#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wrs s SER 5 N 0.00 5.96 0.02 1.08 0.15 -1.26 -5.03 113.70 114.61 1wrs s SER 5 Ca 0.00 -0.19 -0.34 0.00 0.70 0.00 0.00 55.95 56.12 1wrs s SER 5 Cb 0.00 -1.21 -0.13 0.00 -1.71 0.00 0.00 66.02 62.97 1wrs s SER 5 CO 0.00 -0.45 1.73 -2.65 1.20 0.00 0.00 173.24 173.07 1wrs n PRO 6 N -1.66 2.10 0.00 5.44 -0.02 -1.26 -4.10 135.00 135.50 1wrs n PRO 6 Ca 0.00 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 1wrs n PRO 6 Cb 0.58 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.49 1wrs n PRO 6 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1wrs n TYR 7 N 5.13 0.00 0.15 6.00 4.19 -1.26 -4.00 117.16 127.37 1wrs n TYR 7 Ca 0.20 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.41 1wrs n TYR 7 Cb 0.28 0.00 0.00 0.00 0.49 0.00 0.00 39.34 40.11 1wrs n TYR 7 CO 0.00 0.00 0.00 0.43 0.91 0.00 0.00 176.86 178.20 1wrs n SER 8 N 0.55 -2.76 -3.91 2.98 7.64 -1.26 -5.10 113.62 111.76 1wrs n SER 8 Ca 0.00 0.74 -0.30 0.00 1.01 0.00 0.00 58.87 60.33 1wrs n SER 8 Cb 0.00 2.72 -0.16 0.00 -1.01 0.00 0.00 64.21 65.76 1wrs n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wrs s ALA 9 N -2.00 1.75 0.87 -0.43 0.00 -1.26 -4.82 121.76 115.88 1wrs s ALA 9 Ca 0.00 -1.17 -0.04 0.00 0.00 0.00 0.00 51.96 50.75 1wrs s ALA 9 Cb 0.00 -1.34 0.06 0.00 0.00 0.00 0.00 23.12 21.84 1wrs s ALA 9 CO 0.00 -1.10 0.38 0.00 0.00 0.00 0.00 175.76 175.04 1wrs n ALA 10 N 4.76 -0.33 -1.00 0.00 0.00 -1.26 -5.06 120.51 117.61 1wrs n ALA 10 Ca -0.12 -0.55 0.00 0.00 0.00 0.00 0.00 53.44 52.78 1wrs n ALA 10 Cb 0.45 0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1wrs n ALA 10 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1wrs n MET 11 N -1.78 0.00 0.00 0.00 2.81 -1.26 -5.07 117.12 111.82 1wrs n MET 11 Ca 0.05 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.94 1wrs n MET 11 Cb 0.18 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.69 1wrs n MET 11 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1wrs n ALA 12 N -3.00 0.00 -1.07 3.04 0.00 -1.26 -5.11 120.51 113.11 1wrs n ALA 12 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1wrs n ALA 12 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1wrs n ALA 12 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1wrs n GLU 13 N 0.00 0.00 -0.98 0.00 1.02 -1.26 -5.10 120.64 114.33 1wrs n GLU 13 Ca 0.00 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.84 1wrs n GLU 13 Cb 0.00 0.00 0.17 0.00 -0.02 0.00 0.00 31.44 31.59 1wrs n GLU 13 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 1wrs s GLN 14 N 0.00 0.71 0.00 3.49 -2.07 -1.26 -4.89 119.66 115.65 1wrs s GLN 14 Ca 0.00 0.94 0.00 0.00 -1.82 0.00 0.00 55.36 54.48 1wrs s GLN 14 Cb 0.00 -1.74 0.00 0.00 -1.09 0.00 0.00 33.01 30.18 1wrs s GLN 14 CO 0.00 -2.65 0.00 2.89 -1.32 0.00 0.00 175.29 174.21 1wrs n ARG 15 N -4.18 0.00 -0.06 9.60 1.85 -1.26 -4.93 116.66 117.68 1wrs n ARG 15 Ca 0.07 0.00 0.02 0.00 -1.00 0.00 0.00 57.85 56.94 1wrs n ARG 15 Cb 0.55 0.00 0.08 0.00 -1.05 0.00 0.00 32.46 32.03 1wrs n ARG 15 CO 0.00 0.00 0.00 1.58 -0.01 0.00 0.00 177.63 179.20 1wrs n HIS 16 N -0.26 0.17 0.00 2.89 -0.00 -1.26 -3.86 115.22 112.90 1wrs n HIS 16 Ca 0.00 -0.08 0.00 0.00 0.46 0.00 0.00 57.72 58.10 1wrs n HIS 16 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1wrs n HIS 16 CO 0.00 0.00 0.00 0.94 0.46 0.00 0.00 176.34 177.74 1wrs n GLN 17 N -0.14 0.00 -0.48 1.57 7.27 -1.26 -2.95 117.38 121.40 1wrs n GLN 17 Ca 0.05 0.00 0.42 0.00 0.07 0.00 0.00 57.00 57.53 1wrs n GLN 17 Cb 0.11 -0.20 0.76 0.00 2.41 0.00 0.00 30.24 33.32 1wrs n GLN 17 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 1wrs h GLU 18 N 0.00 0.03 0.28 3.69 3.07 -1.99 0.73 114.58 120.38 1wrs h GLU 18 Ca 0.00 -0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.86 1wrs h GLU 18 Cb 0.00 -0.01 -0.03 0.00 -0.84 0.00 0.00 28.75 27.87 1wrs h GLU 18 CO 0.00 0.02 -0.37 2.35 -1.40 0.00 0.00 179.01 179.61 1wrs h TRP 19 N 0.03 -1.00 -0.97 4.33 2.91 -1.74 -1.88 115.95 117.62 1wrs h TRP 19 Ca 0.73 0.01 0.19 0.00 1.13 0.00 0.00 58.89 60.95 1wrs h TRP 19 Cb 2.83 0.40 -0.09 0.00 -0.51 0.00 0.00 29.16 31.79 1wrs h TRP 19 CO -0.00 -0.50 0.61 1.25 -1.03 0.00 0.00 178.44 178.77 1wrs h LEU 20 N -0.70 0.67 0.40 0.65 5.85 0.59 -2.80 115.31 119.96 1wrs h LEU 20 Ca -0.01 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 1wrs h LEU 20 Cb 0.66 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1wrs h LEU 20 CO -0.12 0.26 -0.29 0.03 -0.34 0.00 0.00 178.44 177.98 1wrs h ARG 21 N 0.66 -0.63 -0.79 1.25 3.08 -1.15 0.70 114.38 117.50 1wrs h ARG 21 Ca 0.53 0.04 0.19 0.00 0.07 0.00 0.00 59.98 60.82 1wrs h ARG 21 Cb 0.96 0.14 -0.15 0.00 0.08 0.00 0.00 29.97 31.00 1wrs h ARG 21 CO -0.30 -0.42 -0.08 0.34 -1.07 0.00 0.00 179.97 178.45 1wrs n PHE 22 N -4.11 0.41 0.01 3.04 7.35 -1.06 0.89 117.46 123.98 1wrs n PHE 22 Ca -0.08 0.96 -0.01 0.00 -0.76 0.00 0.00 57.45 57.56 1wrs n PHE 22 Cb 0.28 -1.03 -0.00 0.00 0.35 0.00 0.00 39.48 39.07 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 0.00 -1.68 -2.13 2.07 -1.47 -1.40 116.25 111.63 1wrs h VAL 23 Ca 0.43 -0.13 0.49 0.00 0.82 0.00 0.00 66.70 68.31 1wrs h VAL 23 Cb 0.80 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.51 1wrs h VAL 23 CO -0.78 0.00 1.36 -0.67 0.02 0.00 0.00 177.57 177.51 1wrs n ASP 24 N -2.46 0.00 -0.01 0.57 -0.08 0.24 0.12 116.55 114.93 1wrs n ASP 24 Ca -0.00 0.92 -0.06 0.00 -1.51 0.00 0.00 54.79 54.13 1wrs n ASP 24 Cb 0.01 -0.42 -0.05 0.00 2.34 0.00 0.00 41.12 43.01 1wrs n ASP 24 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1wrs h LEU 25 N 0.00 -0.09 -0.89 -2.67 5.85 0.45 -3.00 115.31 114.96 1wrs h LEU 25 Ca 0.80 -0.28 0.09 0.00 0.84 0.00 0.00 57.88 59.33 1wrs h LEU 25 Cb 3.52 0.02 -0.12 0.00 0.37 0.00 0.00 40.66 44.45 1wrs h LEU 25 CO -0.01 0.52 -0.56 0.25 -0.34 0.00 0.00 178.44 178.30 1wrs h LEU 26 N -0.99 -2.04 0.42 2.25 6.46 0.21 -1.02 115.31 120.58 1wrs h LEU 26 Ca -0.01 0.31 -0.01 0.00 -0.12 0.00 0.00 57.88 58.05 1wrs h LEU 26 Cb 0.37 0.90 -0.02 0.00 -0.73 0.00 0.00 40.66 41.18 1wrs h LEU 26 CO 0.02 -0.27 -0.47 0.11 -0.62 0.00 0.00 178.44 177.21 1wrs h LYS 27 N -0.07 -0.87 -0.72 1.25 1.79 -1.52 0.46 116.57 116.89 1wrs h LYS 27 Ca 0.16 0.06 0.21 0.00 -2.18 0.00 0.00 60.65 58.90 1wrs h LYS 27 Cb 0.46 0.20 -0.03 0.00 -1.58 0.00 0.00 32.23 31.28 1wrs h LYS 27 CO -0.88 -0.58 1.00 -0.91 -1.08 0.00 0.00 179.45 177.00 1wrs h ASN 28 N -0.90 0.00 0.09 0.86 4.21 -1.17 0.70 115.58 119.37 1wrs h ASN 28 Ca -0.05 0.00 -0.36 0.00 1.21 0.00 0.00 56.30 57.10 1wrs h ASN 28 Cb 0.79 0.00 -0.06 0.00 -1.12 0.00 0.00 38.32 37.93 1wrs h ASN 28 CO -0.09 0.00 -2.27 0.00 -1.29 0.00 0.00 177.43 173.78 1wrs n ALA 29 N -2.14 1.46 -0.32 -0.83 0.00 -0.20 -4.27 120.51 114.22 1wrs n ALA 29 Ca 0.16 -1.18 0.17 0.00 0.00 0.00 0.00 53.44 52.59 1wrs n ALA 29 Cb 1.23 -0.31 0.41 0.00 0.00 0.00 0.00 19.45 20.78 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 0.86 0.00 0.00 5.03 0.50 1.31 116.97 124.67 1wrs h TYR 30 Ca -0.50 0.03 -0.03 0.00 2.58 0.00 0.00 58.73 60.80 1wrs h TYR 30 Cb 2.15 -0.26 -0.00 0.00 1.55 0.00 0.00 36.73 40.17 1wrs h TYR 30 CO 0.01 0.17 -0.15 0.37 -1.32 0.00 0.00 178.16 177.24 1wrs h GLN 31 N 0.59 0.00 0.00 1.82 4.15 -1.69 -2.17 115.11 117.81 1wrs h GLN 31 Ca 0.56 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.98 1wrs h GLN 31 Cb 1.11 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.80 1wrs h GLN 31 CO -0.32 0.15 -0.93 0.09 -1.93 0.00 0.00 178.83 175.88 1wrs n ASN 32 N -3.98 0.91 -0.25 -0.69 4.13 0.32 -4.96 115.26 110.74 1wrs n ASN 32 Ca -0.02 -0.95 -0.03 0.00 1.68 0.00 0.00 54.58 55.26 1wrs n ASN 32 Cb 0.23 1.01 -0.01 0.00 -1.54 0.00 0.00 39.78 39.47 1wrs n ASN 32 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1wrs n ASP 33 N -1.47 -3.57 0.08 6.41 8.00 0.37 -4.86 116.55 121.51 1wrs n ASP 33 Ca 0.04 0.08 0.12 0.00 0.71 0.00 0.00 54.79 55.74 1wrs n ASP 33 Cb 0.31 -1.36 0.24 0.00 -0.02 0.00 0.00 41.12 40.29 1wrs n ASP 33 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1wrs h LEU 34 N 0.00 0.00 -0.72 0.64 -0.00 -1.70 -3.32 115.31 110.21 1wrs h LEU 34 Ca -0.07 -0.12 0.00 0.00 -0.00 0.00 0.00 57.88 57.69 1wrs h LEU 34 Cb 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.93 1wrs h LEU 34 CO 0.10 0.06 0.27 0.00 -0.00 0.00 0.00 178.44 178.87 1wrs n HIS 35 N -2.23 0.37 -0.01 1.13 1.44 -1.25 -2.17 115.22 112.49 1wrs n HIS 35 Ca 0.04 0.19 -0.00 0.00 -2.01 0.00 0.00 57.72 55.94 1wrs n HIS 35 Cb 0.45 -0.61 -0.00 0.00 0.12 0.00 0.00 29.99 29.94 1wrs n HIS 35 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 1wrs h LEU 36 N 0.00 -0.02 -2.03 2.39 3.38 -1.94 -0.08 115.31 117.02 1wrs h LEU 36 Ca 0.00 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.09 1wrs h LEU 36 Cb 0.54 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 1wrs h LEU 36 CO 0.00 0.18 0.39 1.55 0.09 0.00 0.00 178.44 180.65 1wrs h PRO 37 N -0.40 0.00 0.06 1.13 0.13 -1.82 0.26 132.00 131.35 1wrs h PRO 37 Ca -0.00 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.88 1wrs h PRO 37 Cb 0.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.15 1wrs h PRO 37 CO 0.00 0.00 -1.06 1.25 -0.23 0.00 0.00 178.00 177.96 1wrs h LEU 38 N 0.00 0.50 -1.63 1.56 5.85 -1.51 -3.13 115.31 116.95 1wrs h LEU 38 Ca 0.20 -0.45 0.12 0.00 0.84 0.00 0.00 57.88 58.59 1wrs h LEU 38 Cb 0.98 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.82 1wrs h LEU 38 CO -0.00 1.28 0.43 -0.07 -0.34 0.00 0.00 178.44 179.74 1wrs h LEU 39 N 0.17 0.37 0.00 2.25 4.07 0.15 0.61 115.31 122.93 1wrs h LEU 39 Ca -0.10 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.87 1wrs h LEU 39 Cb 1.73 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 43.41 1wrs h LEU 39 CO 0.18 0.21 0.00 0.59 -1.08 0.00 0.00 178.44 178.34 1wrs n ASN 40 N -4.47 0.00 -0.01 -0.43 4.13 -1.08 -3.60 115.26 109.81 1wrs n ASN 40 Ca 0.11 -1.11 -0.04 0.00 1.68 0.00 0.00 54.58 55.22 1wrs n ASN 40 Cb 0.43 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.65 1wrs n ASN 40 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1wrs n LEU 41 N -0.74 1.26 -1.65 3.41 4.77 0.21 -4.72 117.00 119.53 1wrs n LEU 41 Ca 0.08 0.19 -0.11 0.00 -0.03 0.00 0.00 56.01 56.15 1wrs n LEU 41 Cb 0.04 -0.44 0.04 0.00 -2.33 0.00 0.00 43.42 40.73 1wrs n LEU 41 CO 0.06 -0.44 1.02 1.15 -1.33 0.00 0.00 177.39 177.85 1wrs n MET 42 N -3.75 1.53 0.00 3.23 0.00 -1.04 -4.78 117.12 112.31 1wrs n MET 42 Ca -0.07 -1.10 0.00 0.00 0.00 0.00 0.00 57.70 56.53 1wrs n MET 42 Cb 0.26 -1.43 0.00 0.00 0.00 0.00 0.00 33.22 32.05 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 0.39 0.00 0.00 3.17 -0.00 -1.24 -5.00 117.00 114.32 1wrs n LEU 43 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.22 1wrs n LEU 43 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.11 1wrs n LEU 43 CO 0.25 0.00 0.00 1.07 -0.00 0.00 0.00 177.39 178.71 1wrs n THR 44 N -0.74 0.00 0.00 1.47 5.66 -1.26 -4.22 114.28 115.19 1wrs n THR 44 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1wrs n THR 44 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1wrs n THR 44 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1wrs n PRO 45 N -0.37 0.00 0.12 1.09 -0.04 -1.26 -3.78 135.00 130.76 1wrs n PRO 45 Ca 0.00 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.51 1wrs n PRO 45 Cb 0.00 0.00 0.27 0.00 -0.04 0.00 0.00 33.50 33.73 1wrs n PRO 45 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1wrs n ASP 46 N 0.00 0.25 0.21 3.54 8.00 -1.26 -1.14 116.55 126.16 1wrs n ASP 46 Ca 0.00 0.49 -0.09 0.00 0.71 0.00 0.00 54.79 55.90 1wrs n ASP 46 Cb 0.00 -0.46 -0.04 0.00 -0.02 0.00 0.00 41.12 40.60 1wrs n ASP 46 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1wrs h GLU 47 N 0.00 -0.56 -0.10 -1.24 4.39 -1.95 2.68 114.58 117.81 1wrs h GLU 47 Ca 0.00 0.04 0.03 0.00 0.34 0.00 0.00 59.36 59.77 1wrs h GLU 47 Cb 0.53 0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 29.30 1wrs h GLU 47 CO 0.00 -0.37 0.28 0.00 -1.16 0.00 0.00 179.01 177.75 1wrs h ARG 48 N -0.99 0.00 0.00 2.33 -0.00 -1.22 -1.86 114.38 112.64 1wrs h ARG 48 Ca -0.06 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.42 1wrs h ARG 48 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.42 1wrs h ARG 48 CO 0.10 0.00 0.00 0.39 0.00 0.00 0.00 179.97 180.46 1wrs n GLU 49 N -3.21 0.00 -0.33 0.04 1.02 -1.07 -4.37 120.64 112.72 1wrs n GLU 49 Ca -0.00 0.00 0.22 0.00 -0.02 0.00 0.00 57.16 57.36 1wrs n GLU 49 Cb 0.36 -0.25 0.49 0.00 -0.02 0.00 0.00 31.44 32.02 1wrs n GLU 49 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wrs h ALA 50 N -1.19 2.16 -0.35 0.62 0.00 0.46 0.36 119.26 121.32 1wrs h ALA 50 Ca 0.00 0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 1wrs h ALA 50 Cb 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1wrs h ALA 50 CO 0.00 -0.58 -0.38 1.37 0.00 0.00 0.00 179.25 179.66 1wrs h LEU 51 N 0.42 0.88 -1.53 0.00 8.10 -0.68 -2.49 115.31 120.02 1wrs h LEU 51 Ca 0.60 -0.40 -0.05 0.00 0.11 0.00 0.00 57.88 58.15 1wrs h LEU 51 Cb 1.47 -0.25 -0.01 0.00 -0.44 0.00 0.00 40.66 41.43 1wrs h LEU 51 CO -0.33 1.16 -0.24 1.23 -4.11 0.00 0.00 178.44 176.15 1wrs h GLY 52 N 0.87 0.00 0.00 0.17 0.00 -1.06 -2.90 103.07 100.16 1wrs h GLY 52 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1wrs h GLY 52 CO 0.09 0.00 0.00 2.41 0.00 0.00 0.00 176.54 179.04 1wrs n THR 53 N -3.98 0.00 -0.29 4.70 -1.04 -0.63 -1.61 114.28 111.43 1wrs n THR 53 Ca -0.02 0.85 0.04 0.00 -2.04 0.00 0.00 64.05 62.88 1wrs n THR 53 Cb 0.32 -1.68 0.10 0.00 -1.82 0.00 0.00 70.33 67.26 1wrs n THR 53 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 1wrs n ARG 54 N -0.58 -0.09 -0.18 -2.82 1.85 -1.06 0.29 116.66 114.06 1wrs n ARG 54 Ca 0.00 1.25 0.06 0.00 -1.00 0.00 0.00 57.85 58.16 1wrs n ARG 54 Cb 0.00 -1.86 0.35 0.00 -1.05 0.00 0.00 32.46 29.90 1wrs n ARG 54 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1wrs h VAL 55 N 0.00 1.03 -0.03 8.89 2.07 -1.57 0.45 116.25 127.09 1wrs h VAL 55 Ca 0.37 -0.26 -0.25 0.00 0.82 0.00 0.00 66.70 67.38 1wrs h VAL 55 Cb 0.57 0.19 0.02 0.00 -1.52 0.00 0.00 31.29 30.55 1wrs h VAL 55 CO -0.82 0.14 -0.95 0.03 0.02 0.00 0.00 177.57 175.99 1wrs h ARG 56 N 0.77 0.70 -0.32 1.57 3.08 0.53 -2.68 114.38 118.03 1wrs h ARG 56 Ca 0.31 -0.71 -0.16 0.00 0.07 0.00 0.00 59.98 59.49 1wrs h ARG 56 Cb 0.24 0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 1wrs h ARG 56 CO -0.10 1.29 -0.45 0.97 -1.07 0.00 0.00 179.97 180.61 1wrs h ILE 57 N 0.38 1.28 0.93 2.04 -0.00 -0.28 -2.15 117.51 119.70 1wrs h ILE 57 Ca -0.11 -1.64 -0.05 0.00 -0.00 0.00 0.00 64.86 63.07 1wrs h ILE 57 Cb 1.60 1.51 0.01 0.00 -0.00 0.00 0.00 36.82 39.94 1wrs h ILE 57 CO 0.19 0.54 -0.46 0.58 -0.00 0.00 0.00 178.15 179.00 1wrs h VAL 58 N 0.66 0.07 -0.40 2.19 2.07 -0.99 -1.81 116.25 118.04 1wrs h VAL 58 Ca 0.04 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.67 1wrs h VAL 58 Cb 1.04 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 1wrs h VAL 58 CO 0.10 0.00 0.51 -0.08 0.02 0.00 0.00 177.57 178.12 1wrs h GLU 59 N -1.26 0.00 0.02 1.57 4.81 -1.48 -2.02 114.58 116.21 1wrs h GLU 59 Ca -0.13 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1wrs h GLU 59 Cb 0.97 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.35 1wrs h GLU 59 CO 0.20 0.00 -0.01 1.49 -0.73 0.00 0.00 179.01 179.96 1wrs h GLU 60 N 0.00 -0.03 -0.14 1.92 4.81 -0.65 -3.31 114.58 117.18 1wrs h GLU 60 Ca 0.19 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.40 1wrs h GLU 60 Cb 1.20 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 1wrs h GLU 60 CO -0.00 0.67 -0.01 -0.07 -0.73 0.00 0.00 179.01 178.87 1wrs h LEU 61 N -0.76 0.18 -0.78 1.64 3.38 -0.85 0.24 115.31 118.36 1wrs h LEU 61 Ca -0.00 -0.02 0.13 0.00 0.09 0.00 0.00 57.88 58.08 1wrs h LEU 61 Cb 0.70 -0.05 -0.14 0.00 0.09 0.00 0.00 40.66 41.27 1wrs h LEU 61 CO 0.00 0.23 -0.34 0.25 0.09 0.00 0.00 178.44 178.67 1wrs h LEU 62 N 0.20 -1.22 -2.91 1.67 5.85 -1.58 -2.63 115.31 114.70 1wrs h LEU 62 Ca 0.05 0.26 -0.03 0.00 0.84 0.00 0.00 57.88 59.00 1wrs h LEU 62 Cb 0.15 0.64 -0.07 0.00 0.37 0.00 0.00 40.66 41.75 1wrs h LEU 62 CO 0.00 -0.29 -0.47 -1.14 -0.34 0.00 0.00 178.44 176.20 1wrs n ARG 63 N -5.46 1.10 -0.67 1.25 0.63 -1.16 -4.70 116.66 107.64 1wrs n ARG 63 Ca 0.07 -2.70 0.01 0.00 -0.92 0.00 0.00 57.85 54.32 1wrs n ARG 63 Cb 0.38 -1.21 0.20 0.00 0.45 0.00 0.00 32.46 32.28 1wrs n ARG 63 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1wrs n GLY 64 N -0.82 5.00 0.00 5.14 0.00 0.82 -4.87 105.19 110.46 1wrs n GLY 64 Ca 0.14 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.90 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 -1.12 0.00 -2.12 1.61 1.02 -1.25 -3.98 120.64 114.80 1wrs n GLU 65 Ca 0.26 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.98 1wrs n GLU 65 Cb 0.85 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 32.24 1wrs n GLU 65 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1wrs s MET 66 N -4.20 4.31 -0.46 3.49 -1.94 -1.26 -4.94 119.30 114.30 1wrs s MET 66 Ca 0.00 2.15 0.07 0.00 -1.71 0.00 0.00 55.69 56.19 1wrs s MET 66 Cb 0.00 -3.20 0.24 0.00 2.01 0.00 0.00 34.83 33.89 1wrs s MET 66 CO 0.00 -0.41 0.78 0.45 -0.01 0.00 0.00 175.02 175.83 1wrs n SER 67 N 3.35 -2.01 -0.04 3.03 2.88 -1.26 -4.94 113.62 114.64 1wrs n SER 67 Ca 0.10 -3.13 -0.06 0.00 -1.33 0.00 0.00 58.87 54.45 1wrs n SER 67 Cb 0.41 1.11 -0.03 0.00 -0.75 0.00 0.00 64.21 64.96 1wrs n SER 67 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wrs n GLN 68 N 1.58 0.17 0.00 -1.46 1.13 -1.26 -4.61 117.38 112.93 1wrs n GLN 68 Ca 0.13 0.05 0.00 0.00 -1.94 0.00 0.00 57.00 55.24 1wrs n GLN 68 Cb 0.60 -0.98 0.00 0.00 0.11 0.00 0.00 30.24 29.97 1wrs n GLN 68 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 1wrs n ARG 69 N -2.97 0.81 0.30 -1.09 3.00 -1.26 -3.99 116.66 111.46 1wrs n ARG 69 Ca -0.13 0.00 0.16 0.00 -0.00 0.00 0.00 57.85 57.88 1wrs n ARG 69 Cb 0.62 -1.18 0.92 0.00 0.00 0.00 0.00 32.46 32.82 1wrs n ARG 69 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1wrs h GLU 70 N 0.33 0.00 -4.73 -0.14 5.08 -1.97 -3.47 114.58 109.67 1wrs h GLU 70 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1wrs h GLU 70 Cb 0.70 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 1wrs h GLU 70 CO 0.00 0.04 -0.98 -0.11 -1.00 0.00 0.00 179.01 176.96 1wrs n LEU 71 N -3.58 -6.34 -3.86 1.33 7.94 -1.26 -4.83 117.00 106.39 1wrs n LEU 71 Ca -0.02 2.76 -0.42 0.00 -1.11 0.00 0.00 56.01 57.22 1wrs n LEU 71 Cb 0.14 -3.19 0.01 0.00 0.53 0.00 0.00 43.42 40.91 1wrs n LEU 71 CO 0.27 -2.97 1.37 1.17 -1.11 0.00 0.00 177.39 176.12 1wrs n LYS 72 N 1.86 4.67 0.00 1.96 4.81 -1.26 -4.77 118.16 125.43 1wrs n LYS 72 Ca -0.02 -4.43 0.00 0.00 -0.87 0.00 0.00 58.31 52.99 1wrs n LYS 72 Cb 0.04 -2.55 0.00 0.00 0.02 0.00 0.00 35.03 32.54 1wrs n LYS 72 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1wrs n ASN 73 N 1.22 0.39 0.00 3.14 4.05 -1.26 -4.84 115.26 117.96 1wrs n ASN 73 Ca 0.35 -1.18 0.00 0.00 0.45 0.00 0.00 54.58 54.20 1wrs n ASN 73 Cb 0.31 -0.20 0.00 0.00 1.23 0.00 0.00 39.78 41.12 1wrs n ASN 73 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1wrs n GLU 74 N -0.03 0.00 0.20 1.20 1.02 -1.26 -2.12 120.64 119.64 1wrs n GLU 74 Ca 0.00 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.25 1wrs n GLU 74 Cb 0.10 0.00 0.58 0.00 -0.02 0.00 0.00 31.44 32.10 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 0.48 -4.62 3.38 -2.00 0.19 115.31 112.74 1wrs h LEU 75 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 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 0.00 -0.23 1.23 0.09 0.00 0.00 178.44 179.53 1wrs h GLY 76 N 0.00 -0.67 0.00 0.83 0.00 -1.80 -3.42 103.07 98.01 1wrs h GLY 76 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1wrs h GLY 76 CO 0.00 -0.24 -0.23 0.00 0.00 0.00 0.00 176.54 176.06 1wrs n ALA 77 N -2.33 0.54 -0.93 3.60 0.00 -1.00 -5.07 120.51 115.31 1wrs n ALA 77 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1wrs n ALA 77 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.70 1wrs n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wrs n GLY 78 N 0.61 -1.77 0.01 0.00 0.00 0.02 -4.58 105.19 99.49 1wrs n GLY 78 Ca 0.00 -0.52 0.01 0.00 0.00 0.00 0.00 46.02 45.50 1wrs n GLY 78 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1wrs n ILE 79 N 0.28 -0.01 0.09 -0.61 0.13 -1.26 0.69 119.36 118.67 1wrs n ILE 79 Ca 0.00 0.08 0.03 0.00 -1.10 0.00 0.00 62.75 61.76 1wrs n ILE 79 Cb 0.00 -0.12 0.17 0.00 -0.84 0.00 0.00 39.64 38.86 1wrs n ILE 79 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1wrs n ALA 80 N -3.42 0.51 -0.10 1.51 0.00 -1.26 -1.51 120.51 116.24 1wrs n ALA 80 Ca 0.01 0.06 -0.19 0.00 0.00 0.00 0.00 53.44 53.32 1wrs n ALA 80 Cb 0.03 -0.59 -0.10 0.00 0.00 0.00 0.00 19.45 18.78 1wrs n ALA 80 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1wrs h THR 81 N 0.00 0.88 -0.01 0.00 2.02 0.01 -3.38 112.91 112.43 1wrs h THR 81 Ca 0.00 -2.06 0.00 0.00 0.77 0.00 0.00 66.41 65.12 1wrs h THR 81 Cb 0.64 2.06 0.00 0.00 -1.74 0.00 0.00 68.15 69.11 1wrs h THR 81 CO 0.00 0.30 0.00 2.30 0.37 0.00 0.00 175.52 178.49 1wrs n ILE 82 N -4.47 0.02 0.47 3.11 -5.35 -0.57 -3.59 119.36 108.98 1wrs n ILE 82 Ca -0.27 -0.02 0.08 0.00 -0.27 0.00 0.00 62.75 62.26 1wrs n ILE 82 Cb 0.61 -0.13 -0.10 0.00 -1.74 0.00 0.00 39.64 38.28 1wrs n ILE 82 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1wrs n THR 83 N -0.60 0.00 -0.08 7.28 -2.24 -1.05 -4.50 114.28 113.09 1wrs n THR 83 Ca 0.08 -0.22 -0.13 0.00 -2.27 0.00 0.00 64.05 61.51 1wrs n THR 83 Cb 0.05 0.69 -0.14 0.00 -2.10 0.00 0.00 70.33 68.83 1wrs n THR 83 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1wrs n ARG 84 N -1.61 0.68 -0.41 -0.78 -4.01 -1.24 -3.94 116.66 105.36 1wrs n ARG 84 Ca 0.01 0.13 0.39 0.00 -1.04 0.00 0.00 57.85 57.34 1wrs n ARG 84 Cb 0.30 -1.60 0.75 0.00 -3.04 0.00 0.00 32.46 28.87 1wrs n ARG 84 CO 0.00 0.00 0.00 0.78 -3.04 0.00 0.00 177.63 175.37 1wrs h GLY 85 N 3.08 0.00 0.00 2.89 0.00 -1.79 -0.49 103.07 106.76 1wrs h GLY 85 Ca -0.49 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 46.49 1wrs h GLY 85 CO 0.02 0.00 -2.01 1.44 0.00 0.00 0.00 176.54 175.99 1wrs n SER 86 N -4.00 1.92 0.00 0.19 7.64 -1.26 -3.49 113.62 114.63 1wrs n SER 86 Ca 0.30 0.37 0.03 0.00 1.01 0.00 0.00 58.87 60.58 1wrs n SER 86 Cb 1.47 -0.87 0.16 0.00 -1.01 0.00 0.00 64.21 63.96 1wrs n SER 86 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1wrs n ASN 87 N -4.33 0.00 -0.02 6.43 4.13 -0.93 -3.14 115.26 117.39 1wrs n ASN 87 Ca -0.44 -0.64 -0.05 0.00 1.68 0.00 0.00 54.58 55.12 1wrs n ASN 87 Cb 0.79 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 39.01 1wrs n ASN 87 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1wrs n SER 88 N -0.71 1.37 -0.36 6.41 7.64 -0.24 -4.59 113.62 123.14 1wrs n SER 88 Ca 0.04 0.03 0.27 0.00 1.01 0.00 0.00 58.87 60.23 1wrs n SER 88 Cb 0.02 -0.12 0.55 0.00 -1.01 0.00 0.00 64.21 63.65 1wrs n SER 88 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 1wrs h LEU 89 N -0.12 0.38 0.00 -3.43 6.46 -1.58 -2.11 115.31 114.91 1wrs h LEU 89 Ca -0.12 0.10 0.00 0.00 -0.12 0.00 0.00 57.88 57.75 1wrs h LEU 89 Cb 1.13 0.05 0.00 0.00 -0.73 0.00 0.00 40.66 41.11 1wrs h LEU 89 CO -0.06 -0.01 0.00 0.29 -0.62 0.00 0.00 178.44 178.04 1wrs n LYS 90 N -4.67 0.00 0.00 1.25 5.02 -1.24 -4.54 118.16 113.98 1wrs n LYS 90 Ca 0.29 0.45 0.00 0.00 -2.02 0.00 0.00 58.31 57.04 1wrs n LYS 90 Cb 1.05 -1.30 0.00 0.00 -0.02 0.00 0.00 35.03 34.76 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 -1.86 0.00 -1.56 7.82 0.00 -1.03 -5.01 120.51 118.87 1wrs n ALA 91 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1wrs n ALA 91 Cb 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 19.45 19.46 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 -1.15 -1.95 -1.35 0.00 0.00 -0.82 -4.80 120.51 110.42 1wrs n ALA 92 Ca 0.00 0.46 -0.36 0.00 0.00 0.00 0.00 53.44 53.54 1wrs n ALA 92 Cb 0.00 -1.41 0.08 0.00 0.00 0.00 0.00 19.45 18.12 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 -2.63 0.47 0.10 0.00 -0.02 -1.26 -4.94 135.00 126.71 1wrs n PRO 93 Ca -0.00 0.21 -0.05 0.00 -2.02 0.00 0.00 63.50 61.64 1wrs n PRO 93 Cb 0.46 -2.07 -0.02 0.00 -0.02 0.00 0.00 33.50 31.85 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 -0.20 0.00 0.00 -1.45 2.07 -2.01 -3.18 116.25 111.48 1wrs h VAL 94 Ca -0.47 -0.62 0.00 0.00 0.82 0.00 0.00 66.70 66.44 1wrs h VAL 94 Cb 1.34 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1wrs h VAL 94 CO 0.46 0.00 0.00 -0.33 0.02 0.00 0.00 177.57 177.72 1wrs h GLU 95 N -0.94 0.00 0.13 1.57 5.08 -2.00 -2.19 114.58 116.24 1wrs h GLU 95 Ca -0.03 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.05 1wrs h GLU 95 Cb 0.25 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.50 1wrs h GLU 95 CO 0.05 0.00 -1.25 1.25 -1.00 0.00 0.00 179.01 178.07 1wrs h LEU 96 N 0.00 0.50 -0.52 1.33 7.12 -1.95 -3.25 115.31 118.54 1wrs h LEU 96 Ca 0.00 -0.52 -0.08 0.00 0.13 0.00 0.00 57.88 57.41 1wrs h LEU 96 Cb 0.02 -0.16 -0.01 0.00 -0.53 0.00 0.00 40.66 39.98 1wrs h LEU 96 CO 0.00 1.39 -0.39 -0.09 -0.13 0.00 0.00 178.44 179.22 1wrs h ARG 97 N 0.10 0.00 0.00 1.25 1.12 -1.37 -2.41 114.38 113.07 1wrs h ARG 97 Ca -0.15 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.72 1wrs h ARG 97 Cb 1.96 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 31.92 1wrs h ARG 97 CO 0.21 0.39 0.00 1.96 -3.11 0.00 0.00 179.97 179.42 1wrs h GLN 98 N 0.00 0.00 0.00 0.20 1.08 -1.54 -3.23 115.11 111.62 1wrs h GLN 98 Ca -0.00 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 57.00 1wrs h GLN 98 Cb 1.10 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.50 1wrs h GLN 98 CO 0.05 0.00 -1.52 1.87 -0.95 0.00 0.00 178.83 178.28 1wrs n TRP 99 N -2.97 0.28 -0.59 2.96 -0.00 -1.04 -4.38 117.44 111.69 1wrs n TRP 99 Ca -0.01 0.12 0.47 0.00 -0.00 0.00 0.00 57.50 58.08 1wrs n TRP 99 Cb 0.19 -0.80 0.72 0.00 -0.00 0.00 0.00 31.31 31.42 1wrs n TRP 99 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 1wrs n LEU 100 N -4.40 0.00 -0.34 5.87 7.99 -0.93 0.10 117.00 125.28 1wrs n LEU 100 Ca -0.30 0.92 0.22 0.00 -0.01 0.00 0.00 56.01 56.84 1wrs n LEU 100 Cb 0.64 -0.43 0.45 0.00 -0.11 0.00 0.00 43.42 43.97 1wrs n LEU 100 CO 0.13 -0.92 1.17 -0.33 -1.51 0.00 0.00 177.39 175.92 1wrs h GLU 101 N 0.00 0.43 0.00 3.23 4.39 -1.76 0.50 114.58 121.37 1wrs h GLU 101 Ca 0.82 -0.03 -0.24 0.00 0.34 0.00 0.00 59.36 60.25 1wrs h GLU 101 Cb 3.54 -0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 32.05 1wrs h GLU 101 CO -0.01 0.28 -1.55 0.93 -1.16 0.00 0.00 179.01 177.50 1wrs h GLU 102 N 0.44 0.00 0.07 2.33 5.08 0.42 -2.89 114.58 120.03 1wrs h GLU 102 Ca 0.67 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.79 1wrs h GLU 102 Cb 1.50 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.75 1wrs h GLU 102 CO -0.47 0.45 -1.11 0.28 -1.00 0.00 0.00 179.01 177.16 1wrs h VAL 103 N 0.00 1.52 0.01 3.13 2.07 -0.53 -1.98 116.25 120.47 1wrs h VAL 103 Ca -0.23 -2.96 -0.03 0.00 0.82 0.00 0.00 66.70 64.30 1wrs h VAL 103 Cb 1.85 2.79 0.00 0.00 -1.52 0.00 0.00 31.29 34.41 1wrs h VAL 103 CO 0.07 0.86 -0.13 0.25 0.02 0.00 0.00 177.57 178.64 1wrs h LEU 104 N 0.09 0.10 -0.64 2.57 6.46 -0.33 -3.30 115.31 120.26 1wrs h LEU 104 Ca -0.09 -0.84 0.04 0.00 -0.12 0.00 0.00 57.88 56.86 1wrs h LEU 104 Cb 1.82 -0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 41.67 1wrs h LEU 104 CO 0.18 0.93 0.38 0.25 -0.62 0.00 0.00 178.44 179.56 1wrs h LEU 105 N -0.72 0.61 -0.32 2.25 7.12 -1.62 -1.17 115.31 121.47 1wrs h LEU 105 Ca -0.02 0.01 0.01 0.00 0.13 0.00 0.00 57.88 58.01 1wrs h LEU 105 Cb 0.96 -0.12 -0.00 0.00 -0.53 0.00 0.00 40.66 40.97 1wrs h LEU 105 CO 0.03 0.41 0.91 0.11 -0.13 0.00 0.00 178.44 179.77 1wrs h LYS 106 N 0.74 0.00 0.00 1.25 1.79 -1.43 -3.51 116.57 115.41 1wrs h LYS 106 Ca 0.27 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.74 1wrs h LYS 106 Cb 0.07 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.72 1wrs h LYS 106 CO -0.13 0.00 0.00 -1.13 -1.08 0.00 0.00 179.45 177.11