#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hpb n GLY 20 N 0.00 -0.53 3.34 3.03 0.00 -0.45 -5.05 105.19 105.54 2hpb n GLY 20 Ca 0.00 -0.18 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 2hpb n GLY 20 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2hpb s SER 21 N -4.26 -0.32 0.02 1.61 1.04 -0.99 -5.00 113.70 105.80 2hpb s SER 21 Ca -0.05 -0.20 0.01 0.00 0.48 0.00 0.00 55.95 56.18 2hpb s SER 21 Cb 0.03 0.50 -0.01 0.00 0.10 0.00 0.00 66.02 66.64 2hpb s SER 21 CO 0.44 -0.86 -0.04 -0.51 0.98 0.00 0.00 173.24 173.25 2hpb s ILE 22 N -3.65 0.23 0.03 -1.02 2.07 -1.26 -0.33 121.20 117.27 2hpb s ILE 22 Ca 0.02 -0.66 0.01 0.00 -1.41 0.00 0.00 60.65 58.61 2hpb s ILE 22 Cb 0.01 -0.30 -0.02 0.00 0.13 0.00 0.00 42.46 42.28 2hpb s ILE 22 CO -0.11 -0.28 -0.06 -0.89 -1.91 0.00 0.00 174.94 171.69 2hpb s THR 23 N -0.94 0.36 -0.17 4.00 2.01 -0.41 -4.93 115.64 115.56 2hpb s THR 23 Ca -0.09 -0.86 -0.18 0.00 0.31 0.00 0.00 61.69 60.88 2hpb s THR 23 Cb -0.07 -0.44 -0.04 0.00 0.01 0.00 0.00 72.50 71.97 2hpb s THR 23 CO -0.00 -0.33 0.47 -0.70 -0.69 0.00 0.00 174.62 173.37 2hpb s GLU 24 N -1.27 4.25 -0.49 4.92 2.12 -1.26 -0.61 118.70 126.36 2hpb s GLU 24 Ca -0.10 0.38 0.03 0.00 0.36 0.00 0.00 54.97 55.65 2hpb s GLU 24 Cb -0.08 -3.50 0.13 0.00 0.26 0.00 0.00 34.13 30.94 2hpb s GLU 24 CO -0.00 0.00 0.26 1.21 -0.54 0.00 0.00 175.26 176.19 2hpb s ASN 25 N 0.90 4.02 0.00 -1.70 3.04 0.68 -4.89 114.94 116.99 2hpb s ASN 25 Ca 0.24 -2.87 0.18 0.00 0.04 0.00 0.00 52.86 50.44 2hpb s ASN 25 Cb -0.15 -1.37 0.88 0.00 -1.54 0.00 0.00 41.25 39.07 2hpb s ASN 25 CO 0.09 -0.24 1.53 0.35 -3.04 0.00 0.00 177.10 175.79 2hpb n THR 26 N 3.26 0.51 -0.28 -5.21 -2.24 -1.26 -3.38 114.28 105.68 2hpb n THR 26 Ca 0.07 0.13 0.04 0.00 -2.27 0.00 0.00 64.05 62.02 2hpb n THR 26 Cb 0.33 -0.84 0.26 0.00 -2.10 0.00 0.00 70.33 67.99 2hpb n THR 26 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2hpb h SER 27 N 0.00 0.86 0.16 3.42 4.64 -1.94 -2.47 113.55 118.21 2hpb h SER 27 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2hpb h SER 27 Cb 0.18 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2hpb h SER 27 CO 0.00 0.55 0.00 0.79 -0.87 0.00 0.00 176.83 177.30 2hpb n TRP 28 N -4.48 0.00 0.00 4.77 8.01 -1.22 -3.25 117.44 121.27 2hpb n TRP 28 Ca 0.13 0.00 0.16 0.00 -1.31 0.00 0.00 57.50 56.48 2hpb n TRP 28 Cb 0.20 -0.47 0.61 0.00 -2.01 0.00 0.00 31.31 29.64 2hpb n TRP 28 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.69 175.77 2hpb h ASN 29 N 0.00 0.14 -0.92 -0.99 2.35 -1.71 -2.16 115.58 112.28 2hpb h ASN 29 Ca 0.00 0.00 0.26 0.00 -0.55 0.00 0.00 56.30 56.02 2hpb h ASN 29 Cb 0.08 -0.02 -0.16 0.00 0.05 0.00 0.00 38.32 38.26 2hpb h ASN 29 CO 0.00 0.08 0.18 0.50 -1.65 0.00 0.00 177.43 176.54 2hpb h LYS 30 N 0.15 0.11 0.00 0.81 3.64 -1.80 0.18 116.57 119.66 2hpb h LYS 30 Ca 0.23 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.51 2hpb h LYS 30 Cb 0.72 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.50 2hpb h LYS 30 CO -0.03 0.07 -0.47 0.93 -2.27 0.00 0.00 179.45 177.67 2hpb h GLU 31 N 0.11 0.00 0.02 1.90 4.39 -1.69 -2.88 114.58 116.44 2hpb h GLU 31 Ca 0.59 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.29 2hpb h GLU 31 Cb 1.26 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.91 2hpb h GLU 31 CO -0.76 0.47 -0.01 0.74 -1.16 0.00 0.00 179.01 178.30 2hpb h PHE 32 N 0.00 -0.02 -0.90 4.33 0.04 -1.02 -3.36 116.94 116.01 2hpb h PHE 32 Ca -0.00 -0.00 0.17 0.00 2.80 0.00 0.00 57.97 60.94 2hpb h PHE 32 Cb 0.96 0.01 -0.10 0.00 2.20 0.00 0.00 35.95 39.01 2hpb h PHE 32 CO 0.00 0.53 0.48 0.77 -0.60 0.00 0.00 178.31 179.49 2hpb h SER 33 N -0.99 0.56 -0.54 2.17 0.02 -0.84 -0.74 113.55 113.20 2hpb h SER 33 Ca -0.00 0.11 0.11 0.00 -0.84 0.00 0.00 61.79 61.16 2hpb h SER 33 Cb 0.56 0.02 -0.11 0.00 0.14 0.00 0.00 62.40 63.01 2hpb h SER 33 CO 0.00 0.19 -0.24 0.00 -1.14 0.00 0.00 176.83 175.65 2hpb h ALA 34 N 1.61 0.14 -0.62 3.77 0.00 -1.65 -0.57 119.26 121.94 2hpb h ALA 34 Ca 0.52 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.61 2hpb h ALA 34 Cb 0.81 0.60 0.00 0.00 0.00 0.00 0.00 17.79 19.19 2hpb h ALA 34 CO -0.40 -0.56 0.00 0.39 0.00 0.00 0.00 179.25 178.67 2hpb n GLU 35 N -5.42 3.07 -4.04 0.00 -0.58 -0.85 -4.96 120.64 107.87 2hpb n GLU 35 Ca 0.05 -2.51 -0.42 0.00 -0.42 0.00 0.00 57.16 53.85 2hpb n GLU 35 Cb 0.33 -1.70 0.01 0.00 -0.57 0.00 0.00 31.44 29.51 2hpb n GLU 35 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2hpb n ALA 36 N 1.20 -2.53 -2.80 0.62 0.00 -0.22 -4.96 120.51 111.82 2hpb n ALA 36 Ca 0.23 -0.51 -0.36 0.00 0.00 0.00 0.00 53.44 52.81 2hpb n ALA 36 Cb 0.71 -2.66 -0.08 0.00 0.00 0.00 0.00 19.45 17.42 2hpb n ALA 36 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2hpb s VAL 37 N -3.62 4.97 -0.48 0.00 1.01 -0.51 -5.00 120.40 116.77 2hpb s VAL 37 Ca 0.43 0.02 -0.15 0.00 0.00 0.00 0.00 61.98 62.27 2hpb s VAL 37 Cb -0.22 -3.18 0.08 0.00 0.00 0.00 0.00 36.38 33.06 2hpb s VAL 37 CO 0.96 0.56 0.41 0.20 0.00 0.00 0.00 175.10 177.22 2hpb s ASN 38 N -0.49 6.15 0.26 3.32 0.01 -1.26 -4.64 114.94 118.28 2hpb s ASN 38 Ca 0.11 -1.40 -0.14 0.00 -0.71 0.00 0.00 52.86 50.71 2hpb s ASN 38 Cb -0.12 -2.18 0.05 0.00 0.41 0.00 0.00 41.25 39.41 2hpb s ASN 38 CO 0.02 -0.68 0.73 0.61 -1.51 0.00 0.00 177.10 176.27 2hpb n GLY 39 N 5.21 0.99 3.15 0.66 0.00 -1.26 -0.75 105.19 113.18 2hpb n GLY 39 Ca -0.13 -1.17 -0.13 0.00 0.00 0.00 0.00 46.02 44.59 2hpb n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hpb s VAL 40 N -2.22 -0.00 -0.08 1.61 0.11 0.14 -4.88 120.40 115.08 2hpb s VAL 40 Ca 0.15 0.01 0.05 0.00 -2.93 0.00 0.00 61.98 59.26 2hpb s VAL 40 Cb -0.03 -0.38 -0.01 0.00 -1.53 0.00 0.00 36.38 34.43 2hpb s VAL 40 CO 0.08 0.00 -0.24 0.12 -3.33 0.00 0.00 175.10 171.73 2hpb s PHE 41 N 0.19 2.51 -0.13 1.54 5.36 -1.26 -1.56 117.98 124.63 2hpb s PHE 41 Ca -0.00 -0.87 0.02 0.00 -0.96 0.00 0.00 56.93 55.11 2hpb s PHE 41 Cb -0.02 -1.66 -0.00 0.00 -0.34 0.00 0.00 43.02 41.00 2hpb s PHE 41 CO -0.00 -0.31 -0.18 0.08 -1.46 0.00 0.00 175.22 173.35 2hpb s VAL 42 N 0.08 2.50 -0.13 3.12 1.01 0.69 -3.61 120.40 124.06 2hpb s VAL 42 Ca -0.11 -0.85 -0.01 0.00 0.00 0.00 0.00 61.98 61.01 2hpb s VAL 42 Cb -0.16 -2.02 0.03 0.00 0.00 0.00 0.00 36.38 34.24 2hpb s VAL 42 CO 0.06 0.54 -0.05 -0.22 0.00 0.00 0.00 175.10 175.43 2hpb s LEU 43 N 0.50 1.26 -0.06 3.92 2.96 -0.26 -1.85 118.68 125.15 2hpb s LEU 43 Ca -0.12 -0.44 0.05 0.00 -0.22 0.00 0.00 54.13 53.40 2hpb s LEU 43 Cb -0.17 -0.79 -0.02 0.00 0.50 0.00 0.00 46.19 45.72 2hpb s LEU 43 CO 0.05 -0.17 -0.22 0.00 -1.32 0.00 0.00 176.35 174.69 2hpb s LYS 45 N -0.28 4.01 0.05 0.00 2.20 -0.20 -1.48 119.74 124.04 2hpb s LYS 45 Ca 0.00 -0.30 -0.21 0.00 -0.36 0.00 0.00 55.97 55.10 2hpb s LYS 45 Cb -0.13 -3.57 -0.13 0.00 -1.51 0.00 0.00 37.83 32.49 2hpb s LYS 45 CO 0.03 -0.03 1.47 1.03 -0.36 0.00 0.00 175.35 177.48 2hpb h SER 46 N 7.84 0.26 -0.32 1.43 0.87 -1.57 -0.52 113.55 121.54 2hpb h SER 46 Ca -0.37 -0.33 0.02 0.00 -1.23 0.00 0.00 61.79 59.88 2hpb h SER 46 Cb 1.18 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 63.04 2hpb h SER 46 CO 0.61 0.53 0.18 0.77 -0.53 0.00 0.00 176.83 178.39 2hpb h SER 47 N -0.02 0.28 0.37 6.23 4.64 -1.94 -2.84 113.55 120.27 2hpb h SER 47 Ca 0.04 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2hpb h SER 47 Cb 0.40 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2hpb h SER 47 CO 0.01 0.21 -0.45 -1.54 -0.87 0.00 0.00 176.83 174.19 2hpb n SER 48 N -4.92 0.75 -2.14 4.97 3.41 -1.23 -4.96 113.62 109.49 2hpb n SER 48 Ca -0.00 -0.54 -0.21 0.00 -0.26 0.00 0.00 58.87 57.85 2hpb n SER 48 Cb 0.06 0.26 -0.04 0.00 -0.26 0.00 0.00 64.21 64.24 2hpb n SER 48 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2hpb n LYS 49 N -1.17 -1.61 -4.69 4.33 3.00 -0.22 -4.92 118.16 112.88 2hpb n LYS 49 Ca 0.08 1.08 -0.32 0.00 -0.00 0.00 0.00 58.31 59.15 2hpb n LYS 49 Cb 0.34 -5.66 -0.12 0.00 0.00 0.00 0.00 35.03 29.59 2hpb n LYS 49 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2hpb s SER 50 N -2.28 4.16 0.19 3.14 1.04 -1.12 -1.34 113.70 117.48 2hpb s SER 50 Ca 0.00 -0.24 0.09 0.00 0.48 0.00 0.00 55.95 56.28 2hpb s SER 50 Cb 0.00 -0.86 -0.04 0.00 0.10 0.00 0.00 66.02 65.22 2hpb s SER 50 CO 0.00 0.30 -0.11 0.00 0.98 0.00 0.00 173.24 174.41 2hpb s ALA 52 N -1.73 1.23 0.07 0.00 0.00 -0.23 -1.29 121.76 119.81 2hpb s ALA 52 Ca 0.25 -0.79 -0.07 0.00 0.00 0.00 0.00 51.96 51.35 2hpb s ALA 52 Cb -0.09 -0.23 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 2hpb s ALA 52 CO 0.15 0.25 0.13 -0.08 0.00 0.00 0.00 175.76 176.21 2hpb s THR 53 N -0.71 0.16 -0.36 0.00 -1.32 0.22 -1.10 115.64 112.52 2hpb s THR 53 Ca 0.03 -1.29 0.22 0.00 -1.21 0.00 0.00 61.69 59.45 2hpb s THR 53 Cb -0.07 -1.31 0.21 0.00 -1.51 0.00 0.00 72.50 69.82 2hpb s THR 53 CO 0.01 -0.71 1.41 -0.55 -2.21 0.00 0.00 174.62 172.57 2hpb h ASN 54 N 2.97 0.00 -2.07 8.08 -1.07 -1.69 2.00 115.58 123.81 2hpb h ASN 54 Ca -0.34 0.00 -0.35 0.00 0.07 0.00 0.00 56.30 55.68 2hpb h ASN 54 Cb 1.18 0.00 -0.32 0.00 -2.07 0.00 0.00 38.32 37.11 2hpb h ASN 54 CO 0.57 0.03 -0.66 -0.62 0.07 0.00 0.00 177.43 176.82 2hpb s ASP 55 N -5.95 1.47 0.27 6.14 -1.08 -1.26 -4.55 116.67 111.71 2hpb s ASP 55 Ca 0.04 -1.15 -0.04 0.00 -0.52 0.00 0.00 52.55 50.88 2hpb s ASP 55 Cb 0.07 0.51 0.35 0.00 -1.46 0.00 0.00 42.92 42.38 2hpb s ASP 55 CO 0.71 -0.33 1.88 -0.07 0.52 0.00 0.00 175.17 177.88 2hpb h LEU 56 N 7.70 0.96 0.03 -1.34 3.38 -1.94 -1.31 115.31 122.79 2hpb h LEU 56 Ca -0.05 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.83 2hpb h LEU 56 Cb 1.06 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2hpb h LEU 56 CO 0.27 0.79 -0.02 0.00 0.09 0.00 0.00 178.44 179.58 2hpb h ALA 57 N 1.36 -0.04 0.00 1.53 0.00 -2.00 -3.05 119.26 117.05 2hpb h ALA 57 Ca 0.26 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 2hpb h ALA 57 Cb 0.08 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2hpb h ALA 57 CO -0.04 -0.46 -0.34 -0.09 0.00 0.00 0.00 179.25 178.33 2hpb h ARG 58 N -0.18 0.00 0.00 0.00 2.43 -1.93 -2.81 114.38 111.90 2hpb h ARG 58 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 2hpb h ARG 58 Cb 0.16 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.71 2hpb h ARG 58 CO 0.01 0.34 -0.05 0.00 -1.51 0.00 0.00 179.97 178.76 2hpb h ALA 59 N 1.66 1.31 -0.00 2.80 0.00 -1.13 -2.26 119.26 121.63 2hpb h ALA 59 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2hpb h ALA 59 Cb 0.83 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2hpb h ALA 59 CO 0.04 0.06 -0.61 0.43 0.00 0.00 0.00 179.25 179.17 2hpb n SER 60 N -3.58 0.96 -4.77 0.00 7.64 -1.07 -1.66 113.62 111.14 2hpb n SER 60 Ca -0.02 -0.98 -0.39 0.00 1.01 0.00 0.00 58.87 58.48 2hpb n SER 60 Cb 0.15 0.85 -0.02 0.00 -1.01 0.00 0.00 64.21 64.18 2hpb n SER 60 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2hpb s LYS 61 N -2.28 4.19 -0.22 1.43 1.02 -0.85 -4.76 119.74 118.27 2hpb s LYS 61 Ca 0.08 1.92 -0.08 0.00 0.02 0.00 0.00 55.97 57.91 2hpb s LYS 61 Cb 0.12 -2.83 -0.04 0.00 -0.52 0.00 0.00 37.83 34.56 2hpb s LYS 61 CO 0.56 -0.22 0.08 -1.21 -0.92 0.00 0.00 175.35 173.64 2hpb s GLU 62 N -2.07 3.85 0.19 1.68 2.02 -1.26 -4.04 118.70 119.06 2hpb s GLU 62 Ca 0.54 -0.39 0.08 0.00 0.02 0.00 0.00 54.97 55.22 2hpb s GLU 62 Cb -0.33 -3.31 -0.04 0.00 0.10 0.00 0.00 34.13 30.55 2hpb s GLU 62 CO 0.42 0.05 -0.16 0.71 0.02 0.00 0.00 175.26 176.30 2hpb s TYR 63 N 0.99 1.75 -0.06 1.61 2.02 0.59 -4.66 117.35 119.59 2hpb s TYR 63 Ca 0.04 -0.52 -0.38 0.00 -0.37 0.00 0.00 57.07 55.84 2hpb s TYR 63 Cb -0.14 -0.84 -0.16 0.00 -0.40 0.00 0.00 41.96 40.42 2hpb s TYR 63 CO 0.03 0.35 1.50 1.28 -1.57 0.00 0.00 175.55 177.13 2hpb n LEU 64 N -0.06 1.92 -0.02 -1.29 4.77 -1.26 0.02 117.00 121.08 2hpb n LEU 64 Ca -0.10 1.10 -0.04 0.00 -0.03 0.00 0.00 56.01 56.94 2hpb n LEU 64 Cb 0.59 -1.17 0.19 0.00 -2.33 0.00 0.00 43.42 40.70 2hpb n LEU 64 CO 0.32 -0.81 0.77 -0.65 -1.33 0.00 0.00 177.39 175.69 2hpb h PRO 65 N 5.58 0.56 0.00 3.23 0.11 -1.74 -3.46 132.00 136.28 2hpb h PRO 65 Ca -0.47 -0.19 0.00 0.00 0.11 0.00 0.00 66.00 65.44 2hpb h PRO 65 Cb 1.33 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.40 2hpb h PRO 65 CO 0.85 0.72 0.00 0.00 -0.21 0.00 0.00 178.00 179.36 2hpb n ALA 66 N -2.49 0.00 0.32 -0.75 0.00 0.13 -2.27 120.51 115.46 2hpb n ALA 66 Ca 0.00 0.00 0.21 0.00 0.00 0.00 0.00 53.44 53.65 2hpb n ALA 66 Cb 0.37 0.00 1.10 0.00 0.00 0.00 0.00 19.45 20.92 2hpb n ALA 66 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2hpb h SER 67 N 4.55 0.00 0.16 0.00 0.02 -1.85 -0.89 113.55 115.54 2hpb h SER 67 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2hpb h SER 67 Cb 0.00 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 2hpb h SER 67 CO 0.00 0.00 -0.02 0.71 -1.14 0.00 0.00 176.83 176.38 2hpb h THR 68 N 0.00 0.24 0.00 -2.27 1.35 -1.41 0.25 112.91 111.07 2hpb h THR 68 Ca 0.00 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 2hpb h THR 68 Cb 0.12 1.11 0.00 0.00 -1.73 0.00 0.00 68.15 67.65 2hpb h THR 68 CO 0.00 0.02 0.00 0.33 -0.25 0.00 0.00 175.52 175.62 2hpb n PHE 69 N -3.38 0.81 0.31 4.73 7.35 -0.34 -2.63 117.46 124.31 2hpb n PHE 69 Ca -0.02 0.31 0.18 0.00 -0.76 0.00 0.00 57.45 57.15 2hpb n PHE 69 Cb 0.12 -1.00 1.02 0.00 0.35 0.00 0.00 39.48 39.97 2hpb n PHE 69 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 2hpb h LYS 70 N 0.00 0.00 0.41 -4.13 1.57 -0.67 -1.73 116.57 112.01 2hpb h LYS 70 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2hpb h LYS 70 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 2hpb h LYS 70 CO 0.00 0.01 -0.20 0.82 -0.57 0.00 0.00 179.45 179.52 2hpb h ILE 71 N 0.00 0.00 -0.88 1.86 2.04 -1.68 -0.14 117.51 118.71 2hpb h ILE 71 Ca -0.00 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.74 2hpb h ILE 71 Cb 0.05 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.08 2hpb h ILE 71 CO 0.00 0.00 0.57 1.55 0.00 0.00 0.00 178.15 180.27 2hpb h PRO 72 N -0.69 1.11 -1.00 2.37 0.13 -1.75 -1.85 132.00 130.32 2hpb h PRO 72 Ca -0.06 -0.07 0.04 0.00 -0.87 0.00 0.00 66.00 65.05 2hpb h PRO 72 Cb 0.42 -0.25 -0.06 0.00 0.13 0.00 0.00 31.00 31.24 2hpb h PRO 72 CO 0.09 0.73 0.65 -0.97 -0.23 0.00 0.00 178.00 178.27 2hpb h ASN 73 N 1.14 1.07 -0.16 1.44 -0.00 -1.36 0.38 115.58 118.09 2hpb h ASN 73 Ca 0.34 -0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 56.63 2hpb h ASN 73 Cb -0.06 -0.24 -0.01 0.00 -0.00 0.00 0.00 38.32 38.02 2hpb h ASN 73 CO -0.10 0.72 0.09 0.00 -0.00 0.00 0.00 177.43 178.14 2hpb h ALA 74 N 1.42 0.21 0.19 1.57 0.00 -0.61 0.34 119.26 122.38 2hpb h ALA 74 Ca 0.41 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.27 2hpb h ALA 74 Cb 0.05 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2hpb h ALA 74 CO -0.14 -0.25 -0.31 0.82 0.00 0.00 0.00 179.25 179.38 2hpb h ILE 75 N 0.15 0.35 -0.27 0.00 2.04 -0.31 -1.37 117.51 118.10 2hpb h ILE 75 Ca 0.06 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.97 2hpb h ILE 75 Cb 0.09 0.35 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 2hpb h ILE 75 CO -0.01 0.00 -0.02 0.40 0.00 0.00 0.00 178.15 178.52 2hpb h ILE 76 N -0.57 0.78 -0.94 -0.67 2.04 -0.23 0.10 117.51 118.02 2hpb h ILE 76 Ca 0.01 -0.02 0.15 0.00 1.00 0.00 0.00 64.86 66.00 2hpb h ILE 76 Cb 0.57 0.72 -0.08 0.00 -0.74 0.00 0.00 36.82 37.29 2hpb h ILE 76 CO -0.14 0.01 0.60 1.23 0.00 0.00 0.00 178.15 179.85 2hpb h GLY 77 N 0.06 1.38 0.91 5.37 0.00 -0.02 0.52 103.07 111.29 2hpb h GLY 77 Ca 0.13 -0.34 -0.21 0.00 0.00 0.00 0.00 47.33 46.91 2hpb h GLY 77 CO -0.23 0.08 -0.89 1.41 0.00 0.00 0.00 176.54 176.91 2hpb h LEU 78 N 0.77 0.63 -0.56 3.11 3.38 -0.87 0.98 115.31 122.75 2hpb h LEU 78 Ca 0.48 -0.84 0.03 0.00 0.09 0.00 0.00 57.88 57.64 2hpb h LEU 78 Cb 0.70 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.22 2hpb h LEU 78 CO -0.24 1.41 0.34 -0.08 0.09 0.00 0.00 178.44 179.95 2hpb h GLU 79 N -0.06 0.65 0.00 1.13 4.57 -0.16 -2.09 114.58 118.61 2hpb h GLU 79 Ca -0.13 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.01 2hpb h GLU 79 Cb 1.62 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 30.06 2hpb h GLU 79 CO 0.17 0.43 0.00 0.25 -1.18 0.00 0.00 179.01 178.68 2hpb n THR 80 N -4.77 0.43 -0.78 0.32 -2.24 0.10 -4.88 114.28 102.45 2hpb n THR 80 Ca 0.05 0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 2hpb n THR 80 Cb 0.08 -0.71 0.00 0.00 -2.10 0.00 0.00 70.33 67.60 2hpb n THR 80 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2hpb n GLY 81 N 0.89 0.90 0.35 3.38 0.00 -0.79 -4.93 105.19 104.99 2hpb n GLY 81 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2hpb n GLY 81 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2hpb h VAL 82 N 0.00 1.19 -3.69 1.61 2.07 -1.35 -3.32 116.25 112.75 2hpb h VAL 82 Ca 0.00 -0.37 -0.62 0.00 0.82 0.00 0.00 66.70 66.53 2hpb h VAL 82 Cb 0.00 0.12 -0.14 0.00 -1.52 0.00 0.00 31.29 29.75 2hpb h VAL 82 CO 0.00 0.19 -0.31 -0.63 0.02 0.00 0.00 177.57 176.84 2hpb s ILE 83 N -5.81 5.22 0.05 4.57 1.01 0.32 -4.98 121.20 121.59 2hpb s ILE 83 Ca -0.11 0.48 -0.30 0.00 0.00 0.00 0.00 60.65 60.73 2hpb s ILE 83 Cb 0.18 -3.65 -0.18 0.00 0.01 0.00 0.00 42.46 38.82 2hpb s ILE 83 CO 0.78 0.21 1.49 0.50 0.00 0.00 0.00 174.94 177.92 2hpb h LYS 84 N 7.99 -0.71 0.00 2.79 3.64 -1.86 -3.39 116.57 125.03 2hpb h LYS 84 Ca -0.34 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 2hpb h LYS 84 Cb 1.17 0.16 0.00 0.00 -0.41 0.00 0.00 32.23 33.15 2hpb h LYS 84 CO 0.64 -0.43 0.00 0.27 -2.27 0.00 0.00 179.45 177.67 2hpb n ASN 85 N -5.36 0.00 0.03 4.20 0.23 -1.26 -5.01 115.26 108.09 2hpb n ASN 85 Ca -0.12 -0.45 0.13 0.00 -0.53 0.00 0.00 54.58 53.61 2hpb n ASN 85 Cb 0.32 0.00 0.53 0.00 -2.08 0.00 0.00 39.78 38.55 2hpb n ASN 85 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 2hpb n GLU 86 N 0.00 0.08 0.00 -3.83 0.00 -1.26 -2.85 120.64 112.78 2hpb n GLU 86 Ca 0.00 0.10 0.12 0.00 0.00 0.00 0.00 57.16 57.38 2hpb n GLU 86 Cb 0.00 -1.60 0.19 0.00 0.00 0.00 0.00 31.44 30.03 2hpb n GLU 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 2hpb n HIS 87 N -1.73 0.00 -1.65 -1.84 8.25 -1.26 -4.53 115.22 112.45 2hpb n HIS 87 Ca 0.06 0.00 -0.49 0.00 -0.26 0.00 0.00 57.72 57.03 2hpb n HIS 87 Cb 0.34 -0.02 -0.05 0.00 1.12 0.00 0.00 29.99 31.38 2hpb n HIS 87 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 2hpb n GLN 88 N 0.47 1.77 -3.94 -0.41 7.27 -1.13 -4.97 117.38 116.44 2hpb n GLN 88 Ca 0.13 0.64 -0.35 0.00 0.07 0.00 0.00 57.00 57.50 2hpb n GLN 88 Cb 0.48 -2.38 -0.09 0.00 2.41 0.00 0.00 30.24 30.66 2hpb n GLN 88 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 2hpb s VAL 89 N 1.61 4.93 -0.56 1.69 1.01 -1.26 -3.70 120.40 124.12 2hpb s VAL 89 Ca 0.85 0.02 -0.20 0.00 0.00 0.00 0.00 61.98 62.64 2hpb s VAL 89 Cb -0.80 -3.23 0.07 0.00 0.00 0.00 0.00 36.38 32.42 2hpb s VAL 89 CO 0.46 0.46 0.75 -0.36 0.00 0.00 0.00 175.10 176.40 2hpb s PHE 90 N 0.37 2.93 0.13 5.22 0.08 -0.04 -4.97 117.98 121.70 2hpb s PHE 90 Ca 0.04 -0.58 -0.31 0.00 0.12 0.00 0.00 56.93 56.20 2hpb s PHE 90 Cb -0.12 -3.88 -0.08 0.00 -0.57 0.00 0.00 43.02 38.37 2hpb s PHE 90 CO -0.00 -1.26 1.36 0.15 -0.10 0.00 0.00 175.22 175.37 2hpb s LYS 91 N 3.09 4.34 -0.15 0.44 1.02 -1.26 -2.90 119.74 124.32 2hpb s LYS 91 Ca 0.18 2.05 -0.25 0.00 0.02 0.00 0.00 55.97 57.96 2hpb s LYS 91 Cb -0.19 -3.24 -0.02 0.00 -0.52 0.00 0.00 37.83 33.86 2hpb s LYS 91 CO 0.11 -0.39 0.83 -0.46 -0.92 0.00 0.00 175.35 174.52 2hpb s TRP 92 N 0.92 3.45 -0.02 3.18 -0.00 -1.26 -4.97 118.94 120.25 2hpb s TRP 92 Ca 0.63 1.29 -0.12 0.00 -0.00 0.00 0.00 56.10 57.90 2hpb s TRP 92 Cb -0.36 -3.00 -0.06 0.00 -0.00 0.00 0.00 33.47 30.04 2hpb s TRP 92 CO 0.32 -0.19 0.63 0.38 -0.00 0.00 0.00 176.95 178.08 2hpb h ASP 93 N 7.24 -0.35 0.00 5.86 3.04 -1.94 -3.46 116.42 126.80 2hpb h ASP 93 Ca -0.31 0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.49 2hpb h ASP 93 Cb 1.14 0.09 0.00 0.00 -1.04 0.00 0.00 39.33 39.52 2hpb h ASP 93 CO 0.82 -0.07 0.00 0.61 -2.04 0.00 0.00 179.24 178.56 2hpb n GLY 94 N 0.34 0.18 3.74 7.15 0.00 -1.26 -5.13 105.19 110.21 2hpb n GLY 94 Ca -0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 2hpb n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hpb s LYS 95 N 0.00 4.16 0.48 1.61 1.02 -1.26 -4.93 119.74 120.82 2hpb s LYS 95 Ca 0.00 2.51 -0.21 0.00 0.02 0.00 0.00 55.97 58.29 2hpb s LYS 95 Cb 0.00 -3.06 -0.10 0.00 -0.52 0.00 0.00 37.83 34.15 2hpb s LYS 95 CO 0.00 -0.61 0.70 -2.30 -0.92 0.00 0.00 175.35 172.21 2hpb n PRO 96 N 2.68 0.78 -4.45 -1.68 -0.02 -1.26 -5.04 135.00 126.02 2hpb n PRO 96 Ca 0.10 0.29 -0.22 0.00 -2.02 0.00 0.00 63.50 61.65 2hpb n PRO 96 Cb 0.38 -1.76 -0.10 0.00 -0.02 0.00 0.00 33.50 32.00 2hpb n PRO 96 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2hpb s ARG 97 N -1.94 1.61 0.55 -0.52 0.52 -1.26 -5.06 118.95 112.84 2hpb s ARG 97 Ca 0.66 -1.85 0.26 0.00 -0.52 0.00 0.00 55.73 54.27 2hpb s ARG 97 Cb -0.53 -1.05 1.55 0.00 0.52 0.00 0.00 34.95 35.44 2hpb s ARG 97 CO 0.56 -0.06 2.16 0.00 0.02 0.00 0.00 175.30 177.97 2hpb h ALA 98 N 2.19 1.54 -3.09 2.13 0.00 -1.97 -3.43 119.26 116.62 2hpb h ALA 98 Ca -0.40 -0.05 -0.29 0.00 0.00 0.00 0.00 54.91 54.17 2hpb h ALA 98 Cb 1.24 -0.01 -0.21 0.00 0.00 0.00 0.00 17.79 18.81 2hpb h ALA 98 CO 0.69 0.07 -0.74 -1.64 0.00 0.00 0.00 179.25 177.64 2hpb s MET 99 N -4.56 0.60 0.45 0.00 -1.94 -1.26 -5.05 119.30 107.54 2hpb s MET 99 Ca -0.04 -0.85 0.13 0.00 -1.71 0.00 0.00 55.69 53.22 2hpb s MET 99 Cb 0.15 -0.35 1.01 0.00 2.01 0.00 0.00 34.83 37.64 2hpb s MET 99 CO 0.59 0.06 2.01 -0.22 -0.01 0.00 0.00 175.02 177.46 2hpb h LYS 100 N 4.30 0.08 -0.80 2.03 3.64 -1.98 -2.55 116.57 121.30 2hpb h LYS 100 Ca -0.36 -0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.08 2hpb h LYS 100 Cb 1.20 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.95 2hpb h LYS 100 CO 0.43 0.19 0.52 1.96 -2.27 0.00 0.00 179.45 180.29 2hpb h GLN 101 N 0.08 0.80 -0.00 1.90 4.20 -1.97 -2.55 115.11 117.56 2hpb h GLN 101 Ca 0.02 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2hpb h GLN 101 Cb 0.24 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 27.84 2hpb h GLN 101 CO 0.01 0.53 -0.20 0.91 -0.67 0.00 0.00 178.83 179.41 2hpb n TRP 102 N -4.49 0.00 -2.10 2.96 8.01 -0.96 -4.35 117.44 116.50 2hpb n TRP 102 Ca 0.13 0.00 -0.41 0.00 -1.31 0.00 0.00 57.50 55.90 2hpb n TRP 102 Cb 0.26 -0.33 -0.00 0.00 -2.01 0.00 0.00 31.31 29.22 2hpb n TRP 102 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.69 177.07 2hpb n GLU 103 N -1.36 4.09 -3.71 -0.99 1.02 -0.96 -4.84 120.64 113.89 2hpb n GLU 103 Ca 0.08 -3.41 -0.03 0.00 -0.02 0.00 0.00 57.16 53.78 2hpb n GLU 103 Cb 0.32 -2.78 -0.01 0.00 -0.02 0.00 0.00 31.44 28.95 2hpb n GLU 103 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2hpb s ARG 104 N -0.24 0.98 0.13 3.49 1.70 -1.26 -5.07 118.95 118.69 2hpb s ARG 104 Ca 0.48 -0.53 -0.30 0.00 -0.47 0.00 0.00 55.73 54.91 2hpb s ARG 104 Cb 0.14 0.34 -0.07 0.00 -0.57 0.00 0.00 34.95 34.80 2hpb s ARG 104 CO -0.05 -0.45 1.15 -0.51 -1.08 0.00 0.00 175.30 174.36 2hpb s ASP 105 N -2.91 7.17 0.11 -2.89 1.01 -1.26 -4.10 116.67 113.80 2hpb s ASP 105 Ca 0.12 2.08 0.06 0.00 0.71 0.00 0.00 52.55 55.52 2hpb s ASP 105 Cb 0.00 -2.59 -0.04 0.00 1.01 0.00 0.00 42.92 41.30 2hpb s ASP 105 CO 0.00 -0.33 -0.15 -0.76 0.21 0.00 0.00 175.17 174.13 2hpb s LEU 106 N 0.18 2.36 0.72 1.23 1.43 -1.14 -4.98 118.68 118.47 2hpb s LEU 106 Ca 0.53 -0.75 -0.03 0.00 -1.03 0.00 0.00 54.13 52.85 2hpb s LEU 106 Cb -0.30 -0.61 0.11 0.00 0.03 0.00 0.00 46.19 45.42 2hpb s LEU 106 CO 0.33 -0.09 1.00 0.42 0.23 0.00 0.00 176.35 178.24 2hpb s THR 107 N -1.78 2.22 0.14 5.49 -4.23 -1.26 -0.86 115.64 115.36 2hpb s THR 107 Ca 0.06 -0.50 -0.22 0.00 -1.18 0.00 0.00 61.69 59.86 2hpb s THR 107 Cb -0.07 -2.72 0.00 0.00 1.34 0.00 0.00 72.50 71.05 2hpb s THR 107 CO 0.03 0.00 1.66 0.25 -0.54 0.00 0.00 174.62 176.02 2hpb h LEU 108 N -0.57 -0.52 -1.85 4.79 5.85 -1.80 -0.59 115.31 120.62 2hpb h LEU 108 Ca -0.39 0.10 0.09 0.00 0.84 0.00 0.00 57.88 58.52 2hpb h LEU 108 Cb 1.27 0.25 -0.02 0.00 0.37 0.00 0.00 40.66 42.54 2hpb h LEU 108 CO 0.44 -0.20 0.29 -0.09 -0.34 0.00 0.00 178.44 178.54 2hpb h ARG 109 N -0.18 0.17 0.28 1.25 2.43 -1.90 -1.78 114.38 114.66 2hpb h ARG 109 Ca 0.11 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 2hpb h ARG 109 Cb 0.35 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2hpb h ARG 109 CO -0.29 0.11 -0.13 0.78 -1.51 0.00 0.00 179.97 178.93 2hpb h GLY 110 N 0.18 -0.39 0.83 2.80 0.00 -1.50 0.92 103.07 105.91 2hpb h GLY 110 Ca 0.19 0.15 0.09 0.00 0.00 0.00 0.00 47.33 47.76 2hpb h GLY 110 CO -0.03 -0.14 0.52 0.00 0.00 0.00 0.00 176.54 176.89 2hpb h ALA 111 N -0.31 1.75 -0.15 3.60 0.00 -1.16 -0.40 119.26 122.59 2hpb h ALA 111 Ca -0.04 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2hpb h ALA 111 Cb 0.51 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2hpb h ALA 111 CO 0.06 0.09 -0.04 0.82 0.00 0.00 0.00 179.25 180.18 2hpb h ILE 112 N 0.75 1.29 0.00 0.00 2.04 -1.26 0.11 117.51 120.43 2hpb h ILE 112 Ca 0.37 -1.01 -0.12 0.00 1.00 0.00 0.00 64.86 65.10 2hpb h ILE 112 Cb 0.43 1.65 -0.02 0.00 -0.74 0.00 0.00 36.82 38.14 2hpb h ILE 112 CO -0.14 0.30 -0.56 1.56 0.00 0.00 0.00 178.15 179.30 2hpb h GLN 113 N -0.01 0.00 -0.10 2.37 1.08 -0.12 -2.83 115.11 115.51 2hpb h GLN 113 Ca 0.04 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.24 2hpb h GLN 113 Cb 0.48 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.91 2hpb h GLN 113 CO 0.02 0.56 0.00 1.33 -0.95 0.00 0.00 178.83 179.79 2hpb n VAL 114 N -3.74 0.10 -3.73 -0.54 0.24 -0.22 -5.00 118.33 105.44 2hpb n VAL 114 Ca -0.01 -0.55 -0.30 0.00 -2.04 0.00 0.00 64.34 61.44 2hpb n VAL 114 Cb 0.59 1.38 0.03 0.00 -1.47 0.00 0.00 33.84 34.38 2hpb n VAL 114 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2hpb n SER 115 N 1.33 -4.17 -4.56 -1.34 7.64 -0.61 -4.84 113.62 107.08 2hpb n SER 115 Ca 0.14 -1.00 -0.38 0.00 1.01 0.00 0.00 58.87 58.64 2hpb n SER 115 Cb 0.58 -3.38 -0.03 0.00 -1.01 0.00 0.00 64.21 60.37 2hpb n SER 115 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2hpb s ALA 116 N -3.56 2.50 0.12 -0.43 0.00 0.27 -4.88 121.76 115.78 2hpb s ALA 116 Ca 0.36 -2.12 -0.32 0.00 0.00 0.00 0.00 51.96 49.89 2hpb s ALA 116 Cb -0.13 -4.54 -0.11 0.00 0.00 0.00 0.00 23.12 18.34 2hpb s ALA 116 CO 0.86 -3.88 1.53 0.28 0.00 0.00 0.00 175.76 174.55 2hpb h VAL 117 N 6.86 0.00 -1.00 0.00 2.07 -1.88 -2.10 116.25 120.21 2hpb h VAL 117 Ca 0.18 0.00 0.29 0.00 0.82 0.00 0.00 66.70 68.00 2hpb h VAL 117 Cb 1.00 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.63 2hpb h VAL 117 CO 1.38 0.00 0.57 1.55 0.02 0.00 0.00 177.57 181.09 2hpb h PRO 118 N -0.44 0.40 -0.59 1.57 0.13 -1.98 0.26 132.00 131.35 2hpb h PRO 118 Ca 0.06 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 65.14 2hpb h PRO 118 Cb 0.60 -0.09 -0.03 0.00 0.13 0.00 0.00 31.00 31.61 2hpb h PRO 118 CO -0.53 0.27 0.28 0.28 -0.23 0.00 0.00 178.00 178.07 2hpb h VAL 119 N 0.41 1.21 0.00 1.56 2.07 -1.79 -0.38 116.25 119.33 2hpb h VAL 119 Ca 0.70 -0.59 -0.16 0.00 0.82 0.00 0.00 66.70 67.46 2hpb h VAL 119 Cb 1.49 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 2hpb h VAL 119 CO -0.56 0.24 -0.92 -0.26 0.02 0.00 0.00 177.57 176.10 2hpb h PHE 120 N 0.81 0.00 -0.16 1.57 0.04 -1.02 -2.70 116.94 115.48 2hpb h PHE 120 Ca 0.20 0.00 0.04 0.00 2.80 0.00 0.00 57.97 61.01 2hpb h PHE 120 Cb 0.12 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.23 2hpb h PHE 120 CO -0.00 0.71 -0.10 1.96 -0.60 0.00 0.00 178.31 180.28 2hpb h GLN 121 N 0.00 -0.09 -0.48 1.51 4.20 -0.32 0.18 115.11 120.11 2hpb h GLN 121 Ca -0.06 0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.70 2hpb h GLN 121 Cb 1.59 0.02 -0.04 0.00 0.30 0.00 0.00 27.48 29.36 2hpb h GLN 121 CO 0.08 -0.06 0.25 0.37 -0.67 0.00 0.00 178.83 178.80 2hpb h GLN 122 N -0.10 0.49 -0.31 1.46 5.75 -1.07 -1.82 115.11 119.50 2hpb h GLN 122 Ca 0.09 -0.03 0.03 0.00 -0.15 0.00 0.00 58.65 58.59 2hpb h GLN 122 Cb 0.23 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.65 2hpb h GLN 122 CO -0.22 0.32 0.13 0.82 -2.65 0.00 0.00 178.83 177.24 2hpb h ILE 123 N 0.50 0.95 -0.53 2.39 2.04 -1.23 -2.35 117.51 119.28 2hpb h ILE 123 Ca 0.21 -0.10 0.09 0.00 1.00 0.00 0.00 64.86 66.05 2hpb h ILE 123 Cb 0.09 0.64 -0.07 0.00 -0.74 0.00 0.00 36.82 36.75 2hpb h ILE 123 CO -0.13 0.05 0.15 0.00 0.00 0.00 0.00 178.15 178.22 2hpb h ALA 124 N 1.18 0.64 -0.31 1.87 0.00 -0.55 0.11 119.26 122.20 2hpb h ALA 124 Ca 0.13 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2hpb h ALA 124 Cb 0.07 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2hpb h ALA 124 CO -0.11 -0.26 0.17 0.00 0.00 0.00 0.00 179.25 179.04 2hpb h ARG 125 N 0.30 0.43 -0.45 0.00 3.08 -1.12 0.81 114.38 117.44 2hpb h ARG 125 Ca 0.27 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.20 2hpb h ARG 125 Cb 0.34 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 2hpb h ARG 125 CO -0.31 0.37 0.02 0.93 -1.07 0.00 0.00 179.97 179.91 2hpb h GLU 126 N 0.37 0.72 0.29 0.04 5.08 -0.97 -2.40 114.58 117.71 2hpb h GLU 126 Ca 0.11 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 2hpb h GLU 126 Cb 0.07 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2hpb h GLU 126 CO -0.02 0.72 -0.14 0.28 -1.00 0.00 0.00 179.01 178.85 2hpb h VAL 127 N 0.68 0.75 0.00 3.13 2.07 -0.55 -3.49 116.25 118.84 2hpb h VAL 127 Ca 0.14 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.36 2hpb h VAL 127 Cb 0.39 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 2hpb h VAL 127 CO 0.01 0.06 0.00 0.61 0.02 0.00 0.00 177.57 178.28 2hpb n GLY 128 N -0.83 -0.23 0.07 2.17 0.00 0.26 -4.48 105.19 102.15 2hpb n GLY 128 Ca -0.10 -1.71 -0.13 0.00 0.00 0.00 0.00 46.02 44.08 2hpb n GLY 128 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2hpb h GLU 129 N 0.00 -0.04 -0.08 1.61 4.81 -1.87 -1.08 114.58 117.93 2hpb h GLU 129 Ca 0.00 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.27 2hpb h GLU 129 Cb 0.00 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.33 2hpb h GLU 129 CO 0.00 0.35 -0.38 0.28 -0.73 0.00 0.00 179.01 178.53 2hpb h VAL 130 N -0.43 0.21 -0.24 0.32 2.07 -1.99 0.28 116.25 116.47 2hpb h VAL 130 Ca -0.00 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.45 2hpb h VAL 130 Cb 0.40 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 2hpb h VAL 130 CO 0.01 0.00 -0.16 0.03 0.02 0.00 0.00 177.57 177.47 2hpb h ARG 131 N -0.48 0.41 -0.28 1.57 3.08 -1.78 -0.67 114.38 116.23 2hpb h ARG 131 Ca 0.07 -0.12 -0.11 0.00 0.07 0.00 0.00 59.98 59.90 2hpb h ARG 131 Cb 0.60 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 2hpb h ARG 131 CO -0.35 0.56 -0.24 1.98 -1.07 0.00 0.00 179.97 180.85 2hpb h MET 132 N 0.38 0.65 -0.92 0.04 4.05 -0.78 -1.93 114.93 116.42 2hpb h MET 132 Ca 0.07 -0.33 0.04 0.00 -0.28 0.00 0.00 59.70 59.20 2hpb h MET 132 Cb 0.50 0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 31.26 2hpb h MET 132 CO 0.03 0.93 0.60 0.37 0.23 0.00 0.00 176.91 179.08 2hpb h GLN 133 N 0.38 1.11 0.01 0.39 5.75 -0.21 -2.24 115.11 120.30 2hpb h GLN 133 Ca 0.05 -0.07 -0.00 0.00 -0.15 0.00 0.00 58.65 58.48 2hpb h GLN 133 Cb 0.80 -0.25 0.00 0.00 1.07 0.00 0.00 27.48 29.10 2hpb h GLN 133 CO 0.06 0.73 -0.01 -0.22 -2.65 0.00 0.00 178.83 176.75 2hpb h LYS 134 N 1.14 -0.01 -0.45 1.69 3.64 -0.96 -2.16 116.57 119.45 2hpb h LYS 134 Ca 0.37 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.65 2hpb h LYS 134 Cb 0.04 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 2hpb h LYS 134 CO -0.12 0.40 -0.12 1.88 -2.27 0.00 0.00 179.45 179.23 2hpb h TYR 135 N -0.43 0.91 0.00 1.91 0.05 -1.30 -0.74 116.97 117.37 2hpb h TYR 135 Ca -0.00 -0.17 -0.08 0.00 0.05 0.00 0.00 58.73 58.52 2hpb h TYR 135 Cb 0.42 -0.23 -0.01 0.00 1.01 0.00 0.00 36.73 37.92 2hpb h TYR 135 CO 0.07 0.90 -0.40 -0.07 -1.05 0.00 0.00 178.16 177.61 2hpb h LEU 136 N 0.74 0.00 -0.09 3.88 3.38 -1.44 0.13 115.31 121.91 2hpb h LEU 136 Ca 0.12 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 2hpb h LEU 136 Cb 0.62 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 2hpb h LEU 136 CO 0.04 0.40 0.02 0.50 0.09 0.00 0.00 178.44 179.48 2hpb h LYS 137 N 0.00 0.15 -0.63 1.13 3.64 -0.94 -1.60 116.57 118.32 2hpb h LYS 137 Ca -0.00 -0.04 0.09 0.00 -1.27 0.00 0.00 60.65 59.43 2hpb h LYS 137 Cb 0.70 -0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.43 2hpb h LYS 137 CO 0.05 0.35 0.26 0.87 -2.27 0.00 0.00 179.45 178.71 2hpb h LYS 138 N -0.08 0.44 -0.00 1.90 1.57 -0.38 -2.71 116.57 117.30 2hpb h LYS 138 Ca 0.03 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2hpb h LYS 138 Cb 0.28 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.49 2hpb h LYS 138 CO 0.00 0.29 -0.11 1.19 -0.57 0.00 0.00 179.45 180.25 2hpb n PHE 139 N -4.96 0.00 -3.90 -1.35 3.72 0.38 -4.79 117.46 106.56 2hpb n PHE 139 Ca 0.09 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.22 2hpb n PHE 139 Cb 0.27 -0.33 0.01 0.00 -0.94 0.00 0.00 39.48 38.49 2hpb n PHE 139 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2hpb n SER 140 N -1.30 -2.27 -4.47 4.37 7.64 -0.66 -4.87 113.62 112.06 2hpb n SER 140 Ca 0.10 -0.88 -0.43 0.00 1.01 0.00 0.00 58.87 58.67 2hpb n SER 140 Cb 0.30 -3.57 -0.03 0.00 -1.01 0.00 0.00 64.21 59.90 2hpb n SER 140 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 2hpb s TYR 141 N -3.59 2.93 0.00 1.43 5.04 -0.84 -4.96 117.35 117.36 2hpb s TYR 141 Ca 0.29 -1.11 0.00 0.00 -2.44 0.00 0.00 57.07 53.81 2hpb s TYR 141 Cb -0.15 -4.34 0.00 0.00 0.35 0.00 0.00 41.96 37.82 2hpb s TYR 141 CO 0.85 -1.59 0.00 0.41 -1.34 0.00 0.00 175.55 173.88 2hpb n GLY 142 N 5.64 1.68 0.18 8.97 0.00 -1.26 -2.99 105.19 117.40 2hpb n GLY 142 Ca 0.18 -0.59 0.14 0.00 0.00 0.00 0.00 46.02 45.75 2hpb n GLY 142 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2hpb h ASN 143 N 9.35 0.00 -2.69 1.61 -1.07 -1.61 -3.47 115.58 117.69 2hpb h ASN 143 Ca 0.00 0.00 -0.30 0.00 0.07 0.00 0.00 56.30 56.07 2hpb h ASN 143 Cb 0.00 0.00 0.01 0.00 -2.07 0.00 0.00 38.32 36.26 2hpb h ASN 143 CO 0.00 0.00 -0.42 0.00 0.07 0.00 0.00 177.43 177.08 2hpb n GLN 144 N -2.61 -2.23 -3.31 4.14 6.02 -1.16 -5.00 117.38 113.24 2hpb n GLN 144 Ca 0.03 0.71 -0.45 0.00 -0.01 0.00 0.00 57.00 57.28 2hpb n GLN 144 Cb 0.35 -5.07 -0.06 0.00 1.02 0.00 0.00 30.24 26.48 2hpb n GLN 144 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2hpb s ASN 145 N -2.51 6.17 -0.32 1.08 3.04 -1.26 -4.94 114.94 116.21 2hpb s ASN 145 Ca 0.09 -1.40 0.10 0.00 0.04 0.00 0.00 52.86 51.69 2hpb s ASN 145 Cb -0.04 -2.22 0.72 0.00 -1.54 0.00 0.00 41.25 38.18 2hpb s ASN 145 CO 0.12 -0.78 1.77 2.30 -3.04 0.00 0.00 177.10 177.47 2hpb n ILE 146 N 5.30 2.89 -2.90 -5.21 -5.35 -1.26 -1.56 119.36 111.28 2hpb n ILE 146 Ca -0.12 -1.73 -0.29 0.00 -0.27 0.00 0.00 62.75 60.35 2hpb n ILE 146 Cb 0.43 -0.35 -0.02 0.00 -1.74 0.00 0.00 39.64 37.96 2hpb n ILE 146 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2hpb s SER 147 N -1.18 6.40 0.00 7.28 1.04 -1.26 -4.63 113.70 121.35 2hpb s SER 147 Ca 0.54 0.94 0.00 0.00 0.48 0.00 0.00 55.95 57.92 2hpb s SER 147 Cb 0.44 -2.25 0.00 0.00 0.10 0.00 0.00 66.02 64.31 2hpb s SER 147 CO 0.12 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 174.54 2hpb n GLY 148 N -1.59 0.69 1.25 7.32 0.00 -1.26 -2.83 105.19 108.76 2hpb n GLY 148 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2hpb n GLY 148 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hpb n GLY 149 N 0.00 -2.38 0.00 -0.02 0.00 -1.26 -3.91 105.19 97.61 2hpb n GLY 149 Ca 0.00 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.10 2hpb n GLY 149 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2hpb n ILE 150 N -0.07 0.00 -1.42 -0.61 0.13 -1.26 -4.64 119.36 111.48 2hpb n ILE 150 Ca 0.00 -0.33 0.07 0.00 -1.10 0.00 0.00 62.75 61.40 2hpb n ILE 150 Cb 0.00 1.34 0.14 0.00 -0.84 0.00 0.00 39.64 40.28 2hpb n ILE 150 CO 0.00 0.00 0.00 -0.90 2.80 0.00 0.00 176.55 178.45 2hpb n ASP 151 N -0.01 1.83 0.00 9.51 5.68 -1.26 -4.50 116.55 127.79 2hpb n ASP 151 Ca 0.00 -3.18 0.00 0.00 -0.50 0.00 0.00 54.79 51.11 2hpb n ASP 151 Cb 0.08 -0.43 0.00 0.00 -1.14 0.00 0.00 41.12 39.63 2hpb n ASP 151 CO 0.00 0.00 0.00 2.29 -1.33 0.00 0.00 177.20 178.16 2hpb n LYS 152 N -1.07 0.00 0.05 0.11 2.85 -1.26 -4.91 118.16 113.93 2hpb n LYS 152 Ca 0.15 0.00 0.03 0.00 -1.05 0.00 0.00 58.31 57.44 2hpb n LYS 152 Cb 0.69 0.00 0.18 0.00 -0.65 0.00 0.00 35.03 35.26 2hpb n LYS 152 CO 0.00 0.00 0.00 1.97 -0.05 0.00 0.00 177.40 179.32 2hpb n PHE 153 N 0.00 0.23 0.13 5.58 1.16 -1.25 -0.14 117.46 123.17 2hpb n PHE 153 Ca 0.00 0.12 0.03 0.00 -1.87 0.00 0.00 57.45 55.73 2hpb n PHE 153 Cb 0.22 -0.69 -0.04 0.00 -1.61 0.00 0.00 39.48 37.36 2hpb n PHE 153 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2hpb n ALA 154 N -1.58 2.47 -0.09 1.98 0.00 -1.26 -1.57 120.51 120.45 2hpb n ALA 154 Ca -0.00 -0.15 -0.11 0.00 0.00 0.00 0.00 53.44 53.18 2hpb n ALA 154 Cb 0.01 -0.20 -0.12 0.00 0.00 0.00 0.00 19.45 19.14 2hpb n ALA 154 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2hpb n LEU 155 N -1.43 1.18 0.00 0.00 7.94 -0.85 -0.69 117.00 123.15 2hpb n LEU 155 Ca -0.00 -0.05 0.00 0.00 -1.11 0.00 0.00 56.01 54.85 2hpb n LEU 155 Cb 0.12 -0.05 0.00 0.00 0.53 0.00 0.00 43.42 44.02 2hpb n LEU 155 CO 0.12 0.60 0.15 -1.84 -1.11 0.00 0.00 177.39 175.31 2hpb n GLU 156 N -2.83 0.00 0.00 1.96 0.28 -0.00 -4.82 120.64 115.23 2hpb n GLU 156 Ca -0.32 -0.31 0.00 0.00 -0.16 0.00 0.00 57.16 56.37 2hpb n GLU 156 Cb 1.00 -0.31 0.00 0.00 1.43 0.00 0.00 31.44 33.56 2hpb n GLU 156 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2hpb n GLY 157 N 0.00 1.57 0.00 -1.84 0.00 0.80 -4.92 105.19 100.81 2hpb n GLY 157 Ca 0.00 -1.64 0.06 0.00 0.00 0.00 0.00 46.02 44.44 2hpb n GLY 157 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2hpb n GLN 158 N 0.00 2.33 -2.26 1.61 1.13 -1.05 -4.85 117.38 114.30 2hpb n GLN 158 Ca 0.00 -0.02 -0.41 0.00 -1.94 0.00 0.00 57.00 54.63 2hpb n GLN 158 Cb 0.00 -1.15 -0.03 0.00 0.11 0.00 0.00 30.24 29.17 2hpb n GLN 158 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 2hpb s LEU 159 N -2.81 4.41 0.01 1.08 2.96 -0.60 -4.70 118.68 119.03 2hpb s LEU 159 Ca 0.04 2.33 0.01 0.00 -0.22 0.00 0.00 54.13 56.29 2hpb s LEU 159 Cb 0.10 -3.60 -0.01 0.00 0.50 0.00 0.00 46.19 43.17 2hpb s LEU 159 CO 0.54 -0.51 -0.05 -0.13 -1.32 0.00 0.00 176.35 174.89 2hpb s ARG 160 N 0.08 0.37 0.02 1.98 1.81 -1.26 -4.14 118.95 117.80 2hpb s ARG 160 Ca 0.57 -0.39 -0.01 0.00 -1.72 0.00 0.00 55.73 54.18 2hpb s ARG 160 Cb -0.35 -0.23 -0.02 0.00 -0.45 0.00 0.00 34.95 33.90 2hpb s ARG 160 CO 0.36 0.05 -0.01 -1.50 -0.68 0.00 0.00 175.30 173.53 2hpb s ILE 161 N -0.67 0.10 0.28 1.52 2.07 0.10 -1.43 121.20 123.16 2hpb s ILE 161 Ca -0.05 -0.81 0.02 0.00 -1.41 0.00 0.00 60.65 58.40 2hpb s ILE 161 Cb -0.05 -0.26 -0.03 0.00 0.13 0.00 0.00 42.46 42.25 2hpb s ILE 161 CO -0.00 -0.45 0.45 -0.94 -1.91 0.00 0.00 174.94 172.09 2hpb s SER 162 N -1.33 6.33 0.18 4.50 1.04 -1.26 -0.30 113.70 122.87 2hpb s SER 162 Ca -0.14 0.32 -0.13 0.00 0.48 0.00 0.00 55.95 56.47 2hpb s SER 162 Cb -0.09 -1.97 0.18 0.00 0.10 0.00 0.00 66.02 64.24 2hpb s SER 162 CO -0.01 -0.16 1.72 0.00 0.98 0.00 0.00 173.24 175.78 2hpb h ALA 163 N 1.20 0.55 -0.74 5.32 0.00 -1.66 -1.50 119.26 122.44 2hpb h ALA 163 Ca -0.50 0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.54 2hpb h ALA 163 Cb 1.22 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 19.07 2hpb h ALA 163 CO 0.63 -0.29 0.46 0.28 0.00 0.00 0.00 179.25 180.33 2hpb h VAL 164 N 0.26 1.07 -0.28 0.00 2.07 -1.69 -2.52 116.25 115.15 2hpb h VAL 164 Ca 0.24 -0.30 -0.07 0.00 0.82 0.00 0.00 66.70 67.39 2hpb h VAL 164 Cb 0.31 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.17 2hpb h VAL 164 CO -0.30 0.16 -0.12 -1.13 0.02 0.00 0.00 177.57 176.20 2hpb h ASN 165 N 0.88 0.46 -0.04 0.57 -0.00 -1.72 -2.42 115.58 113.31 2hpb h ASN 165 Ca 0.31 -0.12 -0.00 0.00 -0.00 0.00 0.00 56.30 56.49 2hpb h ASN 165 Cb 0.07 -0.12 -0.00 0.00 -0.00 0.00 0.00 38.32 38.27 2hpb h ASN 165 CO -0.13 0.62 0.02 1.56 -0.00 0.00 0.00 177.43 179.49 2hpb h GLN 166 N 0.44 0.06 -0.40 6.67 1.08 -0.88 -1.26 115.11 120.83 2hpb h GLN 166 Ca 0.08 -0.01 -0.05 0.00 -1.45 0.00 0.00 58.65 57.22 2hpb h GLN 166 Cb 0.48 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.88 2hpb h GLN 166 CO 0.03 0.18 0.03 -0.39 -0.95 0.00 0.00 178.83 177.72 2hpb h VAL 167 N -0.06 1.21 -0.16 -0.54 -1.51 -1.25 0.18 116.25 114.12 2hpb h VAL 167 Ca 0.01 -0.81 -0.04 0.00 -1.23 0.00 0.00 66.70 64.63 2hpb h VAL 167 Cb 0.14 0.87 -0.00 0.00 -2.13 0.00 0.00 31.29 30.16 2hpb h VAL 167 CO -0.00 0.29 -0.07 -0.33 -1.23 0.00 0.00 177.57 176.22 2hpb h GLU 168 N 0.60 0.33 0.33 5.19 5.08 -1.38 -0.70 114.58 124.02 2hpb h GLU 168 Ca 0.13 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2hpb h GLU 168 Cb 0.33 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 2hpb h GLU 168 CO 0.01 0.64 -0.45 0.35 -1.00 0.00 0.00 179.01 178.57 2hpb h PHE 169 N 0.00 -1.24 -0.76 4.33 3.57 -0.91 -1.48 116.94 120.46 2hpb h PHE 169 Ca 0.04 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.64 2hpb h PHE 169 Cb 0.55 0.50 -0.05 0.00 2.79 0.00 0.00 35.95 39.73 2hpb h PHE 169 CO 0.06 -0.58 0.50 -0.07 -2.23 0.00 0.00 178.31 175.99 2hpb h LEU 170 N -0.82 0.63 -0.84 0.59 3.38 -0.68 -0.53 115.31 117.04 2hpb h LEU 170 Ca -0.02 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 2hpb h LEU 170 Cb 0.76 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 2hpb h LEU 170 CO -0.13 0.38 0.16 -0.08 0.09 0.00 0.00 178.44 178.86 2hpb h GLU 171 N 0.70 1.02 -0.56 1.13 4.81 -0.85 -1.51 114.58 119.33 2hpb h GLU 171 Ca 0.34 -0.23 -0.08 0.00 -0.13 0.00 0.00 59.36 59.26 2hpb h GLU 171 Cb 0.41 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 2hpb h GLU 171 CO -0.12 0.91 0.05 0.77 -0.73 0.00 0.00 179.01 179.88 2hpb h SER 172 N 0.98 0.92 0.26 1.04 0.02 -0.06 -1.90 113.55 114.80 2hpb h SER 172 Ca 0.21 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 2hpb h SER 172 Cb 0.35 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 2hpb h SER 172 CO 0.00 0.98 -0.28 0.25 -1.14 0.00 0.00 176.83 176.63 2hpb h LEU 173 N 0.84 -0.77 -0.55 5.07 5.85 -1.02 0.47 115.31 125.20 2hpb h LEU 173 Ca 0.16 0.07 0.10 0.00 0.84 0.00 0.00 57.88 59.06 2hpb h LEU 173 Cb 0.48 0.27 -0.08 0.00 0.37 0.00 0.00 40.66 41.69 2hpb h LEU 173 CO 0.02 -0.40 0.07 0.22 -0.34 0.00 0.00 178.44 178.01 2hpb h TYR 174 N -0.58 0.10 0.00 1.25 3.20 -1.18 0.32 116.97 120.08 2hpb h TYR 174 Ca -0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2hpb h TYR 174 Cb 0.55 0.04 0.00 0.00 1.54 0.00 0.00 36.73 38.86 2hpb h TYR 174 CO -0.19 -0.06 0.00 1.28 -1.64 0.00 0.00 178.16 177.54 2hpb n LEU 175 N -5.17 0.00 -1.99 2.82 4.77 -0.72 -4.87 117.00 111.84 2hpb n LEU 175 Ca 0.07 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.87 2hpb n LEU 175 Cb 0.29 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.34 2hpb n LEU 175 CO 0.17 0.00 -0.21 0.59 -1.33 0.00 0.00 177.39 176.61 2hpb n ASN 176 N -0.77 -5.14 -0.80 -1.43 3.02 0.10 -4.88 115.26 105.36 2hpb n ASN 176 Ca 0.12 0.24 0.09 0.00 -0.03 0.00 0.00 54.58 55.00 2hpb n ASN 176 Cb 0.05 -4.43 0.27 0.00 -0.61 0.00 0.00 39.78 35.06 2hpb n ASN 176 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2hpb n LYS 177 N -2.61 2.03 -2.29 3.52 5.02 0.16 -4.76 118.16 119.23 2hpb n LYS 177 Ca -0.20 -1.57 -0.33 0.00 -2.02 0.00 0.00 58.31 54.19 2hpb n LYS 177 Cb 0.64 -1.40 -0.02 0.00 -0.02 0.00 0.00 35.03 34.23 2hpb n LYS 177 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2hpb s LEU 178 N -1.30 3.62 -1.07 -0.35 1.43 -1.22 -4.92 118.68 114.86 2hpb s LEU 178 Ca 0.33 1.74 -0.16 0.00 -1.03 0.00 0.00 54.13 55.01 2hpb s LEU 178 Cb 0.18 -4.53 -0.08 0.00 0.03 0.00 0.00 46.19 41.79 2hpb s LEU 178 CO 0.25 -0.86 2.12 -1.20 0.23 0.00 0.00 176.35 176.89 2hpb n SER 179 N -1.63 3.72 -3.80 2.29 7.64 -1.26 -4.70 113.62 115.88 2hpb n SER 179 Ca 0.08 -2.68 -0.09 0.00 1.01 0.00 0.00 58.87 57.19 2hpb n SER 179 Cb 0.53 -1.32 -0.04 0.00 -1.01 0.00 0.00 64.21 62.38 2hpb n SER 179 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2hpb s ALA 180 N 4.01 -0.86 0.36 -0.43 0.00 -1.26 -5.02 121.76 118.55 2hpb s ALA 180 Ca 0.53 -0.35 -0.27 0.00 0.00 0.00 0.00 51.96 51.87 2hpb s ALA 180 Cb 0.14 0.89 -0.09 0.00 0.00 0.00 0.00 23.12 24.06 2hpb s ALA 180 CO 0.02 -0.85 1.21 -1.54 0.00 0.00 0.00 175.76 174.60 2hpb s SER 181 N -2.90 6.71 0.33 0.00 1.04 -1.26 -4.91 113.70 112.71 2hpb s SER 181 Ca 0.12 2.46 0.09 0.00 0.48 0.00 0.00 55.95 59.10 2hpb s SER 181 Cb -0.02 -2.63 0.82 0.00 0.10 0.00 0.00 66.02 64.30 2hpb s SER 181 CO 0.01 -0.55 1.78 0.50 0.98 0.00 0.00 173.24 175.96 2hpb h LYS 182 N 3.08 0.66 -0.53 4.02 3.64 -1.91 -0.31 116.57 125.22 2hpb h LYS 182 Ca -0.48 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 58.86 2hpb h LYS 182 Cb 1.23 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.87 2hpb h LYS 182 CO 0.64 0.44 0.33 1.49 -2.27 0.00 0.00 179.45 180.07 2hpb h GLU 183 N 0.68 0.71 -0.16 1.90 4.81 -1.99 0.91 114.58 121.44 2hpb h GLU 183 Ca 0.57 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.65 2hpb h GLU 183 Cb 1.01 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.22 2hpb h GLU 183 CO -0.35 0.50 -0.33 -0.91 -0.73 0.00 0.00 179.01 177.18 2hpb h ASN 184 N 0.71 0.32 0.11 1.04 2.35 -1.46 -1.21 115.58 117.43 2hpb h ASN 184 Ca 0.19 -0.12 -0.20 0.00 -0.55 0.00 0.00 56.30 55.62 2hpb h ASN 184 Cb -0.04 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.24 2hpb h ASN 184 CO -0.04 0.64 -0.73 1.56 -1.65 0.00 0.00 177.43 177.21 2hpb h GLN 185 N 0.28 0.54 -0.80 0.81 4.20 -0.80 -2.30 115.11 117.05 2hpb h GLN 185 Ca 0.03 -0.44 -0.04 0.00 0.06 0.00 0.00 58.65 58.27 2hpb h GLN 185 Cb 0.72 0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.56 2hpb h GLN 185 CO 0.06 1.06 0.34 -0.07 -0.67 0.00 0.00 178.83 179.55 2hpb h LEU 186 N 0.37 1.09 -0.12 1.46 3.38 -0.64 0.27 115.31 121.12 2hpb h LEU 186 Ca -0.04 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2hpb h LEU 186 Cb 1.32 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 2hpb h LEU 186 CO 0.14 0.95 0.08 0.40 0.09 0.00 0.00 178.44 180.09 2hpb h ILE 187 N 1.15 1.05 -0.21 1.22 2.04 -1.07 -1.75 117.51 119.94 2hpb h ILE 187 Ca 0.27 -0.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.99 2hpb h ILE 187 Cb 0.19 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 2hpb h ILE 187 CO -0.03 0.05 0.05 0.58 0.00 0.00 0.00 178.15 178.80 2hpb h VAL 188 N 0.14 1.21 -0.67 1.67 2.07 -1.27 -2.74 116.25 116.65 2hpb h VAL 188 Ca 0.04 -0.66 0.12 0.00 0.82 0.00 0.00 66.70 67.02 2hpb h VAL 188 Cb 0.01 1.24 -0.09 0.00 -1.52 0.00 0.00 31.29 30.93 2hpb h VAL 188 CO -0.01 0.21 0.24 0.11 0.02 0.00 0.00 177.57 178.14 2hpb h LYS 189 N 0.17 0.38 -0.36 1.57 1.57 -0.86 -0.14 116.57 118.90 2hpb h LYS 189 Ca 0.07 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 2hpb h LYS 189 Cb 0.27 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 2hpb h LYS 189 CO 0.00 0.25 0.07 1.49 -0.57 0.00 0.00 179.45 180.69 2hpb h GLU 190 N 0.40 0.53 -0.00 3.15 4.81 -1.23 -2.15 114.58 120.09 2hpb h GLU 190 Ca 0.36 -0.09 -0.05 0.00 -0.13 0.00 0.00 59.36 59.44 2hpb h GLU 190 Cb 0.50 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 2hpb h GLU 190 CO -0.37 0.51 -0.24 0.00 -0.73 0.00 0.00 179.01 178.18 2hpb h ALA 191 N 1.56 1.59 -0.00 2.92 0.00 -0.75 -2.89 119.26 121.69 2hpb h ALA 191 Ca 0.12 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2hpb h ALA 191 Cb 0.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2hpb h ALA 191 CO -0.00 0.31 -0.17 1.28 0.00 0.00 0.00 179.25 180.66 2hpb n LEU 192 N -4.25 0.17 -4.67 0.00 4.77 -0.64 -4.77 117.00 107.61 2hpb n LEU 192 Ca -0.02 0.33 -0.47 0.00 -0.03 0.00 0.00 56.01 55.82 2hpb n LEU 192 Cb 0.30 -0.41 -0.04 0.00 -2.33 0.00 0.00 43.42 40.93 2hpb n LEU 192 CO 0.37 0.04 1.33 0.52 -1.33 0.00 0.00 177.39 178.32 2hpb n VAL 193 N -1.50 0.27 0.00 4.08 0.31 -1.09 -1.63 118.33 118.77 2hpb n VAL 193 Ca 0.07 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 2hpb n VAL 193 Cb 0.34 -1.70 0.00 0.00 -0.91 0.00 0.00 33.84 31.57 2hpb n VAL 193 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2hpb n THR 194 N 4.20 0.00 -3.71 2.52 -2.24 -0.29 -4.90 114.28 109.87 2hpb n THR 194 Ca 0.19 -0.04 -0.11 0.00 -2.27 0.00 0.00 64.05 61.83 2hpb n THR 194 Cb 0.29 0.50 -0.11 0.00 -2.10 0.00 0.00 70.33 68.91 2hpb n THR 194 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2hpb s GLU 195 N -1.73 0.37 -0.09 -0.78 2.12 -1.16 -5.01 118.70 112.41 2hpb s GLU 195 Ca 0.00 0.71 0.03 0.00 0.36 0.00 0.00 54.97 56.06 2hpb s GLU 195 Cb 0.00 -0.01 0.01 0.00 0.26 0.00 0.00 34.13 34.39 2hpb s GLU 195 CO 0.00 -0.15 -0.16 0.00 -0.54 0.00 0.00 175.26 174.42 2hpb s ALA 196 N 1.22 1.60 0.11 6.30 0.00 -1.26 -0.21 121.76 129.52 2hpb s ALA 196 Ca -0.08 -0.64 0.03 0.00 0.00 0.00 0.00 51.96 51.27 2hpb s ALA 196 Cb -0.08 -0.70 -0.04 0.00 0.00 0.00 0.00 23.12 22.30 2hpb s ALA 196 CO -0.10 0.10 -0.09 0.00 0.00 0.00 0.00 175.76 175.67 2hpb s ALA 197 N 0.68 1.11 0.45 0.00 0.00 0.14 -5.03 121.76 119.11 2hpb s ALA 197 Ca -0.13 -1.30 0.37 0.00 0.00 0.00 0.00 51.96 50.90 2hpb s ALA 197 Cb -0.16 0.09 1.89 0.00 0.00 0.00 0.00 23.12 24.94 2hpb s ALA 197 CO 0.03 -0.13 2.19 -1.35 0.00 0.00 0.00 175.76 176.51 2hpb h PRO 198 N 3.20 0.00 0.00 0.00 0.11 -2.02 -2.85 132.00 130.44 2hpb h PRO 198 Ca -0.36 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.51 2hpb h PRO 198 Cb 1.18 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 2hpb h PRO 198 CO 0.59 0.03 -2.08 0.39 -0.21 0.00 0.00 178.00 176.71 2hpb n GLU 199 N -3.24 0.67 -3.85 1.05 -0.58 -1.26 -5.01 120.64 108.42 2hpb n GLU 199 Ca -0.02 0.00 -0.10 0.00 -0.42 0.00 0.00 57.16 56.62 2hpb n GLU 199 Cb 0.17 -1.59 -0.08 0.00 -0.57 0.00 0.00 31.44 29.38 2hpb n GLU 199 CO 0.00 0.00 0.00 1.52 -0.48 0.00 0.00 177.13 178.17 2hpb s TYR 200 N -2.82 0.06 -0.07 -0.32 -0.85 -1.07 -3.39 117.35 108.89 2hpb s TYR 200 Ca -0.08 -0.30 0.03 0.00 -0.52 0.00 0.00 57.07 56.19 2hpb s TYR 200 Cb 0.09 -0.03 0.01 0.00 0.38 0.00 0.00 41.96 42.40 2hpb s TYR 200 CO 0.85 -0.44 -0.13 -1.17 -1.52 0.00 0.00 175.55 173.13 2hpb s LEU 201 N -2.15 1.70 -0.19 -3.49 2.96 -0.16 -0.68 118.68 116.67 2hpb s LEU 201 Ca -0.04 -0.32 -0.05 0.00 -0.22 0.00 0.00 54.13 53.50 2hpb s LEU 201 Cb -0.01 -0.88 -0.03 0.00 0.50 0.00 0.00 46.19 45.78 2hpb s LEU 201 CO -0.05 0.05 0.00 -0.69 -1.32 0.00 0.00 176.35 174.35 2hpb s VAL 202 N 0.59 4.02 -0.14 1.68 1.01 0.71 -0.98 120.40 127.29 2hpb s VAL 202 Ca -0.14 -0.29 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 2hpb s VAL 202 Cb -0.16 -2.81 -0.02 0.00 0.00 0.00 0.00 36.38 33.39 2hpb s VAL 202 CO 0.04 0.44 -0.08 -1.00 0.00 0.00 0.00 175.10 174.50 2hpb s HIS 203 N 0.84 2.92 0.11 5.22 3.76 -0.00 -1.13 115.29 127.00 2hpb s HIS 203 Ca 0.01 -0.48 -0.25 0.00 -0.15 0.00 0.00 55.06 54.19 2hpb s HIS 203 Cb -0.14 -1.90 0.08 0.00 1.11 0.00 0.00 32.58 31.73 2hpb s HIS 203 CO 0.02 -0.13 0.68 -1.54 -0.85 0.00 0.00 174.74 172.92 2hpb s SER 204 N 0.36 -0.52 -0.10 1.40 1.04 -0.64 -0.12 113.70 115.12 2hpb s SER 204 Ca -0.08 0.02 -0.10 0.00 0.48 0.00 0.00 55.95 56.28 2hpb s SER 204 Cb -0.15 0.54 0.03 0.00 0.10 0.00 0.00 66.02 66.54 2hpb s SER 204 CO 0.04 -0.87 0.28 -0.75 0.98 0.00 0.00 173.24 172.92 2hpb s LYS 205 N -3.51 0.35 0.36 4.02 2.47 0.41 -4.78 119.74 119.05 2hpb s LYS 205 Ca 0.02 0.34 0.02 0.00 -1.56 0.00 0.00 55.97 54.79 2hpb s LYS 205 Cb -0.01 0.17 -0.02 0.00 -1.46 0.00 0.00 37.83 36.51 2hpb s LYS 205 CO -0.11 -0.05 0.54 0.95 0.16 0.00 0.00 175.35 176.84 2hpb s THR 206 N 0.03 4.58 -0.06 3.43 -4.23 -1.26 -1.07 115.64 117.06 2hpb s THR 206 Ca -0.01 -0.67 -0.11 0.00 -1.18 0.00 0.00 61.69 59.72 2hpb s THR 206 Cb -0.02 -3.65 0.02 0.00 1.34 0.00 0.00 72.50 70.19 2hpb s THR 206 CO 0.01 -0.37 0.28 -0.83 -0.54 0.00 0.00 174.62 173.16 2hpb s GLY 207 N -4.11 -0.16 -0.27 3.99 0.00 -0.87 -3.18 107.32 102.73 2hpb s GLY 207 Ca 0.43 0.51 -0.04 0.00 0.00 0.00 0.00 44.72 45.61 2hpb s GLY 207 CO 0.34 0.36 0.52 -0.12 0.00 0.00 0.00 173.10 174.20 2hpb s PHE 208 N -0.60 -1.19 -0.51 1.90 5.36 -1.26 0.94 117.98 122.61 2hpb s PHE 208 Ca -0.07 1.57 0.24 0.00 -0.96 0.00 0.00 56.93 57.71 2hpb s PHE 208 Cb -0.04 0.42 0.41 0.00 -0.34 0.00 0.00 43.02 43.47 2hpb s PHE 208 CO 0.02 -0.72 1.52 0.66 -1.46 0.00 0.00 175.22 175.25 2hpb h SER 209 N 8.08 0.00 -4.58 6.13 4.64 -1.74 -3.44 113.55 122.64 2hpb h SER 209 Ca -0.20 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 2hpb h SER 209 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 2hpb h SER 209 CO 0.20 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 176.79 2hpb n GLY 210 N 1.20 2.33 0.00 -0.77 0.00 -1.26 -4.84 105.19 101.85 2hpb n GLY 210 Ca 0.04 -2.03 0.11 0.00 0.00 0.00 0.00 46.02 44.14 2hpb n GLY 210 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2hpb n VAL 211 N -1.42 0.37 -4.27 1.61 0.24 -1.26 -3.74 118.33 109.85 2hpb n VAL 211 Ca 0.00 0.09 0.00 0.00 -2.04 0.00 0.00 64.34 62.39 2hpb n VAL 211 Cb 0.00 -0.72 0.00 0.00 -1.47 0.00 0.00 33.84 31.65 2hpb n VAL 211 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2hpb n GLY 212 N 0.68 -1.64 0.00 7.63 0.00 -1.26 -2.96 105.19 107.64 2hpb n GLY 212 Ca 0.09 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.82 2hpb n GLY 212 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2hpb n THR 213 N -0.47 0.00 -2.51 2.61 -2.24 -0.26 -4.79 114.28 106.63 2hpb n THR 213 Ca 0.00 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.36 2hpb n THR 213 Cb 0.00 -0.56 -0.03 0.00 -2.10 0.00 0.00 70.33 67.64 2hpb n THR 213 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2hpb s GLU 214 N -1.83 4.41 0.00 -0.78 2.12 -1.26 -3.39 118.70 117.97 2hpb s GLU 214 Ca 0.00 1.64 0.00 0.00 0.36 0.00 0.00 54.97 56.97 2hpb s GLU 214 Cb 0.00 -3.48 0.00 0.00 0.26 0.00 0.00 34.13 30.91 2hpb s GLU 214 CO 0.00 -0.32 0.00 0.43 -0.54 0.00 0.00 175.26 174.83 2hpb n SER 215 N 4.63 0.00 -4.19 -1.70 7.64 -1.26 -4.87 113.62 113.87 2hpb n SER 215 Ca 0.09 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.57 2hpb n SER 215 Cb 0.47 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.61 2hpb n SER 215 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2hpb s ASN 216 N 0.00 6.05 0.72 6.43 -0.87 -1.22 -5.08 114.94 120.97 2hpb s ASN 216 Ca 0.00 -3.10 -0.11 0.00 -1.57 0.00 0.00 52.86 48.09 2hpb s ASN 216 Cb 0.00 -2.00 0.02 0.00 -0.02 0.00 0.00 41.25 39.25 2hpb s ASN 216 CO 0.00 -0.37 1.07 -2.16 -2.57 0.00 0.00 177.10 173.07 2hpb s PRO 217 N -0.43 2.70 0.90 -0.60 0.04 -1.25 -1.10 135.00 135.25 2hpb s PRO 217 Ca 0.21 0.87 -0.15 0.00 0.04 0.00 0.00 61.00 61.97 2hpb s PRO 217 Cb -0.13 -1.97 0.22 0.00 0.04 0.00 0.00 34.50 32.66 2hpb s PRO 217 CO -0.07 -1.24 0.80 0.41 0.04 0.00 0.00 177.00 176.93 2hpb n GLY 218 N -2.01 -2.69 3.14 0.56 0.00 0.82 -4.66 105.19 100.35 2hpb n GLY 218 Ca 0.07 -1.48 -0.22 0.00 0.00 0.00 0.00 46.02 44.40 2hpb n GLY 218 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2hpb s VAL 219 N -2.44 1.17 -0.02 1.61 0.11 -1.25 -0.35 120.40 119.22 2hpb s VAL 219 Ca 0.52 -0.83 0.06 0.00 -2.93 0.00 0.00 61.98 58.79 2hpb s VAL 219 Cb -0.05 -1.02 -0.01 0.00 -1.53 0.00 0.00 36.38 33.77 2hpb s VAL 219 CO 0.40 0.17 -0.20 0.00 -3.33 0.00 0.00 175.10 172.14 2hpb s ALA 220 N -0.60 1.71 0.20 1.54 0.00 -0.67 -2.11 121.76 121.83 2hpb s ALA 220 Ca 0.04 -0.87 0.10 0.00 0.00 0.00 0.00 51.96 51.24 2hpb s ALA 220 Cb -0.07 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.54 2hpb s ALA 220 CO 0.00 0.40 -0.17 -1.58 0.00 0.00 0.00 175.76 174.41 2hpb s TRP 221 N -0.37 2.44 -0.18 0.00 0.52 0.27 -2.13 118.94 119.48 2hpb s TRP 221 Ca 0.05 -0.30 -0.04 0.00 0.02 0.00 0.00 56.10 55.83 2hpb s TRP 221 Cb -0.09 -1.18 0.09 0.00 -1.15 0.00 0.00 33.47 31.15 2hpb s TRP 221 CO 0.00 0.54 0.28 -0.46 0.02 0.00 0.00 176.95 177.33 2hpb s TRP 222 N -1.84 -0.47 0.23 -1.98 -0.00 -0.42 -2.04 118.94 112.42 2hpb s TRP 222 Ca 0.24 0.71 0.07 0.00 -0.00 0.00 0.00 56.10 57.13 2hpb s TRP 222 Cb -0.08 -0.12 -0.05 0.00 -0.00 0.00 0.00 33.47 33.22 2hpb s TRP 222 CO 0.13 -0.52 -0.10 0.14 -0.00 0.00 0.00 176.95 176.60 2hpb s VAL 223 N 2.42 1.63 -5.00 5.86 -7.23 -0.24 -0.50 120.40 117.35 2hpb s VAL 223 Ca 0.05 -2.16 0.00 0.00 -1.81 0.00 0.00 61.98 58.06 2hpb s VAL 223 Cb -0.14 -2.20 0.00 0.00 0.56 0.00 0.00 36.38 34.60 2hpb s VAL 223 CO -0.11 -0.48 0.00 0.61 -0.31 0.00 0.00 175.10 174.81 2hpb n GLY 224 N -0.45 -0.36 3.30 2.32 0.00 -0.77 -0.45 105.19 108.79 2hpb n GLY 224 Ca -0.07 -1.12 -0.11 0.00 0.00 0.00 0.00 46.02 44.73 2hpb n GLY 224 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2hpb s TRP 225 N -3.22 -0.17 -0.09 1.61 -2.14 0.82 -0.69 118.94 115.06 2hpb s TRP 225 Ca 0.00 -0.12 0.03 0.00 2.66 0.00 0.00 56.10 58.66 2hpb s TRP 225 Cb 0.00 0.22 0.01 0.00 -3.10 0.00 0.00 33.47 30.59 2hpb s TRP 225 CO 0.00 -0.66 -0.17 0.08 -2.66 0.00 0.00 176.95 173.53 2hpb s VAL 226 N -3.63 1.59 -0.28 -0.66 1.01 0.09 -0.82 120.40 117.69 2hpb s VAL 226 Ca 0.02 -0.73 -0.09 0.00 0.00 0.00 0.00 61.98 61.18 2hpb s VAL 226 Cb 0.02 -1.41 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 2hpb s VAL 226 CO -0.11 0.46 0.13 -1.61 0.00 0.00 0.00 175.10 173.97 2hpb s GLU 227 N 0.64 3.57 -0.02 2.72 2.02 -0.15 -0.07 118.70 127.39 2hpb s GLU 227 Ca -0.14 -0.55 -0.00 0.00 0.02 0.00 0.00 54.97 54.30 2hpb s GLU 227 Cb -0.16 -3.48 0.03 0.00 0.10 0.00 0.00 34.13 30.61 2hpb s GLU 227 CO 0.04 -0.29 0.03 0.21 0.02 0.00 0.00 175.26 175.27 2hpb s LYS 228 N 1.64 0.04 3.42 1.61 2.36 -0.50 -0.99 119.74 127.32 2hpb s LYS 228 Ca 0.06 0.18 0.00 0.00 -2.55 0.00 0.00 55.97 53.66 2hpb s LYS 228 Cb -0.16 -0.33 0.00 0.00 -1.05 0.00 0.00 37.83 36.29 2hpb s LYS 228 CO 0.06 -0.18 0.00 0.39 1.55 0.00 0.00 175.35 177.17 2hpb n GLU 229 N 4.30 0.00 -0.58 4.03 4.71 -1.22 -0.96 120.64 130.92 2hpb n GLU 229 Ca -0.25 0.00 0.02 0.00 -0.01 0.00 0.00 57.16 56.92 2hpb n GLU 229 Cb 0.50 0.00 0.23 0.00 -1.01 0.00 0.00 31.44 31.16 2hpb n GLU 229 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 2hpb n THR 230 N 0.00 1.79 -4.23 2.62 -2.24 -1.26 -4.92 114.28 106.04 2hpb n THR 230 Ca 0.00 -0.90 -0.25 0.00 -2.27 0.00 0.00 64.05 60.63 2hpb n THR 230 Cb 0.00 -0.41 -0.07 0.00 -2.10 0.00 0.00 70.33 67.75 2hpb n THR 230 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2hpb s GLU 231 N -2.08 2.42 -0.04 -0.78 2.56 -0.14 -4.98 118.70 115.67 2hpb s GLU 231 Ca 0.34 -1.21 0.02 0.00 0.00 0.00 0.00 54.97 54.11 2hpb s GLU 231 Cb 0.26 -2.31 0.01 0.00 2.00 0.00 0.00 34.13 34.09 2hpb s GLU 231 CO 0.09 0.42 -0.07 0.08 -0.56 0.00 0.00 175.26 175.22 2hpb s VAL 232 N -1.99 0.70 -0.29 3.70 1.01 -1.26 -1.40 120.40 120.86 2hpb s VAL 232 Ca 0.29 -0.27 0.03 0.00 0.00 0.00 0.00 61.98 62.04 2hpb s VAL 232 Cb -0.08 -0.66 0.08 0.00 0.00 0.00 0.00 36.38 35.72 2hpb s VAL 232 CO 0.20 0.24 -0.04 -0.31 0.00 0.00 0.00 175.10 175.19 2hpb s TYR 233 N 0.50 3.47 -0.10 5.22 2.02 0.89 -1.46 117.35 127.90 2hpb s TYR 233 Ca -0.08 -2.59 -0.26 0.00 -0.37 0.00 0.00 57.07 53.77 2hpb s TYR 233 Cb -0.11 -2.34 -0.02 0.00 -0.40 0.00 0.00 41.96 39.08 2hpb s TYR 233 CO 0.01 -0.91 0.84 -0.06 -1.57 0.00 0.00 175.55 173.86 2hpb s PHE 234 N 1.02 3.53 0.18 2.71 0.08 -0.55 -0.73 117.98 124.22 2hpb s PHE 234 Ca -0.01 1.38 0.06 0.00 0.12 0.00 0.00 56.93 58.49 2hpb s PHE 234 Cb -0.20 -2.99 -0.05 0.00 -0.57 0.00 0.00 43.02 39.22 2hpb s PHE 234 CO -0.06 -0.09 -0.12 -0.59 -0.10 0.00 0.00 175.22 174.26 2hpb s PHE 235 N 1.49 1.51 -0.20 0.36 -0.71 0.14 -0.78 117.98 119.78 2hpb s PHE 235 Ca 0.42 -0.67 -0.08 0.00 -1.04 0.00 0.00 56.93 55.56 2hpb s PHE 235 Cb -0.18 -0.74 0.08 0.00 -1.21 0.00 0.00 43.02 40.98 2hpb s PHE 235 CO 0.18 0.22 0.45 0.00 -1.34 0.00 0.00 175.22 174.73 2hpb s ALA 236 N -3.15 -1.25 -0.05 1.99 0.00 -0.77 -1.85 121.76 116.69 2hpb s ALA 236 Ca 0.20 1.64 0.06 0.00 0.00 0.00 0.00 51.96 53.86 2hpb s ALA 236 Cb 0.01 -1.27 -0.01 0.00 0.00 0.00 0.00 23.12 21.86 2hpb s ALA 236 CO 0.04 -0.62 -0.22 0.12 0.00 0.00 0.00 175.76 175.09 2hpb s PHE 237 N 2.25 2.12 0.06 0.00 2.19 0.34 -0.22 117.98 124.72 2hpb s PHE 237 Ca -0.05 -0.59 -0.01 0.00 0.33 0.00 0.00 56.93 56.61 2hpb s PHE 237 Cb -0.11 -1.40 -0.04 0.00 -1.31 0.00 0.00 43.02 40.17 2hpb s PHE 237 CO -0.14 -0.18 -0.01 0.54 1.83 0.00 0.00 175.22 177.26 2hpb s ASN 238 N -0.14 0.46 -0.07 6.13 2.20 -0.60 -1.30 114.94 121.62 2hpb s ASN 238 Ca -0.02 -1.04 -0.22 0.00 -0.94 0.00 0.00 52.86 50.65 2hpb s ASN 238 Cb -0.12 0.22 0.05 0.00 -2.00 0.00 0.00 41.25 39.39 2hpb s ASN 238 CO 0.03 -0.62 0.50 0.00 -2.94 0.00 0.00 177.10 174.06 2hpb s MET 239 N -3.94 0.80 0.43 3.55 0.23 -0.91 -0.69 119.30 118.77 2hpb s MET 239 Ca 0.10 0.20 -0.25 0.00 -1.03 0.00 0.00 55.69 54.71 2hpb s MET 239 Cb 0.08 0.37 -0.08 0.00 -1.53 0.00 0.00 34.83 33.67 2hpb s MET 239 CO -0.08 -0.21 1.33 -0.51 -2.03 0.00 0.00 175.02 173.52 2hpb s ASP 240 N -0.88 6.14 -0.15 -1.18 1.01 0.07 -1.68 116.67 120.01 2hpb s ASP 240 Ca -0.09 2.71 -0.07 0.00 0.71 0.00 0.00 52.55 55.80 2hpb s ASP 240 Cb -0.03 -2.64 0.06 0.00 1.01 0.00 0.00 42.92 41.32 2hpb s ASP 240 CO 0.05 -0.97 0.34 -0.51 0.21 0.00 0.00 175.17 174.29 2hpb s ILE 241 N -1.26 -0.09 0.00 0.77 2.07 0.52 -4.73 121.20 118.49 2hpb s ILE 241 Ca 0.59 0.13 0.00 0.00 -1.41 0.00 0.00 60.65 59.96 2hpb s ILE 241 Cb -0.39 -0.52 0.00 0.00 0.13 0.00 0.00 42.46 41.68 2hpb s ILE 241 CO 0.50 0.05 0.35 -0.90 -1.91 0.00 0.00 174.94 173.03 2hpb n ASP 242 N 4.37 0.70 -3.69 4.50 5.68 -1.26 -0.13 116.55 126.72 2hpb n ASP 242 Ca -0.22 -0.89 -0.14 0.00 -0.50 0.00 0.00 54.79 53.04 2hpb n ASP 242 Cb 0.54 0.17 -0.14 0.00 -1.14 0.00 0.00 41.12 40.55 2hpb n ASP 242 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 2hpb s ASN 243 N -0.17 0.18 0.58 -1.12 3.84 -1.26 -4.84 114.94 112.15 2hpb s ASN 243 Ca 0.00 0.50 0.28 0.00 0.21 0.00 0.00 52.86 53.85 2hpb s ASN 243 Cb 0.00 0.49 1.60 0.00 -0.55 0.00 0.00 41.25 42.79 2hpb s ASN 243 CO 0.00 -0.21 2.08 -0.33 -2.79 0.00 0.00 177.10 175.86 2hpb h GLU 244 N 7.85 0.00 -0.44 0.43 5.08 -1.97 -0.72 114.58 124.81 2hpb h GLU 244 Ca -0.25 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.22 2hpb h GLU 244 Cb 1.13 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 2hpb h GLU 244 CO 0.24 0.00 0.31 0.66 -1.00 0.00 0.00 179.01 179.22 2hpb h SER 245 N 0.00 0.08 1.72 1.42 4.64 -2.04 -1.62 113.55 117.76 2hpb h SER 245 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2hpb h SER 245 Cb 0.54 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 2hpb h SER 245 CO -0.00 0.05 0.00 0.11 -0.87 0.00 0.00 176.83 176.12 2hpb h LYS 246 N 0.09 0.00 -0.78 4.77 1.79 -1.56 -3.38 116.57 117.49 2hpb h LYS 246 Ca 0.21 0.00 0.10 0.00 -2.18 0.00 0.00 60.65 58.78 2hpb h LYS 246 Cb 0.71 0.00 -0.11 0.00 -1.58 0.00 0.00 32.23 31.24 2hpb h LYS 246 CO -0.02 0.00 -0.37 -0.11 -1.08 0.00 0.00 179.45 177.87 2hpb n LEU 247 N -2.91 -0.63 0.07 2.94 7.94 -0.61 -0.77 117.00 123.03 2hpb n LEU 247 Ca 0.04 1.38 0.04 0.00 -1.11 0.00 0.00 56.01 56.35 2hpb n LEU 247 Cb 0.47 -0.26 0.19 0.00 0.53 0.00 0.00 43.42 44.35 2hpb n LEU 247 CO 0.32 -1.19 0.63 -2.65 -1.11 0.00 0.00 177.39 173.39 2hpb n PRO 248 N -5.09 0.05 0.25 1.96 -0.02 -1.26 -0.41 135.00 130.47 2hpb n PRO 248 Ca 0.06 0.48 0.16 0.00 -2.02 0.00 0.00 63.50 62.17 2hpb n PRO 248 Cb 0.27 -1.79 0.62 0.00 -0.02 0.00 0.00 33.50 32.58 2hpb n PRO 248 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2hpb h LEU 249 N 0.00 0.00 -1.80 2.45 3.38 -1.27 -2.35 115.31 115.72 2hpb h LEU 249 Ca 0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2hpb h LEU 249 Cb 0.28 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 2hpb h LEU 249 CO 0.00 0.00 -0.14 0.08 0.09 0.00 0.00 178.44 178.47 2hpb h ARG 250 N 0.00 0.00 0.00 1.13 0.11 -0.91 -2.56 114.38 112.15 2hpb h ARG 250 Ca 0.00 0.00 -0.36 0.00 0.10 0.00 0.00 59.98 59.72 2hpb h ARG 250 Cb 0.51 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.53 2hpb h ARG 250 CO 0.00 0.14 -2.35 1.63 0.10 0.00 0.00 179.97 179.49 2hpb n LYS 251 N -3.65 0.67 0.11 0.08 5.02 -1.07 -4.49 118.16 114.83 2hpb n LYS 251 Ca -0.02 0.11 -0.04 0.00 -2.02 0.00 0.00 58.31 56.34 2hpb n LYS 251 Cb 0.26 -1.48 0.08 0.00 -0.02 0.00 0.00 35.03 33.88 2hpb n LYS 251 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2hpb h SER 252 N 0.00 0.09 0.50 4.39 4.64 -1.37 -1.23 113.55 120.57 2hpb h SER 252 Ca -0.53 -0.06 -0.02 0.00 -0.47 0.00 0.00 61.79 60.70 2hpb h SER 252 Cb 1.91 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.97 2hpb h SER 252 CO -0.06 0.78 -0.24 0.40 -0.87 0.00 0.00 176.83 176.84 2hpb h ILE 253 N 0.05 0.35 -0.38 0.95 2.04 -1.73 -2.43 117.51 116.36 2hpb h ILE 253 Ca -0.01 -0.44 -0.05 0.00 1.00 0.00 0.00 64.86 65.36 2hpb h ILE 253 Cb 1.28 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.83 2hpb h ILE 253 CO 0.10 0.05 0.03 -0.65 0.00 0.00 0.00 178.15 177.69 2hpb h PRO 254 N -1.00 0.58 -0.20 2.37 0.11 -1.80 -0.80 132.00 131.26 2hpb h PRO 254 Ca -0.07 -0.12 0.04 0.00 0.11 0.00 0.00 66.00 65.96 2hpb h PRO 254 Cb 0.60 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 31.59 2hpb h PRO 254 CO 0.11 0.57 -0.04 1.15 -0.21 0.00 0.00 178.00 179.59 2hpb h THR 255 N 0.55 0.81 -0.59 -1.15 2.02 -1.28 0.17 112.91 113.45 2hpb h THR 255 Ca 0.12 -0.01 -0.07 0.00 0.77 0.00 0.00 66.41 67.23 2hpb h THR 255 Cb 0.30 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 67.48 2hpb h THR 255 CO 0.01 0.00 0.11 0.11 0.37 0.00 0.00 175.52 176.12 2hpb h LYS 256 N 0.02 0.95 -0.06 6.66 1.79 -1.02 0.36 116.57 125.27 2hpb h LYS 256 Ca 0.10 -0.23 0.01 0.00 -2.18 0.00 0.00 60.65 58.35 2hpb h LYS 256 Cb 0.14 -0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 30.66 2hpb h LYS 256 CO -0.20 0.87 0.00 0.82 -1.08 0.00 0.00 179.45 179.87 2hpb h ILE 257 N 0.90 0.96 0.00 1.86 2.04 -0.63 -0.76 117.51 121.88 2hpb h ILE 257 Ca 0.19 -0.01 -0.08 0.00 1.00 0.00 0.00 64.86 65.96 2hpb h ILE 257 Cb 0.38 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 2hpb h ILE 257 CO 0.01 0.00 -0.37 0.24 0.00 0.00 0.00 178.15 178.03 2hpb h MET 258 N 0.03 0.00 -0.20 2.37 2.86 -0.37 0.75 114.93 120.36 2hpb h MET 258 Ca 0.03 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.61 2hpb h MET 258 Cb 0.03 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 2hpb h MET 258 CO -0.04 0.37 -0.10 0.93 1.06 0.00 0.00 176.91 179.13 2hpb h GLU 259 N 0.00 0.42 0.00 1.72 5.08 -0.21 0.12 114.58 121.71 2hpb h GLU 259 Ca -0.00 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.16 2hpb h GLU 259 Cb 1.02 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.25 2hpb h GLU 259 CO 0.05 0.71 -0.07 0.66 -1.00 0.00 0.00 179.01 179.36 2hpb h SER 260 N 0.12 0.00 0.89 1.42 4.64 -0.91 -1.23 113.55 118.48 2hpb h SER 260 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2hpb h SER 260 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 2hpb h SER 260 CO 0.03 0.07 0.00 -0.62 -0.87 0.00 0.00 176.83 175.44 2hpb n GLU 261 N -3.16 0.04 -0.80 4.77 -0.58 0.24 -4.92 120.64 116.22 2hpb n GLU 261 Ca 0.01 0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 2hpb n GLU 261 Cb 0.41 -1.55 0.00 0.00 -0.57 0.00 0.00 31.44 29.73 2hpb n GLU 261 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2hpb n GLY 262 N 0.98 0.68 0.06 0.62 0.00 -0.47 -4.96 105.19 102.11 2hpb n GLY 262 Ca 0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 2hpb n GLY 262 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2hpb h ILE 263 N 0.00 1.57 -3.54 -0.61 2.04 -0.97 -3.46 117.51 112.54 2hpb h ILE 263 Ca 0.00 -1.73 -0.66 0.00 1.00 0.00 0.00 64.86 63.47 2hpb h ILE 263 Cb 0.00 2.74 -0.17 0.00 -0.74 0.00 0.00 36.82 38.65 2hpb h ILE 263 CO 0.00 0.45 -0.78 0.27 0.00 0.00 0.00 178.15 178.09 2hpb s ILE 264 N -3.23 2.99 0.00 -0.67 -4.36 -1.03 -4.95 121.20 109.94 2hpb s ILE 264 Ca -0.17 -1.51 0.00 0.00 -0.26 0.00 0.00 60.65 58.71 2hpb s ILE 264 Cb -0.01 -2.40 0.00 0.00 1.25 0.00 0.00 42.46 41.31 2hpb s ILE 264 CO 0.67 0.06 0.00 0.61 0.24 0.00 0.00 174.94 176.52