#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3djv n GLU 2 N 0.00 1.55 -1.77 1.64 2.13 -1.26 -4.93 120.64 118.00 3djv n GLU 2 Ca 0.00 0.56 -0.33 0.00 0.66 0.00 0.00 57.16 58.05 3djv n GLU 2 Cb 0.00 -2.26 0.04 0.00 0.27 0.00 0.00 31.44 29.49 3djv n GLU 2 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 3djv s SER 3 N 1.01 5.18 0.25 4.31 1.04 -1.26 -4.84 113.70 119.39 3djv s SER 3 Ca 0.84 1.96 -0.05 0.00 0.48 0.00 0.00 55.95 59.18 3djv s SER 3 Cb -0.85 -2.55 0.32 0.00 0.10 0.00 0.00 66.02 63.04 3djv s SER 3 CO 0.45 -1.58 1.90 0.00 0.98 0.00 0.00 173.24 174.99 3djv h ALA 4 N 0.02 1.30 -0.15 5.32 0.00 -1.99 0.46 119.26 124.22 3djv h ALA 4 Ca -0.47 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3djv h ALA 4 Cb 1.24 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 3djv h ALA 4 CO 0.54 0.53 0.10 0.00 0.00 0.00 0.00 179.25 180.42 3djv h ALA 5 N 1.40 0.19 -0.58 0.00 0.00 -2.00 -1.17 119.26 117.10 3djv h ALA 5 Ca 0.39 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.23 3djv h ALA 5 Cb 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 3djv h ALA 5 CO -0.12 -0.33 0.10 0.00 0.00 0.00 0.00 179.25 178.90 3djv h ALA 6 N 1.06 1.09 -0.70 0.00 0.00 -1.84 -2.01 119.26 116.85 3djv h ALA 6 Ca 0.05 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 3djv h ALA 6 Cb -0.02 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 3djv h ALA 6 CO -0.01 0.59 0.32 -0.22 0.00 0.00 0.00 179.25 179.93 3djv h LYS 7 N 0.87 1.02 -0.49 0.00 3.64 -0.63 0.23 116.57 121.20 3djv h LYS 7 Ca 0.18 -0.16 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 3djv h LYS 7 Cb 0.37 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 3djv h LYS 7 CO 0.01 0.81 0.23 0.35 -2.27 0.00 0.00 179.45 178.58 3djv h PHE 8 N 0.98 0.72 -0.71 1.91 3.04 -0.93 -0.35 116.94 121.61 3djv h PHE 8 Ca 0.24 -0.04 -0.03 0.00 3.98 0.00 0.00 57.97 62.12 3djv h PHE 8 Cb 0.14 -0.22 -0.03 0.00 2.56 0.00 0.00 35.95 38.40 3djv h PHE 8 CO 0.01 0.57 0.33 0.93 -2.02 0.00 0.00 178.31 178.13 3djv h GLU 9 N 0.65 1.02 -0.26 1.11 5.08 -0.93 0.11 114.58 121.36 3djv h GLU 9 Ca 0.17 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 3djv h GLU 9 Cb 0.13 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 3djv h GLU 9 CO -0.02 0.81 0.04 -0.09 -1.00 0.00 0.00 179.01 178.75 3djv h ARG 10 N 0.99 0.43 -0.00 2.33 2.43 -0.73 -2.21 114.38 117.63 3djv h ARG 10 Ca 0.24 -0.12 -0.18 0.00 -0.81 0.00 0.00 59.98 59.12 3djv h ARG 10 Cb 0.13 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.62 3djv h ARG 10 CO -0.03 0.55 -0.82 1.96 -1.51 0.00 0.00 179.97 180.12 3djv h GLN 11 N 0.24 0.09 0.00 0.20 4.20 -0.91 -3.41 115.11 115.53 3djv h GLN 11 Ca 0.08 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.69 3djv h GLN 11 Cb 0.33 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.14 3djv h GLN 11 CO 0.01 0.86 0.00 0.72 -0.67 0.00 0.00 178.83 179.75 3djv n HIS 12 N -3.63 0.00 -4.02 2.96 8.25 0.35 -5.03 115.22 114.10 3djv n HIS 12 Ca -0.02 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.09 3djv n HIS 12 Cb 0.78 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.77 3djv n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 3djv s MET 13 N -0.56 3.68 -0.42 -0.41 -1.94 -0.83 -4.99 119.30 113.83 3djv s MET 13 Ca 0.00 -0.48 0.07 0.00 -1.71 0.00 0.00 55.69 53.56 3djv s MET 13 Cb 0.00 -3.14 0.23 0.00 2.01 0.00 0.00 34.83 33.93 3djv s MET 13 CO 0.00 0.02 0.57 -3.47 -0.01 0.00 0.00 175.02 172.13 3djv n ASP 14 N 4.24 -0.75 -4.73 3.03 2.03 -1.26 -4.83 116.55 114.27 3djv n ASP 14 Ca -0.17 -2.76 -0.42 0.00 0.52 0.00 0.00 54.79 51.96 3djv n ASP 14 Cb 0.52 -0.01 -0.03 0.00 -0.72 0.00 0.00 41.12 40.88 3djv n ASP 14 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 3djv s SER 15 N -0.93 6.59 0.00 1.67 0.01 -1.26 -4.91 113.70 114.86 3djv s SER 15 Ca 0.34 2.67 0.00 0.00 1.31 0.00 0.00 55.95 60.27 3djv s SER 15 Cb 0.15 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.77 3djv s SER 15 CO -0.15 -0.79 0.00 0.61 0.41 0.00 0.00 173.24 173.32 3djv n GLY 16 N 3.06 3.13 0.07 3.44 0.00 -1.26 -5.02 105.19 108.61 3djv n GLY 16 Ca 0.11 -1.06 -0.07 0.00 0.00 0.00 0.00 46.02 45.00 3djv n GLY 16 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3djv h ASN 17 N 0.00 0.00 -2.04 1.61 2.35 -2.08 -3.40 115.58 112.01 3djv h ASN 17 Ca 0.00 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 55.21 3djv h ASN 17 Cb 0.00 0.00 -0.40 0.00 0.05 0.00 0.00 38.32 37.97 3djv h ASN 17 CO 0.00 0.97 -1.06 -1.20 -1.65 0.00 0.00 177.43 174.49 3djv n SER 18 N -3.28 1.06 0.10 5.81 7.64 -1.26 -4.97 113.62 118.72 3djv n SER 18 Ca -0.03 -2.95 0.04 0.00 1.01 0.00 0.00 58.87 56.94 3djv n SER 18 Cb 0.95 -0.63 0.44 0.00 -1.01 0.00 0.00 64.21 63.96 3djv n SER 18 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3djv h PRO 19 N 3.59 0.30 -0.05 1.43 0.13 -1.91 -2.52 132.00 132.97 3djv h PRO 19 Ca 0.10 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 3djv h PRO 19 Cb 0.86 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.94 3djv h PRO 19 CO 0.54 0.32 0.00 -1.13 -0.23 0.00 0.00 178.00 177.49 3djv n SER 20 N -4.38 1.88 -4.67 1.44 3.41 -1.26 -4.85 113.62 105.18 3djv n SER 20 Ca 0.00 -1.64 -0.41 0.00 -0.26 0.00 0.00 58.87 56.56 3djv n SER 20 Cb 0.18 -0.02 0.01 0.00 -0.26 0.00 0.00 64.21 64.11 3djv n SER 20 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3djv n SER 21 N 0.47 2.20 0.26 4.04 2.88 -0.95 -4.88 113.62 117.64 3djv n SER 21 Ca 0.18 1.10 0.15 0.00 -1.33 0.00 0.00 58.87 58.96 3djv n SER 21 Cb 0.41 -1.45 0.84 0.00 -0.75 0.00 0.00 64.21 63.26 3djv n SER 21 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 3djv h SER 22 N 1.99 0.00 0.13 -3.46 4.64 -1.93 -0.47 113.55 114.45 3djv h SER 22 Ca -0.46 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3djv h SER 22 Cb 1.31 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.40 3djv h SER 22 CO 0.59 0.00 -0.00 0.77 -0.87 0.00 0.00 176.83 177.32 3djv h SER 23 N 0.00 0.00 -0.10 4.97 4.64 -1.93 -1.99 113.55 119.14 3djv h SER 23 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3djv h SER 23 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3djv h SER 23 CO -0.00 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.55 3djv n ASN 24 N -3.15 2.26 0.02 4.97 5.03 -0.18 -4.38 115.26 119.83 3djv n ASN 24 Ca -0.03 -1.76 -0.10 0.00 0.87 0.00 0.00 54.58 53.56 3djv n ASN 24 Cb 0.10 -0.06 -0.04 0.00 -1.02 0.00 0.00 39.78 38.77 3djv n ASN 24 CO 0.00 0.00 0.00 0.22 -1.83 0.00 0.00 177.26 175.65 3djv h TYR 25 N 3.34 -0.54 -0.78 3.10 3.20 -1.46 -1.63 116.97 122.20 3djv h TYR 25 Ca 0.00 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 3djv h TYR 25 Cb 0.72 0.25 -0.04 0.00 1.54 0.00 0.00 36.73 39.20 3djv h TYR 25 CO 0.06 -0.29 0.48 0.00 -1.64 0.00 0.00 178.16 176.77 3djv h ASN 27 N 1.06 0.31 -0.06 0.00 2.35 -1.70 0.73 115.58 118.28 3djv h ASN 27 Ca 0.28 0.07 -0.07 0.00 -0.55 0.00 0.00 56.30 56.04 3djv h ASN 27 Cb -0.06 0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.35 3djv h ASN 27 CO -0.05 0.18 -0.23 -0.07 -1.65 0.00 0.00 177.43 175.60 3djv h LEU 28 N 0.48 0.30 -0.31 1.61 3.38 -0.75 -3.11 115.31 116.91 3djv h LEU 28 Ca 0.33 -0.64 -0.10 0.00 0.09 0.00 0.00 57.88 57.56 3djv h LEU 28 Cb 0.38 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3djv h LEU 28 CO -0.30 0.89 -0.18 0.24 0.09 0.00 0.00 178.44 179.18 3djv h MET 29 N -0.27 0.68 -0.50 1.13 2.86 -0.48 0.60 114.93 118.94 3djv h MET 29 Ca -0.01 -0.31 -0.02 0.00 -2.06 0.00 0.00 59.70 57.30 3djv h MET 29 Cb 0.88 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.50 3djv h MET 29 CO 0.05 0.91 0.25 0.52 1.06 0.00 0.00 176.91 179.69 3djv h MET 30 N 0.44 0.69 0.21 1.72 2.86 -0.98 0.19 114.93 120.06 3djv h MET 30 Ca 0.07 -0.08 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 3djv h MET 30 Cb 0.72 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.25 3djv h MET 30 CO 0.05 0.53 -0.10 0.00 1.06 0.00 0.00 176.91 178.46 3djv n ARG 33 N -4.71 2.34 -3.00 0.00 5.12 0.64 -4.91 116.66 112.14 3djv n ARG 33 Ca 0.10 -1.38 -0.14 0.00 -1.93 0.00 0.00 57.85 54.50 3djv n ARG 33 Cb 0.18 -1.57 0.04 0.00 -1.16 0.00 0.00 32.46 29.94 3djv n ARG 33 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 3djv n LYS 34 N 0.41 -4.11 -0.41 5.56 5.02 -0.79 -4.93 118.16 118.91 3djv n LYS 34 Ca 0.12 0.51 0.08 0.00 -2.02 0.00 0.00 58.31 57.01 3djv n LYS 34 Cb 0.50 -4.56 0.25 0.00 -0.02 0.00 0.00 35.03 31.20 3djv n LYS 34 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3djv n MET 35 N -3.01 2.90 -0.19 1.97 2.81 0.06 -4.42 117.12 117.23 3djv n MET 35 Ca -0.02 -2.75 0.05 0.00 -1.81 0.00 0.00 57.70 53.17 3djv n MET 35 Cb 0.55 -1.78 0.07 0.00 -0.71 0.00 0.00 33.22 31.36 3djv n MET 35 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 3djv n THR 36 N -0.41 1.09 -3.31 2.03 -2.24 -1.22 -1.83 114.28 108.40 3djv n THR 36 Ca 0.20 -1.29 -0.39 0.00 -2.27 0.00 0.00 64.05 60.31 3djv n THR 36 Cb 0.84 0.15 -0.07 0.00 -2.10 0.00 0.00 70.33 69.14 3djv n THR 36 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3djv s GLN 37 N -1.61 4.17 0.00 -0.78 -0.21 -1.26 -4.38 119.66 115.59 3djv s GLN 37 Ca 0.17 0.31 0.00 0.00 0.02 0.00 0.00 55.36 55.86 3djv s GLN 37 Cb 0.15 -3.56 0.00 0.00 1.00 0.00 0.00 33.01 30.59 3djv s GLN 37 CO 0.02 -0.12 0.00 0.41 -2.12 0.00 0.00 175.29 173.47 3djv n GLY 38 N 3.97 1.98 3.48 3.09 0.00 -1.26 -4.86 105.19 111.58 3djv n GLY 38 Ca -0.06 -0.35 -0.10 0.00 0.00 0.00 0.00 46.02 45.51 3djv n GLY 38 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3djv s LYS 39 N 0.00 1.33 -0.26 1.61 0.00 -1.26 -5.06 119.74 116.10 3djv s LYS 39 Ca 0.00 -0.69 -0.25 0.00 0.00 0.00 0.00 55.97 55.03 3djv s LYS 39 Cb 0.00 0.55 0.00 0.00 0.00 0.00 0.00 37.83 38.38 3djv s LYS 39 CO 0.00 -0.57 0.87 0.00 0.00 0.00 0.00 175.35 175.65 3djv s LYS 41 N 2.99 4.16 0.27 0.00 2.20 -0.76 -4.89 119.74 123.71 3djv s LYS 41 Ca 0.37 2.45 0.04 0.00 -0.36 0.00 0.00 55.97 58.46 3djv s LYS 41 Cb -0.15 -3.84 0.36 0.00 -1.51 0.00 0.00 37.83 32.69 3djv s LYS 41 CO 0.09 -0.85 1.65 -1.00 -0.36 0.00 0.00 175.35 174.89 3djv h PRO 42 N 9.31 0.36 -3.46 4.03 0.13 -1.94 -3.44 132.00 137.00 3djv h PRO 42 Ca -0.45 -0.18 -0.28 0.00 -0.87 0.00 0.00 66.00 64.22 3djv h PRO 42 Cb 1.21 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 32.01 3djv h PRO 42 CO 0.94 0.72 -0.70 0.08 -0.23 0.00 0.00 178.00 178.81 3djv s VAL 43 N -4.16 -0.06 -0.18 1.56 1.01 -1.26 -1.49 120.40 115.83 3djv s VAL 43 Ca -0.06 0.20 -0.16 0.00 0.00 0.00 0.00 61.98 61.97 3djv s VAL 43 Cb 0.13 -0.12 0.05 0.00 0.00 0.00 0.00 36.38 36.44 3djv s VAL 43 CO 0.79 0.08 0.47 0.21 0.00 0.00 0.00 175.10 176.65 3djv s ASN 44 N 1.08 -0.50 -0.13 3.32 2.47 0.30 -5.01 114.94 116.46 3djv s ASN 44 Ca -0.09 0.95 -0.03 0.00 0.42 0.00 0.00 52.86 54.11 3djv s ASN 44 Cb -0.12 0.95 -0.03 0.00 -1.45 0.00 0.00 41.25 40.59 3djv s ASN 44 CO -0.04 -0.17 -0.03 -0.89 -3.72 0.00 0.00 177.10 172.25 3djv s THR 45 N 0.40 3.97 -0.10 -5.21 2.01 -1.26 -0.28 115.64 115.16 3djv s THR 45 Ca -0.01 -0.34 -0.03 0.00 0.31 0.00 0.00 61.69 61.62 3djv s THR 45 Cb -0.04 -2.71 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 3djv s THR 45 CO -0.01 0.52 0.01 -0.36 -0.69 0.00 0.00 174.62 174.09 3djv s PHE 46 N 0.03 3.17 -0.16 4.92 0.08 -0.01 -4.97 117.98 121.04 3djv s PHE 46 Ca 0.01 0.15 -0.04 0.00 0.12 0.00 0.00 56.93 57.17 3djv s PHE 46 Cb -0.13 -1.83 -0.03 0.00 -0.57 0.00 0.00 43.02 40.46 3djv s PHE 46 CO 0.03 0.41 -0.04 0.08 -0.10 0.00 0.00 175.22 175.59 3djv s VAL 47 N -0.68 3.86 -2.72 -0.44 1.01 -1.26 -0.11 120.40 120.06 3djv s VAL 47 Ca 0.11 -0.37 0.24 0.00 0.00 0.00 0.00 61.98 61.96 3djv s VAL 47 Cb -0.12 -2.70 0.33 0.00 0.00 0.00 0.00 36.38 33.90 3djv s VAL 47 CO 0.02 0.49 1.39 1.41 0.00 0.00 0.00 175.10 178.41 3djv n HIS 48 N 3.59 0.16 -1.93 5.22 -0.00 -0.24 -4.95 115.22 117.07 3djv n HIS 48 Ca -0.17 -0.08 -0.30 0.00 -0.00 0.00 0.00 57.72 57.16 3djv n HIS 48 Cb 0.52 0.00 0.02 0.00 -0.00 0.00 0.00 29.99 30.53 3djv n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 3djv s GLU 49 N -1.84 3.42 0.41 -0.41 0.41 -1.26 -5.00 118.70 114.44 3djv s GLU 49 Ca 0.33 0.64 -0.25 0.00 -0.41 0.00 0.00 54.97 55.28 3djv s GLU 49 Cb 0.21 -2.09 -0.11 0.00 -1.78 0.00 0.00 34.13 30.36 3djv s GLU 49 CO 0.31 -0.65 1.06 0.45 -0.49 0.00 0.00 175.26 175.94 3djv n SER 50 N -2.77 1.51 0.16 -0.19 2.88 -1.26 -4.85 113.62 109.10 3djv n SER 50 Ca 0.06 1.06 0.13 0.00 -1.33 0.00 0.00 58.87 58.78 3djv n SER 50 Cb 0.55 -1.38 0.66 0.00 -0.75 0.00 0.00 64.21 63.29 3djv n SER 50 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 3djv h LEU 51 N 1.67 0.00 -0.68 2.46 5.85 -1.96 -1.54 115.31 121.10 3djv h LEU 51 Ca -0.45 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.28 3djv h LEU 51 Cb 1.33 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 42.33 3djv h LEU 51 CO 0.58 0.00 0.45 0.00 -0.34 0.00 0.00 178.44 179.13 3djv h ALA 52 N 1.90 0.86 -0.40 1.25 0.00 -1.99 0.17 119.26 121.06 3djv h ALA 52 Ca 0.10 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 3djv h ALA 52 Cb 0.40 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3djv h ALA 52 CO -0.00 0.28 -0.22 -0.44 0.00 0.00 0.00 179.25 178.87 3djv h ASP 53 N 0.92 0.80 -0.19 0.00 3.32 -1.65 -1.19 116.42 118.42 3djv h ASP 53 Ca 0.25 -0.29 -0.10 0.00 0.02 0.00 0.00 57.03 56.92 3djv h ASP 53 Cb -0.10 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.23 3djv h ASP 53 CO -0.06 1.00 -0.26 0.58 -1.72 0.00 0.00 179.24 178.78 3djv h VAL 54 N 0.69 1.34 -0.67 -1.35 2.07 -1.14 -2.93 116.25 114.26 3djv h VAL 54 Ca 0.10 -1.46 0.03 0.00 0.82 0.00 0.00 66.70 66.18 3djv h VAL 54 Cb 0.73 1.84 -0.04 0.00 -1.52 0.00 0.00 31.29 32.31 3djv h VAL 54 CO 0.06 0.45 0.44 0.11 0.02 0.00 0.00 177.57 178.65 3djv h LYS 55 N 0.17 0.79 0.00 1.57 1.57 -0.62 -1.97 116.57 118.08 3djv h LYS 55 Ca 0.02 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3djv h LYS 55 Cb 0.83 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.96 3djv h LYS 55 CO 0.06 0.52 -0.02 0.00 -0.57 0.00 0.00 179.45 179.45 3djv h ALA 56 N 1.61 1.15 -0.00 3.86 0.00 -1.02 -2.21 119.26 122.64 3djv h ALA 56 Ca 0.26 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 3djv h ALA 56 Cb 0.05 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3djv h ALA 56 CO -0.07 0.02 -0.11 0.28 0.00 0.00 0.00 179.25 179.37 3djv h VAL 57 N 0.00 1.08 0.00 0.00 2.07 -1.32 -1.39 116.25 116.70 3djv h VAL 57 Ca -0.00 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.13 3djv h VAL 57 Cb 0.10 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 3djv h VAL 57 CO 0.00 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.70 3djv n SER 59 N -1.56 2.81 0.00 0.00 7.64 -0.52 -5.02 113.62 116.97 3djv n SER 59 Ca 0.01 -2.48 0.00 0.00 1.01 0.00 0.00 58.87 57.41 3djv n SER 59 Cb 0.07 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 62.97 3djv n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3djv n GLN 60 N -0.41 2.41 -2.53 1.43 6.02 0.20 -5.02 117.38 119.48 3djv n GLN 60 Ca 0.12 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.68 3djv n GLN 60 Cb 0.54 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.78 3djv n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 3djv s LYS 61 N 4.80 4.01 0.17 -1.09 2.20 -1.03 -4.87 119.74 123.93 3djv s LYS 61 Ca 0.00 1.18 -0.31 0.00 -0.36 0.00 0.00 55.97 56.48 3djv s LYS 61 Cb 0.00 -3.80 -0.10 0.00 -1.51 0.00 0.00 37.83 32.42 3djv s LYS 61 CO 0.00 -0.99 1.52 0.15 -0.36 0.00 0.00 175.35 175.67 3djv s LYS 62 N 3.88 4.24 0.03 4.03 1.02 -1.26 0.98 119.74 132.65 3djv s LYS 62 Ca 0.51 2.30 -0.02 0.00 0.02 0.00 0.00 55.97 58.78 3djv s LYS 62 Cb -0.15 -3.16 -0.02 0.00 -0.52 0.00 0.00 37.83 33.98 3djv s LYS 62 CO 0.19 -0.55 0.01 0.14 -0.92 0.00 0.00 175.35 174.22 3djv s VAL 63 N 0.95 0.13 0.22 3.17 -7.23 -0.81 -4.83 120.40 111.99 3djv s VAL 63 Ca 0.67 -1.05 -0.30 0.00 -1.81 0.00 0.00 61.98 59.49 3djv s VAL 63 Cb -0.42 -0.58 -0.09 0.00 0.56 0.00 0.00 36.38 35.85 3djv s VAL 63 CO 0.33 -0.58 1.23 -0.89 -0.31 0.00 0.00 175.10 174.88 3djv s THR 64 N -2.02 3.36 0.67 5.32 2.01 -1.26 -3.51 115.64 120.21 3djv s THR 64 Ca -0.11 1.19 -0.16 0.00 0.31 0.00 0.00 61.69 62.92 3djv s THR 64 Cb -0.05 -3.76 0.01 0.00 0.01 0.00 0.00 72.50 68.70 3djv s THR 64 CO -0.03 0.21 1.19 0.00 -0.69 0.00 0.00 174.62 175.31 3djv h LYS 66 N 0.17 0.33 -0.28 0.00 1.57 -1.89 -1.35 116.57 115.12 3djv h LYS 66 Ca -0.48 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 3djv h LYS 66 Cb 1.29 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.52 3djv h LYS 66 CO 0.52 0.22 0.00 0.27 -0.57 0.00 0.00 179.45 179.89 3djv n ASN 67 N -4.46 1.75 0.00 0.86 6.94 -1.26 -4.91 115.26 114.18 3djv n ASN 67 Ca 0.12 -1.89 0.00 0.00 -0.02 0.00 0.00 54.58 52.79 3djv n ASN 67 Cb 0.49 -0.18 0.00 0.00 -2.36 0.00 0.00 39.78 37.72 3djv n ASN 67 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3djv n GLY 68 N 1.07 1.16 3.76 4.83 0.00 -0.51 -5.05 105.19 110.46 3djv n GLY 68 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 3djv n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3djv s GLN 69 N -0.47 2.27 -0.25 1.61 -0.21 -1.26 -4.82 119.66 116.53 3djv s GLN 69 Ca 0.00 1.22 0.10 0.00 0.02 0.00 0.00 55.36 56.71 3djv s GLN 69 Cb 0.00 -1.90 0.45 0.00 1.00 0.00 0.00 33.01 32.57 3djv s GLN 69 CO 0.00 -1.64 1.19 0.25 -2.12 0.00 0.00 175.29 172.97 3djv n THR 70 N -3.40 2.21 -1.71 -0.19 -2.24 -1.26 -1.45 114.28 106.24 3djv n THR 70 Ca 0.09 -3.68 0.06 0.00 -2.27 0.00 0.00 64.05 58.25 3djv n THR 70 Cb 0.53 -0.57 0.12 0.00 -2.10 0.00 0.00 70.33 68.32 3djv n THR 70 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3djv n ASN 71 N -0.76 1.49 -4.93 3.42 6.94 -1.26 -5.01 115.26 115.16 3djv n ASN 71 Ca 0.32 -3.04 -0.27 0.00 -0.02 0.00 0.00 54.58 51.57 3djv n ASN 71 Cb 0.88 -0.41 -0.03 0.00 -2.36 0.00 0.00 39.78 37.86 3djv n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3djv s TYR 73 N -1.93 -0.15 -0.12 0.00 1.51 0.06 -1.93 117.35 114.79 3djv s TYR 73 Ca 0.39 0.36 -0.06 0.00 -1.01 0.00 0.00 57.07 56.76 3djv s TYR 73 Cb -0.11 0.04 -0.04 0.00 -0.11 0.00 0.00 41.96 41.75 3djv s TYR 73 CO 0.30 -0.07 0.09 -1.14 -1.11 0.00 0.00 175.55 173.61 3djv s GLN 74 N 0.12 3.43 0.32 -0.62 0.74 0.27 -1.43 119.66 122.49 3djv s GLN 74 Ca -0.00 -0.25 -0.29 0.00 0.05 0.00 0.00 55.36 54.87 3djv s GLN 74 Cb -0.01 -3.09 -0.10 0.00 1.10 0.00 0.00 33.01 30.90 3djv s GLN 74 CO -0.00 0.65 1.38 -1.54 -0.55 0.00 0.00 175.29 175.23 3djv s SER 75 N -0.70 6.65 0.27 6.67 1.04 -0.09 -2.46 113.70 125.08 3djv s SER 75 Ca 0.12 2.76 0.01 0.00 0.48 0.00 0.00 55.95 59.33 3djv s SER 75 Cb -0.12 -2.65 0.38 0.00 0.10 0.00 0.00 66.02 63.73 3djv s SER 75 CO 0.03 -0.65 1.71 0.11 0.98 0.00 0.00 173.24 175.42 3djv h LYS 76 N 3.71 0.53 -6.09 4.02 1.57 -1.94 -3.44 116.57 114.92 3djv h LYS 76 Ca -0.49 -0.20 -0.57 0.00 -1.87 0.00 0.00 60.65 57.52 3djv h LYS 76 Cb 1.23 -0.03 -0.10 0.00 0.08 0.00 0.00 32.23 33.40 3djv h LYS 76 CO 0.68 0.73 -0.62 -1.12 -0.57 0.00 0.00 179.45 178.55 3djv s SER 77 N -6.80 4.31 0.73 0.86 0.01 -1.26 -5.09 113.70 106.46 3djv s SER 77 Ca -0.07 -0.87 -0.12 0.00 1.31 0.00 0.00 55.95 56.20 3djv s SER 77 Cb 0.14 -0.62 0.04 0.00 0.21 0.00 0.00 66.02 65.78 3djv s SER 77 CO 0.80 -0.17 1.10 0.42 0.41 0.00 0.00 173.24 175.80 3djv s THR 78 N -2.45 3.32 0.06 1.44 -4.23 -1.26 -4.56 115.64 107.95 3djv s THR 78 Ca 0.34 0.49 0.04 0.00 -1.18 0.00 0.00 61.69 61.38 3djv s THR 78 Cb -0.02 -2.99 -0.03 0.00 1.34 0.00 0.00 72.50 70.80 3djv s THR 78 CO 0.20 -0.50 -0.12 -0.04 -0.54 0.00 0.00 174.62 173.61 3djv s MET 79 N -4.64 0.74 -0.26 3.99 -1.94 0.28 -4.89 119.30 112.59 3djv s MET 79 Ca 0.63 -0.89 -0.29 0.00 -1.71 0.00 0.00 55.69 53.43 3djv s MET 79 Cb -0.18 -0.69 -0.00 0.00 2.01 0.00 0.00 34.83 35.97 3djv s MET 79 CO 0.51 0.15 1.27 1.03 -0.01 0.00 0.00 175.02 177.97 3djv s ARG 80 N -1.66 4.03 0.16 2.03 0.52 -1.26 -1.99 118.95 120.78 3djv s ARG 80 Ca -0.04 1.36 0.02 0.00 -0.52 0.00 0.00 55.73 56.56 3djv s ARG 80 Cb -0.10 -3.83 -0.05 0.00 0.52 0.00 0.00 34.95 31.49 3djv s ARG 80 CO 0.02 -0.97 -0.03 0.96 0.02 0.00 0.00 175.30 175.30 3djv s ILE 81 N 4.05 0.78 -0.14 1.52 -4.36 -0.42 -1.08 121.20 121.56 3djv s ILE 81 Ca 0.55 -1.99 0.02 0.00 -0.26 0.00 0.00 60.65 58.97 3djv s ILE 81 Cb -0.18 -2.01 0.01 0.00 1.25 0.00 0.00 42.46 41.53 3djv s ILE 81 CO 0.20 -0.58 -0.21 -0.89 0.24 0.00 0.00 174.94 173.69 3djv s THR 82 N -3.58 1.97 -0.24 8.37 2.01 0.84 -1.75 115.64 123.26 3djv s THR 82 Ca 0.21 -0.93 -0.15 0.00 0.31 0.00 0.00 61.69 61.13 3djv s THR 82 Cb 0.05 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.77 3djv s THR 82 CO 0.02 0.53 0.37 -0.62 -0.69 0.00 0.00 174.62 174.23 3djv s ASP 83 N 0.84 6.31 -0.19 3.53 -1.08 0.58 -0.83 116.67 125.83 3djv s ASP 83 Ca -0.07 0.36 -0.03 0.00 -0.52 0.00 0.00 52.55 52.29 3djv s ASP 83 Cb -0.15 -2.21 -0.01 0.00 -1.46 0.00 0.00 42.92 39.08 3djv s ASP 83 CO -0.02 -0.12 -0.06 0.00 0.52 0.00 0.00 175.17 175.49 3djv s ARG 85 N 1.13 0.25 0.29 0.00 0.52 -1.05 -0.54 118.95 119.56 3djv s ARG 85 Ca 0.01 0.06 -0.29 0.00 -0.52 0.00 0.00 55.73 54.99 3djv s ARG 85 Cb -0.15 -0.41 -0.13 0.00 0.52 0.00 0.00 34.95 34.78 3djv s ARG 85 CO -0.01 -0.10 1.19 0.39 0.02 0.00 0.00 175.30 176.79 3djv n GLU 86 N 3.95 1.75 -1.81 3.54 1.02 -0.55 -0.13 120.64 128.40 3djv n GLU 86 Ca -0.25 0.62 -0.30 0.00 -0.02 0.00 0.00 57.16 57.21 3djv n GLU 86 Cb 0.52 -2.12 0.07 0.00 -0.02 0.00 0.00 31.44 29.88 3djv n GLU 86 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3djv s THR 87 N -0.86 3.10 0.51 2.62 -4.23 -0.48 -4.73 115.64 111.58 3djv s THR 87 Ca 0.60 0.36 0.40 0.00 -1.18 0.00 0.00 61.69 61.86 3djv s THR 87 Cb -0.65 -3.30 0.42 0.00 1.34 0.00 0.00 72.50 70.31 3djv s THR 87 CO 0.59 -0.47 2.25 1.23 -0.54 0.00 0.00 174.62 177.68 3djv h GLY 88 N -0.84 0.00 0.60 3.99 0.00 -1.94 -2.55 103.07 102.34 3djv h GLY 88 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 3djv h GLY 88 CO 0.63 0.00 -1.04 1.44 0.00 0.00 0.00 176.54 177.57 3djv n SER 89 N -3.18 0.61 -4.71 0.19 7.64 -1.26 -4.95 113.62 107.96 3djv n SER 89 Ca -0.02 -0.18 -0.43 0.00 1.01 0.00 0.00 58.87 59.25 3djv n SER 89 Cb 0.14 0.80 -0.03 0.00 -1.01 0.00 0.00 64.21 64.11 3djv n SER 89 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3djv n SER 90 N -2.00 3.81 -3.49 6.43 2.88 -0.96 -4.95 113.62 115.35 3djv n SER 90 Ca 0.02 1.06 -0.11 0.00 -1.33 0.00 0.00 58.87 58.50 3djv n SER 90 Cb 0.44 -1.54 -0.10 0.00 -0.75 0.00 0.00 64.21 62.27 3djv n SER 90 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 3djv s LYS 91 N 1.29 0.29 0.27 -1.46 2.20 -0.85 -4.89 119.74 116.58 3djv s LYS 91 Ca 0.77 0.62 -0.29 0.00 -0.36 0.00 0.00 55.97 56.71 3djv s LYS 91 Cb -0.54 -0.35 -0.14 0.00 -1.51 0.00 0.00 37.83 35.29 3djv s LYS 91 CO 0.34 -0.50 1.07 0.98 -0.36 0.00 0.00 175.35 176.88 3djv n TYR 92 N 5.36 1.37 1.58 4.03 9.36 -1.26 -0.20 117.16 137.40 3djv n TYR 92 Ca -0.05 0.68 0.07 0.00 3.32 0.00 0.00 57.90 61.92 3djv n TYR 92 Cb 0.50 -2.27 0.33 0.00 -0.63 0.00 0.00 39.34 37.26 3djv n TYR 92 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3djv n PRO 93 N 0.97 1.36 -3.15 2.98 -0.04 -1.26 -4.97 135.00 130.89 3djv n PRO 93 Ca 0.10 -0.54 -0.44 0.00 -0.04 0.00 0.00 63.50 62.58 3djv n PRO 93 Cb 0.31 -1.27 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 3djv n PRO 93 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3djv n ASN 94 N -0.18 5.49 -4.72 3.54 4.13 0.72 -5.02 115.26 119.21 3djv n ASN 94 Ca 0.12 -3.05 -0.42 0.00 1.68 0.00 0.00 54.58 52.91 3djv n ASN 94 Cb 0.17 -1.44 -0.03 0.00 -1.54 0.00 0.00 39.78 36.94 3djv n ASN 94 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3djv s ALA 96 N 0.48 0.95 0.02 0.00 0.00 -1.26 -4.95 121.76 117.00 3djv s ALA 96 Ca 0.54 -0.41 0.05 0.00 0.00 0.00 0.00 51.96 52.13 3djv s ALA 96 Cb -0.28 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.50 3djv s ALA 96 CO 0.31 0.18 -0.15 0.71 0.00 0.00 0.00 175.76 176.82 3djv s TYR 97 N 0.05 1.28 -0.17 0.00 2.02 -1.26 -1.38 117.35 117.90 3djv s TYR 97 Ca -0.01 -0.31 -0.22 0.00 -0.37 0.00 0.00 57.07 56.15 3djv s TYR 97 Cb -0.08 -0.79 -0.02 0.00 -0.40 0.00 0.00 41.96 40.67 3djv s TYR 97 CO 0.00 0.02 0.69 0.21 -1.57 0.00 0.00 175.55 174.91 3djv s LYS 98 N -0.85 4.27 -0.23 -0.62 2.36 0.81 -4.67 119.74 120.81 3djv s LYS 98 Ca 0.03 0.77 -0.16 0.00 -2.55 0.00 0.00 55.97 54.06 3djv s LYS 98 Cb -0.07 -3.55 -0.04 0.00 -1.05 0.00 0.00 37.83 33.12 3djv s LYS 98 CO 0.01 -0.20 0.41 0.99 1.55 0.00 0.00 175.35 178.10 3djv s THR 99 N 1.76 5.17 -0.12 3.43 2.01 -1.26 -2.53 115.64 124.10 3djv s THR 99 Ca 0.33 0.69 -0.00 0.00 0.31 0.00 0.00 61.69 63.02 3djv s THR 99 Cb -0.16 -3.74 0.02 0.00 0.01 0.00 0.00 72.50 68.64 3djv s THR 99 CO 0.12 0.19 -0.09 -0.89 -0.69 0.00 0.00 174.62 173.27 3djv s THR 100 N 1.72 1.11 -0.21 -0.82 2.01 -0.62 -4.96 115.64 113.88 3djv s THR 100 Ca 0.18 -0.35 -0.20 0.00 0.31 0.00 0.00 61.69 61.63 3djv s THR 100 Cb -0.15 -1.11 -0.03 0.00 0.01 0.00 0.00 72.50 71.22 3djv s THR 100 CO 0.09 0.38 0.61 -1.10 -0.69 0.00 0.00 174.62 173.91 3djv s GLN 101 N 1.65 4.19 0.13 4.92 -0.21 -1.26 -0.31 119.66 128.78 3djv s GLN 101 Ca 0.05 0.56 -0.00 0.00 0.02 0.00 0.00 55.36 55.99 3djv s GLN 101 Cb -0.13 -3.59 -0.04 0.00 1.00 0.00 0.00 33.01 30.26 3djv s GLN 101 CO -0.08 -0.25 0.04 0.14 -2.12 0.00 0.00 175.29 173.02 3djv s VAL 102 N 1.94 0.24 -0.24 1.09 -7.23 -0.72 -5.01 120.40 110.48 3djv s VAL 102 Ca 0.27 -1.92 -0.01 0.00 -1.81 0.00 0.00 61.98 58.51 3djv s VAL 102 Cb -0.16 -2.02 0.02 0.00 0.56 0.00 0.00 36.38 34.78 3djv s VAL 102 CO 0.10 -0.51 -0.08 -1.61 -0.31 0.00 0.00 175.10 172.69 3djv s GLU 103 N -4.01 2.86 0.06 4.82 2.02 -1.26 -1.30 118.70 121.90 3djv s GLU 103 Ca 0.23 -0.95 -0.04 0.00 0.02 0.00 0.00 54.97 54.22 3djv s GLU 103 Cb 0.07 -2.92 -0.02 0.00 0.10 0.00 0.00 34.13 31.36 3djv s GLU 103 CO 0.01 -0.37 0.06 0.15 0.02 0.00 0.00 175.26 175.14 3djv s LYS 104 N 1.32 0.69 0.42 1.61 1.02 -0.84 -4.83 119.74 119.13 3djv s LYS 104 Ca 0.01 -1.10 -0.24 0.00 0.02 0.00 0.00 55.97 54.66 3djv s LYS 104 Cb -0.16 0.26 -0.08 0.00 -0.52 0.00 0.00 37.83 37.33 3djv s LYS 104 CO -0.06 -0.17 1.15 -1.01 -0.92 0.00 0.00 175.35 174.34 3djv s HIS 105 N -3.82 3.04 0.08 3.18 3.76 -0.13 -0.56 115.29 120.85 3djv s HIS 105 Ca 0.05 1.56 0.04 0.00 -0.15 0.00 0.00 55.06 56.57 3djv s HIS 105 Cb 0.06 -3.34 -0.04 0.00 1.11 0.00 0.00 32.58 30.37 3djv s HIS 105 CO -0.10 -1.25 0.03 0.96 -0.85 0.00 0.00 174.74 173.52 3djv s ILE 106 N -1.50 4.20 -0.15 0.60 -4.36 -1.26 -0.94 121.20 117.79 3djv s ILE 106 Ca 0.59 -0.90 0.02 0.00 -0.26 0.00 0.00 60.65 60.10 3djv s ILE 106 Cb -0.28 -3.00 0.02 0.00 1.25 0.00 0.00 42.46 40.44 3djv s ILE 106 CO 0.35 0.13 -0.19 -0.63 0.24 0.00 0.00 174.94 174.84 3djv s ILE 107 N -1.33 1.89 0.12 8.37 1.01 0.73 -0.91 121.20 131.08 3djv s ILE 107 Ca 0.27 -0.86 0.08 0.00 0.00 0.00 0.00 60.65 60.14 3djv s ILE 107 Cb -0.12 -1.70 -0.04 0.00 0.01 0.00 0.00 42.46 40.61 3djv s ILE 107 CO 0.19 0.51 -0.19 0.68 0.00 0.00 0.00 174.94 176.14 3djv s VAL 108 N 1.08 1.65 0.07 2.92 -7.23 -0.52 -0.36 120.40 118.02 3djv s VAL 108 Ca -0.02 -1.62 -0.21 0.00 -1.81 0.00 0.00 61.98 58.32 3djv s VAL 108 Cb -0.14 -1.58 -0.06 0.00 0.56 0.00 0.00 36.38 35.15 3djv s VAL 108 CO -0.06 -0.16 0.63 0.00 -0.31 0.00 0.00 175.10 175.20 3djv s ALA 109 N -1.46 3.52 -0.09 1.32 0.00 -0.30 -0.76 121.76 123.99 3djv s ALA 109 Ca 0.08 0.12 0.02 0.00 0.00 0.00 0.00 51.96 52.18 3djv s ALA 109 Cb -0.09 -2.76 -0.02 0.00 0.00 0.00 0.00 23.12 20.26 3djv s ALA 109 CO 0.05 0.29 -0.16 0.00 0.00 0.00 0.00 175.76 175.93 3djv s GLY 111 N -0.10 0.52 0.00 0.00 0.00 -0.31 -4.84 107.32 102.58 3djv s GLY 111 Ca -0.03 -0.84 0.00 0.00 0.00 0.00 0.00 44.72 43.85 3djv s GLY 111 CO 0.04 -0.56 0.00 0.61 0.00 0.00 0.00 173.10 173.19 3djv n GLY 112 N -0.42 -2.31 2.73 0.20 0.00 -1.26 -1.68 105.19 102.45 3djv n GLY 112 Ca -0.02 -1.54 -0.25 0.00 0.00 0.00 0.00 46.02 44.20 3djv n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3djv s LYS 113 N -0.71 0.54 0.77 1.61 1.02 -1.26 -2.84 119.74 118.86 3djv s LYS 113 Ca 0.00 -0.16 -0.13 0.00 0.02 0.00 0.00 55.97 55.69 3djv s LYS 113 Cb 0.00 -1.62 0.06 0.00 -0.52 0.00 0.00 37.83 35.75 3djv s LYS 113 CO 0.00 -0.51 1.16 -1.25 -0.92 0.00 0.00 175.35 173.83 3djv s PRO 114 N 1.95 2.00 -0.33 -1.68 0.04 -1.26 -5.07 135.00 130.65 3djv s PRO 114 Ca 0.02 1.57 -0.29 0.00 0.04 0.00 0.00 61.00 62.34 3djv s PRO 114 Cb -0.15 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.56 3djv s PRO 114 CO -0.07 -1.90 1.31 0.45 0.04 0.00 0.00 177.00 176.84 3djv s SER 115 N -2.45 6.60 0.22 6.66 0.15 -1.13 -4.86 113.70 118.88 3djv s SER 115 Ca 0.70 1.09 0.04 0.00 0.70 0.00 0.00 55.95 58.47 3djv s SER 115 Cb -0.25 -2.54 -0.05 0.00 -1.71 0.00 0.00 66.02 61.47 3djv s SER 115 CO 0.49 -1.16 -0.02 0.68 1.20 0.00 0.00 173.24 174.43 3djv s VAL 116 N 4.59 1.09 0.21 4.45 -7.23 -0.67 -4.81 120.40 118.03 3djv s VAL 116 Ca 0.57 -2.04 -0.32 0.00 -1.81 0.00 0.00 61.98 58.38 3djv s VAL 116 Cb -0.15 -2.26 -0.12 0.00 0.56 0.00 0.00 36.38 34.40 3djv s VAL 116 CO 0.25 -0.39 1.71 -2.84 -0.31 0.00 0.00 175.10 173.52 3djv s PRO 117 N -3.84 4.12 0.00 4.82 0.02 -1.26 -1.16 135.00 137.70 3djv s PRO 117 Ca 0.26 2.60 0.00 0.00 0.02 0.00 0.00 61.00 63.89 3djv s PRO 117 Cb 0.05 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.50 3djv s PRO 117 CO 0.07 -0.74 0.00 1.33 -0.33 0.00 0.00 177.00 177.33 3djv n VAL 118 N 3.84 0.00 -3.72 3.83 0.24 0.79 -4.87 118.33 118.43 3djv n VAL 118 Ca 0.15 -0.25 -0.14 0.00 -2.04 0.00 0.00 64.34 62.07 3djv n VAL 118 Cb 0.35 0.76 -0.09 0.00 -1.47 0.00 0.00 33.84 33.39 3djv n VAL 118 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 3djv s HIS 119 N -1.19 -0.42 -0.32 6.34 5.65 -1.17 -4.98 115.29 119.21 3djv s HIS 119 Ca 0.00 0.93 -0.16 0.00 0.25 0.00 0.00 55.06 56.09 3djv s HIS 119 Cb 0.00 0.17 -0.02 0.00 -1.18 0.00 0.00 32.58 31.55 3djv s HIS 119 CO 0.00 -0.30 0.40 0.12 -0.65 0.00 0.00 174.74 174.31 3djv s PHE 120 N -0.29 3.21 -0.20 3.88 2.19 -1.26 -1.15 117.98 124.37 3djv s PHE 120 Ca -0.04 0.17 -0.20 0.00 0.33 0.00 0.00 56.93 57.19 3djv s PHE 120 Cb -0.03 -2.70 -0.20 0.00 -1.31 0.00 0.00 43.02 38.78 3djv s PHE 120 CO 0.02 -0.39 0.24 0.22 1.83 0.00 0.00 175.22 177.14 3djv h ASP 121 N 8.36 0.05 -4.68 6.13 3.58 -1.04 -3.48 116.42 125.35 3djv h ASP 121 Ca -0.30 -0.57 0.11 0.00 0.42 0.00 0.00 57.03 56.70 3djv h ASP 121 Cb 1.15 -0.02 -0.15 0.00 1.72 0.00 0.00 39.33 42.03 3djv h ASP 121 CO 0.70 1.53 0.49 0.00 -2.88 0.00 0.00 179.24 179.08 3djv s ALA 122 N -2.39 -1.81 0.00 -0.78 0.00 -1.01 -4.87 121.76 110.91 3djv s ALA 122 Ca -0.28 0.96 0.07 0.00 0.00 0.00 0.00 51.96 52.71 3djv s ALA 122 Cb 0.06 0.44 -0.03 0.00 0.00 0.00 0.00 23.12 23.59 3djv s ALA 122 CO 0.61 -0.71 -0.20 -1.54 0.00 0.00 0.00 175.76 173.93 3djv s SER 123 N -2.51 3.60 0.00 0.00 1.04 -1.26 -0.19 113.70 114.38 3djv s SER 123 Ca 0.05 -0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.09 3djv s SER 123 Cb -0.01 -0.57 0.00 0.00 0.10 0.00 0.00 66.02 65.54 3djv s SER 123 CO -0.09 0.29 0.13 1.33 0.98 0.00 0.00 173.24 175.89