#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rml s PRO 25 N 0.00 2.93 -0.29 1.97 0.04 -1.26 -4.88 135.00 133.51 1rml s PRO 25 Ca 0.00 0.07 -0.19 0.00 0.04 0.00 0.00 61.00 60.93 1rml s PRO 25 Cb 0.00 -4.40 0.17 0.00 0.04 0.00 0.00 34.50 30.32 1rml s PRO 25 CO 0.00 -2.48 1.16 0.21 0.04 0.00 0.00 177.00 175.93 1rml s LYS 26 N 6.34 0.23 -0.04 4.56 2.47 -1.26 -1.95 119.74 130.08 1rml s LYS 26 Ca 0.52 0.35 -0.29 0.00 -1.56 0.00 0.00 55.97 54.99 1rml s LYS 26 Cb -0.09 0.07 0.11 0.00 -1.46 0.00 0.00 37.83 36.45 1rml s LYS 26 CO 0.15 -0.04 0.90 -0.48 0.16 0.00 0.00 175.35 176.04 1rml s LEU 27 N 0.87 -0.38 0.09 5.43 0.05 -1.26 -3.84 118.68 119.64 1rml s LEU 27 Ca -0.04 0.11 0.02 0.00 0.05 0.00 0.00 54.13 54.27 1rml s LEU 27 Cb -0.04 2.01 -0.04 0.00 -2.05 0.00 0.00 46.19 46.07 1rml s LEU 27 CO -0.12 -0.56 0.17 -0.22 -0.55 0.00 0.00 176.35 175.07 1rml s LEU 28 N -2.14 4.14 -0.06 1.48 0.20 -1.26 -2.30 118.68 118.74 1rml s LEU 28 Ca 0.03 0.14 0.01 0.00 0.69 0.00 0.00 54.13 54.99 1rml s LEU 28 Cb -0.01 -2.76 0.02 0.00 -0.43 0.00 0.00 46.19 43.01 1rml s LEU 28 CO -0.06 0.14 -0.06 -0.47 -0.29 0.00 0.00 176.35 175.61 1rml s TYR 29 N -1.53 1.02 0.32 5.38 5.04 -0.26 -3.48 117.35 123.85 1rml s TYR 29 Ca 0.33 -0.36 -0.18 0.00 -2.44 0.00 0.00 57.07 54.42 1rml s TYR 29 Cb -0.12 -0.86 -0.09 0.00 0.35 0.00 0.00 41.96 41.23 1rml s TYR 29 CO 0.26 -0.27 0.79 0.00 -1.34 0.00 0.00 175.55 174.99 1rml n SER 31 N -0.13 0.00 -4.80 0.00 2.88 0.03 -3.75 113.62 107.85 1rml n SER 31 Ca 0.03 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.27 1rml n SER 31 Cb 0.53 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 64.07 1rml n SER 31 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1rml s ASN 32 N -2.75 4.56 0.00 -3.46 2.47 -1.26 -3.78 114.94 110.72 1rml s ASN 32 Ca 0.00 1.36 0.00 0.00 0.42 0.00 0.00 52.86 54.64 1rml s ASN 32 Cb 0.00 -2.10 0.00 0.00 -1.45 0.00 0.00 41.25 37.70 1rml s ASN 32 CO 0.00 -1.93 0.00 0.61 -3.72 0.00 0.00 177.10 172.06 1rml n GLY 33 N -2.04 1.58 1.41 1.21 0.00 -1.26 -4.21 105.19 101.88 1rml n GLY 33 Ca 0.07 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1rml n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rml n GLY 34 N 0.00 0.59 3.76 -0.02 0.00 -1.25 -4.85 105.19 103.43 1rml n GLY 34 Ca 0.00 -0.49 -0.41 0.00 0.00 0.00 0.00 46.02 45.12 1rml n GLY 34 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1rml s HIS 35 N -2.00 2.88 -0.50 1.61 3.76 -1.20 -4.13 115.29 115.71 1rml s HIS 35 Ca 0.00 1.06 -0.06 0.00 -0.15 0.00 0.00 55.06 55.91 1rml s HIS 35 Cb 0.00 -3.89 0.13 0.00 1.11 0.00 0.00 32.58 29.93 1rml s HIS 35 CO 0.00 -2.80 0.34 -0.06 -0.85 0.00 0.00 174.74 171.37 1rml s PHE 36 N -0.42 3.50 0.05 1.40 0.40 0.46 -1.15 117.98 122.23 1rml s PHE 36 Ca 0.57 -2.23 -0.32 0.00 -0.60 0.00 0.00 56.93 54.35 1rml s PHE 36 Cb -0.44 -3.37 -0.17 0.00 0.51 0.00 0.00 43.02 39.56 1rml s PHE 36 CO 0.50 -0.96 0.78 1.28 0.70 0.00 0.00 175.22 177.52 1rml n LEU 37 N 4.48 -0.35 -4.36 -0.37 4.77 -1.23 -3.13 117.00 116.81 1rml n LEU 37 Ca -0.02 1.00 -0.18 0.00 -0.03 0.00 0.00 56.01 56.78 1rml n LEU 37 Cb 0.41 -0.81 -0.10 0.00 -2.33 0.00 0.00 43.42 40.58 1rml n LEU 37 CO 0.37 -1.96 -0.27 0.00 -1.33 0.00 0.00 177.39 174.20 1rml s ARG 38 N -0.27 1.48 -0.08 3.23 1.70 0.16 -4.48 118.95 120.68 1rml s ARG 38 Ca 0.72 -1.80 -0.03 0.00 -0.47 0.00 0.00 55.73 54.15 1rml s ARG 38 Cb -1.01 -0.53 0.04 0.00 -0.57 0.00 0.00 34.95 32.88 1rml s ARG 38 CO 0.49 -0.22 0.08 -1.50 -1.08 0.00 0.00 175.30 173.07 1rml s ILE 39 N -3.54 -0.12 0.17 4.99 2.07 -0.91 -2.89 121.20 120.97 1rml s ILE 39 Ca 0.36 0.24 -0.23 0.00 -1.41 0.00 0.00 60.65 59.61 1rml s ILE 39 Cb 0.08 -0.30 -0.08 0.00 0.13 0.00 0.00 42.46 42.29 1rml s ILE 39 CO 0.13 0.03 0.74 -0.76 -1.91 0.00 0.00 174.94 173.17 1rml s LEU 40 N 2.17 4.50 0.00 8.50 1.43 -0.58 -4.62 118.68 130.08 1rml s LEU 40 Ca 0.04 1.53 0.00 0.00 -1.03 0.00 0.00 54.13 54.67 1rml s LEU 40 Cb -0.13 -3.35 0.00 0.00 0.03 0.00 0.00 46.19 42.74 1rml s LEU 40 CO -0.05 0.16 0.72 -0.81 0.23 0.00 0.00 176.35 176.59 1rml n PRO 41 N 1.31 0.75 -0.04 1.29 -0.04 -1.26 -2.33 135.00 134.67 1rml n PRO 41 Ca -0.05 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.35 1rml n PRO 41 Cb 0.50 -1.03 -0.14 0.00 -0.04 0.00 0.00 33.50 32.79 1rml n PRO 41 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1rml n ASP 42 N -0.45 0.48 0.00 3.54 8.00 -1.26 -4.97 116.55 121.90 1rml n ASP 42 Ca 0.00 0.22 0.00 0.00 0.71 0.00 0.00 54.79 55.72 1rml n ASP 42 Cb 0.02 0.51 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 1rml n ASP 42 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rml n GLY 43 N 1.58 1.86 3.16 0.44 0.00 -0.99 -5.12 105.19 106.13 1rml n GLY 43 Ca -0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 1rml n GLY 43 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rml s THR 44 N -2.00 1.84 0.36 2.61 2.01 -1.25 -4.73 115.64 114.48 1rml s THR 44 Ca 0.00 -0.88 0.08 0.00 0.31 0.00 0.00 61.69 61.20 1rml s THR 44 Cb 0.00 -1.62 -0.03 0.00 0.01 0.00 0.00 72.50 70.86 1rml s THR 44 CO 0.00 0.51 0.31 0.54 -0.69 0.00 0.00 174.62 175.29 1rml s VAL 45 N 0.58 3.19 -2.54 3.82 0.11 -1.26 -1.53 120.40 122.76 1rml s VAL 45 Ca -0.14 -1.39 0.00 0.00 -2.93 0.00 0.00 61.98 57.51 1rml s VAL 45 Cb -0.17 -3.10 0.00 0.00 -1.53 0.00 0.00 36.38 31.58 1rml s VAL 45 CO 0.04 -0.12 0.00 -0.90 -3.33 0.00 0.00 175.10 170.80 1rml n ASP 46 N -1.41 0.00 -4.23 3.54 5.68 -1.14 -4.84 116.55 114.14 1rml n ASP 46 Ca -0.00 0.00 -0.20 0.00 -0.50 0.00 0.00 54.79 54.08 1rml n ASP 46 Cb 0.61 0.00 -0.12 0.00 -1.14 0.00 0.00 41.12 40.47 1rml n ASP 46 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1rml s GLY 47 N 0.00 1.07 -0.12 6.12 0.00 -1.26 0.40 107.32 113.53 1rml s GLY 47 Ca 0.00 -1.17 0.01 0.00 0.00 0.00 0.00 44.72 43.56 1rml s GLY 47 CO 0.00 -1.19 -0.13 -1.59 0.00 0.00 0.00 173.10 170.18 1rml s THR 48 N -1.43 1.42 0.38 0.90 2.01 -1.18 -4.20 115.64 113.53 1rml s THR 48 Ca 0.04 -0.57 0.30 0.00 0.31 0.00 0.00 61.69 61.78 1rml s THR 48 Cb -0.09 -1.33 0.46 0.00 0.01 0.00 0.00 72.50 71.55 1rml s THR 48 CO 0.03 0.43 1.25 -1.14 -0.69 0.00 0.00 174.62 174.51 1rml n ARG 49 N 4.51 -0.02 -3.53 4.92 0.63 -1.26 0.18 116.66 122.08 1rml n ARG 49 Ca -0.17 0.97 -0.08 0.00 -0.92 0.00 0.00 57.85 57.64 1rml n ARG 49 Cb 0.51 -1.99 -0.09 0.00 0.45 0.00 0.00 32.46 31.34 1rml n ARG 49 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1rml s ASP 50 N -4.20 -0.16 -0.23 6.15 1.11 -1.26 -3.23 116.67 114.85 1rml s ASP 50 Ca -0.05 0.75 -0.05 0.00 0.18 0.00 0.00 52.55 53.38 1rml s ASP 50 Cb 0.24 1.33 -0.07 0.00 1.07 0.00 0.00 42.92 45.49 1rml s ASP 50 CO 0.68 -0.25 0.56 -2.11 1.18 0.00 0.00 175.17 175.22 1rml n ARG 51 N 5.39 0.00 -2.26 8.23 0.00 -1.24 -4.69 116.66 122.08 1rml n ARG 51 Ca -0.07 0.00 -0.17 0.00 -0.00 0.00 0.00 57.85 57.61 1rml n ARG 51 Cb 0.50 -0.29 0.03 0.00 -0.00 0.00 0.00 32.46 32.70 1rml n ARG 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 1rml n SER 52 N 1.84 3.97 -3.86 2.89 3.41 -1.26 -5.03 113.62 115.58 1rml n SER 52 Ca 0.16 -3.26 -0.12 0.00 -0.26 0.00 0.00 58.87 55.39 1rml n SER 52 Cb 0.02 -0.38 -0.12 0.00 -0.26 0.00 0.00 64.21 63.47 1rml n SER 52 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1rml s ASP 53 N -3.66 -0.04 0.01 4.04 2.15 -1.26 -5.01 116.67 112.91 1rml s ASP 53 Ca 0.44 0.02 0.05 0.00 0.43 0.00 0.00 52.55 53.49 1rml s ASP 53 Cb 0.39 0.23 0.23 0.00 -0.30 0.00 0.00 42.92 43.46 1rml s ASP 53 CO 0.01 -0.18 1.17 0.00 -0.17 0.00 0.00 175.17 176.00 1rml n GLN 54 N 2.34 0.01 -3.43 4.34 0.00 -1.26 -3.80 117.38 115.57 1rml n GLN 54 Ca -0.17 0.43 -0.23 0.00 0.00 0.00 0.00 57.00 57.03 1rml n GLN 54 Cb 0.57 -1.52 -0.11 0.00 0.00 0.00 0.00 30.24 29.19 1rml n GLN 54 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.06 173.68 1rml s HIS 55 N -3.02 0.15 0.00 2.61 -3.43 -1.26 -4.92 115.29 105.42 1rml s HIS 55 Ca 0.02 -1.05 0.00 0.00 -0.80 0.00 0.00 55.06 53.23 1rml s HIS 55 Cb 0.03 -0.68 0.00 0.00 -1.43 0.00 0.00 32.58 30.50 1rml s HIS 55 CO 0.09 -0.89 0.58 0.44 -2.00 0.00 0.00 174.74 172.95 1rml n ILE 56 N 4.46 0.33 -2.10 -5.38 -0.00 -1.25 -2.15 119.36 113.27 1rml n ILE 56 Ca 0.07 -0.42 -0.33 0.00 -0.00 0.00 0.00 62.75 62.08 1rml n ILE 56 Cb 0.42 1.01 0.00 0.00 -0.00 0.00 0.00 39.64 41.07 1rml n ILE 56 CO 0.00 0.00 0.00 -1.10 -0.00 0.00 0.00 176.55 175.45 1rml s GLN 57 N -0.33 3.42 0.25 6.28 -0.21 -1.26 -4.27 119.66 123.54 1rml s GLN 57 Ca 0.00 1.16 -0.05 0.00 0.02 0.00 0.00 55.36 56.49 1rml s GLN 57 Cb 0.00 -2.05 -0.02 0.00 1.00 0.00 0.00 33.01 31.94 1rml s GLN 57 CO 0.00 -0.73 0.32 -0.51 -2.12 0.00 0.00 175.29 172.25 1rml s LEU 58 N -4.43 0.85 -0.28 2.90 1.02 -1.25 -4.58 118.68 112.91 1rml s LEU 58 Ca 0.63 -1.25 -0.24 0.00 0.02 0.00 0.00 54.13 53.29 1rml s LEU 58 Cb -0.15 1.07 0.10 0.00 0.02 0.00 0.00 46.19 47.23 1rml s LEU 58 CO 0.36 -1.03 0.89 -1.58 0.02 0.00 0.00 176.35 175.01 1rml s GLN 59 N -3.91 0.63 0.26 1.70 2.00 -0.34 -4.53 119.66 115.46 1rml s GLN 59 Ca 0.32 0.80 0.06 0.00 -2.00 0.00 0.00 55.36 54.53 1rml s GLN 59 Cb 0.03 0.28 -0.03 0.00 0.80 0.00 0.00 33.01 34.09 1rml s GLN 59 CO 0.13 -0.08 0.33 -0.51 -0.50 0.00 0.00 175.29 174.66 1rml s LEU 60 N 0.49 4.14 -0.35 3.68 1.02 -1.26 0.20 118.68 126.59 1rml s LEU 60 Ca 0.00 -0.06 0.14 0.00 0.02 0.00 0.00 54.13 54.24 1rml s LEU 60 Cb -0.05 -2.71 0.43 0.00 0.02 0.00 0.00 46.19 43.88 1rml s LEU 60 CO -0.05 -0.12 1.07 -0.24 0.02 0.00 0.00 176.35 177.03 1rml n SER 61 N -1.38 0.23 -4.33 2.29 2.88 -0.32 -4.80 113.62 108.18 1rml n SER 61 Ca -0.07 -2.68 -0.60 0.00 -1.33 0.00 0.00 58.87 54.19 1rml n SER 61 Cb 0.57 0.03 -0.08 0.00 -0.75 0.00 0.00 64.21 63.98 1rml n SER 61 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1rml n ALA 62 N -0.19 -2.34 0.28 -1.46 0.00 -1.26 -3.03 120.51 112.50 1rml n ALA 62 Ca 0.06 0.51 0.03 0.00 0.00 0.00 0.00 53.44 54.05 1rml n ALA 62 Cb 0.82 -1.72 0.02 0.00 0.00 0.00 0.00 19.45 18.56 1rml n ALA 62 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1rml n GLU 63 N 2.60 0.92 0.00 0.00 0.28 -1.24 -4.82 120.64 118.38 1rml n GLU 63 Ca 0.24 -0.72 0.00 0.00 -0.16 0.00 0.00 57.16 56.52 1rml n GLU 63 Cb 0.01 -1.06 0.00 0.00 1.43 0.00 0.00 31.44 31.82 1rml n GLU 63 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1rml n SER 64 N 0.08 0.00 -4.83 -1.84 7.64 -1.02 -5.04 113.62 108.60 1rml n SER 64 Ca 0.03 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.59 1rml n SER 64 Cb 0.15 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.29 1rml n SER 64 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1rml s VAL 65 N -2.00 4.47 -1.95 0.44 -7.23 -1.26 -3.46 120.40 109.41 1rml s VAL 65 Ca 0.00 1.33 0.00 0.00 -1.81 0.00 0.00 61.98 61.50 1rml s VAL 65 Cb 0.00 -3.62 0.00 0.00 0.56 0.00 0.00 36.38 33.32 1rml s VAL 65 CO 0.00 -0.34 0.00 0.61 -0.31 0.00 0.00 175.10 175.06 1rml n GLY 66 N -0.70 1.47 3.31 2.32 0.00 -1.23 -4.87 105.19 105.48 1rml n GLY 66 Ca 0.06 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.11 1rml n GLY 66 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1rml s GLU 67 N -3.81 0.14 0.13 1.61 1.03 -1.22 -3.82 118.70 112.77 1rml s GLU 67 Ca 0.00 0.34 -0.01 0.00 0.03 0.00 0.00 54.97 55.34 1rml s GLU 67 Cb 0.00 0.19 -0.04 0.00 -0.80 0.00 0.00 34.13 33.48 1rml s GLU 67 CO 0.00 -0.05 0.06 0.14 -1.33 0.00 0.00 175.26 174.08 1rml s VAL 68 N 2.11 0.11 0.53 1.83 -7.23 -0.28 -2.44 120.40 115.02 1rml s VAL 68 Ca -0.01 -1.92 0.08 0.00 -1.81 0.00 0.00 61.98 58.32 1rml s VAL 68 Cb -0.03 -2.06 0.05 0.00 0.56 0.00 0.00 36.38 34.90 1rml s VAL 68 CO -0.16 -0.45 0.62 -0.31 -0.31 0.00 0.00 175.10 174.49 1rml s TYR 69 N -4.05 1.82 -0.26 2.82 2.02 -1.17 0.12 117.35 118.66 1rml s TYR 69 Ca 0.25 -0.68 -0.13 0.00 -0.37 0.00 0.00 57.07 56.14 1rml s TYR 69 Cb 0.07 -2.16 0.09 0.00 -0.40 0.00 0.00 41.96 39.56 1rml s TYR 69 CO 0.02 -0.77 0.61 0.42 -1.57 0.00 0.00 175.55 174.27 1rml s ILE 70 N -2.62 -0.22 -0.05 2.71 1.01 -1.26 -1.18 121.20 119.60 1rml s ILE 70 Ca 0.53 0.03 -0.00 0.00 0.00 0.00 0.00 60.65 61.20 1rml s ILE 70 Cb -0.05 -0.90 0.03 0.00 0.01 0.00 0.00 42.46 41.54 1rml s ILE 70 CO 0.33 0.01 -0.00 -0.75 0.00 0.00 0.00 174.94 174.53 1rml s LYS 71 N 1.88 0.46 -1.42 2.79 2.20 0.55 0.28 119.74 126.47 1rml s LYS 71 Ca -0.09 0.09 -0.15 0.00 -0.36 0.00 0.00 55.97 55.46 1rml s LYS 71 Cb -0.07 -0.72 0.05 0.00 -1.51 0.00 0.00 37.83 35.57 1rml s LYS 71 CO -0.18 -0.21 2.11 0.45 -0.36 0.00 0.00 175.35 177.16 1rml n SER 72 N 4.61 4.13 -3.91 1.43 2.88 -1.17 -1.20 113.62 120.40 1rml n SER 72 Ca -0.17 -2.86 -0.28 0.00 -1.33 0.00 0.00 58.87 54.23 1rml n SER 72 Cb 0.50 -1.68 -0.16 0.00 -0.75 0.00 0.00 64.21 62.12 1rml n SER 72 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1rml n THR 73 N 5.38 0.00 0.00 2.46 5.66 -1.26 -2.74 114.28 123.78 1rml n THR 73 Ca 0.51 -0.20 0.00 0.00 -3.05 0.00 0.00 64.05 61.31 1rml n THR 73 Cb 0.41 -0.23 0.00 0.00 -1.55 0.00 0.00 70.33 68.96 1rml n THR 73 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1rml n GLU 74 N 6.15 0.00 0.00 1.09 0.00 -1.26 -4.85 120.64 121.78 1rml n GLU 74 Ca 0.58 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.74 1rml n GLU 74 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.51 1rml n GLU 74 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1rml n THR 75 N 0.00 0.00 -2.68 6.31 -2.24 -1.11 -5.08 114.28 109.48 1rml n THR 75 Ca 0.00 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.73 1rml n THR 75 Cb 0.00 0.00 0.09 0.00 -2.10 0.00 0.00 70.33 68.32 1rml n THR 75 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rml n GLY 76 N 5.00 -0.76 3.47 3.38 0.00 -1.26 -5.10 105.19 109.92 1rml n GLY 76 Ca 0.00 0.50 -0.15 0.00 0.00 0.00 0.00 46.02 46.37 1rml n GLY 76 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rml s GLN 77 N 0.10 1.16 -0.09 1.61 -0.21 -1.26 -4.71 119.66 116.25 1rml s GLN 77 Ca 0.19 -0.07 0.01 0.00 0.02 0.00 0.00 55.36 55.50 1rml s GLN 77 Cb 0.27 0.54 -0.02 0.00 1.00 0.00 0.00 33.01 34.80 1rml s GLN 77 CO -0.14 -0.43 -0.12 0.71 -2.12 0.00 0.00 175.29 173.18 1rml s TYR 78 N -2.35 2.79 0.44 0.91 1.51 -1.04 -3.06 117.35 116.55 1rml s TYR 78 Ca -0.06 -0.38 -0.22 0.00 -1.01 0.00 0.00 57.07 55.41 1rml s TYR 78 Cb -0.00 -1.76 -0.12 0.00 -0.11 0.00 0.00 41.96 39.97 1rml s TYR 78 CO -0.00 0.00 0.56 -0.11 -1.11 0.00 0.00 175.55 174.89 1rml n LEU 79 N 2.94 0.17 -3.83 -1.29 7.94 0.14 0.67 117.00 123.74 1rml n LEU 79 Ca -0.18 0.90 -0.05 0.00 -1.11 0.00 0.00 56.01 55.57 1rml n LEU 79 Cb 0.52 -1.13 0.01 0.00 0.53 0.00 0.00 43.42 43.35 1rml n LEU 79 CO 0.28 -2.84 0.71 0.00 -1.11 0.00 0.00 177.39 174.43 1rml s ALA 80 N -1.49 -1.39 -0.13 1.96 0.00 0.44 -4.58 121.76 116.57 1rml s ALA 80 Ca 0.64 -0.32 -0.04 0.00 0.00 0.00 0.00 51.96 52.24 1rml s ALA 80 Cb -0.58 0.72 0.06 0.00 0.00 0.00 0.00 23.12 23.31 1rml s ALA 80 CO 0.58 -1.04 0.11 1.41 0.00 0.00 0.00 175.76 176.82 1rml s MET 81 N -2.58 0.04 1.17 0.00 1.75 -1.26 0.22 119.30 118.64 1rml s MET 81 Ca 0.17 0.16 -0.19 0.00 -1.25 0.00 0.00 55.69 54.58 1rml s MET 81 Cb -0.03 -1.21 0.28 0.00 2.84 0.00 0.00 34.83 36.71 1rml s MET 81 CO 0.06 -0.54 1.16 -0.51 -0.65 0.00 0.00 175.02 174.54 1rml s ASP 82 N 2.20 1.25 0.24 1.11 1.01 -1.24 -4.71 116.67 116.54 1rml s ASP 82 Ca 0.04 0.50 0.17 0.00 0.71 0.00 0.00 52.55 53.97 1rml s ASP 82 Cb -0.14 -0.66 0.91 0.00 1.01 0.00 0.00 42.92 44.03 1rml s ASP 82 CO -0.08 -3.91 1.53 0.41 0.21 0.00 0.00 175.17 173.34 1rml n THR 83 N -4.59 1.21 0.84 -1.27 -1.04 -1.26 -0.04 114.28 108.13 1rml n THR 83 Ca 0.14 0.64 0.04 0.00 -2.04 0.00 0.00 64.05 62.83 1rml n THR 83 Cb 0.60 -1.62 0.14 0.00 -1.82 0.00 0.00 70.33 67.62 1rml n THR 83 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1rml n ASP 84 N -2.09 1.92 -2.11 8.00 2.03 -1.26 -4.86 116.55 118.19 1rml n ASP 84 Ca -0.01 -2.10 -0.07 0.00 0.52 0.00 0.00 54.79 53.13 1rml n ASP 84 Cb 0.05 -0.30 -0.01 0.00 -0.72 0.00 0.00 41.12 40.13 1rml n ASP 84 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1rml n GLY 85 N 0.76 -0.17 3.31 0.27 0.00 0.94 -3.56 105.19 106.73 1rml n GLY 85 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1rml n GLY 85 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1rml s LEU 86 N -4.65 4.47 0.14 0.99 0.20 -1.26 -1.83 118.68 116.73 1rml s LEU 86 Ca 0.00 -1.08 -0.31 0.00 0.69 0.00 0.00 54.13 53.43 1rml s LEU 86 Cb 0.00 -1.93 -0.18 0.00 -0.43 0.00 0.00 46.19 43.65 1rml s LEU 86 CO 0.00 -0.35 0.68 0.18 -0.29 0.00 0.00 176.35 176.57 1rml n LEU 87 N 4.88 -0.85 -3.57 -0.68 4.32 -1.26 -3.60 117.00 116.24 1rml n LEU 87 Ca -0.12 1.12 -0.14 0.00 -0.02 0.00 0.00 56.01 56.85 1rml n LEU 87 Cb 0.45 -0.93 -0.06 0.00 -1.62 0.00 0.00 43.42 41.26 1rml n LEU 87 CO 0.33 -2.62 0.56 -0.72 -1.22 0.00 0.00 177.39 173.72 1rml s TYR 88 N -0.68 -0.59 0.28 -1.77 1.13 0.58 -4.34 117.35 111.96 1rml s TYR 88 Ca 0.71 1.16 -0.28 0.00 -1.41 0.00 0.00 57.07 57.25 1rml s TYR 88 Cb -1.02 0.39 -0.09 0.00 -1.10 0.00 0.00 41.96 40.13 1rml s TYR 88 CO 0.56 -0.45 0.95 0.20 -2.51 0.00 0.00 175.55 174.29 1rml s GLY 89 N -0.71 2.97 -0.07 5.49 0.00 -1.26 0.16 107.32 113.91 1rml s GLY 89 Ca -0.05 0.58 -0.01 0.00 0.00 0.00 0.00 44.72 45.25 1rml s GLY 89 CO 0.04 1.10 -0.02 -0.45 0.00 0.00 0.00 173.10 173.77 1rml s SER 90 N -1.37 1.50 0.00 1.64 0.15 0.21 -4.80 113.70 111.03 1rml s SER 90 Ca 0.45 -0.13 0.25 0.00 0.70 0.00 0.00 55.95 57.22 1rml s SER 90 Cb -0.23 -0.50 1.48 0.00 -1.71 0.00 0.00 66.02 65.06 1rml s SER 90 CO 0.28 -0.15 1.84 1.67 1.20 0.00 0.00 173.24 178.09 1rml n GLN 91 N 4.82 0.77 -3.82 5.44 7.27 -1.26 -2.49 117.38 128.11 1rml n GLN 91 Ca -0.13 0.00 -0.34 0.00 0.07 0.00 0.00 57.00 56.60 1rml n GLN 91 Cb 0.50 -1.50 -0.12 0.00 2.41 0.00 0.00 30.24 31.53 1rml n GLN 91 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 1rml s THR 92 N -2.01 3.18 -0.54 1.69 -4.23 -1.26 -4.98 115.64 107.49 1rml s THR 92 Ca 0.37 -2.65 -0.28 0.00 -1.18 0.00 0.00 61.69 57.96 1rml s THR 92 Cb 0.17 -3.16 0.01 0.00 1.34 0.00 0.00 72.50 70.86 1rml s THR 92 CO 0.29 -0.76 1.48 -2.16 -0.54 0.00 0.00 174.62 172.93 1rml s PRO 93 N 0.42 3.27 0.00 3.99 0.04 -1.26 -4.50 135.00 136.96 1rml s PRO 93 Ca 0.13 0.58 0.00 0.00 0.04 0.00 0.00 61.00 61.76 1rml s PRO 93 Cb -0.22 -4.14 0.00 0.00 0.04 0.00 0.00 34.50 30.18 1rml s PRO 93 CO -0.04 -1.97 0.00 0.09 0.04 0.00 0.00 177.00 175.12 1rml n ASN 94 N 9.84 0.00 -3.48 6.66 3.02 -1.26 -5.00 115.26 125.05 1rml n ASN 94 Ca 0.14 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.32 1rml n ASN 94 Cb 0.49 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.60 1rml n ASN 94 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1rml n GLU 95 N 0.00 1.06 0.05 3.52 4.71 -1.26 -2.65 120.64 126.07 1rml n GLU 95 Ca 0.00 -1.46 0.00 0.00 -0.01 0.00 0.00 57.16 55.69 1rml n GLU 95 Cb 0.00 -2.67 0.00 0.00 -1.01 0.00 0.00 31.44 27.76 1rml n GLU 95 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 1rml n GLU 96 N 6.72 0.00 0.24 3.49 2.13 -1.26 -4.65 120.64 127.31 1rml n GLU 96 Ca 0.44 0.00 0.10 0.00 0.66 0.00 0.00 57.16 58.36 1rml n GLU 96 Cb 0.34 0.00 0.62 0.00 0.27 0.00 0.00 31.44 32.67 1rml n GLU 96 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1rml n LEU 98 N -3.83 -1.26 -3.48 0.00 7.99 -1.16 -4.43 117.00 110.83 1rml n LEU 98 Ca -0.02 0.15 -0.21 0.00 -0.01 0.00 0.00 56.01 55.92 1rml n LEU 98 Cb 0.27 -1.09 -0.13 0.00 -0.11 0.00 0.00 43.42 42.36 1rml n LEU 98 CO 0.33 -3.50 -0.23 -0.36 -1.51 0.00 0.00 177.39 172.12 1rml s PHE 99 N -2.32 -0.18 -0.73 -1.77 0.08 0.32 -3.58 117.98 109.80 1rml s PHE 99 Ca 0.56 -0.17 -0.25 0.00 0.12 0.00 0.00 56.93 57.18 1rml s PHE 99 Cb -0.17 -0.53 -0.15 0.00 -0.57 0.00 0.00 43.02 41.60 1rml s PHE 99 CO 0.67 -0.74 2.45 1.28 -0.10 0.00 0.00 175.22 178.78 1rml n LEU 100 N 5.30 1.33 -4.93 -0.37 4.77 0.12 -1.12 117.00 122.09 1rml n LEU 100 Ca -0.05 -0.58 -0.25 0.00 -0.03 0.00 0.00 56.01 55.10 1rml n LEU 100 Cb 0.47 -1.34 0.01 0.00 -2.33 0.00 0.00 43.42 40.24 1rml n LEU 100 CO 0.05 -1.60 0.40 -0.70 -1.33 0.00 0.00 177.39 174.21 1rml s GLU 101 N 8.45 3.17 0.00 3.23 2.12 -1.25 -0.05 118.70 134.38 1rml s GLU 101 Ca 1.09 -0.14 0.00 0.00 0.36 0.00 0.00 54.97 56.29 1rml s GLU 101 Cb -0.49 -2.42 0.00 0.00 0.26 0.00 0.00 34.13 31.48 1rml s GLU 101 CO 0.31 -0.36 0.00 2.89 -0.54 0.00 0.00 175.26 177.56 1rml n ARG 102 N -2.27 0.00 -0.83 4.30 1.85 -0.67 -3.57 116.66 115.47 1rml n ARG 102 Ca 0.02 0.00 -0.20 0.00 -1.00 0.00 0.00 57.85 56.67 1rml n ARG 102 Cb 0.57 0.00 -0.10 0.00 -1.05 0.00 0.00 32.46 31.88 1rml n ARG 102 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 1rml n LEU 103 N 0.00 -0.12 0.36 2.89 0.00 -1.26 -4.31 117.00 114.56 1rml n LEU 103 Ca 0.00 -0.01 -0.16 0.00 0.00 0.00 0.00 56.01 55.83 1rml n LEU 103 Cb 0.00 -0.45 -0.08 0.00 0.00 0.00 0.00 43.42 42.89 1rml n LEU 103 CO 0.00 -0.51 0.51 -0.08 0.00 0.00 0.00 177.39 177.31 1rml h GLU 104 N 6.47 -0.89 0.00 1.96 4.22 -1.87 -3.45 114.58 121.01 1rml h GLU 104 Ca -0.01 0.06 0.00 0.00 0.08 0.00 0.00 59.36 59.49 1rml h GLU 104 Cb 0.69 0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.15 1rml h GLU 104 CO 0.80 -0.56 0.00 -1.91 -2.18 0.00 0.00 179.01 175.16 1rml n GLU 105 N -5.43 0.00 -2.77 1.92 2.13 -1.26 -5.03 120.64 110.20 1rml n GLU 105 Ca -0.13 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.66 1rml n GLU 105 Cb 0.38 0.00 0.05 0.00 0.27 0.00 0.00 31.44 32.15 1rml n GLU 105 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1rml n ASN 106 N 0.00 1.20 0.00 4.31 5.15 -1.26 -4.94 115.26 119.71 1rml n ASN 106 Ca 0.00 -2.25 0.00 0.00 -0.60 0.00 0.00 54.58 51.73 1rml n ASN 106 Cb 0.00 -0.36 0.00 0.00 -0.53 0.00 0.00 39.78 38.89 1rml n ASN 106 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 1rml n HIS 107 N -0.51 -0.67 -0.63 1.20 8.25 -1.26 -5.15 115.22 116.45 1rml n HIS 107 Ca 0.05 0.01 -0.19 0.00 -0.26 0.00 0.00 57.72 57.34 1rml n HIS 107 Cb 0.81 0.15 0.11 0.00 1.12 0.00 0.00 29.99 32.18 1rml n HIS 107 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1rml n TYR 108 N -1.77 -1.94 -3.10 4.41 4.01 -1.26 -4.98 117.16 112.52 1rml n TYR 108 Ca 0.00 0.20 -0.17 0.00 -0.16 0.00 0.00 57.90 57.78 1rml n TYR 108 Cb 0.00 -1.40 -0.01 0.00 -0.31 0.00 0.00 39.34 37.61 1rml n TYR 108 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1rml n ASN 109 N -0.01 0.16 -4.60 7.72 5.03 -1.22 -4.36 115.26 117.98 1rml n ASN 109 Ca 0.03 -3.10 -0.52 0.00 0.87 0.00 0.00 54.58 51.87 1rml n ASN 109 Cb 0.36 -0.15 -0.06 0.00 -1.02 0.00 0.00 39.78 38.92 1rml n ASN 109 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1rml n THR 110 N 0.44 0.02 -4.09 3.41 -2.24 -1.26 -4.62 114.28 105.93 1rml n THR 110 Ca 0.21 -0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.71 1rml n THR 110 Cb 0.65 -0.91 -0.02 0.00 -2.10 0.00 0.00 70.33 67.95 1rml n THR 110 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1rml s TYR 111 N 0.68 1.58 -0.20 4.78 1.51 -1.25 -1.67 117.35 122.77 1rml s TYR 111 Ca 0.85 -0.90 -0.16 0.00 -1.01 0.00 0.00 57.07 55.85 1rml s TYR 111 Cb -0.93 -1.83 0.06 0.00 -0.11 0.00 0.00 41.96 39.15 1rml s TYR 111 CO 0.47 -0.36 0.53 0.42 -1.11 0.00 0.00 175.55 175.50 1rml s ILE 112 N -2.82 -0.01 -0.89 2.71 1.01 0.93 -3.03 121.20 119.10 1rml s ILE 112 Ca 0.26 0.02 -0.30 0.00 0.00 0.00 0.00 60.65 60.63 1rml s ILE 112 Cb -0.02 -0.75 -0.19 0.00 0.01 0.00 0.00 42.46 41.51 1rml s ILE 112 CO 0.16 0.01 2.64 -0.24 0.00 0.00 0.00 174.94 177.51 1rml n SER 113 N 3.36 0.71 0.00 3.58 2.88 0.59 0.12 113.62 124.86 1rml n SER 113 Ca -0.17 0.03 0.06 0.00 -1.33 0.00 0.00 58.87 57.47 1rml n SER 113 Cb 0.56 -1.06 0.29 0.00 -0.75 0.00 0.00 64.21 63.25 1rml n SER 113 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1rml n LYS 114 N 8.60 0.04 0.07 -1.46 0.00 -1.24 0.51 118.16 124.68 1rml n LYS 114 Ca 0.60 0.26 0.13 0.00 0.00 0.00 0.00 58.31 59.29 1rml n LYS 114 Cb 0.14 -1.50 0.34 0.00 0.00 0.00 0.00 35.03 34.01 1rml n LYS 114 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 1rml n LYS 115 N -1.46 0.21 -2.67 1.64 4.81 -1.26 -4.48 118.16 114.96 1rml n LYS 115 Ca 0.04 0.12 -0.04 0.00 -0.87 0.00 0.00 58.31 57.56 1rml n LYS 115 Cb 0.14 -1.69 0.10 0.00 0.02 0.00 0.00 35.03 33.60 1rml n LYS 115 CO 0.00 0.00 0.00 -2.39 1.17 0.00 0.00 177.40 176.18 1rml n HIS 116 N -2.03 -0.81 0.98 5.64 1.44 -0.14 -4.98 115.22 115.32 1rml n HIS 116 Ca 0.05 -0.92 0.10 0.00 -2.01 0.00 0.00 57.72 54.93 1rml n HIS 116 Cb 0.41 1.23 0.51 0.00 0.12 0.00 0.00 29.99 32.26 1rml n HIS 116 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1rml n ALA 117 N 0.70 2.07 0.20 1.59 0.00 0.18 -2.71 120.51 122.55 1rml n ALA 117 Ca -0.03 -0.10 0.04 0.00 0.00 0.00 0.00 53.44 53.35 1rml n ALA 117 Cb 0.74 -1.32 0.16 0.00 0.00 0.00 0.00 19.45 19.03 1rml n ALA 117 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1rml n GLU 118 N -1.23 0.02 -0.05 0.00 0.28 -1.26 -0.07 120.64 118.33 1rml n GLU 118 Ca 0.10 0.42 0.03 0.00 -0.16 0.00 0.00 57.16 57.55 1rml n GLU 118 Cb 0.14 -1.54 0.05 0.00 1.43 0.00 0.00 31.44 31.52 1rml n GLU 118 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1rml n LYS 119 N -1.57 1.47 -3.67 3.44 4.81 -1.10 -4.97 118.16 116.56 1rml n LYS 119 Ca 0.01 -1.34 -0.27 0.00 -0.87 0.00 0.00 58.31 55.85 1rml n LYS 119 Cb 0.07 -1.12 0.04 0.00 0.02 0.00 0.00 35.03 34.04 1rml n LYS 119 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1rml n ASN 120 N 0.15 -5.44 -4.56 3.14 5.03 0.90 -4.82 115.26 109.66 1rml n ASN 120 Ca 0.05 -0.61 -0.31 0.00 0.87 0.00 0.00 54.58 54.57 1rml n ASN 120 Cb 0.25 -4.33 -0.04 0.00 -1.02 0.00 0.00 39.78 34.63 1rml n ASN 120 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 1rml s TRP 121 N -3.26 1.86 1.07 3.10 0.51 -1.25 -4.06 118.94 116.90 1rml s TRP 121 Ca 0.58 0.51 -0.18 0.00 -2.12 0.00 0.00 56.10 54.89 1rml s TRP 121 Cb -0.28 -4.13 0.24 0.00 -0.81 0.00 0.00 33.47 28.49 1rml s TRP 121 CO 0.72 -1.90 1.23 -0.06 -0.51 0.00 0.00 176.95 176.43 1rml s PHE 122 N 9.24 1.08 -0.43 -1.98 0.40 0.67 0.22 117.98 127.18 1rml s PHE 122 Ca 0.66 0.39 0.03 0.00 -0.60 0.00 0.00 56.93 57.41 1rml s PHE 122 Cb -0.07 -3.84 0.12 0.00 0.51 0.00 0.00 43.02 39.74 1rml s PHE 122 CO 0.04 -3.21 0.17 0.54 0.70 0.00 0.00 175.22 173.45 1rml s VAL 123 N -3.51 2.58 0.28 -0.44 0.11 -1.17 -4.65 120.40 113.61 1rml s VAL 123 Ca 0.73 -2.72 -0.03 0.00 -2.93 0.00 0.00 61.98 57.02 1rml s VAL 123 Cb -0.06 -2.83 -0.02 0.00 -1.53 0.00 0.00 36.38 31.94 1rml s VAL 123 CO 0.54 -0.70 0.35 -0.83 -3.33 0.00 0.00 175.10 171.14 1rml s GLY 124 N 0.53 1.39 -0.10 6.54 0.00 -1.26 -4.74 107.32 109.68 1rml s GLY 124 Ca 0.13 -1.51 -0.02 0.00 0.00 0.00 0.00 44.72 43.33 1rml s GLY 124 CO -0.04 -1.09 0.01 1.08 0.00 0.00 0.00 173.10 173.05 1rml s LEU 125 N -3.19 0.70 -0.04 0.66 1.02 -1.23 -3.35 118.68 113.26 1rml s LEU 125 Ca 0.32 -0.23 -0.28 0.00 0.02 0.00 0.00 54.13 53.97 1rml s LEU 125 Cb 0.02 -0.47 -0.14 0.00 0.02 0.00 0.00 46.19 45.62 1rml s LEU 125 CO 0.17 -0.21 0.77 1.17 0.02 0.00 0.00 176.35 178.26 1rml n LYS 126 N 5.13 0.00 -0.45 1.70 4.81 -0.24 -4.55 118.16 124.55 1rml n LYS 126 Ca -0.08 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.24 1rml n LYS 126 Cb 0.49 -1.02 -0.02 0.00 0.02 0.00 0.00 35.03 34.50 1rml n LYS 126 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 1rml n LYS 127 N 1.21 1.25 0.00 1.64 -0.00 -1.26 -2.19 118.16 118.80 1rml n LYS 127 Ca 0.14 -1.02 0.00 0.00 -0.00 0.00 0.00 58.31 57.44 1rml n LYS 127 Cb 0.04 -2.22 0.00 0.00 -0.00 0.00 0.00 35.03 32.86 1rml n LYS 127 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1rml n ASN 128 N 4.31 0.00 0.00 -5.58 3.02 -1.26 -4.88 115.26 110.87 1rml n ASN 128 Ca 0.27 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.82 1rml n ASN 128 Cb 0.11 0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.38 1rml n ASN 128 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rml n GLY 129 N 0.13 -0.14 0.00 7.41 0.00 -0.93 -4.87 105.19 106.79 1rml n GLY 129 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1rml n GLY 129 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rml n SER 130 N 0.00 0.00 -3.29 1.61 7.64 -1.25 -4.98 113.62 113.34 1rml n SER 130 Ca 0.00 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.73 1rml n SER 130 Cb 0.00 0.00 0.14 0.00 -1.01 0.00 0.00 64.21 63.34 1rml n SER 130 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rml s LYS 132 N -3.46 2.15 0.13 0.00 2.47 -1.21 -4.25 119.74 115.56 1rml s LYS 132 Ca 0.32 -2.12 0.06 0.00 -1.56 0.00 0.00 55.97 52.68 1rml s LYS 132 Cb -0.06 -1.76 -0.04 0.00 -1.46 0.00 0.00 37.83 34.51 1rml s LYS 132 CO 0.27 -0.24 -0.00 0.50 0.16 0.00 0.00 175.35 176.04 1rml s ARG 133 N -3.89 2.46 0.15 4.03 3.52 -1.26 -4.70 118.95 119.25 1rml s ARG 133 Ca 0.27 -0.97 -0.22 0.00 -0.13 0.00 0.00 55.73 54.68 1rml s ARG 133 Cb 0.04 -2.44 0.02 0.00 -1.56 0.00 0.00 34.95 31.01 1rml s ARG 133 CO 0.15 0.50 1.28 0.41 -0.81 0.00 0.00 175.30 176.83 1rml n GLY 134 N 0.23 -2.02 2.19 8.12 0.00 -0.76 -0.02 105.19 112.93 1rml n GLY 134 Ca -0.10 0.97 -0.13 0.00 0.00 0.00 0.00 46.02 46.76 1rml n GLY 134 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rml n PRO 135 N -5.09 1.74 0.00 1.61 -0.04 -1.26 -2.62 135.00 129.34 1rml n PRO 135 Ca 0.04 -0.94 0.00 0.00 -0.04 0.00 0.00 63.50 62.55 1rml n PRO 135 Cb 0.25 -2.01 0.00 0.00 -0.04 0.00 0.00 33.50 31.70 1rml n PRO 135 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1rml n ARG 136 N 2.87 0.00 -3.15 0.54 1.74 0.97 -5.07 116.66 114.57 1rml n ARG 136 Ca 0.37 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 57.21 1rml n ARG 136 Cb 0.59 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.98 1rml n ARG 136 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1rml n THR 137 N 0.00 1.69 -4.31 0.55 -1.04 -1.08 -4.30 114.28 105.79 1rml n THR 137 Ca 0.00 -5.07 -0.21 0.00 -2.04 0.00 0.00 64.05 56.73 1rml n THR 137 Cb 0.00 -1.41 -0.16 0.00 -1.82 0.00 0.00 70.33 66.94 1rml n THR 137 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1rml s HIS 138 N -2.69 0.94 0.68 -1.42 3.76 -1.26 0.24 115.29 115.54 1rml s HIS 138 Ca 0.43 -0.28 -0.11 0.00 -0.15 0.00 0.00 55.06 54.95 1rml s HIS 138 Cb 0.25 -0.75 0.17 0.00 1.11 0.00 0.00 32.58 33.36 1rml s HIS 138 CO -0.09 -0.19 0.38 2.48 -0.85 0.00 0.00 174.74 176.47 1rml n TYR 139 N 3.82 -2.60 0.00 1.40 4.11 -1.26 -4.87 117.16 117.76 1rml n TYR 139 Ca -0.23 -0.31 0.00 0.00 -0.00 0.00 0.00 57.90 57.36 1rml n TYR 139 Cb 0.52 -0.64 0.00 0.00 -0.00 0.00 0.00 39.34 39.22 1rml n TYR 139 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1rml n GLY 140 N -2.32 0.56 0.00 -7.48 0.00 -1.26 -5.03 105.19 89.66 1rml n GLY 140 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1rml n GLY 140 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1rml n GLN 141 N 0.00 0.00 0.00 1.61 3.00 -1.26 -5.07 117.38 115.66 1rml n GLN 141 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1rml n GLN 141 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 1rml n GLN 141 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.06 177.42 1rml n LYS 142 N -0.84 0.00 -0.16 -1.09 0.00 -1.26 -4.99 118.16 109.82 1rml n LYS 142 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 58.31 58.42 1rml n LYS 142 Cb 0.00 0.00 0.27 0.00 -0.00 0.00 0.00 35.03 35.30 1rml n LYS 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1rml n ALA 143 N 0.00 2.45 -0.01 0.58 0.00 -1.26 -3.90 120.51 118.37 1rml n ALA 143 Ca 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 53.44 52.60 1rml n ALA 143 Cb 0.00 -0.95 -0.03 0.00 0.00 0.00 0.00 19.45 18.47 1rml n ALA 143 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1rml n ILE 144 N 1.09 0.10 -1.53 0.00 -5.35 -1.26 -3.49 119.36 108.92 1rml n ILE 144 Ca 0.18 -0.11 -0.23 0.00 -0.27 0.00 0.00 62.75 62.33 1rml n ILE 144 Cb 0.50 -0.15 -0.14 0.00 -1.74 0.00 0.00 39.64 38.12 1rml n ILE 144 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1rml n LEU 145 N -1.84 0.42 -4.61 7.28 4.77 -1.25 -4.63 117.00 117.14 1rml n LEU 145 Ca -0.03 -0.80 -0.40 0.00 -0.03 0.00 0.00 56.01 54.75 1rml n LEU 145 Cb 0.31 -1.13 -0.07 0.00 -2.33 0.00 0.00 43.42 40.20 1rml n LEU 145 CO 0.07 -1.81 0.27 -0.36 -1.33 0.00 0.00 177.39 174.23 1rml s PHE 146 N 8.14 3.26 -0.37 -1.77 0.08 -1.26 -0.79 117.98 125.27 1rml s PHE 146 Ca 1.14 0.63 -0.09 0.00 0.12 0.00 0.00 56.93 58.73 1rml s PHE 146 Cb -0.55 -2.77 0.04 0.00 -0.57 0.00 0.00 43.02 39.17 1rml s PHE 146 CO 0.34 -0.32 0.18 -1.17 -0.10 0.00 0.00 175.22 174.16 1rml s LEU 147 N 2.36 4.69 0.27 -0.37 1.98 0.37 -3.39 118.68 124.59 1rml s LEU 147 Ca 0.22 -1.17 -0.30 0.00 -2.89 0.00 0.00 54.13 50.00 1rml s LEU 147 Cb -0.16 -1.96 -0.09 0.00 0.66 0.00 0.00 46.19 44.64 1rml s LEU 147 CO 0.09 -0.40 1.08 -2.16 -1.89 0.00 0.00 176.35 173.08 1rml s PRO 148 N 1.47 4.66 -0.44 0.98 0.04 -1.26 -1.11 135.00 139.34 1rml s PRO 148 Ca 0.01 1.77 0.09 0.00 0.04 0.00 0.00 61.00 62.91 1rml s PRO 148 Cb -0.20 -3.20 0.32 0.00 0.04 0.00 0.00 34.50 31.45 1rml s PRO 148 CO 0.04 0.24 0.73 1.47 0.04 0.00 0.00 177.00 179.52 1rml n LEU 149 N 1.31 1.71 -4.80 -3.56 -0.00 -0.97 -4.94 117.00 105.75 1rml n LEU 149 Ca -0.01 -5.12 -0.29 0.00 -0.00 0.00 0.00 56.01 50.58 1rml n LEU 149 Cb 0.45 0.32 0.11 0.00 -0.00 0.00 0.00 43.42 44.30 1rml n LEU 149 CO 0.54 2.24 0.71 -2.16 -0.00 0.00 0.00 177.39 178.72 1rml s PRO 150 N -2.40 1.65 -0.20 1.47 0.04 -1.26 -4.07 135.00 130.24 1rml s PRO 150 Ca 0.41 0.48 0.06 0.00 0.04 0.00 0.00 61.00 61.99 1rml s PRO 150 Cb 0.28 -1.88 0.21 0.00 0.04 0.00 0.00 34.50 33.15 1rml s PRO 150 CO -0.09 -1.88 1.06 1.33 0.04 0.00 0.00 177.00 177.45 1rml n VAL 151 N -3.58 0.00 -1.65 -0.36 0.24 -0.82 -4.96 118.33 107.20 1rml n VAL 151 Ca 0.07 -0.59 -0.16 0.00 -2.04 0.00 0.00 64.34 61.62 1rml n VAL 151 Cb 0.58 0.76 -0.10 0.00 -1.47 0.00 0.00 33.84 33.61 1rml n VAL 151 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1rml s SER 152 N -0.58 3.72 -0.48 -1.34 0.15 -1.18 -4.65 113.70 109.34 1rml s SER 152 Ca 0.06 -0.74 0.08 0.00 0.70 0.00 0.00 55.95 56.04 1rml s SER 152 Cb 0.23 -2.58 0.36 0.00 -1.71 0.00 0.00 66.02 62.31 1rml s SER 152 CO -0.06 -4.35 0.89 -0.24 1.20 0.00 0.00 173.24 170.68 1rml n SER 153 N 18.87 3.08 0.00 5.45 2.88 -1.26 -5.09 113.62 137.55 1rml n SER 153 Ca 0.43 -3.40 0.00 0.00 -1.33 0.00 0.00 58.87 54.57 1rml n SER 153 Cb 0.46 -0.57 0.00 0.00 -0.75 0.00 0.00 64.21 63.35 1rml n SER 153 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14