 0.00 0.00 64.86 61.18 1rlb h ILE 107 Cb 1.12 2.73 -0.27 0.00 -3.07 0.00 0.00 36.82 37.32 1rlb h ILE 107 CO 0.82 0.84 0.85 -0.62 -0.69 0.00 0.00 178.15 179.35 1rlb s ASP 108 N -6.54 -0.11 -0.27 1.72 -1.08 -1.25 -3.22 116.67 105.92 1rlb s ASP 108 Ca -0.00 0.14 -0.26 0.00 -0.52 0.00 0.00 52.55 51.91 1rlb s ASP 108 Cb 0.09 0.12 0.14 0.00 -1.46 0.00 0.00 42.92 41.81 1rlb s ASP 108 CO 0.82 -0.09 1.13 0.28 0.52 0.00 0.00 175.17 177.83 1rlb s THR 109 N -0.85 0.00 -0.23 1.71 -1.32 -1.26 -1.79 115.64 111.90 1rlb s THR 109 Ca 0.07 0.00 0.14 0.00 -1.21 0.00 0.00 61.69 60.69 1rlb s THR 109 Cb -0.02 -1.00 0.63 0.00 -1.51 0.00 0.00 72.50 70.61 1rlb s THR 109 CO -0.07 0.00 1.57 -0.90 -2.21 0.00 0.00 174.62 173.01 1rlb n ASP 110 N 1.81 4.36 0.00 8.08 5.75 -1.22 -4.95 116.55 130.37 1rlb n ASP 110 Ca -0.11 -3.11 0.00 0.00 -0.01 0.00 0.00 54.79 51.56 1rlb n ASP 110 Cb 0.56 -0.62 0.00 0.00 -1.03 0.00 0.00 41.12 40.03 1rlb n ASP 110 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1rlb n TYR 111 N -0.25 0.00 -0.09 2.11 4.01 -1.26 -3.73 117.16 117.95 1rlb n TYR 111 Ca 0.27 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.93 1rlb n TYR 111 Cb 1.07 -0.02 -0.16 0.00 -0.31 0.00 0.00 39.34 39.92 1rlb n TYR 111 CO 0.00 0.00 0.00 -0.85 -0.46 0.00 0.00 176.86 175.55 1rlb n GLU 112 N -0.04 0.69 0.00 -0.72 0.28 -1.26 -4.78 120.64 114.81 1rlb n GLU 112 Ca 0.00 -0.01 0.00 0.00 -0.16 0.00 0.00 57.16 56.99 1rlb n GLU 112 Cb 0.00 -1.53 0.00 0.00 1.43 0.00 0.00 31.44 31.34 1rlb n GLU 112 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1rlb n THR 113 N -2.73 0.00 -3.87 3.84 -1.04 -1.24 -4.67 114.28 104.56 1rlb n THR 113 Ca -0.31 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.60 1rlb n THR 113 Cb 1.12 -0.66 -0.00 0.00 -1.82 0.00 0.00 70.33 68.97 1rlb n THR 113 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 1rlb n PHE 114 N -1.54 -1.72 -3.64 -1.42 -1.74 -1.26 -2.59 117.46 103.55 1rlb n PHE 114 Ca 0.00 -1.90 -0.06 0.00 -0.56 0.00 0.00 57.45 54.93 1rlb n PHE 114 Cb 0.34 0.63 -0.07 0.00 1.52 0.00 0.00 39.48 41.90 1rlb n PHE 114 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1rlb s ALA 115 N -2.34 -2.05 0.02 1.98 0.00 -1.01 -3.40 121.76 114.96 1rlb s ALA 115 Ca 0.21 2.16 -0.06 0.00 0.00 0.00 0.00 51.96 54.27 1rlb s ALA 115 Cb -0.02 -1.52 -0.05 0.00 0.00 0.00 0.00 23.12 21.53 1rlb s ALA 115 CO 0.15 -0.33 0.27 0.08 0.00 0.00 0.00 175.76 175.93 1rlb s VAL 116 N 1.03 5.30 -0.02 0.00 1.01 -0.74 -1.09 120.40 125.89 1rlb s VAL 116 Ca -0.05 0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.11 1rlb s VAL 116 Cb -0.04 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.75 1rlb s VAL 116 CO -0.12 0.32 -0.24 -1.58 0.00 0.00 0.00 175.10 173.48 1rlb s GLN 117 N -1.88 2.02 0.08 2.72 -0.44 0.64 -1.14 119.66 121.66 1rlb s GLN 117 Ca 0.29 -0.87 0.05 0.00 -2.50 0.00 0.00 55.36 52.33 1rlb s GLN 117 Cb -0.13 -1.92 -0.03 0.00 -1.64 0.00 0.00 33.01 29.29 1rlb s GLN 117 CO 0.18 0.50 -0.13 -0.47 0.50 0.00 0.00 175.29 175.86 1rlb s TYR 118 N -0.52 1.19 -0.29 1.67 5.04 0.62 -1.85 117.35 123.21 1rlb s TYR 118 Ca 0.08 -0.49 -0.12 0.00 -2.44 0.00 0.00 57.07 54.10 1rlb s TYR 118 Cb -0.10 -0.66 0.11 0.00 0.35 0.00 0.00 41.96 41.66 1rlb s TYR 118 CO -0.00 0.05 0.67 0.45 -1.34 0.00 0.00 175.55 175.38 1rlb s SER 119 N -1.87 -1.07 -0.14 4.32 0.15 -0.89 -0.51 113.70 113.70 1rlb s SER 119 Ca -0.01 1.55 -0.06 0.00 0.70 0.00 0.00 55.95 58.13 1rlb s SER 119 Cb -0.09 1.95 -0.04 0.00 -1.71 0.00 0.00 66.02 66.13 1rlb s SER 119 CO 0.02 -0.23 0.09 0.00 1.20 0.00 0.00 173.24 174.32 1rlb n ARG 121 N 2.58 0.53 -4.47 0.00 1.74 0.98 -4.48 116.66 113.53 1rlb n ARG 121 Ca -0.18 0.09 -0.30 0.00 -0.77 0.00 0.00 57.85 56.69 1rlb n ARG 121 Cb 0.54 -1.33 -0.17 0.00 -1.02 0.00 0.00 32.46 30.48 1rlb n ARG 121 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1rlb s LEU 122 N -5.89 1.82 0.90 0.55 2.96 -1.25 -5.02 118.68 112.75 1rlb s LEU 122 Ca -0.21 -0.48 -0.14 0.00 -0.22 0.00 0.00 54.13 53.08 1rlb s LEU 122 Cb 0.06 -1.19 0.16 0.00 0.50 0.00 0.00 46.19 45.72 1rlb s LEU 122 CO 0.39 0.03 1.26 -0.22 -1.32 0.00 0.00 176.35 176.49 1rlb s LEU 123 N 0.98 2.66 0.00 -0.68 2.96 -1.26 0.53 118.68 123.88 1rlb s LEU 123 Ca -0.06 0.41 0.08 0.00 -0.22 0.00 0.00 54.13 54.35 1rlb s LEU 123 Cb -0.15 -2.61 0.08 0.00 0.50 0.00 0.00 46.19 44.01 1rlb s LEU 123 CO -0.02 -2.43 0.69 0.59 -1.32 0.00 0.00 176.35 173.85 1rlb n ASN 124 N -3.59 1.93 0.41 3.68 3.02 0.32 -3.87 115.26 117.16 1rlb n ASN 124 Ca 0.13 -2.39 -0.17 0.00 -0.03 0.00 0.00 54.58 52.12 1rlb n ASN 124 Cb 0.60 -0.35 -0.08 0.00 -0.61 0.00 0.00 39.78 39.33 1rlb n ASN 124 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1rlb h LEU 125 N 0.00 -0.89 -2.40 3.41 -0.00 -1.99 -3.16 115.31 110.28 1rlb h LEU 125 Ca -0.25 0.02 0.03 0.00 -0.00 0.00 0.00 57.88 57.68 1rlb h LEU 125 Cb 1.11 0.23 -0.00 0.00 -0.00 0.00 0.00 40.66 42.00 1rlb h LEU 125 CO 0.35 -0.54 0.13 -2.24 -0.00 0.00 0.00 178.44 176.15 1rlb h ASP 126 N -1.25 0.00 0.00 -0.43 3.04 -2.03 -3.45 116.42 112.29 1rlb h ASP 126 Ca -0.11 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.68 1rlb h ASP 126 Cb 0.82 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.11 1rlb h ASP 126 CO 0.18 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 177.99 1rlb n GLY 127 N -1.31 1.51 3.78 7.15 0.00 -1.20 -5.03 105.19 110.09 1rlb n GLY 127 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 1rlb n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rlb s THR 128 N -1.68 3.50 0.10 2.61 -4.23 -1.26 -1.50 115.64 113.18 1rlb s THR 128 Ca 0.00 0.99 -0.31 0.00 -1.18 0.00 0.00 61.69 61.19 1rlb s THR 128 Cb 0.00 -3.43 -0.09 0.00 1.34 0.00 0.00 72.50 70.33 1rlb s THR 128 CO 0.00 -0.15 1.57 0.00 -0.54 0.00 0.00 174.62 175.50 1rlb h ALA 130 N 7.58 0.98 -0.84 0.00 0.00 -0.02 -3.44 119.26 123.52 1rlb h ALA 130 Ca -0.42 0.00 0.10 0.00 0.00 0.00 0.00 54.91 54.59 1rlb h ALA 130 Cb 1.20 0.00 -0.21 0.00 0.00 0.00 0.00 17.79 18.78 1rlb h ALA 130 CO 0.91 0.00 -0.23 0.34 0.00 0.00 0.00 179.25 180.27 1rlb s ASP 131 N -4.63 -1.26 0.28 0.00 2.15 -1.19 -4.94 116.67 107.07 1rlb s ASP 131 Ca 0.10 0.46 0.10 0.00 0.43 0.00 0.00 52.55 53.64 1rlb s ASP 131 Cb 0.12 1.93 -0.05 0.00 -0.30 0.00 0.00 42.92 44.61 1rlb s ASP 131 CO 0.61 -0.23 -0.16 -0.94 -0.17 0.00 0.00 175.17 174.28 1rlb s SER 132 N 2.87 3.35 -0.01 -0.34 1.04 -1.26 -0.01 113.70 119.35 1rlb s SER 132 Ca 0.15 -1.08 0.01 0.00 0.48 0.00 0.00 55.95 55.51 1rlb s SER 132 Cb -0.11 -0.27 0.01 0.00 0.10 0.00 0.00 66.02 65.75 1rlb s SER 132 CO -0.22 -0.08 -0.02 -0.72 0.98 0.00 0.00 173.24 173.18 1rlb s TYR 133 N -2.66 0.26 -0.04 5.02 -0.85 -0.04 -3.61 117.35 115.42 1rlb s TYR 133 Ca 0.29 -0.03 0.01 0.00 -0.52 0.00 0.00 57.07 56.82 1rlb s TYR 133 Cb -0.02 -0.22 0.02 0.00 0.38 0.00 0.00 41.96 42.12 1rlb s TYR 133 CO 0.14 -0.03 -0.05 0.45 -1.52 0.00 0.00 175.55 174.53 1rlb s SER 134 N 0.21 0.95 -0.08 -0.18 0.15 -1.16 -2.09 113.70 111.49 1rlb s SER 134 Ca -0.02 -0.14 -0.00 0.00 0.70 0.00 0.00 55.95 56.49 1rlb s SER 134 Cb -0.04 -0.43 -0.03 0.00 -1.71 0.00 0.00 66.02 63.81 1rlb s SER 134 CO -0.01 -0.03 -0.05 -0.36 1.20 0.00 0.00 173.24 174.00 1rlb s PHE 135 N 0.75 3.00 -0.28 3.44 0.08 -0.77 0.38 117.98 124.59 1rlb s PHE 135 Ca -0.10 0.03 -0.09 0.00 0.12 0.00 0.00 56.93 56.88 1rlb s PHE 135 Cb -0.13 -1.76 -0.03 0.00 -0.57 0.00 0.00 43.02 40.53 1rlb s PHE 135 CO 0.00 0.32 0.14 0.08 -0.10 0.00 0.00 175.22 175.67 1rlb s VAL 136 N -0.69 4.75 0.16 -0.44 1.01 0.13 -0.26 120.40 125.05 1rlb s VAL 136 Ca 0.11 -0.15 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 1rlb s VAL 136 Cb -0.11 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 1rlb s VAL 136 CO 0.02 0.21 0.34 -0.36 0.00 0.00 0.00 175.10 175.31 1rlb s PHE 137 N 1.66 3.49 0.13 5.22 0.08 -0.25 -0.51 117.98 127.80 1rlb s PHE 137 Ca 0.06 0.34 0.10 0.00 0.12 0.00 0.00 56.93 57.55 1rlb s PHE 137 Cb -0.16 -1.85 -0.04 0.00 -0.57 0.00 0.00 43.02 40.40 1rlb s PHE 137 CO 0.07 0.45 -0.23 0.00 -0.10 0.00 0.00 175.22 175.40 1rlb s ALA 138 N -1.74 2.13 -2.52 5.36 0.00 -0.93 -2.39 121.76 121.67 1rlb s ALA 138 Ca 0.38 -1.40 0.23 0.00 0.00 0.00 0.00 51.96 51.17 1rlb s ALA 138 Cb -0.12 -0.30 0.49 0.00 0.00 0.00 0.00 23.12 23.19 1rlb s ALA 138 CO 0.28 0.43 1.43 -2.13 0.00 0.00 0.00 175.76 175.77 1rlb n ARG 139 N 0.85 2.27 -4.85 0.00 0.63 -1.07 -1.96 116.66 112.53 1rlb n ARG 139 Ca -0.18 -1.90 -0.27 0.00 -0.92 0.00 0.00 57.85 54.59 1rlb n ARG 139 Cb 0.54 -1.48 -0.17 0.00 0.45 0.00 0.00 32.46 31.81 1rlb n ARG 139 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1rlb s ASP 140 N -1.61 2.28 0.39 6.15 2.15 -1.26 -4.76 116.67 120.00 1rlb s ASP 140 Ca 0.35 -0.39 0.14 0.00 0.43 0.00 0.00 52.55 53.08 1rlb s ASP 140 Cb 0.21 -0.92 0.98 0.00 -0.30 0.00 0.00 42.92 42.89 1rlb s ASP 140 CO 0.30 0.11 1.84 1.55 -0.17 0.00 0.00 175.17 178.80 1rlb h PRO 141 N 6.66 0.51 -0.58 4.34 0.13 -1.95 -3.26 132.00 137.85 1rlb h PRO 141 Ca -0.28 -0.03 0.11 0.00 -0.87 0.00 0.00 66.00 64.92 1rlb h PRO 141 Cb 1.20 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 32.18 1rlb h PRO 141 CO 0.47 0.33 0.39 0.77 -0.23 0.00 0.00 178.00 179.74 1rlb h SER 142 N 0.52 0.30 0.00 1.44 0.02 -1.97 -3.49 113.55 110.37 1rlb h SER 142 Ca 0.49 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.45 1rlb h SER 142 Cb 1.05 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.54 1rlb h SER 142 CO -0.22 0.18 0.00 0.61 -1.14 0.00 0.00 176.83 176.26 1rlb n GLY 143 N -1.54 0.67 3.49 -3.77 0.00 -1.23 -5.14 105.19 97.67 1rlb n GLY 143 Ca 0.10 -1.73 -0.15 0.00 0.00 0.00 0.00 46.02 44.24 1rlb n GLY 143 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1rlb s PHE 144 N -3.07 -0.59 -0.38 1.61 -0.71 -1.26 -4.66 117.98 108.92 1rlb s PHE 144 Ca 0.00 0.80 -0.36 0.00 -1.04 0.00 0.00 56.93 56.34 1rlb s PHE 144 Cb 0.00 0.47 -0.15 0.00 -1.21 0.00 0.00 43.02 42.13 1rlb s PHE 144 CO 0.00 -0.67 1.27 0.43 -1.34 0.00 0.00 175.22 174.91 1rlb n SER 145 N 0.43 0.88 0.26 1.98 7.64 -1.26 -4.59 113.62 118.95 1rlb n SER 145 Ca -0.17 0.86 0.14 0.00 1.01 0.00 0.00 58.87 60.71 1rlb n SER 145 Cb 0.60 -0.67 0.65 0.00 -1.01 0.00 0.00 64.21 63.77 1rlb n SER 145 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1rlb h PRO 146 N 4.19 0.00 0.20 1.43 0.11 -2.00 -0.68 132.00 135.25 1rlb h PRO 146 Ca -0.30 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.80 1rlb h PRO 146 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1rlb h PRO 146 CO 0.76 0.00 -0.10 1.96 -0.21 0.00 0.00 178.00 180.41 1rlb h GLN 147 N 0.00 -0.26 0.00 1.05 7.50 -1.99 0.81 115.11 122.22 1rlb h GLN 147 Ca 0.06 0.02 -0.18 0.00 0.50 0.00 0.00 58.65 59.05 1rlb h GLN 147 Cb 1.09 0.06 -0.03 0.00 0.05 0.00 0.00 27.48 28.65 1rlb h GLN 147 CO -0.00 0.12 -0.86 -0.39 -1.50 0.00 0.00 178.83 176.20 1rlb h VAL 148 N -0.75 1.61 -0.82 -0.54 -1.51 -1.72 -2.03 116.25 110.49 1rlb h VAL 148 Ca -0.03 -2.95 0.06 0.00 -1.23 0.00 0.00 66.70 62.55 1rlb h VAL 148 Cb 0.50 2.60 -0.05 0.00 -2.13 0.00 0.00 31.29 32.21 1rlb h VAL 148 CO 0.05 0.84 0.53 -0.61 -1.23 0.00 0.00 177.57 177.15 1rlb h GLN 149 N 0.00 0.88 -0.57 5.19 4.15 -0.95 -0.50 115.11 123.32 1rlb h GLN 149 Ca -0.01 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.32 1rlb h GLN 149 Cb 1.53 -0.20 -0.03 0.00 0.21 0.00 0.00 27.48 28.99 1rlb h GLN 149 CO 0.11 0.58 0.20 -0.22 -1.93 0.00 0.00 178.83 177.57 1rlb h LYS 150 N 0.90 0.84 0.34 1.69 3.64 -0.11 -0.98 116.57 122.89 1rlb h LYS 150 Ca 0.35 -0.14 -0.02 0.00 -1.27 0.00 0.00 60.65 59.57 1rlb h LYS 150 Cb 0.21 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1rlb h LYS 150 CO -0.12 0.71 -0.17 0.82 -2.27 0.00 0.00 179.45 178.42 1rlb h ILE 151 N 0.82 0.67 0.00 2.00 2.04 -0.81 -2.66 117.51 119.58 1rlb h ILE 151 Ca 0.19 -0.31 -0.08 0.00 1.00 0.00 0.00 64.86 65.66 1rlb h ILE 151 Cb 0.21 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1rlb h ILE 151 CO -0.01 0.06 -0.37 1.62 0.00 0.00 0.00 178.15 179.45 1rlb h VAL 152 N -0.63 0.88 -0.57 1.67 3.04 -0.95 -1.78 116.25 117.91 1rlb h VAL 152 Ca -0.05 -1.51 -0.01 0.00 -1.01 0.00 0.00 66.70 64.12 1rlb h VAL 152 Cb 0.46 1.92 -0.03 0.00 -2.01 0.00 0.00 31.29 31.63 1rlb h VAL 152 CO 0.08 0.36 0.31 0.08 -1.01 0.00 0.00 177.57 177.39 1rlb h ARG 153 N 0.00 0.80 0.16 4.17 -0.00 -1.13 -2.66 114.38 115.72 1rlb h ARG 153 Ca -0.00 -0.10 0.01 0.00 -0.00 0.00 0.00 59.98 59.89 1rlb h ARG 153 Cb 0.89 -0.15 -0.02 0.00 -0.00 0.00 0.00 29.97 30.69 1rlb h ARG 153 CO 0.05 0.62 -0.20 0.37 -0.00 0.00 0.00 179.97 180.80 1rlb h GLN 154 N 0.77 -0.40 -0.38 0.08 4.15 -0.98 -1.64 115.11 116.70 1rlb h GLN 154 Ca 0.20 0.03 0.08 0.00 0.77 0.00 0.00 58.65 59.72 1rlb h GLN 154 Cb 0.06 0.09 -0.07 0.00 0.21 0.00 0.00 27.48 27.77 1rlb h GLN 154 CO -0.03 -0.27 -0.08 0.00 -1.93 0.00 0.00 178.83 176.53 1rlb h ARG 155 N -0.42 0.02 -0.86 1.69 2.47 -1.29 -0.16 114.38 115.84 1rlb h ARG 155 Ca 0.01 -0.00 0.21 0.00 -1.26 0.00 0.00 59.98 58.94 1rlb h ARG 155 Cb 0.41 -0.00 -0.13 0.00 -1.65 0.00 0.00 29.97 28.60 1rlb h ARG 155 CO -0.07 0.01 0.30 1.96 0.56 0.00 0.00 179.97 182.73 1rlb h GLN 156 N 0.02 0.30 -0.14 0.04 4.20 -0.94 1.03 115.11 119.62 1rlb h GLN 156 Ca 0.19 -0.02 -0.14 0.00 0.06 0.00 0.00 58.65 58.74 1rlb h GLN 156 Cb 0.28 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 1rlb h GLN 156 CO -0.38 0.20 -0.52 1.49 -0.67 0.00 0.00 178.83 178.95 1rlb h GLU 157 N 0.31 0.38 0.00 1.46 4.57 -0.90 0.68 114.58 121.09 1rlb h GLU 157 Ca 0.53 -0.23 0.00 0.00 -1.18 0.00 0.00 59.36 58.48 1rlb h GLU 157 Cb 1.01 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.62 1rlb h GLU 157 CO -0.56 0.81 0.00 0.93 -1.18 0.00 0.00 179.01 179.01 1rlb h GLU 158 N 0.30 0.00 0.00 1.92 5.08 0.14 0.26 114.58 122.28 1rlb h GLU 158 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1rlb h GLU 158 Cb 1.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1rlb h GLU 158 CO 0.09 0.00 -1.18 1.28 -1.00 0.00 0.00 179.01 178.20 1rlb n LEU 159 N -2.37 0.61 0.00 1.33 4.77 -0.48 -4.86 117.00 115.99 1rlb n LEU 159 Ca 0.01 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1rlb n LEU 159 Cb 0.18 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1rlb n LEU 159 CO 0.18 0.10 0.00 0.00 -1.33 0.00 0.00 177.39 176.34 1rlb n LEU 161 N 0.00 6.14 -0.06 0.00 4.32 -1.21 -4.72 117.00 121.48 1rlb n LEU 161 Ca 0.00 -5.16 0.02 0.00 -0.02 0.00 0.00 56.01 50.85 1rlb n LEU 161 Cb 0.07 -1.33 0.03 0.00 -1.62 0.00 0.00 43.42 40.56 1rlb n LEU 161 CO 0.00 1.59 0.43 0.00 -1.22 0.00 0.00 177.39 178.19 1rlb n ALA 162 N 1.74 1.82 -1.15 -1.18 0.00 -1.26 -3.28 120.51 117.19 1rlb n ALA 162 Ca 0.25 -1.19 0.00 0.00 0.00 0.00 0.00 53.44 52.50 1rlb n ALA 162 Cb 0.35 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.68 1rlb n ALA 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1rlb n ARG 163 N -0.52 0.00 -2.96 0.00 1.74 -1.26 -4.84 116.66 108.83 1rlb n ARG 163 Ca 0.03 -0.26 -0.42 0.00 -0.77 0.00 0.00 57.85 56.43 1rlb n ARG 163 Cb 0.42 -0.42 0.01 0.00 -1.02 0.00 0.00 32.46 31.44 1rlb n ARG 163 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1rlb n GLN 164 N 0.00 4.55 -4.07 5.56 3.00 -1.21 -5.01 117.38 120.21 1rlb n GLN 164 Ca 0.00 -4.59 -0.12 0.00 -0.01 0.00 0.00 57.00 52.28 1rlb n GLN 164 Cb 0.40 -2.49 -0.11 0.00 0.00 0.00 0.00 30.24 28.05 1rlb n GLN 164 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.06 177.77 1rlb s TYR 165 N -3.09 0.67 0.04 1.08 1.51 -1.26 -4.34 117.35 111.96 1rlb s TYR 165 Ca 0.33 -0.56 0.02 0.00 -1.01 0.00 0.00 57.07 55.85 1rlb s TYR 165 Cb 0.08 -0.40 -0.02 0.00 -0.11 0.00 0.00 41.96 41.51 1rlb s TYR 165 CO 0.06 -0.10 -0.06 0.50 -1.11 0.00 0.00 175.55 174.83 1rlb s ARG 166 N -1.86 0.49 0.29 -0.62 3.52 -1.18 -4.98 118.95 114.61 1rlb s ARG 166 Ca -0.08 -0.76 -0.21 0.00 -0.13 0.00 0.00 55.73 54.56 1rlb s ARG 166 Cb -0.08 -0.17 -0.09 0.00 -1.56 0.00 0.00 34.95 33.05 1rlb s ARG 166 CO -0.00 0.02 0.82 -1.17 -0.81 0.00 0.00 175.30 174.15 1rlb s LEU 167 N -1.65 4.25 -0.39 -0.88 2.96 -1.26 -3.00 118.68 118.71 1rlb s LEU 167 Ca -0.10 1.55 -0.05 0.00 -0.22 0.00 0.00 54.13 55.31 1rlb s LEU 167 Cb -0.09 -3.90 0.09 0.00 0.50 0.00 0.00 46.19 42.79 1rlb s LEU 167 CO -0.00 -0.08 0.18 -0.63 -1.32 0.00 0.00 176.35 174.49 1rlb s ILE 168 N -1.70 3.53 -0.27 6.68 1.01 -0.57 -4.96 121.20 124.91 1rlb s ILE 168 Ca 0.49 -1.69 -0.33 0.00 0.00 0.00 0.00 60.65 59.12 1rlb s ILE 168 Cb -0.15 -3.24 -0.10 0.00 0.01 0.00 0.00 42.46 38.98 1rlb s ILE 168 CO 0.20 -0.50 2.15 -2.65 0.00 0.00 0.00 174.94 174.14 1rlb n PRO 169 N 4.70 1.52 -3.39 2.79 -0.02 -1.26 -4.81 135.00 134.53 1rlb n PRO 169 Ca -0.07 0.45 -0.43 0.00 -2.02 0.00 0.00 63.50 61.42 1rlb n PRO 169 Cb 0.42 -2.73 -0.09 0.00 -0.02 0.00 0.00 33.50 31.09 1rlb n PRO 169 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1rlb s HIS 170 N 7.08 3.21 -0.37 6.00 3.76 -1.26 -2.80 115.29 130.91 1rlb s HIS 170 Ca 1.04 -0.57 0.12 0.00 -0.15 0.00 0.00 55.06 55.50 1rlb s HIS 170 Cb -0.67 -2.81 0.35 0.00 1.11 0.00 0.00 32.58 30.55 1rlb s HIS 170 CO 0.45 -0.68 0.72 0.27 -0.85 0.00 0.00 174.74 174.66 1rlb n ASN 171 N 5.35 0.78 -3.97 1.40 0.23 -1.26 -5.01 115.26 112.78 1rlb n ASN 171 Ca -0.10 -3.00 -0.31 0.00 -0.53 0.00 0.00 54.58 50.64 1rlb n ASN 171 Cb 0.47 -0.61 0.01 0.00 -2.08 0.00 0.00 39.78 37.57 1rlb n ASN 171 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1rlb n GLY 172 N 0.33 -0.53 0.11 4.83 0.00 -1.26 -4.84 105.19 103.83 1rlb n GLY 172 Ca 0.25 0.21 -0.01 0.00 0.00 0.00 0.00 46.02 46.47 1rlb n GLY 172 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1rlb h TYR 173 N -0.63 0.00 -0.01 1.61 3.20 -1.95 -3.54 116.97 115.65 1rlb h TYR 173 Ca -0.46 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.41 1rlb h TYR 173 Cb 0.91 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.18 1rlb h TYR 173 CO 0.24 0.70 0.00 0.00 -1.64 0.00 0.00 178.16 177.46