#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hpm n VAL 19 N 0.00 0.00 -0.90 1.61 0.24 -1.17 -4.43 118.33 113.68 3hpm n VAL 19 Ca 0.00 -0.53 -0.30 0.00 -2.04 0.00 0.00 64.34 61.47 3hpm n VAL 19 Cb 0.00 0.18 0.18 0.00 -1.47 0.00 0.00 33.84 32.73 3hpm n VAL 19 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3hpm s PRO 20 N -2.35 0.53 0.12 7.34 0.04 -1.25 -1.90 135.00 137.52 3hpm s PRO 20 Ca 0.04 0.97 -0.19 0.00 0.04 0.00 0.00 61.00 61.87 3hpm s PRO 20 Cb 0.00 -1.71 0.07 0.00 0.04 0.00 0.00 34.50 32.89 3hpm s PRO 20 CO 0.03 -2.78 0.89 0.41 0.04 0.00 0.00 177.00 175.58 3hpm n GLY 21 N -0.27 0.64 3.25 0.56 0.00 -0.84 -4.88 105.19 103.65 3hpm n GLY 21 Ca 0.07 -1.09 -0.23 0.00 0.00 0.00 0.00 46.02 44.77 3hpm n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hpm s LYS 22 N -2.04 1.07 -0.15 1.61 1.02 -1.26 -1.94 119.74 118.06 3hpm s LYS 22 Ca 0.20 -1.08 -0.04 0.00 0.02 0.00 0.00 55.97 55.07 3hpm s LYS 22 Cb -0.02 -1.26 0.07 0.00 -0.52 0.00 0.00 37.83 36.11 3hpm s LYS 22 CO 0.04 0.29 0.22 0.54 -0.92 0.00 0.00 175.35 175.52 3hpm s VAL 23 N -1.14 -0.35 -0.22 3.17 0.11 -0.20 -4.97 120.40 116.81 3hpm s VAL 23 Ca 0.04 0.12 -0.17 0.00 -2.93 0.00 0.00 61.98 59.05 3hpm s VAL 23 Cb -0.10 -0.52 -0.04 0.00 -1.53 0.00 0.00 36.38 34.20 3hpm s VAL 23 CO 0.03 -0.02 0.44 0.28 -3.33 0.00 0.00 175.10 172.51 3hpm s THR 24 N 2.35 5.16 0.06 5.04 -1.32 -1.26 -0.72 115.64 124.95 3hpm s THR 24 Ca 0.04 0.77 0.06 0.00 -1.21 0.00 0.00 61.69 61.35 3hpm s THR 24 Cb -0.14 -3.76 -0.03 0.00 -1.51 0.00 0.00 72.50 67.06 3hpm s THR 24 CO -0.10 0.20 -0.17 -0.76 -2.21 0.00 0.00 174.62 171.58 3hpm s LEU 25 N 1.61 2.21 0.12 9.08 1.43 0.81 -4.94 118.68 129.00 3hpm s LEU 25 Ca 0.20 -0.55 -0.12 0.00 -1.03 0.00 0.00 54.13 52.63 3hpm s LEU 25 Cb -0.15 -0.75 -0.06 0.00 0.03 0.00 0.00 46.19 45.25 3hpm s LEU 25 CO 0.09 0.06 0.49 -1.58 0.23 0.00 0.00 176.35 175.64 3hpm s GLN 26 N -1.41 3.89 0.37 1.70 0.74 -1.26 -0.14 119.66 123.55 3hpm s GLN 26 Ca 0.04 0.37 -0.24 0.00 0.05 0.00 0.00 55.36 55.57 3hpm s GLN 26 Cb -0.09 -2.95 -0.10 0.00 1.10 0.00 0.00 33.01 30.98 3hpm s GLN 26 CO 0.02 0.50 0.99 0.15 -0.55 0.00 0.00 175.29 176.41 3hpm s LYS 27 N -1.96 4.35 0.10 1.67 1.02 -1.08 -4.78 119.74 119.06 3hpm s LYS 27 Ca 0.36 1.38 -0.02 0.00 0.02 0.00 0.00 55.97 57.71 3hpm s LYS 27 Cb -0.14 -2.60 0.02 0.00 -0.52 0.00 0.00 37.83 34.59 3hpm s LYS 27 CO 0.19 0.05 0.13 -0.40 -0.92 0.00 0.00 175.35 174.40 3hpm n ASP 28 N 0.11 -0.11 0.24 2.83 5.68 -0.67 -4.80 116.55 119.83 3hpm n ASP 28 Ca 0.04 -0.99 0.16 0.00 -0.50 0.00 0.00 54.79 53.50 3hpm n ASP 28 Cb 0.50 -0.10 0.86 0.00 -1.14 0.00 0.00 41.12 41.25 3hpm n ASP 28 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3hpm h ALA 29 N -1.99 1.70 -0.57 2.12 0.00 -1.97 -1.89 119.26 116.66 3hpm h ALA 29 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3hpm h ALA 29 Cb 0.12 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3hpm h ALA 29 CO 0.03 -0.17 0.00 1.04 0.00 0.00 0.00 179.25 180.15 3hpm n GLN 30 N -3.84 2.54 -2.75 0.00 3.00 -1.26 -4.96 117.38 110.11 3hpm n GLN 30 Ca -0.00 -2.37 -0.09 0.00 -0.01 0.00 0.00 57.00 54.53 3hpm n GLN 30 Cb 0.22 -1.52 0.05 0.00 0.00 0.00 0.00 30.24 28.98 3hpm n GLN 30 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 3hpm n ASN 31 N 1.47 -2.26 -3.86 1.08 5.15 -0.71 -5.05 115.26 111.08 3hpm n ASN 31 Ca 0.22 -0.34 -0.13 0.00 -0.60 0.00 0.00 54.58 53.73 3hpm n ASN 31 Cb 0.58 -3.02 -0.14 0.00 -0.53 0.00 0.00 39.78 36.67 3hpm n ASN 31 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3hpm s LEU 32 N -4.36 1.84 -0.13 1.20 2.96 -1.26 -4.87 118.68 114.06 3hpm s LEU 32 Ca 0.02 -0.00 -0.03 0.00 -0.22 0.00 0.00 54.13 53.91 3hpm s LEU 32 Cb -0.00 -0.03 -0.25 0.00 0.50 0.00 0.00 46.19 46.41 3hpm s LEU 32 CO 0.40 -0.02 0.31 -0.38 -1.32 0.00 0.00 176.35 175.33 3hpm n ILE 33 N 3.26 1.71 0.00 6.68 5.41 0.10 -1.66 119.36 134.86 3hpm n ILE 33 Ca -0.15 -0.66 0.00 0.00 1.00 0.00 0.00 62.75 62.94 3hpm n ILE 33 Cb 0.58 -1.58 0.00 0.00 -0.71 0.00 0.00 39.64 37.93 3hpm n ILE 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3hpm n GLY 34 N 1.98 1.05 3.19 7.39 0.00 -1.24 -1.84 105.19 115.72 3hpm n GLY 34 Ca -0.32 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.53 3hpm n GLY 34 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3hpm s ILE 35 N -2.00 1.13 -0.28 -0.61 -4.36 -1.26 -1.16 121.20 112.66 3hpm s ILE 35 Ca 0.00 -1.53 -0.02 0.00 -0.26 0.00 0.00 60.65 58.84 3hpm s ILE 35 Cb 0.00 -1.29 0.03 0.00 1.25 0.00 0.00 42.46 42.45 3hpm s ILE 35 CO 0.00 -0.38 -0.02 -0.94 0.24 0.00 0.00 174.94 173.84 3hpm s SER 36 N -2.16 4.66 -0.02 4.36 1.04 -0.19 -0.51 113.70 120.88 3hpm s SER 36 Ca 0.03 -1.04 -0.16 0.00 0.48 0.00 0.00 55.95 55.27 3hpm s SER 36 Cb -0.06 -1.71 -0.05 0.00 0.10 0.00 0.00 66.02 64.29 3hpm s SER 36 CO 0.02 -0.20 0.43 0.27 0.98 0.00 0.00 173.24 174.74 3hpm s ILE 37 N 1.31 5.04 0.00 -1.02 -4.36 -0.44 -0.79 121.20 120.94 3hpm s ILE 37 Ca -0.02 0.88 0.00 0.00 -0.26 0.00 0.00 60.65 61.25 3hpm s ILE 37 Cb -0.18 -3.74 0.00 0.00 1.25 0.00 0.00 42.46 39.79 3hpm s ILE 37 CO -0.02 0.53 0.00 0.61 0.24 0.00 0.00 174.94 176.29 3hpm n GLY 38 N 2.13 2.52 0.00 6.27 0.00 0.54 -0.79 105.19 115.85 3hpm n GLY 38 Ca -0.12 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.34 3hpm n GLY 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hpm n GLY 39 N 0.00 0.15 1.03 -0.02 0.00 -0.95 -0.51 105.19 104.88 3hpm n GLY 39 Ca 0.00 -1.02 -0.08 0.00 0.00 0.00 0.00 46.02 44.91 3hpm n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hpm n GLY 40 N -0.40 -2.15 0.11 -0.02 0.00 -1.26 -1.92 105.19 99.55 3hpm n GLY 40 Ca 0.00 -1.53 -0.19 0.00 0.00 0.00 0.00 46.02 44.30 3hpm n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hpm h ALA 41 N -2.13 -0.01 -2.22 4.61 0.00 -1.96 -3.44 119.26 114.10 3hpm h ALA 41 Ca -0.12 -0.75 -0.49 0.00 0.00 0.00 0.00 54.91 53.56 3hpm h ALA 41 Cb 0.35 0.17 0.20 0.00 0.00 0.00 0.00 17.79 18.51 3hpm h ALA 41 CO 0.08 0.40 0.14 1.14 0.00 0.00 0.00 179.25 181.01 3hpm s GLN 42 N -2.39 0.27 0.23 0.00 1.03 -1.26 -4.89 119.66 112.65 3hpm s GLN 42 Ca -0.16 1.23 -0.31 0.00 0.04 0.00 0.00 55.36 56.15 3hpm s GLN 42 Cb 0.01 -1.66 -0.11 0.00 0.03 0.00 0.00 33.01 31.28 3hpm s GLN 42 CO 0.78 -3.04 1.59 -0.47 -2.54 0.00 0.00 175.29 171.62 3hpm s TYR 43 N -2.59 2.91 -0.10 9.60 5.04 -1.26 -5.00 117.35 125.94 3hpm s TYR 43 Ca 0.67 0.68 -0.05 0.00 -2.44 0.00 0.00 57.07 55.93 3hpm s TYR 43 Cb -0.23 -4.01 0.05 0.00 0.35 0.00 0.00 41.96 38.11 3hpm s TYR 43 CO 0.61 -3.58 0.23 0.00 -1.34 0.00 0.00 175.55 171.47 3hpm n PRO 45 N 4.44 0.29 -3.85 0.00 -0.02 -1.26 -4.83 135.00 129.77 3hpm n PRO 45 Ca -0.22 0.02 -0.11 0.00 -2.02 0.00 0.00 63.50 61.18 3hpm n PRO 45 Cb 0.52 -1.50 -0.09 0.00 -0.02 0.00 0.00 33.50 32.42 3hpm n PRO 45 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3hpm s GLY 46 N -2.07 0.03 0.12 -1.23 0.00 -1.26 -4.76 107.32 98.16 3hpm s GLY 46 Ca 0.14 -0.25 0.05 0.00 0.00 0.00 0.00 44.72 44.67 3hpm s GLY 46 CO 0.12 -0.42 0.01 1.08 0.00 0.00 0.00 173.10 173.89 3hpm s LEU 47 N -1.98 3.45 0.00 0.66 1.43 -1.26 -4.85 118.68 116.13 3hpm s LEU 47 Ca -0.06 -0.23 0.00 0.00 -1.03 0.00 0.00 54.13 52.81 3hpm s LEU 47 Cb -0.02 -2.15 -0.00 0.00 0.03 0.00 0.00 46.19 44.04 3hpm s LEU 47 CO -0.03 0.15 -0.02 -0.31 0.23 0.00 0.00 176.35 176.37 3hpm s TYR 48 N -1.44 0.13 -0.24 0.29 1.51 0.33 -1.53 117.35 116.40 3hpm s TYR 48 Ca 0.26 -0.05 -0.29 0.00 -1.01 0.00 0.00 57.07 55.99 3hpm s TYR 48 Cb -0.11 -0.09 -0.03 0.00 -0.11 0.00 0.00 41.96 41.62 3hpm s TYR 48 CO 0.19 -0.01 1.75 0.42 -1.11 0.00 0.00 175.55 176.79 3hpm s ILE 49 N -0.10 3.52 -0.05 2.71 1.01 -0.34 -0.34 121.20 127.62 3hpm s ILE 49 Ca -0.00 0.57 -0.08 0.00 0.00 0.00 0.00 60.65 61.13 3hpm s ILE 49 Cb -0.01 -3.59 -0.29 0.00 0.01 0.00 0.00 42.46 38.58 3hpm s ILE 49 CO -0.00 -0.30 0.66 0.58 0.00 0.00 0.00 174.94 175.88 3hpm h VAL 50 N 6.43 0.93 -2.11 2.92 2.07 -1.29 0.12 116.25 125.31 3hpm h VAL 50 Ca -0.35 -2.54 -0.04 0.00 0.82 0.00 0.00 66.70 64.59 3hpm h VAL 50 Cb 1.17 2.72 -0.22 0.00 -1.52 0.00 0.00 31.29 33.44 3hpm h VAL 50 CO 1.00 0.85 0.04 -1.58 0.02 0.00 0.00 177.57 177.90 3hpm s GLN 51 N -2.58 0.75 -0.11 1.57 0.74 -1.23 -4.72 119.66 114.07 3hpm s GLN 51 Ca -0.15 1.00 -0.01 0.00 0.05 0.00 0.00 55.36 56.25 3hpm s GLN 51 Cb 0.06 0.30 -0.02 0.00 1.10 0.00 0.00 33.01 34.45 3hpm s GLN 51 CO 0.84 -0.11 -0.09 0.08 -0.55 0.00 0.00 175.29 175.46 3hpm s VAL 52 N 0.72 3.46 -0.13 1.34 1.01 -1.26 -1.02 120.40 124.52 3hpm s VAL 52 Ca -0.03 -0.53 -0.15 0.00 0.00 0.00 0.00 61.98 61.27 3hpm s VAL 52 Cb -0.05 -2.45 -0.05 0.00 0.00 0.00 0.00 36.38 33.83 3hpm s VAL 52 CO -0.05 0.54 0.36 -0.36 0.00 0.00 0.00 175.10 175.59 3hpm s PHE 53 N -0.05 3.50 0.32 5.22 0.08 -0.31 -5.00 117.98 121.75 3hpm s PHE 53 Ca -0.01 0.72 0.04 0.00 0.12 0.00 0.00 56.93 57.80 3hpm s PHE 53 Cb -0.14 -2.40 0.63 0.00 -0.57 0.00 0.00 43.02 40.55 3hpm s PHE 53 CO 0.03 0.26 1.90 -0.44 -0.10 0.00 0.00 175.22 176.87 3hpm h ASP 54 N 6.50 0.81 -0.50 1.36 5.19 -1.98 -2.96 116.42 124.84 3hpm h ASP 54 Ca -0.42 0.02 -0.21 0.00 -0.62 0.00 0.00 57.03 55.80 3hpm h ASP 54 Cb 1.17 -0.15 -0.12 0.00 0.18 0.00 0.00 39.33 40.41 3hpm h ASP 54 CO 0.74 0.48 0.27 0.59 -3.12 0.00 0.00 179.24 178.20 3hpm n ASN 55 N -4.53 3.52 -4.28 6.45 3.02 -1.26 -4.60 115.26 113.58 3hpm n ASN 55 Ca 0.15 -2.81 -0.17 0.00 -0.03 0.00 0.00 54.58 51.72 3hpm n ASN 55 Cb 0.29 -0.67 -0.11 0.00 -0.61 0.00 0.00 39.78 38.69 3hpm n ASN 55 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3hpm s THR 56 N -1.92 1.43 0.26 3.41 -4.23 -1.12 -5.03 115.64 108.45 3hpm s THR 56 Ca 0.32 -1.96 -0.04 0.00 -1.18 0.00 0.00 61.69 58.83 3hpm s THR 56 Cb 0.26 -1.77 0.28 0.00 1.34 0.00 0.00 72.50 72.61 3hpm s THR 56 CO 0.07 -0.54 1.65 -0.65 -0.54 0.00 0.00 174.62 174.60 3hpm h PRO 57 N 3.05 0.15 -0.91 3.99 0.11 -1.79 0.10 132.00 136.71 3hpm h PRO 57 Ca -0.39 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.75 3hpm h PRO 57 Cb 1.20 -0.03 -0.05 0.00 0.11 0.00 0.00 31.00 32.22 3hpm h PRO 57 CO 0.57 0.10 0.60 0.00 -0.21 0.00 0.00 178.00 179.06 3hpm h ALA 58 N 1.71 1.43 -0.18 -0.75 0.00 -1.68 -0.39 119.26 119.39 3hpm h ALA 58 Ca 0.45 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.24 3hpm h ALA 58 Cb 0.82 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 3hpm h ALA 58 CO -0.64 0.48 -0.20 0.00 0.00 0.00 0.00 179.25 178.90 3hpm h ALA 59 N 1.47 0.26 -0.87 0.00 0.00 -1.03 -0.34 119.26 118.76 3hpm h ALA 59 Ca 0.36 -0.35 0.02 0.00 0.00 0.00 0.00 54.91 54.94 3hpm h ALA 59 Cb 0.03 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 3hpm h ALA 59 CO -0.11 0.19 0.57 -0.07 0.00 0.00 0.00 179.25 179.83 3hpm h LEU 60 N 0.10 0.98 -0.21 0.00 3.38 -1.12 -2.74 115.31 115.70 3hpm h LEU 60 Ca 0.03 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 3hpm h LEU 60 Cb 0.74 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 3hpm h LEU 60 CO 0.05 0.69 0.05 -0.78 0.09 0.00 0.00 178.44 178.54 3hpm h ASP 61 N 1.15 0.32 -1.26 -0.43 3.58 -1.05 -3.48 116.42 115.25 3hpm h ASP 61 Ca 0.33 -0.24 -0.32 0.00 0.42 0.00 0.00 57.03 57.22 3hpm h ASP 61 Cb -0.09 -0.08 -0.09 0.00 1.72 0.00 0.00 39.33 40.79 3hpm h ASP 61 CO -0.09 0.47 -0.33 0.61 -2.88 0.00 0.00 179.24 177.02 3hpm n GLY 62 N -0.51 0.98 0.12 -0.78 0.00 -0.14 -4.89 105.19 99.96 3hpm n GLY 62 Ca -0.04 -0.25 -0.20 0.00 0.00 0.00 0.00 46.02 45.53 3hpm n GLY 62 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3hpm h THR 63 N 0.00 1.50 -2.65 2.61 2.02 -1.90 -3.47 112.91 111.02 3hpm h THR 63 Ca -0.34 -2.51 -0.46 0.00 0.77 0.00 0.00 66.41 63.86 3hpm h THR 63 Cb 1.12 3.16 0.02 0.00 -1.74 0.00 0.00 68.15 70.70 3hpm h THR 63 CO 0.47 0.71 -0.18 0.68 0.37 0.00 0.00 175.52 177.57 3hpm s VAL 64 N -2.49 4.57 0.14 3.16 -7.23 -1.26 -5.10 120.40 112.19 3hpm s VAL 64 Ca -0.13 -0.55 -0.11 0.00 -1.81 0.00 0.00 61.98 59.37 3hpm s VAL 64 Cb 0.01 -3.66 0.01 0.00 0.56 0.00 0.00 36.38 33.29 3hpm s VAL 64 CO 0.83 -0.42 0.32 0.00 -0.31 0.00 0.00 175.10 175.52 3hpm s ALA 65 N -2.38 -0.36 0.17 1.32 0.00 -1.26 -4.97 121.76 114.28 3hpm s ALA 65 Ca 0.43 -0.58 -0.31 0.00 0.00 0.00 0.00 51.96 51.51 3hpm s ALA 65 Cb -0.10 0.73 -0.09 0.00 0.00 0.00 0.00 23.12 23.67 3hpm s ALA 65 CO 0.36 -0.64 1.39 0.00 0.00 0.00 0.00 175.76 176.88 3hpm s ALA 66 N -3.90 3.60 0.00 0.00 0.00 -1.26 -2.66 121.76 117.53 3hpm s ALA 66 Ca 0.10 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.24 3hpm s ALA 66 Cb 0.03 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.62 3hpm s ALA 66 CO -0.05 -0.63 0.00 0.41 0.00 0.00 0.00 175.76 175.49 3hpm n GLY 67 N 2.96 3.17 3.53 0.00 0.00 0.40 -4.26 105.19 110.98 3hpm n GLY 67 Ca 0.09 -1.06 -0.35 0.00 0.00 0.00 0.00 46.02 44.71 3hpm n GLY 67 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hpm n ASP 68 N 0.23 -0.68 -4.60 1.61 8.00 -1.09 -4.67 116.55 115.35 3hpm n ASP 68 Ca 0.00 0.53 -0.34 0.00 0.71 0.00 0.00 54.79 55.69 3hpm n ASP 68 Cb 0.00 -1.31 -0.10 0.00 -0.02 0.00 0.00 41.12 39.69 3hpm n ASP 68 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3hpm s GLU 69 N -3.40 3.80 -0.28 -1.24 2.12 -0.79 -1.19 118.70 117.72 3hpm s GLU 69 Ca 0.66 -0.40 -0.24 0.00 0.36 0.00 0.00 54.97 55.35 3hpm s GLU 69 Cb -0.30 -3.09 -0.00 0.00 0.26 0.00 0.00 34.13 31.00 3hpm s GLU 69 CO 0.58 0.30 0.81 0.42 -0.54 0.00 0.00 175.26 176.83 3hpm s ILE 70 N 0.25 4.81 -0.03 -3.70 1.01 -0.58 -0.40 121.20 122.56 3hpm s ILE 70 Ca 0.02 1.38 0.10 0.00 0.00 0.00 0.00 60.65 62.14 3hpm s ILE 70 Cb -0.13 -4.13 -0.16 0.00 0.01 0.00 0.00 42.46 38.05 3hpm s ILE 70 CO 0.01 -0.17 0.23 0.35 0.00 0.00 0.00 174.94 175.37 3hpm n THR 71 N 5.41 0.00 -3.49 2.92 -2.24 0.15 -4.37 114.28 112.65 3hpm n THR 71 Ca 0.05 -0.23 -0.10 0.00 -2.27 0.00 0.00 64.05 61.50 3hpm n THR 71 Cb 0.48 0.29 -0.02 0.00 -2.10 0.00 0.00 70.33 68.97 3hpm n THR 71 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3hpm s GLY 72 N -3.14 -0.49 -0.07 3.38 0.00 -0.95 -2.27 107.32 103.77 3hpm s GLY 72 Ca -0.04 0.98 0.01 0.00 0.00 0.00 0.00 44.72 45.68 3hpm s GLY 72 CO 0.42 0.37 -0.09 0.54 0.00 0.00 0.00 173.10 174.34 3hpm s VAL 73 N -3.05 0.97 -1.28 1.40 0.11 0.70 -0.34 120.40 118.91 3hpm s VAL 73 Ca 0.03 -0.34 -0.11 0.00 -2.93 0.00 0.00 61.98 58.63 3hpm s VAL 73 Cb -0.01 -0.94 -0.00 0.00 -1.53 0.00 0.00 36.38 33.90 3hpm s VAL 73 CO -0.08 0.33 0.59 0.59 -3.33 0.00 0.00 175.10 173.20 3hpm n ASN 74 N 4.20 -2.56 -0.62 3.54 4.13 0.71 -1.66 115.26 123.00 3hpm n ASN 74 Ca -0.20 -1.02 -0.08 0.00 1.68 0.00 0.00 54.58 54.96 3hpm n ASN 74 Cb 0.51 -3.13 -0.03 0.00 -1.54 0.00 0.00 39.78 35.59 3hpm n ASN 74 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3hpm n GLY 75 N -1.86 0.94 2.98 7.41 0.00 -1.26 -4.99 105.19 108.41 3hpm n GLY 75 Ca -0.21 -0.31 -0.28 0.00 0.00 0.00 0.00 46.02 45.22 3hpm n GLY 75 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3hpm s ARG 76 N -2.40 1.88 0.55 1.61 3.52 -0.66 -5.13 118.95 118.32 3hpm s ARG 76 Ca 0.00 -0.41 -0.19 0.00 -0.13 0.00 0.00 55.73 55.00 3hpm s ARG 76 Cb 0.00 -1.76 -0.06 0.00 -1.56 0.00 0.00 34.95 31.58 3hpm s ARG 76 CO 0.00 -0.18 1.13 0.45 -0.81 0.00 0.00 175.30 175.88 3hpm s SER 77 N 1.39 5.70 0.00 -2.12 0.15 -1.26 -0.21 113.70 117.34 3hpm s SER 77 Ca 0.00 2.16 0.05 0.00 0.70 0.00 0.00 55.95 58.86 3hpm s SER 77 Cb -0.13 -2.58 0.02 0.00 -1.71 0.00 0.00 66.02 61.62 3hpm s SER 77 CO -0.06 -1.23 0.57 -0.38 1.20 0.00 0.00 173.24 173.34 3hpm n ILE 78 N -1.37 0.00 -1.69 6.45 -0.00 -0.96 -4.86 119.36 116.93 3hpm n ILE 78 Ca 0.11 -0.48 -0.52 0.00 -0.00 0.00 0.00 62.75 61.87 3hpm n ILE 78 Cb 0.51 1.08 -0.06 0.00 -0.00 0.00 0.00 39.64 41.18 3hpm n ILE 78 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72 3hpm n LYS 79 N 0.02 1.80 0.00 0.38 3.00 -1.26 -1.07 118.16 121.03 3hpm n LYS 79 Ca 0.03 0.66 0.00 0.00 -0.00 0.00 0.00 58.31 59.00 3hpm n LYS 79 Cb 0.11 -2.44 0.00 0.00 0.00 0.00 0.00 35.03 32.70 3hpm n LYS 79 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3hpm n GLY 80 N 4.28 2.23 3.76 3.14 0.00 -1.26 -5.07 105.19 112.27 3hpm n GLY 80 Ca 0.24 -0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 3hpm n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hpm s LYS 81 N 0.00 4.62 0.95 1.61 3.01 -0.23 -5.05 119.74 124.64 3hpm s LYS 81 Ca 0.00 1.68 -0.13 0.00 -1.01 0.00 0.00 55.97 56.51 3hpm s LYS 81 Cb 0.00 -3.10 0.16 0.00 -1.01 0.00 0.00 37.83 33.88 3hpm s LYS 81 CO 0.00 0.23 1.14 0.95 0.51 0.00 0.00 175.35 178.18 3hpm s THR 82 N -1.25 1.96 0.31 2.17 -4.23 -1.26 -4.86 115.64 108.48 3hpm s THR 82 Ca 0.46 0.00 -0.01 0.00 -1.18 0.00 0.00 61.69 60.96 3hpm s THR 82 Cb -0.29 -2.72 0.24 0.00 1.34 0.00 0.00 72.50 71.07 3hpm s THR 82 CO 0.37 0.00 1.95 0.11 -0.54 0.00 0.00 174.62 176.50 3hpm h LYS 83 N -1.65 0.96 -0.12 3.99 1.57 -1.96 -2.45 116.57 116.90 3hpm h LYS 83 Ca -0.50 -0.09 -0.16 0.00 -1.87 0.00 0.00 60.65 58.03 3hpm h LYS 83 Cb 1.32 -0.20 0.01 0.00 0.08 0.00 0.00 32.23 33.44 3hpm h LYS 83 CO 0.57 0.68 -0.54 -0.39 -0.57 0.00 0.00 179.45 179.20 3hpm h VAL 84 N 0.97 1.34 -0.75 0.50 -1.51 -1.96 -1.61 116.25 113.24 3hpm h VAL 84 Ca 0.25 -1.83 0.07 0.00 -1.23 0.00 0.00 66.70 63.96 3hpm h VAL 84 Cb -0.02 2.11 -0.06 0.00 -2.13 0.00 0.00 31.29 31.19 3hpm h VAL 84 CO -0.05 0.56 0.43 -0.33 -1.23 0.00 0.00 177.57 176.95 3hpm h GLU 85 N 0.23 0.74 -0.27 5.19 5.08 -1.91 0.48 114.58 124.11 3hpm h GLU 85 Ca -0.03 -0.04 -0.18 0.00 -1.00 0.00 0.00 59.36 58.11 3hpm h GLU 85 Cb 1.18 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 3hpm h GLU 85 CO 0.11 0.49 -0.53 0.28 -1.00 0.00 0.00 179.01 178.36 3hpm h VAL 86 N 0.76 1.28 -0.54 3.13 2.07 -1.42 -0.57 116.25 120.96 3hpm h VAL 86 Ca 0.35 -1.73 -0.07 0.00 0.82 0.00 0.00 66.70 66.07 3hpm h VAL 86 Cb 0.25 1.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 3hpm h VAL 86 CO -0.21 0.56 0.08 0.00 0.02 0.00 0.00 177.57 178.02 3hpm h ALA 87 N 0.77 0.72 0.16 1.67 0.00 -0.76 -2.40 119.26 119.42 3hpm h ALA 87 Ca 0.02 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.68 3hpm h ALA 87 Cb 1.12 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 3hpm h ALA 87 CO 0.12 0.47 -0.19 -0.22 0.00 0.00 0.00 179.25 179.42 3hpm h LYS 88 N 0.78 -0.38 -0.77 0.00 3.64 0.19 0.26 116.57 120.29 3hpm h LYS 88 Ca 0.16 0.03 0.18 0.00 -1.27 0.00 0.00 60.65 59.75 3hpm h LYS 88 Cb 0.42 0.09 -0.13 0.00 -0.41 0.00 0.00 32.23 32.20 3hpm h LYS 88 CO 0.01 -0.26 0.06 0.52 -2.27 0.00 0.00 179.45 177.51 3hpm h MET 89 N -0.40 0.13 -0.12 1.90 2.86 -0.97 0.18 114.93 118.51 3hpm h MET 89 Ca 0.01 -0.01 -0.21 0.00 -2.06 0.00 0.00 59.70 57.44 3hpm h MET 89 Cb 0.39 -0.03 0.01 0.00 0.06 0.00 0.00 31.60 32.03 3hpm h MET 89 CO -0.07 0.09 -0.73 0.82 1.06 0.00 0.00 176.91 178.08 3hpm h ILE 90 N 0.13 1.30 -0.20 -1.22 2.04 -1.08 -2.94 117.51 115.54 3hpm h ILE 90 Ca 0.43 -1.96 -0.01 0.00 1.00 0.00 0.00 64.86 64.33 3hpm h ILE 90 Cb 0.78 2.09 -0.01 0.00 -0.74 0.00 0.00 36.82 38.95 3hpm h ILE 90 CO -0.65 0.61 0.09 -0.61 0.00 0.00 0.00 178.15 177.59 3hpm h GLN 91 N 0.40 0.27 0.00 2.37 4.15 0.50 -2.79 115.11 120.00 3hpm h GLN 91 Ca -0.06 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.34 3hpm h GLN 91 Cb 1.37 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 29.00 3hpm h GLN 91 CO 0.15 0.22 -0.09 0.93 -1.93 0.00 0.00 178.83 178.11 3hpm h GLU 92 N 0.28 0.00 -6.15 1.69 5.08 -0.55 -3.45 114.58 111.48 3hpm h GLU 92 Ca 0.07 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.86 3hpm h GLU 92 Cb 0.04 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 3hpm h GLU 92 CO -0.01 0.00 0.84 0.08 -1.00 0.00 0.00 179.01 178.92 3hpm s VAL 93 N -3.15 4.40 -0.26 3.13 1.01 -1.06 -4.99 120.40 119.48 3hpm s VAL 93 Ca 0.09 1.70 -0.21 0.00 0.00 0.00 0.00 61.98 63.56 3hpm s VAL 93 Cb 0.10 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.37 3hpm s VAL 93 CO 0.64 -0.13 0.64 -0.54 0.00 0.00 0.00 175.10 175.71 3hpm s LYS 94 N 3.24 4.07 1.55 2.72 -0.14 -1.26 -4.81 119.74 125.11 3hpm s LYS 94 Ca 0.52 0.52 0.00 0.00 -1.36 0.00 0.00 55.97 55.64 3hpm s LYS 94 Cb -0.20 -3.67 0.00 0.00 -1.68 0.00 0.00 37.83 32.28 3hpm s LYS 94 CO 0.13 -0.45 0.00 0.41 -0.76 0.00 0.00 175.35 174.68 3hpm n GLY 95 N 4.20 1.16 3.77 -3.33 0.00 -1.26 -4.94 105.19 104.78 3hpm n GLY 95 Ca -0.00 -1.02 -0.39 0.00 0.00 0.00 0.00 46.02 44.60 3hpm n GLY 95 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hpm s GLU 96 N 0.00 4.44 -0.04 1.61 2.02 -1.26 -2.62 118.70 122.84 3hpm s GLU 96 Ca 0.00 0.99 0.04 0.00 0.02 0.00 0.00 54.97 56.02 3hpm s GLU 96 Cb 0.00 -3.30 -0.00 0.00 0.10 0.00 0.00 34.13 30.92 3hpm s GLU 96 CO 0.00 0.46 -0.18 0.54 0.02 0.00 0.00 175.26 176.11 3hpm s VAL 97 N -0.66 1.49 -0.15 2.63 0.11 0.80 -4.95 120.40 119.66 3hpm s VAL 97 Ca 0.35 -0.75 -0.03 0.00 -2.93 0.00 0.00 61.98 58.61 3hpm s VAL 97 Cb -0.21 -1.28 -0.03 0.00 -1.53 0.00 0.00 36.38 33.34 3hpm s VAL 97 CO 0.23 0.43 -0.05 0.28 -3.33 0.00 0.00 175.10 172.66 3hpm s THR 98 N 0.01 3.83 -0.18 5.04 -1.32 -1.26 -0.14 115.64 121.62 3hpm s THR 98 Ca -0.04 -0.38 -0.01 0.00 -1.21 0.00 0.00 61.69 60.05 3hpm s THR 98 Cb -0.12 -2.67 -0.00 0.00 -1.51 0.00 0.00 72.50 68.20 3hpm s THR 98 CO 0.02 0.50 -0.11 -0.63 -2.21 0.00 0.00 174.62 172.19 3hpm s ILE 99 N 0.31 2.98 -0.17 5.08 1.01 0.10 -0.21 121.20 130.31 3hpm s ILE 99 Ca -0.04 -0.65 -0.11 0.00 0.00 0.00 0.00 60.65 59.85 3hpm s ILE 99 Cb -0.14 -2.30 -0.05 0.00 0.01 0.00 0.00 42.46 39.98 3hpm s ILE 99 CO 0.03 0.48 0.19 -1.00 0.00 0.00 0.00 174.94 174.65 3hpm s HIS 100 N 1.02 3.45 0.14 3.97 3.76 0.54 -1.04 115.29 127.14 3hpm s HIS 100 Ca -0.01 0.45 -0.05 0.00 -0.15 0.00 0.00 55.06 55.31 3hpm s HIS 100 Cb -0.15 -2.20 -0.02 0.00 1.11 0.00 0.00 32.58 31.32 3hpm s HIS 100 CO -0.02 0.32 0.16 1.52 -0.85 0.00 0.00 174.74 175.88 3hpm s TYR 101 N 0.23 0.61 -0.28 1.40 -0.85 -0.82 0.30 117.35 117.95 3hpm s TYR 101 Ca 0.12 -0.99 -0.00 0.00 -0.52 0.00 0.00 57.07 55.68 3hpm s TYR 101 Cb -0.12 -0.27 0.05 0.00 0.38 0.00 0.00 41.96 42.00 3hpm s TYR 101 CO 0.01 -0.61 -0.05 -0.80 -1.52 0.00 0.00 175.55 172.58 3hpm s ASN 102 N -3.00 4.60 -0.35 -0.18 0.02 0.47 -1.99 114.94 114.52 3hpm s ASN 102 Ca 0.20 -1.20 -0.29 0.00 -1.02 0.00 0.00 52.86 50.55 3hpm s ASN 102 Cb 0.05 -1.65 -0.01 0.00 0.02 0.00 0.00 41.25 39.66 3hpm s ASN 102 CO 0.00 -0.21 1.60 -0.75 0.02 0.00 0.00 177.10 177.77 3hpm s LYS 103 N 1.23 3.51 0.49 -0.60 2.20 -0.80 -1.88 119.74 123.89 3hpm s LYS 103 Ca -0.05 1.26 -0.19 0.00 -0.36 0.00 0.00 55.97 56.63 3hpm s LYS 103 Cb -0.19 -4.10 -0.08 0.00 -1.51 0.00 0.00 37.83 31.95 3hpm s LYS 103 CO -0.03 -1.64 1.01 -0.51 -0.36 0.00 0.00 175.35 173.82 3hpm s LEU 104 N 5.99 3.80 0.25 5.43 1.43 -1.26 -2.69 118.68 131.63 3hpm s LEU 104 Ca 0.71 1.81 0.04 0.00 -1.03 0.00 0.00 54.13 55.66 3hpm s LEU 104 Cb -0.19 -4.55 0.30 0.00 0.03 0.00 0.00 46.19 41.79 3hpm s LEU 104 CO 0.32 -0.69 1.60 1.56 0.23 0.00 0.00 176.35 179.38 3hpm h GLN 105 N 1.44 0.27 -6.96 1.70 1.08 -1.94 -3.43 115.11 107.27 3hpm h GLN 105 Ca -0.49 -0.16 -0.54 0.00 -1.45 0.00 0.00 58.65 56.01 3hpm h GLN 105 Cb 1.20 0.02 0.12 0.00 -0.05 0.00 0.00 27.48 28.77 3hpm h GLN 105 CO 0.60 0.74 0.74 0.00 -0.95 0.00 0.00 178.83 179.96 3hpm n ALA 106 N -2.47 2.23 -1.71 3.87 0.00 -1.26 -4.84 120.51 116.33 3hpm n ALA 106 Ca -0.02 0.30 -0.61 0.00 0.00 0.00 0.00 53.44 53.11 3hpm n ALA 106 Cb 0.57 -2.41 -0.08 0.00 0.00 0.00 0.00 19.45 17.53 3hpm n ALA 106 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3hpm n ASP 107 N 0.16 1.93 0.17 0.00 5.75 -1.26 -4.79 116.55 118.51 3hpm n ASP 107 Ca 0.03 1.09 0.14 0.00 -0.01 0.00 0.00 54.79 56.04 3hpm n ASP 107 Cb 0.40 -1.04 0.51 0.00 -1.03 0.00 0.00 41.12 39.95 3hpm n ASP 107 CO 0.00 0.00 0.00 1.55 -0.11 0.00 0.00 177.20 178.64 3hpm h PRO 108 N 6.59 0.00 -0.11 0.11 0.13 -1.92 -1.97 132.00 134.83 3hpm h PRO 108 Ca -0.44 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.64 3hpm h PRO 108 Cb 1.34 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.47 3hpm h PRO 108 CO 0.97 0.00 -0.10 0.87 -0.23 0.00 0.00 178.00 179.52 3hpm h LYS 109 N 0.00 0.26 -0.34 0.86 6.56 -1.91 -2.51 116.57 119.49 3hpm h LYS 109 Ca 0.00 -0.13 -0.08 0.00 -1.06 0.00 0.00 60.65 59.38 3hpm h LYS 109 Cb 0.51 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 32.15 3hpm h LYS 109 CO 0.00 0.66 -0.11 -0.56 -2.06 0.00 0.00 179.45 177.38 3hpm h GLN 110 N -0.13 0.59 -0.09 3.15 3.07 -1.74 0.91 115.11 120.88 3hpm h GLN 110 Ca 0.02 -0.18 -0.04 0.00 0.09 0.00 0.00 58.65 58.55 3hpm h GLN 110 Cb 0.61 -0.06 -0.01 0.00 0.08 0.00 0.00 27.48 28.10 3hpm h GLN 110 CO 0.02 0.70 -0.11 1.37 0.09 0.00 0.00 178.83 180.90 3hpm h LEU 111 N 0.55 0.12 0.07 0.06 -0.00 -1.50 0.51 115.31 115.13 3hpm h LEU 111 Ca 0.10 -0.02 -0.30 0.00 -0.00 0.00 0.00 57.88 57.66 3hpm h LEU 111 Cb 0.52 -0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 41.12 3hpm h LEU 111 CO 0.03 0.26 -1.56 -0.08 -0.00 0.00 0.00 178.44 177.09 3hpm h GLU 112 N 0.13 0.15 0.04 0.17 4.81 -0.85 -3.19 114.58 115.84 3hpm h GLU 112 Ca 0.03 -0.26 -0.00 0.00 -0.13 0.00 0.00 59.36 59.00 3hpm h GLU 112 Cb 0.28 0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.76 3hpm h GLU 112 CO 0.02 0.94 -0.02 -0.39 -0.73 0.00 0.00 179.01 178.83 3hpm h VAL 113 N 0.04 1.24 -0.35 0.32 -1.51 0.11 -2.69 116.25 113.42 3hpm h VAL 113 Ca -0.24 -0.91 -0.06 0.00 -1.23 0.00 0.00 66.70 64.25 3hpm h VAL 113 Cb 1.98 1.84 -0.02 0.00 -2.13 0.00 0.00 31.29 32.97 3hpm h VAL 113 CO 0.13 0.23 -0.05 0.25 -1.23 0.00 0.00 177.57 176.90 3hpm h LEU 114 N -0.45 0.55 0.00 4.19 5.85 -1.08 -1.10 115.31 123.27 3hpm h LEU 114 Ca -0.01 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.59 3hpm h LEU 114 Cb 0.41 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.30 3hpm h LEU 114 CO 0.01 0.65 0.00 0.49 -0.34 0.00 0.00 178.44 179.25 3hpm n PHE 115 N -4.23 0.00 0.03 1.25 3.01 -1.20 -3.57 117.46 112.74 3hpm n PHE 115 Ca 0.01 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.28 3hpm n PHE 115 Cb 0.29 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.66 3hpm n PHE 115 CO 0.00 0.00 0.00 -0.91 1.01 0.00 0.00 176.76 176.86 3hpm h ASN 116 N 0.00 0.93 -0.76 4.37 2.35 -0.84 -3.48 115.58 118.14 3hpm h ASN 116 Ca 0.00 -0.71 0.00 0.00 -0.55 0.00 0.00 56.30 55.04 3hpm h ASN 116 Cb 0.00 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.09 3hpm h ASN 116 CO 0.00 1.51 0.00 0.61 -1.65 0.00 0.00 177.43 177.90 3hpm n GLY 117 N 1.00 -0.46 3.96 2.83 0.00 -1.23 -4.89 105.19 106.40 3hpm n GLY 117 Ca -0.10 -1.40 -0.24 0.00 0.00 0.00 0.00 46.02 44.28 3hpm n GLY 117 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3hpm s PRO 118 N -2.00 2.11 -0.17 1.61 0.04 -1.26 -4.96 135.00 130.37 3hpm s PRO 118 Ca 0.00 -0.61 0.00 0.00 0.04 0.00 0.00 61.00 60.43 3hpm s PRO 118 Cb 0.00 -2.29 0.00 0.00 0.04 0.00 0.00 34.50 32.25 3hpm s PRO 118 CO 0.00 -1.18 0.00 0.41 0.04 0.00 0.00 177.00 176.27 3hpm n GLY 119 N -2.76 0.50 3.60 0.56 0.00 -1.26 -5.01 105.19 100.82 3hpm n GLY 119 Ca 0.10 -1.00 -0.41 0.00 0.00 0.00 0.00 46.02 44.71 3hpm n GLY 119 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hpm s ILE 120 N -2.06 4.88 -0.12 -0.61 1.01 -1.26 -3.90 121.20 119.14 3hpm s ILE 120 Ca 0.00 0.90 -0.17 0.00 0.00 0.00 0.00 60.65 61.39 3hpm s ILE 120 Cb 0.00 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 38.37 3hpm s ILE 120 CO 0.00 -0.21 0.42 -0.70 0.00 0.00 0.00 174.94 174.45 3hpm s GLU 121 N 2.74 4.29 0.03 2.79 2.12 -0.81 -4.96 118.70 124.90 3hpm s GLU 121 Ca 0.27 0.35 -0.05 0.00 0.36 0.00 0.00 54.97 55.90 3hpm s GLU 121 Cb -0.15 -3.42 -0.01 0.00 0.26 0.00 0.00 34.13 30.82 3hpm s GLU 121 CO 0.13 0.22 0.09 -1.54 -0.54 0.00 0.00 175.26 173.61 3hpm s SER 122 N 0.47 0.15 -0.13 -1.70 1.04 -1.26 -2.24 113.70 110.04 3hpm s SER 122 Ca 0.23 -0.45 0.02 0.00 0.48 0.00 0.00 55.95 56.23 3hpm s SER 122 Cb -0.15 0.20 -0.00 0.00 0.10 0.00 0.00 66.02 66.18 3hpm s SER 122 CO 0.09 -0.44 -0.19 -0.69 0.98 0.00 0.00 173.24 172.98 3hpm s VAL 123 N -2.15 2.40 -0.08 5.02 1.01 0.03 -4.93 120.40 121.71 3hpm s VAL 123 Ca -0.09 -0.88 -0.23 0.00 0.00 0.00 0.00 61.98 60.78 3hpm s VAL 123 Cb -0.04 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.34 3hpm s VAL 123 CO -0.02 0.54 0.69 -0.75 0.00 0.00 0.00 175.10 175.56 3hpm s LYS 124 N 0.54 4.41 0.00 2.72 2.20 -1.26 -1.33 119.74 127.02 3hpm s LYS 124 Ca -0.12 0.85 0.00 0.00 -0.36 0.00 0.00 55.97 56.34 3hpm s LYS 124 Cb -0.17 -3.46 0.00 0.00 -1.51 0.00 0.00 37.83 32.70 3hpm s LYS 124 CO 0.04 0.03 0.19 0.44 -0.36 0.00 0.00 175.35 175.70