#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hbp s ARG 2 N 0.00 4.19 0.20 5.31 1.81 -1.26 -4.95 118.95 124.25 1hbp s ARG 2 Ca 0.00 2.40 -0.30 0.00 -1.72 0.00 0.00 55.73 56.11 1hbp s ARG 2 Cb 0.00 -3.38 -0.08 0.00 -0.45 0.00 0.00 34.95 31.04 1hbp s ARG 2 CO 0.00 -0.70 1.20 0.34 -0.68 0.00 0.00 175.30 175.46 1hbp s ASP 3 N 1.84 7.07 -0.05 0.23 -1.08 -1.26 -4.93 116.67 118.50 1hbp s ASP 3 Ca 0.73 2.27 0.12 0.00 -0.52 0.00 0.00 52.55 55.15 1hbp s ASP 3 Cb -0.43 -2.61 0.36 0.00 -1.46 0.00 0.00 42.92 38.78 1hbp s ASP 3 CO 0.32 -0.37 1.29 0.00 0.52 0.00 0.00 175.17 176.94 1hbp s ARG 5 N -1.49 4.45 0.22 0.00 0.52 -1.26 -4.27 118.95 117.13 1hbp s ARG 5 Ca 0.28 1.69 -0.09 0.00 -0.52 0.00 0.00 55.73 57.08 1hbp s ARG 5 Cb 0.18 -3.39 0.34 0.00 0.52 0.00 0.00 34.95 32.60 1hbp s ARG 5 CO 0.14 -0.23 1.66 0.28 0.02 0.00 0.00 175.30 177.17 1hbp h VAL 6 N 4.61 0.46 0.00 3.52 2.07 -1.57 -0.36 116.25 124.98 1hbp h VAL 6 Ca -0.41 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1hbp h VAL 6 Cb 1.21 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1hbp h VAL 6 CO 0.80 0.02 0.04 0.77 0.02 0.00 0.00 177.57 179.23 1hbp h SER 7 N 0.13 0.00 0.05 0.57 4.64 -1.91 -0.73 113.55 116.30 1hbp h SER 7 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 1hbp h SER 7 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1hbp h SER 7 CO -0.56 0.00 -0.49 -1.54 -0.87 0.00 0.00 176.83 173.37 1hbp n SER 8 N -2.41 1.68 -4.75 4.97 3.41 -0.15 -4.96 113.62 111.42 1hbp n SER 8 Ca -0.02 -1.30 -0.41 0.00 -0.26 0.00 0.00 58.87 56.88 1hbp n SER 8 Cb 0.08 0.46 -0.02 0.00 -0.26 0.00 0.00 64.21 64.47 1hbp n SER 8 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1hbp s PHE 9 N -2.55 3.05 0.38 7.33 0.08 -0.28 -5.00 117.98 120.99 1hbp s PHE 9 Ca 0.18 1.07 -0.24 0.00 0.12 0.00 0.00 56.93 58.07 1hbp s PHE 9 Cb 0.18 -3.79 -0.10 0.00 -0.57 0.00 0.00 43.02 38.75 1hbp s PHE 9 CO 0.60 -2.52 1.00 1.03 -0.10 0.00 0.00 175.22 175.22 1hbp s ARG 10 N -0.43 4.30 0.39 0.44 1.81 -1.26 -5.07 118.95 119.13 1hbp s ARG 10 Ca 0.58 1.38 0.04 0.00 -1.72 0.00 0.00 55.73 56.01 1hbp s ARG 10 Cb -0.41 -2.55 -0.04 0.00 -0.45 0.00 0.00 34.95 31.50 1hbp s ARG 10 CO 0.43 0.00 0.07 0.14 -0.68 0.00 0.00 175.30 175.27 1hbp s VAL 11 N -1.74 1.05 0.04 3.52 -7.23 -1.26 -4.79 120.40 109.99 1hbp s VAL 11 Ca 0.56 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.43 1hbp s VAL 11 Cb -0.19 -2.55 -0.08 0.00 0.56 0.00 0.00 36.38 34.12 1hbp s VAL 11 CO 0.24 0.00 1.81 -0.75 -0.31 0.00 0.00 175.10 176.08 1hbp s LYS 12 N -3.81 4.16 0.09 4.82 2.47 -0.16 -4.91 119.74 122.41 1hbp s LYS 12 Ca 0.27 2.46 -0.31 0.00 -1.56 0.00 0.00 55.97 56.83 1hbp s LYS 12 Cb 0.05 -3.88 -0.07 0.00 -1.46 0.00 0.00 37.83 32.47 1hbp s LYS 12 CO 0.13 -0.86 1.30 -1.83 0.16 0.00 0.00 175.35 174.26 1hbp s GLU 13 N 3.61 4.37 -1.48 4.03 1.03 -1.26 -3.52 118.70 125.48 1hbp s GLU 13 Ca 0.81 1.94 -0.06 0.00 0.03 0.00 0.00 54.97 57.69 1hbp s GLU 13 Cb -0.41 -3.29 0.05 0.00 -0.80 0.00 0.00 34.13 29.68 1hbp s GLU 13 CO 0.36 -0.35 0.62 0.09 -1.33 0.00 0.00 175.26 174.64 1hbp n ASN 14 N 3.89 -1.72 -4.57 0.83 3.02 -1.26 -4.85 115.26 110.60 1hbp n ASN 14 Ca 0.10 -0.95 -0.52 0.00 -0.03 0.00 0.00 54.58 53.18 1hbp n ASN 14 Cb 0.44 -3.24 -0.06 0.00 -0.61 0.00 0.00 39.78 36.32 1hbp n ASN 14 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1hbp n PHE 15 N -4.42 1.29 -3.62 3.10 7.35 -1.23 -4.94 117.46 114.99 1hbp n PHE 15 Ca -0.17 0.71 -0.40 0.00 -0.76 0.00 0.00 57.45 56.83 1hbp n PHE 15 Cb 0.62 -2.28 -0.10 0.00 0.35 0.00 0.00 39.48 38.07 1hbp n PHE 15 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1hbp s ASP 16 N 0.23 5.62 0.26 -2.13 -1.08 -1.26 -4.87 116.67 113.43 1hbp s ASP 16 Ca 0.81 -1.43 -0.05 0.00 -0.52 0.00 0.00 52.55 51.36 1hbp s ASP 16 Cb -0.96 -1.98 0.32 0.00 -1.46 0.00 0.00 42.92 38.84 1hbp s ASP 16 CO 0.50 -0.51 1.91 0.11 0.52 0.00 0.00 175.17 177.70 1hbp h LYS 17 N 8.39 1.24 -0.28 4.34 1.57 -1.93 -2.69 116.57 127.22 1hbp h LYS 17 Ca -0.23 -0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 58.37 1hbp h LYS 17 Cb 1.08 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 33.10 1hbp h LYS 17 CO 0.74 0.82 -0.25 0.00 -0.57 0.00 0.00 179.45 180.18 1hbp h ALA 18 N 1.41 1.03 0.00 3.86 0.00 -1.98 -2.61 119.26 120.97 1hbp h ALA 18 Ca 0.40 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1hbp h ALA 18 Cb -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1hbp h ALA 18 CO -0.12 0.58 0.00 0.00 0.00 0.00 0.00 179.25 179.71 1hbp h ARG 19 N 0.49 0.00 0.00 0.00 3.08 -1.92 -3.06 114.38 112.97 1hbp h ARG 19 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1hbp h ARG 19 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.75 1hbp h ARG 19 CO 0.05 0.00 -0.36 0.34 -1.07 0.00 0.00 179.97 178.93 1hbp n PHE 20 N -2.59 0.70 -0.94 3.04 7.35 -1.00 -4.88 117.46 119.13 1hbp n PHE 20 Ca 0.04 0.20 -0.33 0.00 -0.76 0.00 0.00 57.45 56.60 1hbp n PHE 20 Cb 0.39 -0.77 0.13 0.00 0.35 0.00 0.00 39.48 39.58 1hbp n PHE 20 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1hbp n ALA 21 N -1.80 -1.12 0.00 3.13 0.00 -1.10 -4.80 120.51 114.82 1hbp n ALA 21 Ca 0.04 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.04 1hbp n ALA 21 Cb 0.43 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.82 1hbp n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hbp n GLY 22 N 0.90 -0.17 3.74 0.00 0.00 -0.32 -4.90 105.19 104.45 1hbp n GLY 22 Ca 0.11 -2.26 -0.39 0.00 0.00 0.00 0.00 46.02 43.48 1hbp n GLY 22 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hbp s THR 23 N 0.00 4.99 -0.06 2.61 2.01 -1.26 -1.42 115.64 122.51 1hbp s THR 23 Ca 0.00 1.26 0.03 0.00 0.31 0.00 0.00 61.69 63.30 1hbp s THR 23 Cb 0.00 -3.95 0.00 0.00 0.01 0.00 0.00 72.50 68.57 1hbp s THR 23 CO 0.00 0.35 -0.16 0.26 -0.69 0.00 0.00 174.62 174.39 1hbp s TRP 24 N 0.23 1.68 -0.24 4.92 0.52 0.89 -4.69 118.94 122.26 1hbp s TRP 24 Ca 0.32 -0.58 -0.09 0.00 0.02 0.00 0.00 56.10 55.77 1hbp s TRP 24 Cb -0.18 -1.17 -0.04 0.00 -1.15 0.00 0.00 33.47 30.93 1hbp s TRP 24 CO 0.16 -0.25 0.12 0.71 0.02 0.00 0.00 176.95 177.71 1hbp s TYR 25 N 0.37 3.22 -0.13 -1.98 1.51 1.00 -0.45 117.35 120.88 1hbp s TYR 25 Ca -0.11 -0.01 -0.29 0.00 -1.01 0.00 0.00 57.07 55.65 1hbp s TYR 25 Cb -0.14 -2.24 -0.02 0.00 -0.11 0.00 0.00 41.96 39.45 1hbp s TYR 25 CO 0.04 -0.07 1.26 0.00 -1.11 0.00 0.00 175.55 175.66 1hbp s ALA 26 N 1.18 3.62 -0.17 3.71 0.00 -0.82 -0.25 121.76 129.03 1hbp s ALA 26 Ca 0.06 0.52 0.07 0.00 0.00 0.00 0.00 51.96 52.61 1hbp s ALA 26 Cb -0.14 -3.60 -0.22 0.00 0.00 0.00 0.00 23.12 19.16 1hbp s ALA 26 CO 0.05 -1.07 0.15 -0.12 0.00 0.00 0.00 175.76 174.77 1hbp n MET 27 N 6.25 0.68 -3.66 0.00 1.56 0.24 -4.72 117.12 117.47 1hbp n MET 27 Ca 0.13 0.15 -0.10 0.00 -0.27 0.00 0.00 57.70 57.61 1hbp n MET 27 Cb 0.45 -1.61 -0.04 0.00 2.15 0.00 0.00 33.22 34.17 1hbp n MET 27 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1hbp s ALA 28 N -2.53 -0.91 0.09 -5.12 0.00 -1.18 -1.11 121.76 111.00 1hbp s ALA 28 Ca -0.19 -0.10 -0.18 0.00 0.00 0.00 0.00 51.96 51.50 1hbp s ALA 28 Cb 0.07 0.72 0.04 0.00 0.00 0.00 0.00 23.12 23.95 1hbp s ALA 28 CO 0.75 -0.66 0.43 0.21 0.00 0.00 0.00 175.76 176.48 1hbp s LYS 29 N -3.82 1.03 -0.19 0.00 2.20 -0.51 -1.66 119.74 116.80 1hbp s LYS 29 Ca 0.04 -0.54 -0.00 0.00 -0.36 0.00 0.00 55.97 55.11 1hbp s LYS 29 Cb 0.02 0.46 0.01 0.00 -1.51 0.00 0.00 37.83 36.80 1hbp s LYS 29 CO -0.10 -0.39 -0.15 0.21 -0.36 0.00 0.00 175.35 174.56 1hbp s LYS 30 N -3.25 3.13 0.33 4.03 2.36 0.30 -1.13 119.74 125.51 1hbp s LYS 30 Ca -0.01 -0.76 -0.09 0.00 -2.55 0.00 0.00 55.97 52.56 1hbp s LYS 30 Cb 0.01 -2.70 -0.06 0.00 -1.05 0.00 0.00 37.83 34.03 1hbp s LYS 30 CO -0.08 -0.17 0.66 -0.51 1.55 0.00 0.00 175.35 176.80 1hbp s ASP 31 N 1.26 6.55 0.21 1.43 1.01 -1.26 -1.88 116.67 123.99 1hbp s ASP 31 Ca 0.03 0.99 0.00 0.00 0.71 0.00 0.00 52.55 54.28 1hbp s ASP 31 Cb -0.14 -2.26 0.00 0.00 1.01 0.00 0.00 42.92 41.53 1hbp s ASP 31 CO -0.08 -0.26 0.00 -0.81 0.21 0.00 0.00 175.17 174.23 1hbp n PRO 32 N -0.88 1.02 -2.69 8.23 -0.04 -1.15 -4.67 135.00 134.81 1hbp n PRO 32 Ca 0.01 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.14 1hbp n PRO 32 Cb 0.54 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.94 1hbp n PRO 32 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1hbp s GLU 33 N -1.57 4.10 0.37 0.54 2.02 -1.26 -4.91 118.70 117.99 1hbp s GLU 33 Ca 0.00 1.14 0.00 0.00 0.02 0.00 0.00 54.97 56.13 1hbp s GLU 33 Cb 0.00 -2.16 0.00 0.00 0.10 0.00 0.00 34.13 32.07 1hbp s GLU 33 CO 0.00 -0.15 0.00 0.41 0.02 0.00 0.00 175.26 175.54 1hbp n GLY 34 N -0.73 -2.42 3.72 -1.39 0.00 -1.26 -4.89 105.19 98.22 1hbp n GLY 34 Ca 0.07 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.99 1hbp n GLY 34 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1hbp s LEU 35 N 0.00 4.37 0.20 0.99 2.96 -1.26 -4.99 118.68 120.95 1hbp s LEU 35 Ca 0.00 2.53 -0.06 0.00 -0.22 0.00 0.00 54.13 56.38 1hbp s LEU 35 Cb 0.00 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 43.08 1hbp s LEU 35 CO 0.00 -0.78 0.26 0.12 -1.32 0.00 0.00 176.35 174.64 1hbp s PHE 36 N 1.16 0.74 0.20 5.38 5.36 -1.26 -5.06 117.98 124.50 1hbp s PHE 36 Ca 0.68 -1.05 -0.31 0.00 -0.96 0.00 0.00 56.93 55.30 1hbp s PHE 36 Cb -0.42 -0.22 -0.10 0.00 -0.34 0.00 0.00 43.02 41.93 1hbp s PHE 36 CO 0.31 -0.75 1.57 -1.17 -1.46 0.00 0.00 175.22 173.72 1hbp s LEU 37 N -3.07 4.37 -0.15 6.12 0.20 -1.26 -4.62 118.68 120.27 1hbp s LEU 37 Ca 0.28 2.70 -0.11 0.00 0.69 0.00 0.00 54.13 57.70 1hbp s LEU 37 Cb 0.04 -3.60 -0.04 0.00 -0.43 0.00 0.00 46.19 42.15 1hbp s LEU 37 CO 0.08 -0.84 -0.17 0.00 -0.29 0.00 0.00 176.35 175.13 1hbp n GLN 38 N 3.49 0.47 -2.13 1.98 3.00 0.31 -5.00 117.38 119.49 1hbp n GLN 38 Ca 0.12 0.50 -0.04 0.00 -0.01 0.00 0.00 57.00 57.58 1hbp n GLN 38 Cb 0.38 -1.67 -0.00 0.00 0.00 0.00 0.00 30.24 28.95 1hbp n GLN 38 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.06 176.66 1hbp n ASP 39 N -4.59 -0.57 -4.00 1.08 5.68 -1.21 -4.86 116.55 108.08 1hbp n ASP 39 Ca -0.10 -1.56 -0.32 0.00 -0.50 0.00 0.00 54.79 52.31 1hbp n ASP 39 Cb 0.32 1.00 0.01 0.00 -1.14 0.00 0.00 41.12 41.30 1hbp n ASP 39 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1hbp n ASN 40 N -1.61 -4.30 -4.66 -1.12 3.02 0.13 -1.61 115.26 105.12 1hbp n ASN 40 Ca -0.01 -0.85 -0.40 0.00 -0.03 0.00 0.00 54.58 53.29 1hbp n ASN 40 Cb 0.19 -3.57 -0.06 0.00 -0.61 0.00 0.00 39.78 35.74 1hbp n ASN 40 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1hbp s ILE 41 N -3.31 5.00 -0.05 2.41 1.01 -1.26 -4.03 121.20 120.98 1hbp s ILE 41 Ca 0.67 1.22 0.02 0.00 0.00 0.00 0.00 60.65 62.56 1hbp s ILE 41 Cb -0.34 -3.96 0.01 0.00 0.01 0.00 0.00 42.46 38.17 1hbp s ILE 41 CO 0.86 0.09 -0.10 -0.69 0.00 0.00 0.00 174.94 175.10 1hbp s VAL 42 N 1.99 0.92 0.12 2.92 1.01 -0.76 -1.94 120.40 124.66 1hbp s VAL 42 Ca 0.29 -0.39 0.11 0.00 0.00 0.00 0.00 61.98 61.99 1hbp s VAL 42 Cb -0.16 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 1hbp s VAL 42 CO 0.10 0.30 -0.26 0.00 0.00 0.00 0.00 175.10 175.23 1hbp s ALA 43 N 0.50 2.39 -0.18 5.51 0.00 0.41 -1.58 121.76 128.80 1hbp s ALA 43 Ca -0.09 -1.45 -0.01 0.00 0.00 0.00 0.00 51.96 50.41 1hbp s ALA 43 Cb -0.13 -0.40 0.05 0.00 0.00 0.00 0.00 23.12 22.64 1hbp s ALA 43 CO 0.02 0.54 -0.02 -2.00 0.00 0.00 0.00 175.76 174.30 1hbp s GLU 44 N -2.02 1.20 0.00 0.00 2.56 -0.62 -0.07 118.70 119.76 1hbp s GLU 44 Ca 0.14 -0.55 -0.02 0.00 0.00 0.00 0.00 54.97 54.55 1hbp s GLU 44 Cb -0.10 -2.09 -0.04 0.00 2.00 0.00 0.00 34.13 33.90 1hbp s GLU 44 CO 0.06 -0.52 0.16 -0.06 -0.56 0.00 0.00 175.26 174.34 1hbp s PHE 45 N 1.67 3.46 0.05 5.30 0.40 -0.51 -1.13 117.98 127.23 1hbp s PHE 45 Ca -0.01 0.29 -0.04 0.00 -0.60 0.00 0.00 56.93 56.57 1hbp s PHE 45 Cb -0.16 -1.79 -0.02 0.00 0.51 0.00 0.00 43.02 41.56 1hbp s PHE 45 CO -0.07 0.61 0.06 -1.12 0.70 0.00 0.00 175.22 175.40 1hbp s SER 46 N -1.98 0.28 -0.04 1.36 0.01 0.26 -1.17 113.70 112.42 1hbp s SER 46 Ca 0.27 -0.72 0.00 0.00 1.31 0.00 0.00 55.95 56.81 1hbp s SER 46 Cb -0.12 0.23 0.03 0.00 0.21 0.00 0.00 66.02 66.36 1hbp s SER 46 CO 0.19 -0.58 -0.01 0.54 0.41 0.00 0.00 173.24 173.79 1hbp s VAL 47 N -3.27 0.32 0.76 3.43 0.11 -1.26 -0.82 120.40 119.68 1hbp s VAL 47 Ca 0.01 0.03 -0.11 0.00 -2.93 0.00 0.00 61.98 58.98 1hbp s VAL 47 Cb 0.03 -0.41 0.17 0.00 -1.53 0.00 0.00 36.38 34.64 1hbp s VAL 47 CO -0.08 0.19 1.04 -0.90 -3.33 0.00 0.00 175.10 172.02 1hbp n ASP 48 N 4.28 0.30 -0.13 3.54 5.68 -0.35 -4.91 116.55 124.96 1hbp n ASP 48 Ca -0.22 -1.51 0.06 0.00 -0.50 0.00 0.00 54.79 52.62 1hbp n ASP 48 Cb 0.50 -0.77 0.38 0.00 -1.14 0.00 0.00 41.12 40.09 1hbp n ASP 48 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1hbp h GLU 49 N 0.00 0.67 -0.00 0.11 4.81 -2.01 -1.87 114.58 116.28 1hbp h GLU 49 Ca -0.34 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1hbp h GLU 49 Cb 0.98 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.21 1hbp h GLU 49 CO 0.26 0.44 -0.00 -1.71 -0.73 0.00 0.00 179.01 177.27 1hbp n ASN 50 N -4.47 0.03 0.00 1.04 4.05 -1.26 -4.90 115.26 109.75 1hbp n ASN 50 Ca 0.09 -0.96 0.00 0.00 0.45 0.00 0.00 54.58 54.15 1hbp n ASN 50 Cb 0.19 -0.02 0.00 0.00 1.23 0.00 0.00 39.78 41.19 1hbp n ASN 50 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1hbp n GLY 51 N 1.02 0.76 3.60 8.20 0.00 -0.70 -5.02 105.19 113.05 1hbp n GLY 51 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 1hbp n GLY 51 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1hbp s HIS 52 N -2.30 3.13 0.06 1.61 3.76 -1.26 -4.83 115.29 115.46 1hbp s HIS 52 Ca 0.00 0.76 -0.20 0.00 -0.15 0.00 0.00 55.06 55.47 1hbp s HIS 52 Cb 0.00 -3.47 -0.06 0.00 1.11 0.00 0.00 32.58 30.15 1hbp s HIS 52 CO 0.00 -0.73 0.58 1.41 -0.85 0.00 0.00 174.74 175.15 1hbp s MET 53 N 3.25 4.23 0.27 1.40 1.75 -1.26 -1.21 119.30 127.74 1hbp s MET 53 Ca 0.35 0.75 -0.03 0.00 -1.25 0.00 0.00 55.69 55.51 1hbp s MET 53 Cb -0.13 -3.26 -0.02 0.00 2.84 0.00 0.00 34.83 34.26 1hbp s MET 53 CO 0.16 0.59 0.33 -1.54 -0.65 0.00 0.00 175.02 173.91 1hbp s SER 54 N -0.94 0.54 0.16 1.11 1.04 0.00 -1.57 113.70 114.05 1hbp s SER 54 Ca 0.29 -1.37 -0.23 0.00 0.48 0.00 0.00 55.95 55.13 1hbp s SER 54 Cb -0.19 0.53 0.06 0.00 0.10 0.00 0.00 66.02 66.52 1hbp s SER 54 CO 0.19 -1.07 0.68 0.00 0.98 0.00 0.00 173.24 174.02 1hbp s ALA 55 N -3.72 -1.55 0.02 5.32 0.00 0.83 -0.57 121.76 122.09 1hbp s ALA 55 Ca 0.33 0.37 0.06 0.00 0.00 0.00 0.00 51.96 52.72 1hbp s ALA 55 Cb 0.02 0.81 -0.02 0.00 0.00 0.00 0.00 23.12 23.94 1hbp s ALA 55 CO 0.16 -0.83 -0.17 0.95 0.00 0.00 0.00 175.76 175.87 1hbp s THR 56 N -3.69 1.39 0.03 0.00 -4.23 -0.28 -0.07 115.64 108.79 1hbp s THR 56 Ca 0.04 -0.98 0.04 0.00 -1.18 0.00 0.00 61.69 59.61 1hbp s THR 56 Cb -0.02 -1.20 -0.02 0.00 1.34 0.00 0.00 72.50 72.60 1hbp s THR 56 CO -0.08 0.20 -0.11 0.00 -0.54 0.00 0.00 174.62 174.09 1hbp s ALA 57 N -0.69 0.94 -0.02 3.99 0.00 0.93 -1.58 121.76 125.32 1hbp s ALA 57 Ca 0.05 -0.73 0.07 0.00 0.00 0.00 0.00 51.96 51.36 1hbp s ALA 57 Cb -0.08 -0.12 -0.02 0.00 0.00 0.00 0.00 23.12 22.90 1hbp s ALA 57 CO 0.01 0.15 -0.24 0.21 0.00 0.00 0.00 175.76 175.89 1hbp s LYS 58 N -1.09 1.98 0.00 0.00 2.20 -0.62 0.36 119.74 122.57 1hbp s LYS 58 Ca -0.01 -0.84 0.00 0.00 -0.36 0.00 0.00 55.97 54.76 1hbp s LYS 58 Cb -0.07 -1.88 0.00 0.00 -1.51 0.00 0.00 37.83 34.37 1hbp s LYS 58 CO 0.01 0.49 0.00 0.41 -0.36 0.00 0.00 175.35 175.90 1hbp n GLY 59 N 2.56 1.03 3.74 5.54 0.00 -0.95 -1.83 105.19 115.28 1hbp n GLY 59 Ca -0.16 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 44.84 1hbp n GLY 59 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1hbp s ARG 60 N -2.00 4.51 -0.00 1.61 3.52 -0.63 0.79 118.95 126.74 1hbp s ARG 60 Ca 0.00 1.10 0.05 0.00 -0.13 0.00 0.00 55.73 56.75 1hbp s ARG 60 Cb 0.00 -3.39 -0.01 0.00 -1.56 0.00 0.00 34.95 29.99 1hbp s ARG 60 CO 0.00 0.21 -0.16 0.08 -0.81 0.00 0.00 175.30 174.61 1hbp s VAL 61 N 0.20 1.30 -0.36 7.11 1.01 0.14 0.11 120.40 129.92 1hbp s VAL 61 Ca 0.40 -0.76 -0.12 0.00 0.00 0.00 0.00 61.98 61.50 1hbp s VAL 61 Cb -0.20 -1.09 0.00 0.00 0.00 0.00 0.00 36.38 35.09 1hbp s VAL 61 CO 0.23 0.33 0.23 -0.13 0.00 0.00 0.00 175.10 175.75 1hbp s ARG 62 N -0.50 3.17 0.72 2.72 1.81 -1.26 -1.29 118.95 124.32 1hbp s ARG 62 Ca 0.06 -0.86 -0.14 0.00 -1.72 0.00 0.00 55.73 53.07 1hbp s ARG 62 Cb -0.07 -3.77 0.03 0.00 -0.45 0.00 0.00 34.95 30.69 1hbp s ARG 62 CO -0.00 -0.57 1.15 -0.51 -0.68 0.00 0.00 175.30 174.69 1hbp s LEU 63 N 1.65 3.28 0.56 2.53 2.01 0.64 -4.86 118.68 124.48 1hbp s LEU 63 Ca 0.04 2.15 0.25 0.00 0.01 0.00 0.00 54.13 56.59 1hbp s LEU 63 Cb -0.18 -4.57 1.50 0.00 0.01 0.00 0.00 46.19 42.96 1hbp s LEU 63 CO 0.08 -2.06 2.07 0.25 1.01 0.00 0.00 176.35 177.71 1hbp h LEU 64 N -0.37 0.00 -0.85 1.79 7.12 -1.97 0.33 115.31 121.36 1hbp h LEU 64 Ca -0.47 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.54 1hbp h LEU 64 Cb 1.27 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.40 1hbp h LEU 64 CO 0.51 0.00 0.00 -0.46 -0.13 0.00 0.00 178.44 178.36 1hbp n ASN 65 N -4.11 1.23 -0.38 1.25 6.94 -1.26 -4.88 115.26 114.04 1hbp n ASN 65 Ca 0.04 -2.02 -0.05 0.00 -0.02 0.00 0.00 54.58 52.52 1hbp n ASN 65 Cb 0.38 -0.18 -0.02 0.00 -2.36 0.00 0.00 39.78 37.61 1hbp n ASN 65 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 1hbp n ASN 66 N 0.12 -4.40 -4.74 0.53 5.15 0.12 -5.00 115.26 107.03 1hbp n ASN 66 Ca 0.07 0.12 -0.41 0.00 -0.60 0.00 0.00 54.58 53.77 1hbp n ASN 66 Cb 0.21 -2.34 -0.05 0.00 -0.53 0.00 0.00 39.78 37.07 1hbp n ASN 66 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 1hbp s TRP 67 N -1.92 3.83 -0.19 1.20 0.23 -1.25 -4.77 118.94 116.07 1hbp s TRP 67 Ca 0.00 1.81 -0.12 0.00 -2.03 0.00 0.00 56.10 55.76 1hbp s TRP 67 Cb 0.00 -3.07 -0.05 0.00 0.03 0.00 0.00 33.47 30.38 1hbp s TRP 67 CO 0.00 0.14 0.20 -0.51 0.96 0.00 0.00 176.95 177.74 1hbp s ASP 68 N -0.53 6.28 0.10 2.95 1.01 -1.26 -0.26 116.67 124.96 1hbp s ASP 68 Ca 0.45 0.32 0.05 0.00 0.71 0.00 0.00 52.55 54.08 1hbp s ASP 68 Cb -0.26 -2.13 -0.03 0.00 1.01 0.00 0.00 42.92 41.51 1hbp s ASP 68 CO 0.32 0.12 -0.13 0.68 0.21 0.00 0.00 175.17 176.37 1hbp s VAL 69 N 0.56 1.12 -0.37 -1.27 -7.23 -0.42 -4.99 120.40 107.81 1hbp s VAL 69 Ca 0.11 -1.55 -0.13 0.00 -1.81 0.00 0.00 61.98 58.60 1hbp s VAL 69 Cb -0.12 -1.31 0.01 0.00 0.56 0.00 0.00 36.38 35.51 1hbp s VAL 69 CO 0.01 -0.40 0.25 0.00 -0.31 0.00 0.00 175.10 174.65 1hbp s ALA 71 N 1.66 3.55 -0.38 0.00 0.00 0.24 -4.90 121.76 121.92 1hbp s ALA 71 Ca 0.05 -0.05 -0.06 0.00 0.00 0.00 0.00 51.96 51.90 1hbp s ALA 71 Cb -0.18 -2.63 0.07 0.00 0.00 0.00 0.00 23.12 20.38 1hbp s ALA 71 CO 0.09 0.26 0.18 -0.51 0.00 0.00 0.00 175.76 175.77 1hbp s ASP 72 N -0.46 5.37 0.11 0.00 1.01 -1.26 -2.24 116.67 119.20 1hbp s ASP 72 Ca 0.28 -1.53 0.05 0.00 0.71 0.00 0.00 52.55 52.06 1hbp s ASP 72 Cb -0.18 -1.88 -0.04 0.00 1.01 0.00 0.00 42.92 41.83 1hbp s ASP 72 CO 0.16 -0.46 0.01 -0.04 0.21 0.00 0.00 175.17 175.05 1hbp s MET 73 N 1.33 2.55 -0.03 8.23 -1.94 0.16 -0.90 119.30 128.70 1hbp s MET 73 Ca 0.02 -0.88 0.05 0.00 -1.71 0.00 0.00 55.69 53.17 1hbp s MET 73 Cb -0.22 -2.52 -0.01 0.00 2.01 0.00 0.00 34.83 34.09 1hbp s MET 73 CO 0.00 0.52 -0.16 0.08 -0.01 0.00 0.00 175.02 175.45 1hbp s VAL 74 N -1.41 1.33 -0.00 -6.03 1.01 -0.09 -0.05 120.40 115.16 1hbp s VAL 74 Ca 0.26 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.56 1hbp s VAL 74 Cb -0.11 -1.13 -0.00 0.00 0.00 0.00 0.00 36.38 35.14 1hbp s VAL 74 CO 0.19 0.38 -0.01 -0.83 0.00 0.00 0.00 175.10 174.82 1hbp s GLY 75 N -0.16 0.07 -0.08 4.51 0.00 0.90 -1.53 107.32 111.03 1hbp s GLY 75 Ca 0.01 -0.06 0.04 0.00 0.00 0.00 0.00 44.72 44.72 1hbp s GLY 75 CO 0.01 -0.04 -0.22 -0.51 0.00 0.00 0.00 173.10 172.33 1hbp s THR 76 N -0.02 2.28 -0.11 0.90 -4.23 -0.54 -0.12 115.64 113.80 1hbp s THR 76 Ca 0.00 -0.97 -0.01 0.00 -1.18 0.00 0.00 61.69 59.54 1hbp s THR 76 Cb -0.01 -1.87 -0.03 0.00 1.34 0.00 0.00 72.50 71.94 1hbp s THR 76 CO -0.00 0.56 -0.07 -0.36 -0.54 0.00 0.00 174.62 174.21 1hbp s PHE 77 N 0.04 2.93 -0.14 3.99 0.40 -0.61 -1.32 117.98 123.27 1hbp s PHE 77 Ca -0.09 -0.24 -0.04 0.00 -0.60 0.00 0.00 56.93 55.96 1hbp s PHE 77 Cb -0.15 -1.82 -0.03 0.00 0.51 0.00 0.00 43.02 41.52 1hbp s PHE 77 CO 0.06 0.08 0.02 0.99 0.70 0.00 0.00 175.22 177.07 1hbp s THR 78 N -0.15 4.45 0.56 0.64 2.01 0.20 -4.40 115.64 118.96 1hbp s THR 78 Ca 0.02 -0.17 -0.15 0.00 0.31 0.00 0.00 61.69 61.69 1hbp s THR 78 Cb -0.13 -2.94 -0.06 0.00 0.01 0.00 0.00 72.50 69.38 1hbp s THR 78 CO 0.03 0.53 1.02 -1.81 -0.69 0.00 0.00 174.62 173.70 1hbp s ASP 79 N -0.19 6.27 0.24 3.53 1.11 -1.26 -1.84 116.67 124.53 1hbp s ASP 79 Ca 0.06 1.62 0.02 0.00 0.18 0.00 0.00 52.55 54.43 1hbp s ASP 79 Cb -0.12 -2.51 -0.01 0.00 1.07 0.00 0.00 42.92 41.35 1hbp s ASP 79 CO 0.02 -0.83 0.07 0.35 1.18 0.00 0.00 175.17 175.95 1hbp n THR 80 N -1.95 0.00 0.32 -1.27 -2.24 -1.24 -4.88 114.28 103.02 1hbp n THR 80 Ca 0.07 -1.36 0.08 0.00 -2.27 0.00 0.00 64.05 60.58 1hbp n THR 80 Cb 0.54 0.44 0.37 0.00 -2.10 0.00 0.00 70.33 69.58 1hbp n THR 80 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1hbp n GLU 81 N -0.56 0.09 -3.85 -0.78 4.71 -1.26 -4.22 120.64 114.76 1hbp n GLU 81 Ca -0.05 0.42 -0.36 0.00 -0.01 0.00 0.00 57.16 57.16 1hbp n GLU 81 Cb 0.35 -1.71 -0.13 0.00 -1.01 0.00 0.00 31.44 28.94 1hbp n GLU 81 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1hbp s ASP 82 N -3.62 4.88 0.10 1.62 -1.08 -1.26 -4.99 116.67 112.31 1hbp s ASP 82 Ca 0.03 -1.00 0.05 0.00 -0.52 0.00 0.00 52.55 51.11 1hbp s ASP 82 Cb 0.07 -1.77 0.26 0.00 -1.46 0.00 0.00 42.92 40.02 1hbp s ASP 82 CO 0.25 -0.22 1.02 -0.81 0.52 0.00 0.00 175.17 175.93 1hbp n PRO 83 N 4.73 0.03 0.00 4.34 -0.04 -1.26 -1.47 135.00 141.34 1hbp n PRO 83 Ca -0.14 0.42 0.10 0.00 -0.04 0.00 0.00 63.50 63.84 1hbp n PRO 83 Cb 0.46 -1.78 0.01 0.00 -0.04 0.00 0.00 33.50 32.15 1hbp n PRO 83 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1hbp n ALA 84 N -1.43 3.24 -3.44 0.55 0.00 -1.26 -4.62 120.51 113.55 1hbp n ALA 84 Ca -0.00 -0.61 -0.33 0.00 0.00 0.00 0.00 53.44 52.50 1hbp n ALA 84 Cb 0.18 -0.69 -0.15 0.00 0.00 0.00 0.00 19.45 18.79 1hbp n ALA 84 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1hbp s LYS 85 N -2.14 3.25 0.28 0.00 1.02 -0.54 -0.69 119.74 120.93 1hbp s LYS 85 Ca 0.17 -0.73 0.08 0.00 0.02 0.00 0.00 55.97 55.51 1hbp s LYS 85 Cb 0.16 -2.68 -0.06 0.00 -0.52 0.00 0.00 37.83 34.74 1hbp s LYS 85 CO 0.46 0.01 -0.09 -0.06 -0.92 0.00 0.00 175.35 174.75 1hbp s PHE 86 N 0.85 2.02 -0.26 3.18 0.08 0.51 -3.60 117.98 120.76 1hbp s PHE 86 Ca -0.04 -0.62 -0.08 0.00 0.12 0.00 0.00 56.93 56.31 1hbp s PHE 86 Cb -0.15 -1.10 -0.03 0.00 -0.57 0.00 0.00 43.02 41.17 1hbp s PHE 86 CO -0.00 0.38 0.09 0.15 -0.10 0.00 0.00 175.22 175.73 1hbp s LYS 87 N -3.68 3.60 -0.21 0.44 3.01 -0.77 0.50 119.74 122.63 1hbp s LYS 87 Ca 0.29 -0.52 -0.01 0.00 -1.01 0.00 0.00 55.97 54.72 1hbp s LYS 87 Cb 0.02 -3.38 0.01 0.00 -1.01 0.00 0.00 37.83 33.47 1hbp s LYS 87 CO 0.12 -0.23 -0.11 1.41 0.51 0.00 0.00 175.35 177.05 1hbp s MET 88 N 1.62 3.11 -0.15 1.68 -2.45 -0.16 -0.63 119.30 122.32 1hbp s MET 88 Ca 0.06 -0.78 -0.15 0.00 -1.25 0.00 0.00 55.69 53.57 1hbp s MET 88 Cb -0.16 -2.83 -0.04 0.00 1.25 0.00 0.00 34.83 33.05 1hbp s MET 88 CO 0.04 -0.25 0.35 0.21 1.05 0.00 0.00 175.02 176.42 1hbp s LYS 89 N 1.37 4.28 0.07 4.11 2.20 -0.44 -1.45 119.74 129.88 1hbp s LYS 89 Ca 0.04 0.20 0.01 0.00 -0.36 0.00 0.00 55.97 55.87 1hbp s LYS 89 Cb -0.14 -3.43 -0.03 0.00 -1.51 0.00 0.00 37.83 32.71 1hbp s LYS 89 CO -0.07 0.21 -0.06 1.52 -0.36 0.00 0.00 175.35 176.59 1hbp s TYR 90 N 0.51 0.71 0.28 4.03 1.13 -0.38 -1.47 117.35 122.18 1hbp s TYR 90 Ca 0.19 -0.77 -0.15 0.00 -1.41 0.00 0.00 57.07 54.93 1hbp s TYR 90 Cb -0.14 -0.43 0.01 0.00 -1.10 0.00 0.00 41.96 40.30 1hbp s TYR 90 CO 0.06 -0.17 0.60 1.67 -2.51 0.00 0.00 175.55 175.20 1hbp s TRP 91 N -2.77 0.20 0.32 -3.49 -2.14 -0.58 -1.97 118.94 108.51 1hbp s TRP 91 Ca 0.02 -0.63 0.09 0.00 2.66 0.00 0.00 56.10 58.24 1hbp s TRP 91 Cb -0.00 0.43 -0.04 0.00 -3.10 0.00 0.00 33.47 30.75 1hbp s TRP 91 CO -0.04 -1.17 0.08 0.20 -2.66 0.00 0.00 176.95 173.36 1hbp s GLY 92 N -3.01 1.89 0.20 3.67 0.00 -1.26 -0.91 107.32 107.91 1hbp s GLY 92 Ca 0.18 -1.81 -0.08 0.00 0.00 0.00 0.00 44.72 43.02 1hbp s GLY 92 CO 0.10 -1.78 1.71 -0.39 0.00 0.00 0.00 173.10 172.74 1hbp h VAL 93 N 1.69 1.26 -3.38 1.40 -1.51 -1.40 -3.41 116.25 110.91 1hbp h VAL 93 Ca -0.44 -1.02 -0.55 0.00 -1.23 0.00 0.00 66.70 63.46 1hbp h VAL 93 Cb 1.25 0.63 -0.04 0.00 -2.13 0.00 0.00 31.29 30.99 1hbp h VAL 93 CO 0.63 0.38 0.09 0.00 -1.23 0.00 0.00 177.57 177.45 1hbp s ALA 94 N -5.21 3.43 0.52 5.19 0.00 -1.26 -4.97 121.76 119.46 1hbp s ALA 94 Ca -0.12 0.19 0.37 0.00 0.00 0.00 0.00 51.96 52.40 1hbp s ALA 94 Cb 0.15 -2.89 1.98 0.00 0.00 0.00 0.00 23.12 22.36 1hbp s ALA 94 CO 0.85 0.13 2.24 0.66 0.00 0.00 0.00 175.76 179.64 1hbp h SER 95 N 5.51 0.00 0.07 0.00 4.64 -2.01 -2.42 113.55 119.35 1hbp h SER 95 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1hbp h SER 95 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1hbp h SER 95 CO 0.70 0.02 -0.02 2.22 -0.87 0.00 0.00 176.83 178.88 1hbp n PHE 96 N -3.34 0.00 -2.68 4.77 1.16 -1.26 -4.87 117.46 111.23 1hbp n PHE 96 Ca -0.02 0.00 -0.32 0.00 -1.87 0.00 0.00 57.45 55.23 1hbp n PHE 96 Cb 0.14 -0.04 -0.05 0.00 -1.61 0.00 0.00 39.48 37.92 1hbp n PHE 96 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1hbp s LEU 97 N -2.10 3.82 0.33 5.98 1.43 -0.91 -4.99 118.68 122.23 1hbp s LEU 97 Ca 0.40 1.57 -0.29 0.00 -1.03 0.00 0.00 54.13 54.78 1hbp s LEU 97 Cb 0.21 -4.46 -0.11 0.00 0.03 0.00 0.00 46.19 41.86 1hbp s LEU 97 CO 0.38 -0.44 1.57 1.67 0.23 0.00 0.00 176.35 179.76 1hbp n GLN 98 N -1.03 2.73 -4.54 1.70 7.27 -1.26 -4.58 117.38 117.68 1hbp n GLN 98 Ca 0.06 0.97 -0.30 0.00 0.07 0.00 0.00 57.00 57.80 1hbp n GLN 98 Cb 0.54 -2.74 -0.13 0.00 2.41 0.00 0.00 30.24 30.32 1hbp n GLN 98 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 1hbp s LYS 99 N -1.13 1.69 0.01 3.69 1.02 -1.26 -4.24 119.74 119.51 1hbp s LYS 99 Ca 0.60 -1.20 -0.04 0.00 0.02 0.00 0.00 55.97 55.35 1hbp s LYS 99 Cb -0.48 -2.01 0.01 0.00 -0.52 0.00 0.00 37.83 34.83 1hbp s LYS 99 CO 0.54 0.49 0.18 0.41 -0.92 0.00 0.00 175.35 176.05 1hbp n GLY 100 N 1.20 0.76 2.72 -3.33 0.00 -0.83 -5.00 105.19 100.70 1hbp n GLY 100 Ca -0.17 -0.89 -0.19 0.00 0.00 0.00 0.00 46.02 44.77 1hbp n GLY 100 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hbp s ASN 101 N -1.40 0.99 0.03 1.61 -0.87 -1.26 -1.24 114.94 112.79 1hbp s ASN 101 Ca 0.04 0.14 0.02 0.00 -1.57 0.00 0.00 52.86 51.50 1hbp s ASN 101 Cb -0.00 -0.04 -0.02 0.00 -0.02 0.00 0.00 41.25 41.17 1hbp s ASN 101 CO 0.00 -0.24 -0.08 -1.81 -2.57 0.00 0.00 177.10 172.40 1hbp s ASP 102 N 2.14 0.92 0.71 -1.22 1.01 -0.53 -4.96 116.67 114.74 1hbp s ASP 102 Ca 0.04 -0.41 -0.13 0.00 0.71 0.00 0.00 52.55 52.75 1hbp s ASP 102 Cb -0.12 -0.01 0.02 0.00 1.01 0.00 0.00 42.92 43.82 1hbp s ASP 102 CO -0.04 -0.09 1.11 -1.81 0.21 0.00 0.00 175.17 174.55 1hbp s ASP 103 N -1.12 4.80 -0.23 0.27 1.01 -1.26 -0.99 116.67 119.15 1hbp s ASP 103 Ca -0.05 1.96 -0.04 0.00 0.71 0.00 0.00 52.55 55.13 1hbp s ASP 103 Cb -0.07 -2.54 0.08 0.00 1.01 0.00 0.00 42.92 41.39 1hbp s ASP 103 CO 0.00 -1.84 0.11 -2.28 0.21 0.00 0.00 175.17 171.38 1hbp s HIS 104 N -2.53 0.24 -0.10 4.23 2.46 0.18 -4.59 115.29 115.18 1hbp s HIS 104 Ca 0.65 -0.56 -0.00 0.00 0.47 0.00 0.00 55.06 55.61 1hbp s HIS 104 Cb -0.20 -0.78 -0.03 0.00 -0.13 0.00 0.00 32.58 31.45 1hbp s HIS 104 CO 0.47 -0.66 -0.08 -1.58 -2.47 0.00 0.00 174.74 170.42 1hbp s TRP 105 N 2.13 2.92 -0.41 3.88 0.52 -0.16 -0.36 118.94 127.45 1hbp s TRP 105 Ca 0.05 -0.21 -0.18 0.00 0.02 0.00 0.00 56.10 55.78 1hbp s TRP 105 Cb -0.16 -1.80 0.02 0.00 -1.15 0.00 0.00 33.47 30.38 1hbp s TRP 105 CO -0.22 0.12 0.51 0.42 0.02 0.00 0.00 176.95 177.79 1hbp s ILE 106 N -0.26 5.00 0.03 2.03 -1.09 0.13 -1.83 121.20 125.21 1hbp s ILE 106 Ca 0.03 -0.09 -0.20 0.00 -2.23 0.00 0.00 60.65 58.16 1hbp s ILE 106 Cb -0.13 -4.07 -0.17 0.00 -1.58 0.00 0.00 42.46 36.51 1hbp s ILE 106 CO 0.03 -0.44 1.24 0.40 -1.23 0.00 0.00 174.94 174.94 1hbp h ILE 107 N 5.75 1.39 -2.49 2.92 1.08 -0.06 -0.39 117.51 125.71 1hbp h ILE 107 Ca -0.26 -1.65 0.07 0.00 -0.39 0.00 0.00 64.86 62.63 1hbp h ILE 107 Cb 1.11 2.16 -0.14 0.00 -3.07 0.00 0.00 36.82 36.87 1hbp h ILE 107 CO 0.82 0.49 0.41 -0.62 -0.69 0.00 0.00 178.15 178.56 1hbp s ASP 108 N -6.42 -0.42 -0.27 1.72 2.15 -1.13 -2.34 116.67 109.95 1hbp s ASP 108 Ca -0.14 -0.01 -0.30 0.00 0.43 0.00 0.00 52.55 52.54 1hbp s ASP 108 Cb 0.05 0.45 0.18 0.00 -0.30 0.00 0.00 42.92 43.30 1hbp s ASP 108 CO 0.79 -0.73 1.33 0.28 -0.17 0.00 0.00 175.17 176.66 1hbp s THR 109 N -3.31 0.00 -0.90 1.71 -1.32 -1.26 -1.02 115.64 109.54 1hbp s THR 109 Ca 0.04 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.62 1hbp s THR 109 Cb -0.01 -1.00 0.24 0.00 -1.51 0.00 0.00 72.50 70.22 1hbp s THR 109 CO -0.10 0.00 1.16 -0.90 -2.21 0.00 0.00 174.62 172.57 1hbp n ASP 110 N 0.49 2.67 0.00 8.08 5.75 -1.13 -4.98 116.55 127.43 1hbp n ASP 110 Ca -0.01 -1.91 0.00 0.00 -0.01 0.00 0.00 54.79 52.87 1hbp n ASP 110 Cb 0.59 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.50 1hbp n ASP 110 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1hbp n TYR 111 N 0.44 0.00 0.53 2.11 4.01 -1.26 -4.51 117.16 118.48 1hbp n TYR 111 Ca 0.10 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.90 1hbp n TYR 111 Cb 0.38 -0.11 -0.08 0.00 -0.31 0.00 0.00 39.34 39.23 1hbp n TYR 111 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1hbp n GLU 112 N -0.44 2.48 0.00 -0.72 1.02 -1.26 -4.85 120.64 116.87 1hbp n GLU 112 Ca 0.00 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 1hbp n GLU 112 Cb 0.00 -1.13 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 1hbp n GLU 112 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1hbp n THR 113 N -1.38 0.00 -3.97 2.62 -1.04 -1.26 -4.65 114.28 104.59 1hbp n THR 113 Ca 0.02 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.93 1hbp n THR 113 Cb 0.22 -0.57 -0.06 0.00 -1.82 0.00 0.00 70.33 68.10 1hbp n THR 113 CO 0.00 0.00 0.00 0.72 -0.64 0.00 0.00 175.07 175.15 1hbp s PHE 114 N -1.71 0.40 -0.07 -1.42 -0.71 -1.26 -2.26 117.98 110.95 1hbp s PHE 114 Ca 0.00 -0.75 -0.16 0.00 -1.04 0.00 0.00 56.93 54.98 1hbp s PHE 114 Cb 0.00 0.02 0.03 0.00 -1.21 0.00 0.00 43.02 41.86 1hbp s PHE 114 CO 0.00 -0.81 0.38 0.00 -1.34 0.00 0.00 175.22 173.44 1hbp s ALA 115 N -3.99 -0.96 -0.18 1.99 0.00 -0.33 -2.83 121.76 115.46 1hbp s ALA 115 Ca 0.20 0.71 0.00 0.00 0.00 0.00 0.00 51.96 52.87 1hbp s ALA 115 Cb 0.02 -0.19 0.04 0.00 0.00 0.00 0.00 23.12 22.98 1hbp s ALA 115 CO 0.03 -0.25 -0.10 0.08 0.00 0.00 0.00 175.76 175.53 1hbp s VAL 116 N -0.76 1.49 0.18 0.00 1.01 -0.19 -0.42 120.40 121.71 1hbp s VAL 116 Ca -0.08 -0.84 0.08 0.00 0.00 0.00 0.00 61.98 61.13 1hbp s VAL 116 Cb -0.04 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 1hbp s VAL 116 CO 0.03 0.21 -0.03 -1.58 0.00 0.00 0.00 175.10 173.73 1hbp s GLN 117 N 1.47 2.29 -0.06 2.72 -0.44 -0.67 0.68 119.66 125.65 1hbp s GLN 117 Ca 0.00 -1.17 -0.27 0.00 -2.50 0.00 0.00 55.36 51.42 1hbp s GLN 117 Cb -0.15 -2.28 0.06 0.00 -1.64 0.00 0.00 33.01 28.99 1hbp s GLN 117 CO -0.08 0.44 0.60 -0.47 0.50 0.00 0.00 175.29 176.28 1hbp s TYR 118 N -1.75 -0.56 -0.15 1.67 5.04 -0.76 -2.62 117.35 118.21 1hbp s TYR 118 Ca 0.27 1.02 -0.09 0.00 -2.44 0.00 0.00 57.07 55.83 1hbp s TYR 118 Cb -0.09 0.33 0.05 0.00 0.35 0.00 0.00 41.96 42.60 1hbp s TYR 118 CO 0.17 -0.53 0.37 -1.12 -1.34 0.00 0.00 175.55 173.10 1hbp s SER 119 N -1.04 -0.44 -0.27 4.32 0.01 -0.70 -0.98 113.70 114.59 1hbp s SER 119 Ca -0.10 0.79 -0.05 0.00 1.31 0.00 0.00 55.95 57.90 1hbp s SER 119 Cb -0.02 0.69 0.01 0.00 0.21 0.00 0.00 66.02 66.92 1hbp s SER 119 CO 0.08 -0.18 0.02 0.00 0.41 0.00 0.00 173.24 173.57 1hbp n ARG 121 N 4.79 0.07 -3.65 0.00 1.74 0.03 -4.66 116.66 114.98 1hbp n ARG 121 Ca -0.15 0.01 -0.05 0.00 -0.77 0.00 0.00 57.85 56.89 1hbp n ARG 121 Cb 0.48 -1.54 -0.07 0.00 -1.02 0.00 0.00 32.46 30.31 1hbp n ARG 121 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1hbp s LEU 122 N -3.27 -0.92 0.00 0.55 2.96 -1.23 -4.95 118.68 111.82 1hbp s LEU 122 Ca 0.10 1.45 -0.15 0.00 -0.22 0.00 0.00 54.13 55.31 1hbp s LEU 122 Cb 0.17 2.20 -0.06 0.00 0.50 0.00 0.00 46.19 49.00 1hbp s LEU 122 CO 0.71 -0.23 0.41 -0.76 -1.32 0.00 0.00 176.35 175.17 1hbp s LEU 123 N 2.11 4.48 0.83 -0.68 1.02 -1.26 0.10 118.68 125.27 1hbp s LEU 123 Ca -0.08 0.97 -0.12 0.00 0.02 0.00 0.00 54.13 54.92 1hbp s LEU 123 Cb -0.08 -2.60 0.09 0.00 0.02 0.00 0.00 46.19 43.62 1hbp s LEU 123 CO -0.19 0.32 1.14 0.20 0.02 0.00 0.00 176.35 177.85 1hbp s ASN 124 N -1.10 4.27 0.45 2.29 0.01 0.15 -4.74 114.94 116.28 1hbp s ASN 124 Ca 0.24 0.98 0.18 0.00 -0.71 0.00 0.00 52.86 53.55 1hbp s ASN 124 Cb -0.17 -1.58 1.06 0.00 0.41 0.00 0.00 41.25 40.97 1hbp s ASN 124 CO 0.14 -2.07 1.97 -0.07 -1.51 0.00 0.00 177.10 175.55 1hbp h LEU 125 N -1.17 0.00 -0.10 0.60 -0.00 -1.98 -1.65 115.31 111.01 1hbp h LEU 125 Ca -0.48 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.40 1hbp h LEU 125 Cb 1.31 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.97 1hbp h LEU 125 CO 0.63 0.22 -0.03 -0.90 -0.00 0.00 0.00 178.44 178.36 1hbp n ASP 126 N -4.02 0.18 0.00 -0.43 5.68 -1.26 -4.89 116.55 111.80 1hbp n ASP 126 Ca -0.02 -0.57 0.00 0.00 -0.50 0.00 0.00 54.79 53.70 1hbp n ASP 126 Cb 0.29 -0.13 0.00 0.00 -1.14 0.00 0.00 41.12 40.14 1hbp n ASP 126 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1hbp n GLY 127 N 1.19 0.29 3.90 6.12 0.00 -0.62 -4.94 105.19 111.13 1hbp n GLY 127 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 1hbp n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1hbp s THR 128 N -2.09 2.48 -0.03 2.61 -4.23 -1.26 -1.46 115.64 111.65 1hbp s THR 128 Ca 0.00 0.04 -0.17 0.00 -1.18 0.00 0.00 61.69 60.39 1hbp s THR 128 Cb 0.00 -3.13 -0.05 0.00 1.34 0.00 0.00 72.50 70.66 1hbp s THR 128 CO 0.00 -0.16 0.45 0.00 -0.54 0.00 0.00 174.62 174.37 1hbp n ALA 130 N 2.49 1.52 -3.51 0.00 0.00 0.12 -4.78 120.51 116.35 1hbp n ALA 130 Ca -0.11 -0.92 -0.19 0.00 0.00 0.00 0.00 53.44 52.21 1hbp n ALA 130 Cb 0.52 -0.66 -0.13 0.00 0.00 0.00 0.00 19.45 19.17 1hbp n ALA 130 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1hbp s ASP 131 N -5.90 1.53 0.30 0.00 2.15 -1.17 -4.97 116.67 108.62 1hbp s ASP 131 Ca -0.06 -0.30 0.03 0.00 0.43 0.00 0.00 52.55 52.65 1hbp s ASP 131 Cb 0.07 0.30 -0.05 0.00 -0.30 0.00 0.00 42.92 42.94 1hbp s ASP 131 CO 0.83 -0.33 0.08 -0.94 -0.17 0.00 0.00 175.17 174.64 1hbp s SER 132 N 2.30 1.79 0.02 -0.34 1.04 -1.26 -0.79 113.70 116.46 1hbp s SER 132 Ca 0.06 -1.40 -0.03 0.00 0.48 0.00 0.00 55.95 55.06 1hbp s SER 132 Cb -0.16 0.08 -0.01 0.00 0.10 0.00 0.00 66.02 66.03 1hbp s SER 132 CO -0.12 -0.69 0.03 -0.72 0.98 0.00 0.00 173.24 172.72 1hbp s TYR 133 N -3.52 0.20 -0.14 5.02 1.13 -0.88 -2.93 117.35 116.23 1hbp s TYR 133 Ca 0.37 -0.44 -0.13 0.00 -1.41 0.00 0.00 57.07 55.45 1hbp s TYR 133 Cb 0.08 -0.15 0.04 0.00 -1.10 0.00 0.00 41.96 40.82 1hbp s TYR 133 CO 0.15 -0.25 0.38 0.45 -2.51 0.00 0.00 175.55 173.77 1hbp s SER 134 N -1.58 -0.40 0.06 -0.18 0.15 -0.79 -1.72 113.70 109.24 1hbp s SER 134 Ca -0.13 0.78 0.09 0.00 0.70 0.00 0.00 55.95 57.38 1hbp s SER 134 Cb -0.08 0.78 -0.03 0.00 -1.71 0.00 0.00 66.02 64.98 1hbp s SER 134 CO -0.01 -0.14 -0.24 -0.36 1.20 0.00 0.00 173.24 173.69 1hbp s PHE 135 N 0.27 2.13 -0.24 3.44 0.08 -1.08 -0.54 117.98 122.05 1hbp s PHE 135 Ca -0.01 -0.40 -0.05 0.00 0.12 0.00 0.00 56.93 56.60 1hbp s PHE 135 Cb -0.03 -1.25 -0.01 0.00 -0.57 0.00 0.00 43.02 41.17 1hbp s PHE 135 CO -0.00 0.16 -0.01 0.08 -0.10 0.00 0.00 175.22 175.35 1hbp s VAL 136 N -0.87 3.57 0.21 -0.44 1.01 -0.66 -1.67 120.40 121.56 1hbp s VAL 136 Ca 0.10 -0.49 0.10 0.00 0.00 0.00 0.00 61.98 61.69 1hbp s VAL 136 Cb -0.10 -2.67 -0.04 0.00 0.00 0.00 0.00 36.38 33.57 1hbp s VAL 136 CO 0.03 0.36 -0.09 -0.36 0.00 0.00 0.00 175.10 175.03 1hbp s PHE 137 N 1.50 2.59 0.06 5.22 0.08 0.44 -0.59 117.98 127.28 1hbp s PHE 137 Ca 0.05 -0.24 0.03 0.00 0.12 0.00 0.00 56.93 56.89 1hbp s PHE 137 Cb -0.15 -1.22 -0.03 0.00 -0.57 0.00 0.00 43.02 41.05 1hbp s PHE 137 CO -0.02 0.56 -0.09 0.00 -0.10 0.00 0.00 175.22 175.58 1hbp s ALA 138 N -1.94 0.80 0.13 5.36 0.00 0.66 -1.18 121.76 125.59 1hbp s ALA 138 Ca 0.27 -0.94 -0.07 0.00 0.00 0.00 0.00 51.96 51.22 1hbp s ALA 138 Cb -0.08 0.03 -0.07 0.00 0.00 0.00 0.00 23.12 23.01 1hbp s ALA 138 CO 0.16 -0.02 1.34 -0.09 0.00 0.00 0.00 175.76 177.15 1hbp h ARG 139 N 4.13 0.56 -5.29 0.00 9.65 -1.72 0.28 114.38 122.00 1hbp h ARG 139 Ca -0.37 -0.50 -0.64 0.00 -1.10 0.00 0.00 59.98 57.37 1hbp h ARG 139 Cb 1.19 0.12 -0.22 0.00 -1.39 0.00 0.00 29.97 29.67 1hbp h ARG 139 CO 0.45 1.13 -0.67 0.34 2.80 0.00 0.00 179.97 184.02 1hbp s ASP 140 N -7.07 4.74 0.00 -3.80 -1.08 -1.26 -4.76 116.67 103.44 1hbp s ASP 140 Ca -0.08 -0.15 0.11 0.00 -0.52 0.00 0.00 52.55 51.92 1hbp s ASP 140 Cb 0.09 -1.77 0.55 0.00 -1.46 0.00 0.00 42.92 40.32 1hbp s ASP 140 CO 0.88 0.16 1.26 -0.81 0.52 0.00 0.00 175.17 177.17 1hbp n PRO 141 N 3.57 0.14 0.03 4.34 -0.04 -1.26 -0.52 135.00 141.26 1hbp n PRO 141 Ca -0.17 0.19 0.13 0.00 -0.04 0.00 0.00 63.50 63.61 1hbp n PRO 141 Cb 0.52 -1.50 0.37 0.00 -0.04 0.00 0.00 33.50 32.86 1hbp n PRO 141 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1hbp n SER 142 N -1.30 0.43 0.00 3.54 7.64 -1.26 -5.03 113.62 117.63 1hbp n SER 142 Ca 0.05 0.19 0.00 0.00 1.01 0.00 0.00 58.87 60.12 1hbp n SER 142 Cb 0.09 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 1hbp n SER 142 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1hbp n GLY 143 N 1.44 0.11 3.51 0.23 0.00 0.32 -5.02 105.19 105.77 1hbp n GLY 143 Ca 0.06 -1.83 -0.25 0.00 0.00 0.00 0.00 46.02 44.00 1hbp n GLY 143 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1hbp s PHE 144 N 0.00 2.27 0.55 1.61 0.08 -1.26 -4.64 117.98 116.59 1hbp s PHE 144 Ca 0.00 -0.55 -0.07 0.00 0.12 0.00 0.00 56.93 56.43 1hbp s PHE 144 Cb 0.00 -1.29 -0.02 0.00 -0.57 0.00 0.00 43.02 41.14 1hbp s PHE 144 CO 0.00 0.50 0.88 -1.54 -0.10 0.00 0.00 175.22 174.96 1hbp s SER 145 N -3.56 6.01 0.33 1.36 1.04 -1.26 -4.87 113.70 112.75 1hbp s SER 145 Ca 0.32 0.96 0.04 0.00 0.48 0.00 0.00 55.95 57.75 1hbp s SER 145 Cb 0.03 -2.10 0.66 0.00 0.10 0.00 0.00 66.02 64.70 1hbp s SER 145 CO 0.15 -0.82 1.89 -0.65 0.98 0.00 0.00 173.24 174.80 1hbp h PRO 146 N -0.04 0.85 -0.72 4.02 0.11 -2.01 -0.38 132.00 133.84 1hbp h PRO 146 Ca -0.46 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 1hbp h PRO 146 Cb 1.22 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.11 1hbp h PRO 146 CO 0.62 0.56 0.41 0.93 -0.21 0.00 0.00 178.00 180.30 1hbp h GLU 147 N 0.87 0.99 -0.13 1.05 3.07 -2.00 -1.57 114.58 116.86 1hbp h GLU 147 Ca 0.41 -0.10 -0.14 0.00 -0.50 0.00 0.00 59.36 59.03 1hbp h GLU 147 Cb 0.41 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.11 1hbp h GLU 147 CO -0.17 0.72 -0.52 -0.24 -1.40 0.00 0.00 179.01 177.39 1hbp h VAL 148 N 0.98 1.34 -0.87 3.13 3.04 -1.50 -2.97 116.25 119.40 1hbp h VAL 148 Ca 0.25 -1.79 0.08 0.00 -1.01 0.00 0.00 66.70 64.24 1hbp h VAL 148 Cb 0.01 1.82 -0.07 0.00 -2.01 0.00 0.00 31.29 31.04 1hbp h VAL 148 CO -0.04 0.54 0.53 -0.61 -1.01 0.00 0.00 177.57 176.97 1hbp h GLN 149 N 0.28 0.89 -0.67 4.17 4.15 -0.55 -0.35 115.11 123.03 1hbp h GLN 149 Ca 0.01 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.33 1hbp h GLN 149 Cb 1.02 -0.20 -0.03 0.00 0.21 0.00 0.00 27.48 28.48 1hbp h GLN 149 CO 0.09 0.59 0.24 -0.22 -1.93 0.00 0.00 178.83 177.59 1hbp h LYS 150 N 0.91 1.00 -0.14 1.69 3.11 -1.15 0.92 116.57 122.92 1hbp h LYS 150 Ca 0.40 -0.18 -0.13 0.00 -2.81 0.00 0.00 60.65 57.92 1hbp h LYS 150 Cb 0.28 -0.16 0.00 0.00 -1.00 0.00 0.00 32.23 31.36 1hbp h LYS 150 CO -0.21 0.84 -0.43 0.82 -2.81 0.00 0.00 179.45 177.65 1hbp h ILE 151 N 0.97 1.36 -0.58 2.00 2.04 -1.21 -2.75 117.51 119.33 1hbp h ILE 151 Ca 0.22 -1.72 0.04 0.00 1.00 0.00 0.00 64.86 64.40 1hbp h ILE 151 Cb 0.23 2.07 -0.05 0.00 -0.74 0.00 0.00 36.82 38.34 1hbp h ILE 151 CO -0.01 0.52 0.33 0.58 0.00 0.00 0.00 178.15 179.56 1hbp h VAL 152 N 0.16 0.99 -0.77 1.67 2.07 -0.86 -1.73 116.25 117.78 1hbp h VAL 152 Ca -0.02 -0.21 0.06 0.00 0.82 0.00 0.00 66.70 67.35 1hbp h VAL 152 Cb 1.06 0.31 -0.06 0.00 -1.52 0.00 0.00 31.29 31.08 1hbp h VAL 152 CO 0.09 0.11 0.45 0.08 0.02 0.00 0.00 177.57 178.33 1hbp h ARG 153 N 0.62 0.80 -0.83 1.57 0.11 -0.79 -1.02 114.38 114.85 1hbp h ARG 153 Ca 0.25 -0.05 -0.03 0.00 0.10 0.00 0.00 59.98 60.26 1hbp h ARG 153 Cb 0.12 -0.18 -0.04 0.00 1.11 0.00 0.00 29.97 30.98 1hbp h ARG 153 CO -0.15 0.53 0.41 0.37 0.10 0.00 0.00 179.97 181.23 1hbp h GLN 154 N 0.82 1.19 0.00 0.08 4.15 -1.08 -1.69 115.11 118.58 1hbp h GLN 154 Ca 0.34 -0.17 -0.08 0.00 0.77 0.00 0.00 58.65 59.52 1hbp h GLN 154 Cb 0.20 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.66 1hbp h GLN 154 CO -0.19 0.91 -0.36 0.00 -1.93 0.00 0.00 178.83 177.26 1hbp h ARG 155 N 1.17 0.00 -0.31 1.69 2.47 -0.50 -1.05 114.38 117.85 1hbp h ARG 155 Ca 0.29 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.95 1hbp h ARG 155 Cb 0.10 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.41 1hbp h ARG 155 CO -0.04 0.36 -0.04 1.96 0.56 0.00 0.00 179.97 182.78 1hbp h GLN 156 N 0.00 0.58 -0.85 0.04 4.20 -0.57 -2.51 115.11 116.00 1hbp h GLN 156 Ca -0.00 -0.21 0.01 0.00 0.06 0.00 0.00 58.65 58.51 1hbp h GLN 156 Cb 0.64 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.34 1hbp h GLN 156 CO 0.05 0.75 0.56 1.49 -0.67 0.00 0.00 178.83 181.00 1hbp h GLU 157 N 0.37 1.10 0.00 1.46 4.57 -1.00 -1.43 114.58 119.64 1hbp h GLU 157 Ca 0.08 -0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.19 1hbp h GLU 157 Cb 0.51 -0.25 -0.00 0.00 -0.16 0.00 0.00 28.75 28.85 1hbp h GLU 157 CO 0.02 0.73 -0.04 0.93 -1.18 0.00 0.00 179.01 179.47 1hbp h GLU 158 N 1.13 0.00 -0.11 1.92 5.08 -0.88 -0.53 114.58 121.18 1hbp h GLU 158 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1hbp h GLU 158 Cb -0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.14 1hbp h GLU 158 CO -0.08 0.04 0.00 1.28 -1.00 0.00 0.00 179.01 179.25 1hbp n LEU 159 N -3.29 2.71 -2.51 1.33 4.77 -0.78 -4.92 117.00 114.30 1hbp n LEU 159 Ca -0.02 -0.98 -0.16 0.00 -0.03 0.00 0.00 56.01 54.82 1hbp n LEU 159 Cb 0.19 -0.06 0.05 0.00 -2.33 0.00 0.00 43.42 41.27 1hbp n LEU 159 CO 0.26 0.49 0.12 0.00 -1.33 0.00 0.00 177.39 176.93 1hbp n LEU 161 N -3.41 1.61 -4.64 0.00 4.77 -0.61 -5.04 117.00 109.67 1hbp n LEU 161 Ca -0.02 -1.63 -0.43 0.00 -0.03 0.00 0.00 56.01 53.90 1hbp n LEU 161 Cb 0.55 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.63 1hbp n LEU 161 CO 0.41 0.41 0.72 0.00 -1.33 0.00 0.00 177.39 177.60 1hbp n ALA 162 N -0.42 0.53 -0.91 -1.18 0.00 -1.18 -1.30 120.51 116.05 1hbp n ALA 162 Ca 0.00 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.80 1hbp n ALA 162 Cb 0.31 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 17.62 1hbp n ALA 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1hbp n ARG 163 N 0.55 -1.05 -0.37 0.00 1.74 -1.26 -4.86 116.66 111.42 1hbp n ARG 163 Ca 0.07 0.26 0.08 0.00 -0.77 0.00 0.00 57.85 57.50 1hbp n ARG 163 Cb 0.35 -4.28 0.26 0.00 -1.02 0.00 0.00 32.46 27.77 1hbp n ARG 163 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1hbp n GLN 164 N -0.65 3.07 -4.01 5.56 6.02 -0.42 -4.97 117.38 121.97 1hbp n GLN 164 Ca 0.00 -2.51 -0.28 0.00 -0.01 0.00 0.00 57.00 54.19 1hbp n GLN 164 Cb 0.26 -1.57 -0.05 0.00 1.02 0.00 0.00 30.24 29.90 1hbp n GLN 164 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1hbp s TYR 165 N -1.42 3.30 0.09 1.08 1.51 -1.26 -4.48 117.35 116.16 1hbp s TYR 165 Ca 0.39 0.09 0.08 0.00 -1.01 0.00 0.00 57.07 56.61 1hbp s TYR 165 Cb 0.23 -1.62 -0.03 0.00 -0.11 0.00 0.00 41.96 40.43 1hbp s TYR 165 CO 0.22 0.53 -0.20 1.03 -1.11 0.00 0.00 175.55 176.02 1hbp s ARG 166 N -2.79 1.08 0.38 -0.62 0.52 -0.28 -4.90 118.95 112.34 1hbp s ARG 166 Ca 0.32 -1.10 -0.26 0.00 -0.52 0.00 0.00 55.73 54.17 1hbp s ARG 166 Cb -0.11 -1.29 -0.09 0.00 0.52 0.00 0.00 34.95 33.98 1hbp s ARG 166 CO 0.25 0.30 1.13 -0.51 0.02 0.00 0.00 175.30 176.49 1hbp s LEU 167 N -1.81 4.24 -0.21 2.53 1.02 -1.26 -1.42 118.68 121.77 1hbp s LEU 167 Ca 0.05 2.27 -0.07 0.00 0.02 0.00 0.00 54.13 56.40 1hbp s LEU 167 Cb -0.10 -4.00 -0.03 0.00 0.02 0.00 0.00 46.19 42.08 1hbp s LEU 167 CO 0.04 -0.56 0.05 -0.63 0.02 0.00 0.00 176.35 175.27 1hbp s ILE 168 N -1.43 4.45 0.62 -0.59 1.01 -0.27 -4.90 121.20 120.08 1hbp s ILE 168 Ca 0.55 -0.14 -0.13 0.00 0.00 0.00 0.00 60.65 60.93 1hbp s ILE 168 Cb -0.29 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.13 1hbp s ILE 168 CO 0.37 0.41 1.04 -2.84 0.00 0.00 0.00 174.94 173.92 1hbp s PRO 169 N 0.90 3.31 -0.25 2.79 0.02 -1.26 -4.82 135.00 135.70 1hbp s PRO 169 Ca 0.03 1.01 0.00 0.00 0.02 0.00 0.00 61.00 62.07 1hbp s PRO 169 Cb -0.14 -2.04 0.07 0.00 0.02 0.00 0.00 34.50 32.41 1hbp s PRO 169 CO 0.02 -0.80 -0.02 -1.01 -0.33 0.00 0.00 177.00 174.87 1hbp s HIS 170 N -2.80 2.23 -0.04 6.54 3.76 -1.26 -0.69 115.29 123.03 1hbp s HIS 170 Ca 0.60 -1.73 0.08 0.00 -0.15 0.00 0.00 55.06 53.86 1hbp s HIS 170 Cb -0.14 -1.62 0.15 0.00 1.11 0.00 0.00 32.58 32.08 1hbp s HIS 170 CO 0.45 -0.78 1.07 0.27 -0.85 0.00 0.00 174.74 174.90 1hbp n ASN 171 N 4.71 0.80 -2.43 1.40 0.23 -1.26 -4.99 115.26 113.73 1hbp n ASN 171 Ca -0.09 -2.38 -0.20 0.00 -0.53 0.00 0.00 54.58 51.38 1hbp n ASN 171 Cb 0.44 -0.29 0.00 0.00 -2.08 0.00 0.00 39.78 37.85 1hbp n ASN 171 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1hbp n GLY 172 N -0.37 -0.46 0.29 4.83 0.00 -1.26 -4.91 105.19 103.32 1hbp n GLY 172 Ca 0.06 -0.01 0.04 0.00 0.00 0.00 0.00 46.02 46.11 1hbp n GLY 172 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1hbp h TYR 173 N -0.34 0.44 -3.55 1.61 5.03 -1.95 -3.42 116.97 114.79 1hbp h TYR 173 Ca -0.48 0.00 -0.45 0.00 2.58 0.00 0.00 58.73 60.37 1hbp h TYR 173 Cb 1.35 -0.14 0.07 0.00 1.55 0.00 0.00 36.73 39.56 1hbp h TYR 173 CO 0.52 0.31 0.19 0.00 -1.32 0.00 0.00 178.16 177.87