#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 1.96 -1.97 1.64 2.13 -1.26 -4.94 120.64 118.20 3djv n GLU 2 Ca 0.00 0.71 -0.34 0.00 0.66 0.00 0.00 57.16 58.19 3djv n GLU 2 Cb 0.00 -2.45 0.03 0.00 0.27 0.00 0.00 31.44 29.29 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 0.86 5.35 0.31 4.31 1.04 -1.26 -4.83 113.70 119.48 3djv s SER 3 Ca 0.80 2.09 -0.00 0.00 0.48 0.00 0.00 55.95 59.32 3djv s SER 3 Cb -0.73 -2.57 0.51 0.00 0.10 0.00 0.00 66.02 63.33 3djv s SER 3 CO 0.40 -1.47 1.96 0.00 0.98 0.00 0.00 173.24 175.11 3djv h ALA 4 N 0.55 1.47 -0.37 5.32 0.00 -1.98 0.19 119.26 124.43 3djv h ALA 4 Ca -0.48 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 3djv h ALA 4 Cb 1.26 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 3djv h ALA 4 CO 0.55 0.46 0.19 0.00 0.00 0.00 0.00 179.25 180.45 3djv h ALA 5 N 1.51 0.47 -0.60 0.00 0.00 -1.99 -0.28 119.26 118.37 3djv h ALA 5 Ca 0.32 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 3djv h ALA 5 Cb -0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3djv h ALA 5 CO -0.09 0.02 0.02 0.00 0.00 0.00 0.00 179.25 179.21 3djv h ALA 6 N 1.04 0.90 -0.71 0.00 0.00 -1.80 -1.80 119.26 116.90 3djv h ALA 6 Ca 0.13 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 3djv h ALA 6 Cb 0.10 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3djv h ALA 6 CO -0.02 0.66 0.43 -0.22 0.00 0.00 0.00 179.25 180.10 3djv h LYS 7 N 0.96 0.96 -0.58 0.00 3.64 -0.43 0.31 116.57 121.42 3djv h LYS 7 Ca 0.18 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 3djv h LYS 7 Cb 0.52 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 32.11 3djv h LYS 7 CO 0.03 0.68 0.28 0.35 -2.27 0.00 0.00 179.45 178.51 3djv h PHE 8 N 0.96 0.85 -0.74 1.91 3.04 -0.73 0.21 116.94 122.43 3djv h PHE 8 Ca 0.25 -0.04 -0.01 0.00 3.98 0.00 0.00 57.97 62.15 3djv h PHE 8 Cb -0.04 -0.26 -0.03 0.00 2.56 0.00 0.00 35.95 38.18 3djv h PHE 8 CO -0.01 0.65 0.41 0.93 -2.02 0.00 0.00 178.31 178.27 3djv h GLU 9 N 0.80 1.03 -0.24 1.11 5.08 -0.87 0.61 114.58 122.09 3djv h GLU 9 Ca 0.20 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 3djv h GLU 9 Cb 0.13 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3djv h GLU 9 CO -0.02 0.76 0.04 -0.09 -1.00 0.00 0.00 179.01 178.70 3djv h ARG 10 N 1.02 0.40 0.00 2.33 2.43 -0.61 -2.20 114.38 117.75 3djv h ARG 10 Ca 0.26 -0.10 -0.17 0.00 -0.81 0.00 0.00 59.98 59.16 3djv h ARG 10 Cb 0.03 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 3djv h ARG 10 CO -0.04 0.52 -0.81 1.96 -1.51 0.00 0.00 179.97 180.09 3djv h GLN 11 N 0.21 0.00 0.00 0.20 4.20 -0.77 -3.41 115.11 115.54 3djv h GLN 11 Ca 0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.78 3djv h GLN 11 Cb 0.32 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.10 3djv h GLN 11 CO 0.00 0.81 0.00 0.72 -0.67 0.00 0.00 178.83 179.70 3djv n HIS 12 N -3.37 0.00 -4.10 2.96 8.25 0.19 -5.04 115.22 114.10 3djv n HIS 12 Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.12 3djv n HIS 12 Cb 0.84 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.83 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 -0.47 3.70 -0.38 -0.41 -1.94 -0.83 -4.98 119.30 113.98 3djv s MET 13 Ca 0.00 -0.48 0.09 0.00 -1.71 0.00 0.00 55.69 53.59 3djv s MET 13 Cb 0.00 -3.09 0.29 0.00 2.01 0.00 0.00 34.83 34.03 3djv s MET 13 CO 0.00 0.09 0.60 -3.47 -0.01 0.00 0.00 175.02 172.22 3djv n ASP 14 N 4.04 0.40 0.21 3.03 2.03 -1.26 -4.83 116.55 120.16 3djv n ASP 14 Ca -0.17 -2.81 0.08 0.00 0.52 0.00 0.00 54.79 52.41 3djv n ASP 14 Cb 0.52 -0.63 0.40 0.00 -0.72 0.00 0.00 41.12 40.70 3djv n ASP 14 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 3djv h SER 15 N 3.64 0.00 -0.30 1.67 0.02 -1.98 -3.27 113.55 113.33 3djv h SER 15 Ca 0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 3djv h SER 15 Cb 0.91 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.45 3djv h SER 15 CO 0.47 0.30 0.00 0.61 -1.14 0.00 0.00 176.83 177.07 3djv n GLY 16 N 0.14 1.20 3.04 -3.77 0.00 -1.26 -4.95 105.19 99.59 3djv n GLY 16 Ca -0.00 -0.62 -0.08 0.00 0.00 0.00 0.00 46.02 45.31 3djv n GLY 16 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3djv s ASN 17 N -1.52 0.37 -0.21 1.61 0.01 -1.23 -5.14 114.94 108.82 3djv s ASN 17 Ca 0.36 -0.76 -0.11 0.00 -0.71 0.00 0.00 52.86 51.64 3djv s ASN 17 Cb 0.21 0.16 -0.05 0.00 0.41 0.00 0.00 41.25 41.98 3djv s ASN 17 CO 0.29 -0.46 0.18 -0.55 -1.51 0.00 0.00 177.10 175.05 3djv s SER 18 N -2.24 6.21 0.33 -1.22 0.15 -1.26 -4.99 113.70 110.67 3djv s SER 18 Ca -0.04 0.23 0.25 0.00 0.70 0.00 0.00 55.95 57.09 3djv s SER 18 Cb -0.00 -2.12 1.12 0.00 -1.71 0.00 0.00 66.02 63.31 3djv s SER 18 CO -0.06 0.10 1.77 1.55 1.20 0.00 0.00 173.24 177.80 3djv h PRO 19 N 7.10 0.00 -0.24 5.44 0.13 -2.01 -2.40 132.00 140.03 3djv h PRO 19 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 3djv h PRO 19 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3djv h PRO 19 CO 0.71 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.35 3djv n SER 20 N -2.39 2.16 -4.76 1.44 3.41 -1.26 -4.95 113.62 107.28 3djv n SER 20 Ca 0.01 -1.81 -0.41 0.00 -0.26 0.00 0.00 58.87 56.41 3djv n SER 20 Cb 0.20 -0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 63.97 3djv n SER 20 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3djv s SER 21 N -1.51 7.02 0.06 4.04 0.15 -0.91 -4.93 113.70 117.62 3djv s SER 21 Ca 0.33 2.45 0.23 0.00 0.70 0.00 0.00 55.95 59.66 3djv s SER 21 Cb 0.18 -2.63 -0.04 0.00 -1.71 0.00 0.00 66.02 61.82 3djv s SER 21 CO 0.27 -0.35 0.93 -1.54 1.20 0.00 0.00 173.24 173.75 3djv n SER 22 N 1.26 0.56 -0.69 5.45 3.41 -1.26 -4.42 113.62 117.93 3djv n SER 22 Ca 0.00 -0.11 0.13 0.00 -0.26 0.00 0.00 58.87 58.63 3djv n SER 22 Cb 0.43 0.96 0.30 0.00 -0.26 0.00 0.00 64.21 65.64 3djv n SER 22 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3djv n SER 23 N -2.12 2.18 -0.51 4.04 3.41 -1.26 -3.79 113.62 115.57 3djv n SER 23 Ca 0.01 -1.70 0.13 0.00 -0.26 0.00 0.00 58.87 57.05 3djv n SER 23 Cb 0.48 0.03 0.41 0.00 -0.26 0.00 0.00 64.21 64.86 3djv n SER 23 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3djv n ASN 24 N 0.66 1.66 -0.05 4.04 5.15 -1.26 -4.36 115.26 121.10 3djv n ASN 24 Ca 0.16 -1.46 -0.08 0.00 -0.60 0.00 0.00 54.58 52.60 3djv n ASN 24 Cb 0.47 0.05 -0.02 0.00 -0.53 0.00 0.00 39.78 39.75 3djv n ASN 24 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 3djv h TYR 25 N 2.49 -0.59 -0.73 1.20 3.20 -1.86 -2.07 116.97 118.62 3djv h TYR 25 Ca 0.00 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 3djv h TYR 25 Cb 0.59 0.30 -0.03 0.00 1.54 0.00 0.00 36.73 39.12 3djv h TYR 25 CO 0.00 -0.30 0.37 0.00 -1.64 0.00 0.00 178.16 176.59 3djv h ASN 27 N 1.02 0.32 0.06 0.00 2.35 -1.71 0.73 115.58 118.35 3djv h ASN 27 Ca 0.25 0.07 -0.23 0.00 -0.55 0.00 0.00 56.30 55.85 3djv h ASN 27 Cb 0.09 0.03 0.02 0.00 0.05 0.00 0.00 38.32 38.51 3djv h ASN 27 CO -0.04 0.18 -0.93 -0.07 -1.65 0.00 0.00 177.43 174.93 3djv h LEU 28 N 0.49 0.71 -0.26 1.61 3.38 -0.91 -3.10 115.31 117.23 3djv h LEU 28 Ca 0.33 -0.81 -0.20 0.00 0.09 0.00 0.00 57.88 57.29 3djv h LEU 28 Cb 0.39 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.92 3djv h LEU 28 CO -0.30 1.44 -0.65 -0.03 0.09 0.00 0.00 178.44 178.99 3djv h MET 29 N 0.07 0.81 -0.58 1.13 4.05 -0.48 0.15 114.93 120.08 3djv h MET 29 Ca -0.13 -0.58 -0.01 0.00 -0.28 0.00 0.00 59.70 58.69 3djv h MET 29 Cb 1.63 0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 32.50 3djv h MET 29 CO 0.18 1.20 0.31 0.52 0.23 0.00 0.00 176.91 179.35 3djv h MET 30 N 0.59 0.80 0.31 0.39 2.86 -0.99 0.79 114.93 119.69 3djv h MET 30 Ca -0.02 -0.09 -0.02 0.00 -2.06 0.00 0.00 59.70 57.52 3djv h MET 30 Cb 1.26 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.77 3djv h MET 30 CO 0.14 0.60 -0.15 0.00 1.06 0.00 0.00 176.91 178.56 3djv n ARG 33 N -5.08 2.66 -3.13 0.00 5.12 0.25 -4.91 116.66 111.56 3djv n ARG 33 Ca 0.12 -1.58 -0.16 0.00 -1.93 0.00 0.00 57.85 54.30 3djv n ARG 33 Cb 0.40 -1.69 0.05 0.00 -1.16 0.00 0.00 32.46 30.05 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 0.45 -4.91 -0.29 5.56 5.02 -0.77 -4.91 118.16 118.32 3djv n LYS 34 Ca 0.14 0.58 0.07 0.00 -2.02 0.00 0.00 58.31 57.08 3djv n LYS 34 Cb 0.60 -4.82 0.20 0.00 -0.02 0.00 0.00 35.03 30.99 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 -3.42 2.93 -0.04 1.97 2.81 -0.21 -4.38 117.12 116.78 3djv n MET 35 Ca -0.01 -2.36 0.04 0.00 -1.81 0.00 0.00 57.70 53.56 3djv n MET 35 Cb 0.55 -1.49 0.06 0.00 -0.71 0.00 0.00 33.22 31.63 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 0.19 1.30 -3.36 2.03 -2.24 -1.22 -1.67 114.28 109.31 3djv n THR 36 Ca 0.15 -1.45 -0.38 0.00 -2.27 0.00 0.00 64.05 60.10 3djv n THR 36 Cb 0.61 0.22 -0.06 0.00 -2.10 0.00 0.00 70.33 68.99 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 -1.70 4.30 0.00 -0.78 -0.21 -1.26 -4.38 119.66 115.63 3djv s GLN 37 Ca 0.13 0.36 0.00 0.00 0.02 0.00 0.00 55.36 55.87 3djv s GLN 37 Cb 0.11 -3.45 0.00 0.00 1.00 0.00 0.00 33.01 30.67 3djv s GLN 37 CO 0.01 0.13 0.00 0.41 -2.12 0.00 0.00 175.29 173.73 3djv n GLY 38 N 3.39 1.37 3.50 3.09 0.00 -1.26 -4.82 105.19 110.46 3djv n GLY 38 Ca -0.08 -0.09 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 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 1.36 -0.29 1.61 -2.85 -1.26 -5.07 119.74 113.24 3djv s LYS 39 Ca 0.00 -0.67 -0.26 0.00 -1.00 0.00 0.00 55.97 54.05 3djv s LYS 39 Cb 0.00 0.56 0.00 0.00 -2.06 0.00 0.00 37.83 36.34 3djv s LYS 39 CO 0.00 -0.59 0.90 0.00 0.10 0.00 0.00 175.35 175.76 3djv s LYS 41 N 3.14 4.15 0.31 0.00 2.20 -0.67 -4.88 119.74 123.99 3djv s LYS 41 Ca 0.38 2.53 0.07 0.00 -0.36 0.00 0.00 55.97 58.59 3djv s LYS 41 Cb -0.14 -3.92 0.52 0.00 -1.51 0.00 0.00 37.83 32.78 3djv s LYS 41 CO 0.11 -0.89 1.74 -1.00 -0.36 0.00 0.00 175.35 174.96 3djv h PRO 42 N 9.67 0.23 -3.36 4.03 0.13 -1.94 -3.44 132.00 137.32 3djv h PRO 42 Ca -0.47 -0.10 -0.26 0.00 -0.87 0.00 0.00 66.00 64.31 3djv h PRO 42 Cb 1.22 -0.01 -0.32 0.00 0.13 0.00 0.00 31.00 32.02 3djv h PRO 42 CO 0.94 0.57 -0.64 0.08 -0.23 0.00 0.00 178.00 178.72 3djv s VAL 43 N -4.25 -0.05 -0.19 1.56 1.01 -1.26 -1.05 120.40 116.18 3djv s VAL 43 Ca -0.05 0.17 -0.18 0.00 0.00 0.00 0.00 61.98 61.92 3djv s VAL 43 Cb 0.14 -0.18 0.05 0.00 0.00 0.00 0.00 36.38 36.39 3djv s VAL 43 CO 0.76 0.07 0.53 0.21 0.00 0.00 0.00 175.10 176.67 3djv s ASN 44 N 1.03 -0.55 -0.12 3.32 2.47 -0.44 -5.03 114.94 115.63 3djv s ASN 44 Ca -0.08 1.05 -0.01 0.00 0.42 0.00 0.00 52.86 54.24 3djv s ASN 44 Cb -0.11 1.06 -0.02 0.00 -1.45 0.00 0.00 41.25 40.73 3djv s ASN 44 CO -0.04 -0.19 -0.07 -0.89 -3.72 0.00 0.00 177.10 172.18 3djv s THR 45 N 0.25 3.59 -0.11 -5.21 2.01 -1.26 -0.69 115.64 114.22 3djv s THR 45 Ca -0.00 -0.49 -0.03 0.00 0.31 0.00 0.00 61.69 61.48 3djv s THR 45 Cb -0.04 -2.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.92 3djv s THR 45 CO 0.01 0.54 0.01 -0.36 -0.69 0.00 0.00 174.62 174.12 3djv s PHE 46 N -0.04 3.16 -0.14 4.92 0.08 -0.26 -4.97 117.98 120.74 3djv s PHE 46 Ca -0.00 0.10 -0.03 0.00 0.12 0.00 0.00 56.93 57.12 3djv s PHE 46 Cb -0.14 -1.86 -0.03 0.00 -0.57 0.00 0.00 43.02 40.43 3djv s PHE 46 CO 0.03 0.35 -0.03 0.08 -0.10 0.00 0.00 175.22 175.55 3djv s VAL 47 N -0.52 3.94 -1.79 -0.44 1.01 -1.26 0.07 120.40 121.41 3djv s VAL 47 Ca 0.09 -0.35 0.16 0.00 0.00 0.00 0.00 61.98 61.88 3djv s VAL 47 Cb -0.12 -2.70 0.07 0.00 0.00 0.00 0.00 36.38 33.63 3djv s VAL 47 CO 0.02 0.52 0.94 1.41 0.00 0.00 0.00 175.10 177.99 3djv n HIS 48 N 3.18 0.00 -1.26 5.22 -0.00 -0.05 -4.95 115.22 117.36 3djv n HIS 48 Ca -0.18 0.00 -0.29 0.00 -0.00 0.00 0.00 57.72 57.26 3djv n HIS 48 Cb 0.53 0.00 0.17 0.00 -0.00 0.00 0.00 29.99 30.68 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 -1.58 0.61 0.67 -0.41 0.41 -1.25 -4.98 118.70 112.16 3djv s GLU 49 Ca 0.16 0.46 -0.17 0.00 -0.41 0.00 0.00 54.97 55.02 3djv s GLU 49 Cb 0.13 -1.76 0.00 0.00 -1.78 0.00 0.00 34.13 30.72 3djv s GLU 49 CO 0.29 -2.60 1.21 -1.54 -0.49 0.00 0.00 175.26 172.13 3djv s SER 50 N -3.60 4.66 0.30 -0.19 1.04 -1.26 -4.86 113.70 109.79 3djv s SER 50 Ca 0.65 2.37 0.00 0.00 0.48 0.00 0.00 55.95 59.45 3djv s SER 50 Cb -0.18 -2.59 0.52 0.00 0.10 0.00 0.00 66.02 63.87 3djv s SER 50 CO 0.56 -1.95 1.92 0.25 0.98 0.00 0.00 173.24 175.01 3djv h LEU 51 N 0.24 0.90 -0.52 2.42 5.85 -1.96 -1.75 115.31 120.49 3djv h LEU 51 Ca -0.49 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.26 3djv h LEU 51 Cb 1.30 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 42.10 3djv h LEU 51 CO 0.52 0.60 0.31 0.00 -0.34 0.00 0.00 178.44 179.53 3djv h ALA 52 N 1.51 0.67 -0.65 1.25 0.00 -1.99 0.91 119.26 120.96 3djv h ALA 52 Ca 0.37 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.22 3djv h ALA 52 Cb 0.14 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3djv h ALA 52 CO -0.13 0.01 0.21 -0.44 0.00 0.00 0.00 179.25 178.90 3djv h ASP 53 N 0.61 0.92 -0.20 0.00 3.32 -1.73 -1.18 116.42 118.17 3djv h ASP 53 Ca 0.21 -0.15 -0.12 0.00 0.02 0.00 0.00 57.03 56.99 3djv h ASP 53 Cb 0.04 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.35 3djv h ASP 53 CO -0.10 0.85 -0.33 0.58 -1.72 0.00 0.00 179.24 178.52 3djv h VAL 54 N 0.96 1.33 -0.91 -1.35 2.07 -0.90 -2.92 116.25 114.53 3djv h VAL 54 Ca 0.21 -1.55 0.10 0.00 0.82 0.00 0.00 66.70 66.28 3djv h VAL 54 Cb 0.26 1.85 -0.07 0.00 -1.52 0.00 0.00 31.29 31.82 3djv h VAL 54 CO -0.01 0.48 0.59 0.11 0.02 0.00 0.00 177.57 178.75 3djv h LYS 55 N 0.24 0.89 0.00 1.57 1.57 -0.71 -2.10 116.57 118.03 3djv h LYS 55 Ca 0.01 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 3djv h LYS 55 Cb 0.92 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 33.03 3djv h LYS 55 CO 0.08 0.59 -0.04 0.00 -0.57 0.00 0.00 179.45 179.51 3djv h ALA 56 N 1.55 1.21 -0.27 3.86 0.00 -1.02 -2.49 119.26 122.10 3djv h ALA 56 Ca 0.42 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.36 3djv h ALA 56 Cb 0.40 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3djv h ALA 56 CO -0.18 0.04 0.19 0.28 0.00 0.00 0.00 179.25 179.58 3djv h VAL 57 N 0.00 0.93 0.00 0.00 2.07 -1.34 -0.80 116.25 117.11 3djv h VAL 57 Ca -0.00 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.48 3djv h VAL 57 Cb 0.16 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 3djv h VAL 57 CO 0.00 0.02 0.00 0.00 0.02 0.00 0.00 177.57 177.62 3djv n SER 59 N -2.19 3.25 0.00 0.00 7.64 -0.31 -5.00 113.62 117.02 3djv n SER 59 Ca -0.01 -2.01 0.00 0.00 1.01 0.00 0.00 58.87 57.87 3djv n SER 59 Cb 0.07 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 62.96 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 0.86 3.33 -2.45 1.43 6.02 -0.05 -5.02 117.38 121.50 3djv n GLN 60 Ca 0.16 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.72 3djv n GLN 60 Cb 0.49 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.73 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 4.62 4.13 0.08 -1.09 2.20 -1.11 -4.85 119.74 123.72 3djv s LYS 61 Ca 0.00 1.49 -0.31 0.00 -0.36 0.00 0.00 55.97 56.79 3djv s LYS 61 Cb 0.00 -3.79 -0.08 0.00 -1.51 0.00 0.00 37.83 32.45 3djv s LYS 61 CO 0.00 -0.83 1.63 0.15 -0.36 0.00 0.00 175.35 175.94 3djv s LYS 62 N 3.69 4.20 0.18 4.03 -0.14 -1.26 -0.01 119.74 130.43 3djv s LYS 62 Ca 0.54 2.32 0.00 0.00 -1.36 0.00 0.00 55.97 57.48 3djv s LYS 62 Cb -0.19 -3.54 -0.04 0.00 -1.68 0.00 0.00 37.83 32.37 3djv s LYS 62 CO 0.16 -0.71 0.05 0.14 -0.76 0.00 0.00 175.35 174.24 3djv s VAL 63 N 2.43 0.36 0.30 3.17 -7.23 -0.65 -4.90 120.40 113.89 3djv s VAL 63 Ca 0.73 -1.96 -0.29 0.00 -1.81 0.00 0.00 61.98 58.65 3djv s VAL 63 Cb -0.40 -2.23 -0.11 0.00 0.56 0.00 0.00 36.38 34.20 3djv s VAL 63 CO 0.32 -0.33 1.47 0.42 -0.31 0.00 0.00 175.10 176.68 3djv s THR 64 N -3.88 2.36 0.28 5.32 -4.23 -1.26 -4.12 115.64 110.11 3djv s THR 64 Ca 0.28 0.33 -0.20 0.00 -1.18 0.00 0.00 61.69 60.92 3djv s THR 64 Cb 0.07 -3.21 -0.09 0.00 1.34 0.00 0.00 72.50 70.61 3djv s THR 64 CO 0.06 0.06 0.78 0.00 -0.54 0.00 0.00 174.62 174.98 3djv h LYS 66 N 2.99 0.14 -0.38 0.00 1.57 -1.91 -1.21 116.57 117.76 3djv h LYS 66 Ca -0.48 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 3djv h LYS 66 Cb 1.19 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.47 3djv h LYS 66 CO 0.65 0.09 0.00 0.27 -0.57 0.00 0.00 179.45 179.89 3djv n ASN 67 N -4.46 2.33 0.00 0.86 6.94 -1.26 -4.94 115.26 114.74 3djv n ASN 67 Ca 0.05 -1.93 0.00 0.00 -0.02 0.00 0.00 54.58 52.68 3djv n ASN 67 Cb 0.35 -0.25 0.00 0.00 -2.36 0.00 0.00 39.78 37.52 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 1.22 0.80 3.77 4.83 0.00 -0.46 -5.02 105.19 110.34 3djv n GLY 68 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.10 1.27 -0.29 1.61 -0.21 -1.26 -4.88 119.66 115.80 3djv s GLN 69 Ca 0.00 0.43 0.08 0.00 0.02 0.00 0.00 55.36 55.89 3djv s GLN 69 Cb 0.00 -1.84 0.46 0.00 1.00 0.00 0.00 33.01 32.63 3djv s GLN 69 CO 0.00 -2.14 1.34 0.25 -2.12 0.00 0.00 175.29 172.63 3djv n THR 70 N -3.75 2.51 -1.41 -0.19 -2.24 -1.26 -3.54 114.28 104.40 3djv n THR 70 Ca 0.06 -3.35 0.07 0.00 -2.27 0.00 0.00 64.05 58.57 3djv n THR 70 Cb 0.58 -0.58 0.15 0.00 -2.10 0.00 0.00 70.33 68.38 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 -1.00 1.86 -4.90 3.42 6.94 -1.26 -5.03 115.26 115.29 3djv n ASN 71 Ca 0.34 -3.23 -0.33 0.00 -0.02 0.00 0.00 54.58 51.33 3djv n ASN 71 Cb 0.88 -0.44 -0.05 0.00 -2.36 0.00 0.00 39.78 37.82 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 -1.37 0.25 -0.11 0.00 1.51 -0.03 -1.63 117.35 115.97 3djv s TYR 73 Ca 0.30 -0.05 -0.03 0.00 -1.01 0.00 0.00 57.07 56.28 3djv s TYR 73 Cb -0.13 -0.17 -0.03 0.00 -0.11 0.00 0.00 41.96 41.52 3djv s TYR 73 CO 0.20 -0.01 0.01 -1.14 -1.11 0.00 0.00 175.55 173.50 3djv s GLN 74 N -0.04 3.25 0.29 -0.62 0.74 0.99 -1.13 119.66 123.13 3djv s GLN 74 Ca 0.01 -0.41 -0.29 0.00 0.05 0.00 0.00 55.36 54.72 3djv s GLN 74 Cb -0.01 -2.88 -0.10 0.00 1.10 0.00 0.00 33.01 31.11 3djv s GLN 74 CO -0.00 0.57 1.41 -1.54 -0.55 0.00 0.00 175.29 175.18 3djv s SER 75 N -0.52 6.64 0.39 6.67 1.04 0.03 -2.77 113.70 125.19 3djv s SER 75 Ca 0.09 2.73 0.09 0.00 0.48 0.00 0.00 55.95 59.34 3djv s SER 75 Cb -0.12 -2.64 0.79 0.00 0.10 0.00 0.00 66.02 64.15 3djv s SER 75 CO 0.02 -0.68 1.94 0.07 0.98 0.00 0.00 173.24 175.57 3djv h LYS 76 N 4.23 0.30 -6.26 4.02 2.10 -1.94 -3.44 116.57 115.57 3djv h LYS 76 Ca -0.48 -0.06 -0.61 0.00 -2.00 0.00 0.00 60.65 57.50 3djv h LYS 76 Cb 1.22 -0.05 -0.14 0.00 -0.90 0.00 0.00 32.23 32.37 3djv h LYS 76 CO 0.72 0.38 -0.76 -1.12 -2.00 0.00 0.00 179.45 176.68 3djv s SER 77 N -6.85 3.68 0.73 7.07 0.01 -1.26 -5.10 113.70 111.97 3djv s SER 77 Ca -0.06 -0.96 -0.13 0.00 1.31 0.00 0.00 55.95 56.10 3djv s SER 77 Cb 0.16 -0.36 0.04 0.00 0.21 0.00 0.00 66.02 66.07 3djv s SER 77 CO 0.73 0.05 1.13 0.42 0.41 0.00 0.00 173.24 175.98 3djv s THR 78 N -2.37 2.92 0.10 1.44 -4.23 -1.26 -4.57 115.64 107.66 3djv s THR 78 Ca 0.29 0.39 0.06 0.00 -1.18 0.00 0.00 61.69 61.25 3djv s THR 78 Cb -0.06 -2.85 -0.03 0.00 1.34 0.00 0.00 72.50 70.90 3djv s THR 78 CO 0.15 -0.30 -0.16 -0.04 -0.54 0.00 0.00 174.62 173.73 3djv s MET 79 N -4.29 0.98 -0.24 3.99 -1.94 0.25 -4.88 119.30 113.17 3djv s MET 79 Ca 0.67 -1.13 -0.29 0.00 -1.71 0.00 0.00 55.69 53.24 3djv s MET 79 Cb -0.22 -1.01 -0.01 0.00 2.01 0.00 0.00 34.83 35.60 3djv s MET 79 CO 0.47 0.22 1.31 1.03 -0.01 0.00 0.00 175.02 178.04 3djv s ARG 80 N -2.16 4.03 0.16 2.03 0.52 -1.26 -2.39 118.95 119.88 3djv s ARG 80 Ca 0.05 1.44 0.02 0.00 -0.52 0.00 0.00 55.73 56.71 3djv s ARG 80 Cb -0.08 -3.85 -0.05 0.00 0.52 0.00 0.00 34.95 31.50 3djv s ARG 80 CO 0.03 -0.97 0.00 0.96 0.02 0.00 0.00 175.30 175.34 3djv s ILE 81 N 4.09 0.63 -0.13 1.52 -4.36 -0.24 -0.87 121.20 121.85 3djv s ILE 81 Ca 0.57 -1.97 0.03 0.00 -0.26 0.00 0.00 60.65 59.02 3djv s ILE 81 Cb -0.19 -2.08 0.01 0.00 1.25 0.00 0.00 42.46 41.45 3djv s ILE 81 CO 0.20 -0.51 -0.22 -0.89 0.24 0.00 0.00 174.94 173.76 3djv s THR 82 N -3.69 2.04 -0.18 8.37 2.01 0.11 -1.20 115.64 123.11 3djv s THR 82 Ca 0.23 -0.98 -0.17 0.00 0.31 0.00 0.00 61.69 61.08 3djv s THR 82 Cb 0.06 -1.80 -0.04 0.00 0.01 0.00 0.00 72.50 70.73 3djv s THR 82 CO 0.03 0.55 0.43 -0.62 -0.69 0.00 0.00 174.62 174.32 3djv s ASP 83 N 0.70 6.52 -0.22 3.53 -1.08 0.02 -1.10 116.67 125.05 3djv s ASP 83 Ca -0.10 0.61 -0.01 0.00 -0.52 0.00 0.00 52.55 52.53 3djv s ASP 83 Cb -0.16 -2.25 0.01 0.00 -1.46 0.00 0.00 42.92 39.06 3djv s ASP 83 CO 0.01 -0.07 -0.11 0.00 0.52 0.00 0.00 175.17 175.52 3djv s ARG 85 N 1.35 2.30 0.27 0.00 1.81 -0.91 -1.33 118.95 122.43 3djv s ARG 85 Ca 0.03 -0.75 -0.30 0.00 -1.72 0.00 0.00 55.73 52.99 3djv s ARG 85 Cb -0.15 -1.90 -0.11 0.00 -0.45 0.00 0.00 34.95 32.34 3djv s ARG 85 CO -0.07 0.25 1.62 -2.00 -0.68 0.00 0.00 175.30 174.42 3djv s GLU 86 N 0.10 4.13 0.76 3.54 2.12 -0.21 -0.04 118.70 129.10 3djv s GLU 86 Ca -0.08 2.57 -0.11 0.00 0.36 0.00 0.00 54.97 57.70 3djv s GLU 86 Cb -0.14 -3.04 0.05 0.00 0.26 0.00 0.00 34.13 31.25 3djv s GLU 86 CO 0.04 -0.65 1.10 0.95 -0.54 0.00 0.00 175.26 176.16 3djv s THR 87 N 0.32 3.20 0.45 -1.70 -4.23 0.30 -4.79 115.64 109.20 3djv s THR 87 Ca 0.66 0.39 0.22 0.00 -1.18 0.00 0.00 61.69 61.78 3djv s THR 87 Cb -0.48 -3.25 0.25 0.00 1.34 0.00 0.00 72.50 70.36 3djv s THR 87 CO 0.43 -0.51 2.06 1.23 -0.54 0.00 0.00 174.62 177.29 3djv h GLY 88 N -0.91 0.00 1.16 3.99 0.00 -1.94 -2.63 103.07 102.75 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 0.61 0.00 -0.73 1.76 0.00 0.00 0.00 176.54 178.18 3djv h SER 89 N 0.00 0.00 -2.40 0.19 0.02 -1.93 -3.47 113.55 105.96 3djv h SER 89 Ca -0.00 -0.11 -0.56 0.00 -0.84 0.00 0.00 61.79 60.27 3djv h SER 89 Cb 0.28 0.00 0.06 0.00 0.14 0.00 0.00 62.40 62.88 3djv h SER 89 CO 0.02 0.06 0.86 -0.24 -1.14 0.00 0.00 176.83 176.38 3djv n SER 90 N -2.42 3.35 -3.64 3.07 2.88 -0.99 -4.97 113.62 110.90 3djv n SER 90 Ca 0.02 1.08 -0.12 0.00 -1.33 0.00 0.00 58.87 58.52 3djv n SER 90 Cb 0.49 -1.47 -0.12 0.00 -0.75 0.00 0.00 64.21 62.36 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 0.94 0.21 0.26 -1.46 2.20 -0.97 -4.91 119.74 116.01 3djv s LYS 91 Ca 0.77 0.80 -0.30 0.00 -0.36 0.00 0.00 55.97 56.89 3djv s LYS 91 Cb -0.63 0.01 -0.14 0.00 -1.51 0.00 0.00 37.83 35.56 3djv s LYS 91 CO 0.37 -0.31 1.15 0.98 -0.36 0.00 0.00 175.35 177.18 3djv n TYR 92 N 5.36 1.58 0.68 4.03 9.36 -1.26 -0.19 117.16 136.72 3djv n TYR 92 Ca -0.07 0.63 0.05 0.00 3.32 0.00 0.00 57.90 61.83 3djv n TYR 92 Cb 0.50 -2.32 0.16 0.00 -0.63 0.00 0.00 39.34 37.05 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 1.16 2.10 -3.28 2.98 -0.04 -1.26 -4.99 135.00 131.66 3djv n PRO 93 Ca 0.10 -1.26 -0.45 0.00 -0.04 0.00 0.00 63.50 61.86 3djv n PRO 93 Cb 0.31 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 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 0.40 5.56 -4.66 3.54 4.13 0.73 -5.02 115.26 119.94 3djv n ASN 94 Ca 0.11 -3.06 -0.43 0.00 1.68 0.00 0.00 54.58 52.88 3djv n ASN 94 Cb 0.41 -1.39 -0.02 0.00 -1.54 0.00 0.00 39.78 37.24 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 3.20 2.11 0.02 0.00 0.00 -1.26 -4.91 121.76 120.92 3djv s ALA 96 Ca 0.45 -1.02 0.06 0.00 0.00 0.00 0.00 51.96 51.44 3djv s ALA 96 Cb -0.16 -0.65 -0.02 0.00 0.00 0.00 0.00 23.12 22.30 3djv s ALA 96 CO 0.07 0.41 -0.17 0.71 0.00 0.00 0.00 175.76 176.79 3djv s TYR 97 N -0.19 1.47 -0.13 0.00 2.02 -1.26 -0.54 117.35 118.73 3djv s TYR 97 Ca -0.02 -0.33 -0.25 0.00 -0.37 0.00 0.00 57.07 56.10 3djv s TYR 97 Cb -0.13 -0.90 -0.02 0.00 -0.40 0.00 0.00 41.96 40.51 3djv s TYR 97 CO 0.03 0.03 0.78 0.21 -1.57 0.00 0.00 175.55 175.03 3djv s LYS 98 N -0.89 4.35 -0.21 -0.62 2.47 0.94 -4.66 119.74 121.11 3djv s LYS 98 Ca 0.05 0.96 -0.15 0.00 -1.56 0.00 0.00 55.97 55.27 3djv s LYS 98 Cb -0.08 -3.53 -0.04 0.00 -1.46 0.00 0.00 37.83 32.73 3djv s LYS 98 CO 0.01 -0.18 0.36 0.99 0.16 0.00 0.00 175.35 176.69 3djv s THR 99 N 1.63 5.22 -0.13 3.43 2.01 -1.26 -2.14 115.64 124.41 3djv s THR 99 Ca 0.38 0.61 0.01 0.00 0.31 0.00 0.00 61.69 63.00 3djv s THR 99 Cb -0.17 -3.69 0.02 0.00 0.01 0.00 0.00 72.50 68.67 3djv s THR 99 CO 0.15 0.26 -0.15 -0.89 -0.69 0.00 0.00 174.62 173.31 3djv s THR 100 N 1.29 1.54 -0.11 -0.82 2.01 -0.32 -4.99 115.64 114.25 3djv s THR 100 Ca 0.17 -0.64 -0.30 0.00 0.31 0.00 0.00 61.69 61.23 3djv s THR 100 Cb -0.15 -1.43 -0.02 0.00 0.01 0.00 0.00 72.50 70.92 3djv s THR 100 CO 0.07 0.45 1.10 -1.10 -0.69 0.00 0.00 174.62 174.45 3djv s GLN 101 N 1.26 4.37 0.05 4.92 -0.21 -1.26 -0.80 119.66 127.98 3djv s GLN 101 Ca -0.00 1.51 0.01 0.00 0.02 0.00 0.00 55.36 56.90 3djv s GLN 101 Cb -0.14 -3.57 -0.03 0.00 1.00 0.00 0.00 33.01 30.27 3djv s GLN 101 CO -0.07 -0.43 -0.06 0.14 -2.12 0.00 0.00 175.29 172.76 3djv s VAL 102 N 2.32 0.45 -0.30 1.09 -7.23 -0.34 -4.98 120.40 111.43 3djv s VAL 102 Ca 0.51 -1.29 0.03 0.00 -1.81 0.00 0.00 61.98 59.42 3djv s VAL 102 Cb -0.20 -0.84 0.08 0.00 0.56 0.00 0.00 36.38 35.97 3djv s VAL 102 CO 0.18 -0.56 -0.01 -1.61 -0.31 0.00 0.00 175.10 172.78 3djv s GLU 103 N -2.24 1.68 0.12 4.82 2.02 -1.26 -1.07 118.70 122.77 3djv s GLU 103 Ca -0.05 -1.52 -0.01 0.00 0.02 0.00 0.00 54.97 53.41 3djv s GLU 103 Cb -0.05 -2.92 -0.04 0.00 0.10 0.00 0.00 34.13 31.21 3djv s GLU 103 CO -0.02 -0.78 0.03 0.15 0.02 0.00 0.00 175.26 174.67 3djv s LYS 104 N 1.09 0.88 0.32 1.61 1.02 -1.01 -4.81 119.74 118.85 3djv s LYS 104 Ca 0.02 -1.41 -0.27 0.00 0.02 0.00 0.00 55.97 54.33 3djv s LYS 104 Cb -0.19 0.19 -0.09 0.00 -0.52 0.00 0.00 37.83 37.22 3djv s LYS 104 CO -0.08 -0.22 1.07 -1.01 -0.92 0.00 0.00 175.35 174.19 3djv s HIS 105 N -3.99 3.48 0.01 3.18 3.76 -0.28 -0.58 115.29 120.87 3djv s HIS 105 Ca 0.21 1.69 -0.01 0.00 -0.15 0.00 0.00 55.06 56.80 3djv s HIS 105 Cb 0.07 -3.20 -0.04 0.00 1.11 0.00 0.00 32.58 30.52 3djv s HIS 105 CO -0.00 -0.51 0.14 0.96 -0.85 0.00 0.00 174.74 174.48 3djv s ILE 106 N -1.36 5.12 -0.16 0.60 -4.36 -1.26 -1.01 121.20 118.77 3djv s ILE 106 Ca 0.49 -0.33 0.01 0.00 -0.26 0.00 0.00 60.65 60.56 3djv s ILE 106 Cb -0.28 -3.40 0.00 0.00 1.25 0.00 0.00 42.46 40.04 3djv s ILE 106 CO 0.35 0.29 -0.17 -0.63 0.24 0.00 0.00 174.94 175.02 3djv s ILE 107 N -1.31 2.51 0.08 8.37 1.01 0.60 -0.79 121.20 131.67 3djv s ILE 107 Ca 0.27 -0.82 0.07 0.00 0.00 0.00 0.00 60.65 60.17 3djv s ILE 107 Cb -0.12 -2.05 -0.03 0.00 0.01 0.00 0.00 42.46 40.27 3djv s ILE 107 CO 0.19 0.52 -0.18 0.68 0.00 0.00 0.00 174.94 176.15 3djv s VAL 108 N 0.87 1.44 0.07 2.92 -7.23 -0.29 -0.72 120.40 117.46 3djv s VAL 108 Ca -0.05 -1.39 -0.21 0.00 -1.81 0.00 0.00 61.98 58.51 3djv s VAL 108 Cb -0.15 -1.33 -0.06 0.00 0.56 0.00 0.00 36.38 35.40 3djv s VAL 108 CO -0.01 -0.10 0.64 0.00 -0.31 0.00 0.00 175.10 175.31 3djv s ALA 109 N -1.16 3.51 0.02 1.32 0.00 0.04 -0.85 121.76 124.64 3djv s ALA 109 Ca 0.03 0.13 0.07 0.00 0.00 0.00 0.00 51.96 52.18 3djv s ALA 109 Cb -0.10 -2.77 -0.03 0.00 0.00 0.00 0.00 23.12 20.22 3djv s ALA 109 CO 0.03 0.28 -0.18 0.00 0.00 0.00 0.00 175.76 175.89 3djv s GLY 111 N -1.27 0.30 0.00 0.00 0.00 -0.19 -4.87 107.32 101.29 3djv s GLY 111 Ca 0.14 -0.65 0.00 0.00 0.00 0.00 0.00 44.72 44.21 3djv s GLY 111 CO 0.04 -0.37 0.00 0.61 0.00 0.00 0.00 173.10 173.38 3djv n GLY 112 N -0.45 -0.91 2.63 0.20 0.00 -1.26 -1.41 105.19 103.99 3djv n GLY 112 Ca -0.03 -1.67 -0.28 0.00 0.00 0.00 0.00 46.02 44.04 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 -1.23 0.30 0.65 1.61 -0.14 -1.26 -2.65 119.74 117.03 3djv s LYS 113 Ca 0.00 -0.39 -0.16 0.00 -1.36 0.00 0.00 55.97 54.06 3djv s LYS 113 Cb 0.00 -1.72 -0.00 0.00 -1.68 0.00 0.00 37.83 34.43 3djv s LYS 113 CO 0.00 -0.80 1.14 -1.25 -0.76 0.00 0.00 175.35 173.68 3djv s PRO 114 N 2.01 2.75 -0.25 -1.68 0.04 -1.26 -5.09 135.00 131.52 3djv s PRO 114 Ca 0.04 1.53 -0.29 0.00 0.04 0.00 0.00 61.00 62.32 3djv s PRO 114 Cb -0.16 -1.93 -0.01 0.00 0.04 0.00 0.00 34.50 32.43 3djv s PRO 114 CO -0.18 -1.31 1.44 0.45 0.04 0.00 0.00 177.00 177.43 3djv s SER 115 N -2.27 6.56 0.19 6.66 0.15 -1.08 -4.88 113.70 119.03 3djv s SER 115 Ca 0.70 1.43 0.05 0.00 0.70 0.00 0.00 55.95 58.84 3djv s SER 115 Cb -0.24 -2.54 -0.05 0.00 -1.71 0.00 0.00 66.02 61.49 3djv s SER 115 CO 0.39 -1.13 -0.09 0.68 1.20 0.00 0.00 173.24 174.29 3djv s VAL 116 N 4.66 1.33 0.23 4.45 -7.23 -0.50 -4.83 120.40 118.52 3djv s VAL 116 Ca 0.63 -2.10 -0.31 0.00 -1.81 0.00 0.00 61.98 58.39 3djv s VAL 116 Cb -0.21 -2.05 -0.11 0.00 0.56 0.00 0.00 36.38 34.57 3djv s VAL 116 CO 0.25 -0.59 1.64 -2.84 -0.31 0.00 0.00 175.10 173.25 3djv s PRO 117 N -3.74 4.15 0.00 4.82 0.02 -1.26 -1.02 135.00 137.97 3djv s PRO 117 Ca 0.22 2.53 0.00 0.00 0.02 0.00 0.00 61.00 63.77 3djv s PRO 117 Cb 0.02 -3.08 0.00 0.00 0.02 0.00 0.00 34.50 31.47 3djv s PRO 117 CO 0.05 -0.67 0.00 1.33 -0.33 0.00 0.00 177.00 177.38 3djv n VAL 118 N 3.33 0.00 -3.67 3.83 0.24 0.76 -4.86 118.33 117.96 3djv n VAL 118 Ca 0.13 -0.40 -0.12 0.00 -2.04 0.00 0.00 64.34 61.91 3djv n VAL 118 Cb 0.37 0.98 -0.08 0.00 -1.47 0.00 0.00 33.84 33.63 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 -0.86 -0.73 -0.31 6.34 5.65 -1.16 -4.98 115.29 119.24 3djv s HIS 119 Ca 0.00 1.65 -0.20 0.00 0.25 0.00 0.00 55.06 56.76 3djv s HIS 119 Cb 0.00 0.32 -0.01 0.00 -1.18 0.00 0.00 32.58 31.71 3djv s HIS 119 CO 0.00 -0.36 0.62 0.12 -0.65 0.00 0.00 174.74 174.47 3djv s PHE 120 N 0.76 3.21 -0.21 3.88 2.19 -1.26 -0.78 117.98 125.77 3djv s PHE 120 Ca -0.04 0.56 -0.20 0.00 0.33 0.00 0.00 56.93 57.58 3djv s PHE 120 Cb -0.05 -2.99 -0.18 0.00 -1.31 0.00 0.00 43.02 38.49 3djv s PHE 120 CO -0.06 -0.48 0.14 -3.47 1.83 0.00 0.00 175.22 173.19 3djv n ASP 121 N 5.88 1.87 -3.51 6.13 2.03 0.10 -4.96 116.55 124.09 3djv n ASP 121 Ca -0.01 0.42 -0.08 0.00 0.52 0.00 0.00 54.79 55.64 3djv n ASP 121 Cb 0.49 -0.95 -0.02 0.00 -0.72 0.00 0.00 41.12 39.92 3djv n ASP 121 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3djv s ALA 122 N -2.39 -1.85 -0.08 -1.67 0.00 -1.03 -4.91 121.76 109.83 3djv s ALA 122 Ca -0.29 1.08 0.05 0.00 0.00 0.00 0.00 51.96 52.79 3djv s ALA 122 Cb 0.07 0.34 -0.01 0.00 0.00 0.00 0.00 23.12 23.52 3djv s ALA 122 CO 0.57 -0.67 -0.23 -1.54 0.00 0.00 0.00 175.76 173.89 3djv s SER 123 N -2.41 3.21 0.00 0.00 1.04 -1.26 -0.29 113.70 113.98 3djv s SER 123 Ca 0.05 -0.50 0.00 0.00 0.48 0.00 0.00 55.95 55.98 3djv s SER 123 Cb -0.01 -1.12 0.00 0.00 0.10 0.00 0.00 66.02 64.99 3djv s SER 123 CO -0.08 0.21 0.05 0.55 0.98 0.00 0.00 173.24 174.95