#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wrs h SER 5 N 0.00 0.21 -3.90 1.08 0.87 -2.12 -3.46 113.55 106.21 1wrs h SER 5 Ca 0.00 -0.74 -0.52 0.00 -1.23 0.00 0.00 61.79 59.30 1wrs h SER 5 Cb 0.00 -0.07 0.06 0.00 -0.44 0.00 0.00 62.40 61.95 1wrs h SER 5 CO 0.00 1.56 0.58 -2.16 -0.53 0.00 0.00 176.83 176.28 1wrs s PRO 6 N -2.43 4.22 1.23 2.24 0.05 -1.26 -5.01 135.00 134.05 1wrs s PRO 6 Ca -0.24 2.06 -0.20 0.00 0.05 0.00 0.00 61.00 62.66 1wrs s PRO 6 Cb 0.05 -2.91 0.30 0.00 0.05 0.00 0.00 34.50 31.99 1wrs s PRO 6 CO 0.69 -0.25 1.12 0.71 0.05 0.00 0.00 177.00 179.32 1wrs s TYR 7 N -1.24 0.19 0.00 0.56 2.02 -1.26 -5.00 117.35 112.61 1wrs s TYR 7 Ca 0.52 0.39 0.00 0.00 -0.37 0.00 0.00 57.07 57.61 1wrs s TYR 7 Cb -0.36 -3.52 0.00 0.00 -0.40 0.00 0.00 41.96 37.68 1wrs s TYR 7 CO 0.47 -4.03 0.00 0.43 -1.57 0.00 0.00 175.55 170.85 1wrs n SER 8 N -4.84 1.35 -3.13 2.29 7.64 -1.26 -4.87 113.62 110.80 1wrs n SER 8 Ca 0.15 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.71 1wrs n SER 8 Cb 0.60 0.16 -0.02 0.00 -1.01 0.00 0.00 64.21 63.95 1wrs n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wrs n ALA 9 N -0.80 5.22 -2.66 -0.43 0.00 -1.26 -5.03 120.51 115.56 1wrs n ALA 9 Ca 0.00 -4.63 -0.42 0.00 0.00 0.00 0.00 53.44 48.38 1wrs n ALA 9 Cb 0.11 -1.22 -0.03 0.00 0.00 0.00 0.00 19.45 18.30 1wrs n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wrs s ALA 10 N -3.78 3.63 -0.20 0.00 0.00 -1.26 -5.01 121.76 115.15 1wrs s ALA 10 Ca 0.46 0.07 -0.22 0.00 0.00 0.00 0.00 51.96 52.27 1wrs s ALA 10 Cb 0.27 -3.41 -0.02 0.00 0.00 0.00 0.00 23.12 19.95 1wrs s ALA 10 CO -0.15 -0.92 0.68 -1.64 0.00 0.00 0.00 175.76 173.72 1wrs s MET 11 N 2.86 4.22 -0.25 0.00 -1.94 -1.26 -5.00 119.30 117.93 1wrs s MET 11 Ca 0.40 0.71 -0.29 0.00 -1.71 0.00 0.00 55.69 54.80 1wrs s MET 11 Cb -0.16 -3.58 -0.02 0.00 2.01 0.00 0.00 34.83 33.08 1wrs s MET 11 CO 0.08 -0.27 1.62 0.00 -0.01 0.00 0.00 175.02 176.44 1wrs s ALA 12 N 2.01 3.20 -0.39 3.03 0.00 -1.26 -4.90 121.76 123.45 1wrs s ALA 12 Ca 0.31 0.40 -0.27 0.00 0.00 0.00 0.00 51.96 52.39 1wrs s ALA 12 Cb -0.16 -3.88 -0.06 0.00 0.00 0.00 0.00 23.12 19.02 1wrs s ALA 12 CO 0.11 -2.07 2.30 -1.21 0.00 0.00 0.00 175.76 174.89 1wrs s GLU 13 N 4.82 2.52 0.45 0.00 2.02 -1.26 -4.88 118.70 122.36 1wrs s GLU 13 Ca 0.72 1.60 -0.21 0.00 0.02 0.00 0.00 54.97 57.10 1wrs s GLU 13 Cb -0.24 -4.49 -0.14 0.00 0.10 0.00 0.00 34.13 29.37 1wrs s GLU 13 CO 0.30 -2.80 0.26 1.04 0.02 0.00 0.00 175.26 174.07 1wrs n GLN 14 N 8.91 0.25 -3.18 1.61 1.13 -1.26 -4.84 117.38 120.00 1wrs n GLN 14 Ca 0.33 0.09 -0.44 0.00 -1.94 0.00 0.00 57.00 55.04 1wrs n GLN 14 Cb 0.51 -1.26 0.00 0.00 0.11 0.00 0.00 30.24 29.60 1wrs n GLN 14 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1wrs n ARG 15 N 0.93 3.61 0.00 -1.09 1.74 -1.26 -4.23 116.66 116.36 1wrs n ARG 15 Ca 0.11 -4.30 0.00 0.00 -0.77 0.00 0.00 57.85 52.89 1wrs n ARG 15 Cb 0.42 -2.67 0.00 0.00 -1.02 0.00 0.00 32.46 29.19 1wrs n ARG 15 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 1wrs n HIS 16 N 3.23 0.00 0.00 -1.55 -0.00 -1.26 -4.88 115.22 110.75 1wrs n HIS 16 Ca 0.28 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.46 1wrs n HIS 16 Cb 0.39 0.02 0.00 0.00 -0.12 0.00 0.00 29.99 30.28 1wrs n HIS 16 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 1wrs n GLN 17 N 0.00 0.00 -0.40 1.57 6.02 -1.26 -3.16 117.38 120.14 1wrs n GLN 17 Ca 0.00 0.00 0.34 0.00 -0.01 0.00 0.00 57.00 57.33 1wrs n GLN 17 Cb 0.13 -0.10 0.65 0.00 1.02 0.00 0.00 30.24 31.95 1wrs n GLN 17 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.06 177.10 1wrs h GLU 18 N 0.00 0.15 0.19 -1.09 4.11 -1.95 0.85 114.58 116.83 1wrs h GLU 18 Ca 0.00 -0.01 0.01 0.00 0.07 0.00 0.00 59.36 59.43 1wrs h GLU 18 Cb 0.00 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 1wrs h GLU 18 CO 0.00 0.10 -0.46 2.35 0.07 0.00 0.00 179.01 181.06 1wrs h TRP 19 N 0.15 -1.31 -0.11 2.06 2.91 -1.90 -0.25 115.95 117.49 1wrs h TRP 19 Ca 0.70 0.03 0.03 0.00 1.13 0.00 0.00 58.89 60.78 1wrs h TRP 19 Cb 2.30 0.55 -0.00 0.00 -0.51 0.00 0.00 29.16 31.49 1wrs h TRP 19 CO -0.00 -0.57 0.09 -0.07 -1.03 0.00 0.00 178.44 176.86 1wrs h LEU 20 N -0.74 0.00 0.13 0.65 3.38 0.73 -3.12 115.31 116.34 1wrs h LEU 20 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1wrs h LEU 20 Cb 0.74 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.48 1wrs h LEU 20 CO -0.22 0.00 -0.10 0.03 0.09 0.00 0.00 178.44 178.24 1wrs h ARG 21 N 0.00 -0.21 -0.66 1.13 2.47 0.01 0.27 114.38 117.38 1wrs h ARG 21 Ca 0.05 0.01 0.28 0.00 -1.26 0.00 0.00 59.98 59.07 1wrs h ARG 21 Cb 0.24 0.05 -0.12 0.00 -1.65 0.00 0.00 29.97 28.48 1wrs h ARG 21 CO -0.00 -0.14 0.35 0.34 0.56 0.00 0.00 179.97 181.08 1wrs n PHE 22 N -2.86 0.77 -0.03 3.04 7.35 -1.15 0.20 117.46 124.78 1wrs n PHE 22 Ca -0.03 0.78 -0.14 0.00 -0.76 0.00 0.00 57.45 57.31 1wrs n PHE 22 Cb 0.10 -1.22 -0.09 0.00 0.35 0.00 0.00 39.48 38.62 1wrs n PHE 22 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1wrs h VAL 23 N 0.00 1.43 -0.19 -2.13 2.07 -1.39 -2.70 116.25 113.34 1wrs h VAL 23 Ca 0.56 -1.52 0.06 0.00 0.82 0.00 0.00 66.70 66.62 1wrs h VAL 23 Cb 1.49 2.27 -0.01 0.00 -1.52 0.00 0.00 31.29 33.52 1wrs h VAL 23 CO -0.51 0.42 0.77 -0.78 0.02 0.00 0.00 177.57 177.49 1wrs h ASP 24 N -0.29 0.00 0.00 0.57 3.58 0.58 0.00 116.42 120.86 1wrs h ASP 24 Ca -0.00 0.00 -0.42 0.00 0.42 0.00 0.00 57.03 57.03 1wrs h ASP 24 Cb 0.77 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 41.75 1wrs h ASP 24 CO 0.03 0.00 -2.50 0.18 -2.88 0.00 0.00 179.24 174.07 1wrs n LEU 25 N -2.85 2.63 -0.34 2.28 4.77 -1.05 -4.17 117.00 118.27 1wrs n LEU 25 Ca 0.04 0.02 0.22 0.00 -0.03 0.00 0.00 56.01 56.26 1wrs n LEU 25 Cb 0.85 -0.88 0.47 0.00 -2.33 0.00 0.00 43.42 41.54 1wrs n LEU 25 CO 0.10 0.82 1.19 0.25 -1.33 0.00 0.00 177.39 178.42 1wrs h LEU 26 N -0.34 0.52 -0.01 2.23 6.46 -0.66 -0.75 115.31 122.76 1wrs h LEU 26 Ca -0.62 0.12 -0.27 0.00 -0.12 0.00 0.00 57.88 56.99 1wrs h LEU 26 Cb 1.80 0.04 0.02 0.00 -0.73 0.00 0.00 40.66 41.79 1wrs h LEU 26 CO -0.20 0.04 -1.08 0.50 -0.62 0.00 0.00 178.44 177.08 1wrs h LYS 27 N 0.42 0.58 -0.00 1.25 3.64 -1.71 -2.65 116.57 118.10 1wrs h LYS 27 Ca 0.65 -0.68 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1wrs h LYS 27 Cb 1.52 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 33.55 1wrs h LYS 27 CO -0.40 1.28 -0.03 0.09 -2.27 0.00 0.00 179.45 178.11 1wrs n ASN 28 N -3.79 0.37 -0.02 4.20 4.13 -0.41 -4.07 115.26 115.67 1wrs n ASN 28 Ca -0.10 -0.83 -0.02 0.00 1.68 0.00 0.00 54.58 55.30 1wrs n ASN 28 Cb 0.91 -0.06 -0.04 0.00 -1.54 0.00 0.00 39.78 39.05 1wrs n ASN 28 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1wrs n ALA 29 N -0.85 1.89 -0.35 5.41 0.00 -0.48 -4.60 120.51 121.53 1wrs n ALA 29 Ca 0.19 -0.30 0.27 0.00 0.00 0.00 0.00 53.44 53.60 1wrs n ALA 29 Cb 0.22 0.17 0.53 0.00 0.00 0.00 0.00 19.45 20.36 1wrs n ALA 29 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1wrs h TYR 30 N 0.00 0.82 0.00 0.00 3.20 -1.61 0.83 116.97 120.21 1wrs h TYR 30 Ca -0.13 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 61.62 1wrs h TYR 30 Cb 1.28 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 39.31 1wrs h TYR 30 CO 0.00 -0.20 -0.77 1.96 -1.64 0.00 0.00 178.16 177.52 1wrs h GLN 31 N 0.25 0.00 0.00 1.82 4.20 -1.83 -3.13 115.11 116.42 1wrs h GLN 31 Ca 0.75 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.46 1wrs h GLN 31 Cb 1.90 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.68 1wrs h GLN 31 CO -0.57 0.77 -0.44 0.09 -0.67 0.00 0.00 178.83 178.00 1wrs n ASN 32 N -3.59 0.48 0.00 1.46 4.13 0.25 -4.93 115.26 113.06 1wrs n ASN 32 Ca -0.01 -0.02 0.00 0.00 1.68 0.00 0.00 54.58 56.23 1wrs n ASN 32 Cb 0.75 0.09 0.00 0.00 -1.54 0.00 0.00 39.78 39.08 1wrs n ASN 32 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1wrs n ASP 33 N -1.67 -1.94 0.02 6.41 2.03 0.12 -4.92 116.55 116.59 1wrs n ASP 33 Ca 0.05 0.00 0.07 0.00 0.52 0.00 0.00 54.79 55.43 1wrs n ASP 33 Cb 0.36 -0.47 -0.11 0.00 -0.72 0.00 0.00 41.12 40.18 1wrs n ASP 33 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1wrs n LEU 34 N 0.00 0.37 0.28 -2.67 7.99 -1.02 -4.21 117.00 117.74 1wrs n LEU 34 Ca 0.00 0.15 0.12 0.00 -0.01 0.00 0.00 56.01 56.27 1wrs n LEU 34 Cb 0.22 0.06 0.65 0.00 -0.11 0.00 0.00 43.42 44.24 1wrs n LEU 34 CO 0.00 0.03 1.01 1.12 -1.51 0.00 0.00 177.39 178.05 1wrs h HIS 35 N 0.00 0.00 0.03 -1.77 2.07 -1.89 -2.65 115.15 110.93 1wrs h HIS 35 Ca -0.09 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.43 1wrs h HIS 35 Cb 1.25 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.23 1wrs h HIS 35 CO 0.00 0.00 -0.01 -0.07 -3.07 0.00 0.00 177.93 174.78 1wrs h LEU 36 N 0.00 -0.03 -1.93 6.12 3.38 -1.93 -1.01 115.31 119.91 1wrs h LEU 36 Ca 0.00 0.00 0.21 0.00 0.09 0.00 0.00 57.88 58.18 1wrs h LEU 36 Cb 0.66 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 1wrs h LEU 36 CO 0.00 0.18 0.62 1.55 0.09 0.00 0.00 178.44 180.88 1wrs h PRO 37 N -0.44 0.00 0.11 1.13 0.13 -1.81 0.24 132.00 131.37 1wrs h PRO 37 Ca -0.00 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.84 1wrs h PRO 37 Cb 0.03 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.15 1wrs h PRO 37 CO 0.01 0.00 -1.39 -0.07 -0.23 0.00 0.00 178.00 176.32 1wrs h LEU 38 N 0.00 0.36 -2.26 1.56 3.38 -1.57 -3.26 115.31 113.52 1wrs h LEU 38 Ca 0.35 -0.45 0.03 0.00 0.09 0.00 0.00 57.88 57.91 1wrs h LEU 38 Cb 1.58 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 42.21 1wrs h LEU 38 CO -0.00 1.36 0.12 -0.07 0.09 0.00 0.00 178.44 179.94 1wrs h LEU 39 N 0.06 0.00 -1.71 1.67 4.07 0.90 0.70 115.31 121.00 1wrs h LEU 39 Ca -0.19 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.77 1wrs h LEU 39 Cb 1.98 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.72 1wrs h LEU 39 CO 0.17 0.00 0.00 0.59 -1.08 0.00 0.00 178.44 178.12 1wrs n ASN 40 N -3.95 2.49 0.01 -0.43 3.02 -1.07 -4.22 115.26 111.10 1wrs n ASN 40 Ca -0.00 -2.22 -0.02 0.00 -0.03 0.00 0.00 54.58 52.31 1wrs n ASN 40 Cb 0.23 -0.41 -0.01 0.00 -0.61 0.00 0.00 39.78 38.98 1wrs n ASN 40 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1wrs n LEU 41 N 0.37 0.87 0.00 3.41 7.94 0.24 -4.63 117.00 125.20 1wrs n LEU 41 Ca 0.12 0.12 0.01 0.00 -1.11 0.00 0.00 56.01 55.15 1wrs n LEU 41 Cb 0.49 -0.34 0.03 0.00 0.53 0.00 0.00 43.42 44.13 1wrs n LEU 41 CO 0.11 -0.58 0.14 1.15 -1.11 0.00 0.00 177.39 177.11 1wrs n MET 42 N -3.32 0.13 -3.31 1.96 0.00 -1.10 -4.69 117.12 106.78 1wrs n MET 42 Ca -0.03 0.00 -0.10 0.00 0.00 0.00 0.00 57.70 57.57 1wrs n MET 42 Cb 0.10 -1.13 -0.01 0.00 0.00 0.00 0.00 33.22 32.18 1wrs n MET 42 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 175.97 177.44 1wrs n LEU 43 N -0.63 0.00 0.00 3.17 -0.00 -1.26 -5.10 117.00 113.18 1wrs n LEU 43 Ca 0.01 -2.10 0.00 0.00 -0.00 0.00 0.00 56.01 53.92 1wrs n LEU 43 Cb 0.00 2.10 0.00 0.00 -0.00 0.00 0.00 43.42 45.53 1wrs n LEU 43 CO 0.01 -0.52 0.00 0.41 -0.00 0.00 0.00 177.39 177.28 1wrs n THR 44 N -0.43 0.00 -0.06 1.47 -1.04 -1.26 -4.84 114.28 108.12 1wrs n THR 44 Ca -0.01 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.79 1wrs n THR 44 Cb 0.44 -0.00 -0.13 0.00 -1.82 0.00 0.00 70.33 68.82 1wrs n THR 44 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1wrs n PRO 45 N 0.00 0.69 0.26 -2.82 -0.04 -1.26 -3.90 135.00 127.92 1wrs n PRO 45 Ca 0.00 0.29 0.17 0.00 -0.04 0.00 0.00 63.50 63.92 1wrs n PRO 45 Cb 0.00 -1.65 0.80 0.00 -0.04 0.00 0.00 33.50 32.61 1wrs n PRO 45 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1wrs h ASP 46 N -0.23 0.00 0.04 3.54 1.82 -2.00 0.36 116.42 119.95 1wrs h ASP 46 Ca -0.47 0.00 -0.23 0.00 -0.39 0.00 0.00 57.03 55.94 1wrs h ASP 46 Cb 1.84 0.00 0.02 0.00 0.68 0.00 0.00 39.33 41.87 1wrs h ASP 46 CO -0.05 0.00 -0.92 -0.33 -1.61 0.00 0.00 179.24 176.33 1wrs h GLU 47 N 0.00 0.55 -0.04 0.28 5.08 -1.98 -2.45 114.58 116.03 1wrs h GLU 47 Ca 0.06 -0.65 -0.03 0.00 -1.00 0.00 0.00 59.36 57.75 1wrs h GLU 47 Cb 0.78 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 1wrs h GLU 47 CO -0.00 1.26 -0.11 -0.09 -1.00 0.00 0.00 179.01 179.07 1wrs h ARG 48 N 0.13 0.05 0.23 2.33 2.43 -0.43 0.55 114.38 119.67 1wrs h ARG 48 Ca -0.13 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.02 1wrs h ARG 48 Cb 1.61 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 31.16 1wrs h ARG 48 CO 0.18 0.17 -0.11 0.93 -1.51 0.00 0.00 179.97 179.63 1wrs h GLU 49 N 0.05 -0.30 -0.77 0.20 5.08 -1.36 -2.93 114.58 114.56 1wrs h GLU 49 Ca 0.01 0.02 0.20 0.00 -1.00 0.00 0.00 59.36 58.59 1wrs h GLU 49 Cb 0.23 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 1wrs h GLU 49 CO 0.01 -0.20 0.54 0.00 -1.00 0.00 0.00 179.01 178.36 1wrs h ALA 50 N -1.38 2.54 0.57 3.43 0.00 -1.38 -1.67 119.26 121.37 1wrs h ALA 50 Ca -0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1wrs h ALA 50 Cb 0.24 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1wrs h ALA 50 CO 0.05 -0.76 -0.44 -0.07 0.00 0.00 0.00 179.25 178.02 1wrs h LEU 51 N 0.12 -1.17 -0.58 0.00 3.38 -0.89 -2.66 115.31 113.50 1wrs h LEU 51 Ca 0.37 0.08 0.11 0.00 0.09 0.00 0.00 57.88 58.53 1wrs h LEU 51 Cb 1.30 0.37 -0.11 0.00 0.09 0.00 0.00 40.66 42.30 1wrs h LEU 51 CO -0.05 -0.63 -0.30 1.23 0.09 0.00 0.00 178.44 178.78 1wrs h GLY 52 N -0.98 -0.02 0.00 0.83 0.00 -1.12 -2.53 103.07 99.25 1wrs h GLY 52 Ca -0.07 0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1wrs h GLY 52 CO 0.02 -0.22 0.00 2.41 0.00 0.00 0.00 176.54 178.75 1wrs n THR 53 N -5.44 0.00 -0.35 4.70 -1.04 -1.04 0.75 114.28 111.87 1wrs n THR 53 Ca 0.04 0.98 -0.00 0.00 -2.04 0.00 0.00 64.05 63.03 1wrs n THR 53 Cb 0.35 -1.47 0.05 0.00 -1.82 0.00 0.00 70.33 67.43 1wrs n THR 53 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1wrs n ARG 54 N -0.98 -0.20 0.17 -2.82 1.74 -1.03 0.15 116.66 113.68 1wrs n ARG 54 Ca 0.00 1.40 0.04 0.00 -0.77 0.00 0.00 57.85 58.52 1wrs n ARG 54 Cb 0.00 -2.07 0.46 0.00 -1.02 0.00 0.00 32.46 29.83 1wrs n ARG 54 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1wrs h VAL 55 N 0.00 1.13 0.06 1.55 2.07 -0.96 0.35 116.25 120.46 1wrs h VAL 55 Ca 0.33 -0.58 -0.24 0.00 0.82 0.00 0.00 66.70 67.02 1wrs h VAL 55 Cb 0.55 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 1wrs h VAL 55 CO -0.90 0.18 -1.08 0.08 0.02 0.00 0.00 177.57 175.87 1wrs h ARG 56 N 0.14 0.22 0.11 1.57 0.11 0.75 -2.69 114.38 114.58 1wrs h ARG 56 Ca 0.03 -0.32 -0.29 0.00 0.10 0.00 0.00 59.98 59.50 1wrs h ARG 56 Cb 0.28 0.11 -0.01 0.00 1.11 0.00 0.00 29.97 31.46 1wrs h ARG 56 CO 0.02 1.11 -1.40 0.97 0.10 0.00 0.00 179.97 180.76 1wrs h ILE 57 N 0.08 1.30 0.33 0.08 -0.00 -0.38 -2.73 117.51 116.19 1wrs h ILE 57 Ca -0.08 -2.92 -0.01 0.00 -0.00 0.00 0.00 64.86 61.84 1wrs h ILE 57 Cb 1.79 2.82 0.00 0.00 -0.00 0.00 0.00 36.82 41.43 1wrs h ILE 57 CO 0.17 0.84 -0.17 0.58 -0.00 0.00 0.00 178.15 179.57 1wrs h VAL 58 N 0.06 0.64 -0.36 2.19 2.07 -0.39 -2.27 116.25 118.19 1wrs h VAL 58 Ca -0.19 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.35 1wrs h VAL 58 Cb 1.99 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 32.37 1wrs h VAL 58 CO 0.17 0.00 0.20 -0.33 0.02 0.00 0.00 177.57 177.63 1wrs h GLU 59 N -0.47 0.39 -1.15 1.57 5.08 -1.58 0.69 114.58 119.11 1wrs h GLU 59 Ca -0.04 -0.02 0.33 0.00 -1.00 0.00 0.00 59.36 58.62 1wrs h GLU 59 Cb 0.37 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.48 1wrs h GLU 59 CO 0.06 0.26 0.81 1.49 -1.00 0.00 0.00 179.01 180.63 1wrs h GLU 60 N 0.40 0.06 0.00 2.33 4.81 -1.21 1.75 114.58 122.73 1wrs h GLU 60 Ca 0.15 -0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.21 1wrs h GLU 60 Cb 0.03 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 1wrs h GLU 60 CO -0.09 0.04 -1.92 1.28 -0.73 0.00 0.00 179.01 177.59 1wrs n LEU 61 N -4.26 0.27 -0.78 1.64 4.77 -0.17 -4.21 117.00 114.26 1wrs n LEU 61 Ca 0.25 0.12 0.12 0.00 -0.03 0.00 0.00 56.01 56.47 1wrs n LEU 61 Cb 1.17 0.18 0.21 0.00 -2.33 0.00 0.00 43.42 42.65 1wrs n LEU 61 CO 0.38 0.19 0.67 -0.11 -1.33 0.00 0.00 177.39 177.18 1wrs n LEU 62 N -2.60 2.47 0.00 2.23 7.94 0.22 -4.47 117.00 122.79 1wrs n LEU 62 Ca -0.15 -0.83 0.00 0.00 -1.11 0.00 0.00 56.01 53.93 1wrs n LEU 62 Cb 0.83 -0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.77 1wrs n LEU 62 CO 0.44 0.42 0.38 -1.14 -1.11 0.00 0.00 177.39 176.37 1wrs n ARG 63 N 0.88 0.00 0.01 1.96 3.00 0.56 -4.88 116.66 118.18 1wrs n ARG 63 Ca 0.15 0.43 0.00 0.00 -0.00 0.00 0.00 57.85 58.43 1wrs n ARG 63 Cb 0.52 -1.33 0.00 0.00 0.00 0.00 0.00 32.46 31.65 1wrs n ARG 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1wrs n GLY 64 N -0.35 -0.03 1.60 5.14 0.00 -1.26 -5.07 105.19 105.22 1wrs n GLY 64 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1wrs n GLY 64 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wrs n GLU 65 N -2.63 0.00 0.00 1.61 1.02 -1.26 -5.11 120.64 114.27 1wrs n GLU 65 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1wrs n GLU 65 Cb 0.00 -0.03 0.00 0.00 -0.02 0.00 0.00 31.44 31.39 1wrs n GLU 65 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1wrs n MET 66 N -2.30 0.00 -2.85 3.49 2.81 -1.26 -4.87 117.12 112.13 1wrs n MET 66 Ca 0.00 0.00 -0.11 0.00 -1.81 0.00 0.00 57.70 55.78 1wrs n MET 66 Cb 0.00 0.00 0.06 0.00 -0.71 0.00 0.00 33.22 32.57 1wrs n MET 66 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1wrs n SER 67 N 0.00 -1.51 0.00 7.83 3.41 -1.26 -4.36 113.62 117.73 1wrs n SER 67 Ca 0.00 -3.51 0.00 0.00 -0.26 0.00 0.00 58.87 55.10 1wrs n SER 67 Cb 0.00 1.24 0.00 0.00 -0.26 0.00 0.00 64.21 65.19 1wrs n SER 67 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wrs n GLN 68 N 0.39 0.00 -0.05 4.33 6.02 -1.26 -4.76 117.38 122.05 1wrs n GLN 68 Ca 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.10 1wrs n GLN 68 Cb 0.69 -0.56 0.00 0.00 1.02 0.00 0.00 30.24 31.38 1wrs n GLN 68 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 1wrs n ARG 69 N -2.25 0.66 -0.18 -1.09 3.00 -1.26 -3.76 116.66 111.78 1wrs n ARG 69 Ca 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 57.85 57.90 1wrs n ARG 69 Cb 0.24 -1.17 0.15 0.00 0.00 0.00 0.00 32.46 31.68 1wrs n ARG 69 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 1wrs n GLU 70 N 0.82 1.80 -0.52 -0.14 0.28 -1.26 -4.94 120.64 116.68 1wrs n GLU 70 Ca 0.00 -1.22 -0.22 0.00 -0.16 0.00 0.00 57.16 55.56 1wrs n GLU 70 Cb 0.33 -1.27 0.17 0.00 1.43 0.00 0.00 31.44 32.09 1wrs n GLU 70 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1wrs n LEU 71 N 0.48 -1.44 -4.14 -1.84 4.77 -1.25 -4.89 117.00 108.69 1wrs n LEU 71 Ca 0.11 -0.39 -0.33 0.00 -0.03 0.00 0.00 56.01 55.37 1wrs n LEU 71 Cb 0.29 -0.83 -0.16 0.00 -2.33 0.00 0.00 43.42 40.40 1wrs n LEU 71 CO 0.08 -3.37 -0.49 -0.75 -1.33 0.00 0.00 177.39 171.53 1wrs s LYS 72 N -3.64 2.93 0.00 3.23 2.20 -1.26 -4.99 119.74 118.22 1wrs s LYS 72 Ca 0.44 -0.88 0.00 0.00 -0.36 0.00 0.00 55.97 55.17 1wrs s LYS 72 Cb -0.08 -2.69 0.00 0.00 -1.51 0.00 0.00 37.83 33.55 1wrs s LYS 72 CO 0.43 -0.27 0.00 0.09 -0.36 0.00 0.00 175.35 175.24 1wrs n ASN 73 N 4.62 0.00 0.18 1.43 4.13 -1.26 -5.10 115.26 119.27 1wrs n ASN 73 Ca -0.19 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.07 1wrs n ASN 73 Cb 0.49 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.73 1wrs n ASN 73 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1wrs n GLU 74 N 0.00 0.00 0.09 3.52 1.02 -1.26 -4.92 120.64 119.10 1wrs n GLU 74 Ca 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.17 1wrs n GLU 74 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.41 1wrs n GLU 74 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1wrs h LEU 75 N 0.00 0.00 0.00 -4.62 3.38 -2.05 -3.39 115.31 108.64 1wrs h LEU 75 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1wrs h LEU 75 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1wrs h LEU 75 CO 0.00 0.43 0.00 0.61 0.09 0.00 0.00 178.44 179.57 1wrs n GLY 76 N 1.28 -2.97 0.00 0.83 0.00 -1.26 -4.93 105.19 98.14 1wrs n GLY 76 Ca -0.03 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.38 1wrs n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wrs n ALA 77 N -2.35 0.00 -3.64 4.61 0.00 -1.26 -5.10 120.51 112.77 1wrs n ALA 77 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1wrs n ALA 77 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1wrs n ALA 77 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1wrs s GLY 78 N 0.00 -0.08 0.24 0.00 0.00 -1.26 -4.90 107.32 101.32 1wrs s GLY 78 Ca 0.00 2.29 -0.07 0.00 0.00 0.00 0.00 44.72 46.94 1wrs s GLY 78 CO 0.00 0.84 1.64 1.19 0.00 0.00 0.00 173.10 176.77 1wrs h ILE 79 N 2.03 0.36 0.79 0.90 6.09 -1.97 -2.08 117.51 123.63 1wrs h ILE 79 Ca -0.06 -0.04 -0.04 0.00 -1.37 0.00 0.00 64.86 63.36 1wrs h ILE 79 Cb 1.16 0.24 0.01 0.00 0.47 0.00 0.00 36.82 38.69 1wrs h ILE 79 CO 0.21 0.02 -0.39 0.00 -3.07 0.00 0.00 178.15 174.92 1wrs h ALA 80 N 1.69 -1.28 -0.96 0.18 0.00 -2.00 -2.55 119.26 114.34 1wrs h ALA 80 Ca 0.40 -0.23 0.24 0.00 0.00 0.00 0.00 54.91 55.32 1wrs h ALA 80 Cb 0.71 0.42 -0.18 0.00 0.00 0.00 0.00 17.79 18.74 1wrs h ALA 80 CO -0.65 -1.21 -0.07 2.41 0.00 0.00 0.00 179.25 179.73 1wrs n THR 81 N -4.89 -0.40 0.67 0.00 -1.04 -0.87 0.74 114.28 108.49 1wrs n THR 81 Ca -0.13 2.15 0.13 0.00 -2.04 0.00 0.00 64.05 64.15 1wrs n THR 81 Cb 0.42 -3.08 0.47 0.00 -1.82 0.00 0.00 70.33 66.32 1wrs n THR 81 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 1wrs n ILE 82 N -5.48 0.52 -0.07 12.58 -5.35 -0.84 -3.56 119.36 117.17 1wrs n ILE 82 Ca 0.20 -0.07 -0.05 0.00 -0.27 0.00 0.00 62.75 62.55 1wrs n ILE 82 Cb 0.65 -0.70 -0.02 0.00 -1.74 0.00 0.00 39.64 37.82 1wrs n ILE 82 CO 0.00 0.00 0.00 0.71 -1.76 0.00 0.00 176.55 175.50 1wrs h THR 83 N 0.00 0.12 0.00 7.28 1.35 0.76 -3.29 112.91 119.12 1wrs h THR 83 Ca 0.00 -1.13 0.00 0.00 -0.55 0.00 0.00 66.41 64.73 1wrs h THR 83 Cb 0.57 0.26 0.00 0.00 -1.73 0.00 0.00 68.15 67.25 1wrs h THR 83 CO 0.00 0.04 0.00 -2.11 -0.25 0.00 0.00 175.52 173.20 1wrs n ARG 84 N -4.64 0.30 -0.10 4.72 0.00 -0.93 -1.94 116.66 114.07 1wrs n ARG 84 Ca -0.08 0.00 -0.11 0.00 -0.00 0.00 0.00 57.85 57.66 1wrs n ARG 84 Cb 0.25 -1.17 -0.13 0.00 -0.00 0.00 0.00 32.46 31.41 1wrs n ARG 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1wrs n GLY 85 N -0.27 -0.66 0.07 2.89 0.00 -1.23 -3.96 105.19 102.02 1wrs n GLY 85 Ca 0.02 -0.24 -0.08 0.00 0.00 0.00 0.00 46.02 45.72 1wrs n GLY 85 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1wrs h SER 86 N 0.00 0.04 -0.43 1.61 0.87 -1.46 -3.27 113.55 110.92 1wrs h SER 86 Ca -0.49 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.01 1wrs h SER 86 Cb 1.98 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.92 1wrs h SER 86 CO -0.01 1.04 0.00 0.59 -0.53 0.00 0.00 176.83 177.92 1wrs n ASN 87 N -3.28 2.62 -0.20 6.23 5.03 -1.12 -4.36 115.26 120.18 1wrs n ASN 87 Ca -0.06 -1.95 0.31 0.00 0.87 0.00 0.00 54.58 53.75 1wrs n ASN 87 Cb 0.98 -0.29 0.67 0.00 -1.02 0.00 0.00 39.78 40.12 1wrs n ASN 87 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 1wrs h SER 88 N 3.01 0.00 -1.29 6.41 0.02 -1.68 0.12 113.55 120.14 1wrs h SER 88 Ca 0.00 0.00 0.37 0.00 -0.84 0.00 0.00 61.79 61.32 1wrs h SER 88 Cb 0.68 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.17 1wrs h SER 88 CO 0.00 0.00 1.08 -0.07 -1.14 0.00 0.00 176.83 176.70 1wrs h LEU 89 N 0.00 0.00 0.00 5.07 3.38 -1.87 -2.25 115.31 119.63 1wrs h LEU 89 Ca 0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.44 1wrs h LEU 89 Cb 2.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 43.01 1wrs h LEU 89 CO -0.00 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.82 1wrs n LYS 90 N -3.78 0.00 -0.24 1.13 5.02 0.41 -4.45 118.16 116.25 1wrs n LYS 90 Ca 0.28 0.41 -0.06 0.00 -2.02 0.00 0.00 58.31 56.92 1wrs n LYS 90 Cb 1.48 -0.90 -0.06 0.00 -0.02 0.00 0.00 35.03 35.53 1wrs n LYS 90 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1wrs n ALA 91 N -1.81 -0.37 -1.29 7.82 0.00 -0.91 -4.32 120.51 119.64 1wrs n ALA 91 Ca 0.00 0.48 -0.58 0.00 0.00 0.00 0.00 53.44 53.35 1wrs n ALA 91 Cb 0.00 0.05 -0.12 0.00 0.00 0.00 0.00 19.45 19.38 1wrs n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wrs n ALA 92 N -3.20 0.28 -1.06 0.00 0.00 -0.90 -4.84 120.51 110.80 1wrs n ALA 92 Ca 0.01 0.13 -0.34 0.00 0.00 0.00 0.00 53.44 53.24 1wrs n ALA 92 Cb 0.15 -2.13 0.11 0.00 0.00 0.00 0.00 19.45 17.58 1wrs n ALA 92 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1wrs n PRO 93 N 7.64 0.08 -0.20 0.00 -0.02 -1.26 -4.91 135.00 136.33 1wrs n PRO 93 Ca 0.55 0.09 -0.09 0.00 -2.02 0.00 0.00 63.50 62.03 1wrs n PRO 93 Cb -0.02 -2.14 0.02 0.00 -0.02 0.00 0.00 33.50 31.34 1wrs n PRO 93 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1wrs h VAL 94 N -0.95 1.26 0.00 -1.45 2.07 -1.90 -2.63 116.25 112.65 1wrs h VAL 94 Ca -0.45 -1.02 -0.05 0.00 0.82 0.00 0.00 66.70 65.99 1wrs h VAL 94 Cb 1.31 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1wrs h VAL 94 CO 0.42 0.37 -0.26 -0.33 0.02 0.00 0.00 177.57 177.80 1wrs h GLU 95 N 0.85 0.00 -0.92 1.57 5.08 -2.01 -2.68 114.58 116.47 1wrs h GLU 95 Ca 0.17 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.54 1wrs h GLU 95 Cb 0.45 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.66 1wrs h GLU 95 CO 0.02 0.26 0.61 1.25 -1.00 0.00 0.00 179.01 180.14 1wrs h LEU 96 N 0.00 1.04 -2.14 1.33 5.85 -1.82 -0.78 115.31 118.78 1wrs h LEU 96 Ca -0.00 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.75 1wrs h LEU 96 Cb 0.52 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1wrs h LEU 96 CO 0.03 0.74 0.15 0.03 -0.34 0.00 0.00 178.44 179.06 1wrs h ARG 97 N 1.22 0.00 0.00 1.25 -0.00 -1.49 0.36 114.38 115.72 1wrs h ARG 97 Ca 0.34 0.00 -0.04 0.00 -0.50 0.00 0.00 59.98 59.79 1wrs h ARG 97 Cb -0.10 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 29.86 1wrs h ARG 97 CO -0.08 0.00 -0.18 -0.56 0.00 0.00 0.00 179.97 179.15 1wrs h GLN 98 N 0.00 0.00 0.00 0.04 3.07 -1.25 -3.15 115.11 113.82 1wrs h GLN 98 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.82 1wrs h GLN 98 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.94 1wrs h GLN 98 CO -0.00 0.18 -0.27 1.87 0.09 0.00 0.00 178.83 180.70 1wrs n TRP 99 N -3.22 0.15 -0.39 0.06 -0.00 0.10 -4.47 117.44 109.67 1wrs n TRP 99 Ca 0.02 0.06 0.34 0.00 -0.00 0.00 0.00 57.50 57.92 1wrs n TRP 99 Cb 0.50 -0.29 0.61 0.00 -0.00 0.00 0.00 31.31 32.13 1wrs n TRP 99 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 177.69 177.62 1wrs h LEU 100 N -0.35 0.30 -1.09 5.87 -0.00 -1.02 0.85 115.31 119.87 1wrs h LEU 100 Ca 0.00 0.19 0.41 0.00 -0.00 0.00 0.00 57.88 58.48 1wrs h LEU 100 Cb 0.27 0.19 -0.16 0.00 -0.00 0.00 0.00 40.66 40.96 1wrs h LEU 100 CO 0.00 -0.29 0.62 -0.33 -0.00 0.00 0.00 178.44 178.43 1wrs h GLU 101 N 0.06 0.08 0.00 1.13 5.08 -1.75 1.37 114.58 120.56 1wrs h GLU 101 Ca 0.84 -0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.97 1wrs h GLU 101 Cb 2.41 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 31.60 1wrs h GLU 101 CO -0.59 0.05 -1.53 0.39 -1.00 0.00 0.00 179.01 176.34 1wrs n GLU 102 N -5.10 0.62 0.00 2.33 1.02 0.29 -2.82 120.64 116.98 1wrs n GLU 102 Ca 0.37 0.26 0.13 0.00 -0.02 0.00 0.00 57.16 57.90 1wrs n GLU 102 Cb 1.27 -1.81 0.34 0.00 -0.02 0.00 0.00 31.44 31.22 1wrs n GLU 102 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1wrs n VAL 103 N -2.96 0.00 -0.11 2.62 0.31 0.29 -3.33 118.33 115.13 1wrs n VAL 103 Ca -0.13 -0.05 -0.20 0.00 -0.01 0.00 0.00 64.34 63.96 1wrs n VAL 103 Cb 0.93 0.23 -0.07 0.00 -0.91 0.00 0.00 33.84 34.01 1wrs n VAL 103 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1wrs n LEU 104 N -1.18 1.93 0.05 7.52 7.94 0.39 -3.97 117.00 129.68 1wrs n LEU 104 Ca 0.08 0.37 -0.02 0.00 -1.11 0.00 0.00 56.01 55.34 1wrs n LEU 104 Cb 0.33 -0.82 -0.01 0.00 0.53 0.00 0.00 43.42 43.46 1wrs n LEU 104 CO 0.31 0.18 0.27 -0.07 -1.11 0.00 0.00 177.39 176.97 1wrs h LEU 105 N -1.00 -0.11 -1.58 -1.96 -0.00 -1.67 -3.11 115.31 105.89 1wrs h LEU 105 Ca -0.38 0.00 0.13 0.00 -0.00 0.00 0.00 57.88 57.63 1wrs h LEU 105 Cb 1.29 0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 41.96 1wrs h LEU 105 CO -0.23 -0.04 0.66 0.50 -0.00 0.00 0.00 178.44 179.34 1wrs h LYS 106 N -0.20 0.00 0.00 1.13 3.64 -1.76 -3.51 116.57 115.87 1wrs h LYS 106 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1wrs h LYS 106 Cb 0.10 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1wrs h LYS 106 CO 0.02 0.00 0.00 0.45 -2.27 0.00 0.00 179.45 177.65