#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wrs n SER 5 N 0.00 -5.42 -4.60 1.08 7.64 -1.26 -4.76 113.62 106.30 1wrs n SER 5 Ca 0.00 -0.83 -0.43 0.00 1.01 0.00 0.00 58.87 58.62 1wrs n SER 5 Cb 0.00 -2.59 -0.03 0.00 -1.01 0.00 0.00 64.21 60.58 1wrs n SER 5 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 1wrs s PRO 6 N -4.94 3.22 0.00 1.43 0.02 -1.26 -4.70 135.00 128.77 1wrs s PRO 6 Ca 0.11 1.74 0.00 0.00 0.02 0.00 0.00 61.00 62.87 1wrs s PRO 6 Cb -0.05 -4.29 0.00 0.00 0.02 0.00 0.00 34.50 30.18 1wrs s PRO 6 CO 0.87 -2.00 0.27 0.98 -0.33 0.00 0.00 177.00 176.79 1wrs n TYR 7 N 11.07 0.00 -2.54 6.54 9.36 -1.26 -4.99 117.16 135.34 1wrs n TYR 7 Ca 0.27 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 61.06 1wrs n TYR 7 Cb 0.46 0.03 0.00 0.00 -0.63 0.00 0.00 39.34 39.20 1wrs n TYR 7 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 1wrs n SER 8 N 0.00 4.89 0.00 2.98 7.64 -1.26 -4.82 113.62 123.05 1wrs n SER 8 Ca 0.00 -2.92 0.00 0.00 1.01 0.00 0.00 58.87 56.96 1wrs n SER 8 Cb 0.43 -1.74 0.00 0.00 -1.01 0.00 0.00 64.21 61.89 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 8.23 0.00 -0.28 -0.43 0.00 -1.26 -5.03 120.51 121.74 1wrs n ALA 9 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.93 1wrs n ALA 9 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 1wrs n ALA 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wrs n ALA 10 N -3.00 0.00 -1.77 0.00 0.00 -1.26 -4.53 120.51 109.95 1wrs n ALA 10 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 1wrs n ALA 10 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1wrs n ALA 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wrs s MET 11 N 0.00 3.85 0.00 0.00 0.23 -1.26 -5.00 119.30 117.12 1wrs s MET 11 Ca 0.00 1.84 0.00 0.00 -1.03 0.00 0.00 55.69 56.50 1wrs s MET 11 Cb 0.00 -2.52 0.00 0.00 -1.53 0.00 0.00 34.83 30.78 1wrs s MET 11 CO 0.00 -0.49 0.00 0.00 -2.03 0.00 0.00 175.02 172.50 1wrs n ALA 12 N -0.28 0.00 -2.24 3.16 0.00 -1.26 -5.03 120.51 114.86 1wrs n ALA 12 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.11 1wrs n ALA 12 Cb 0.47 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.94 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 4.28 0.00 0.00 1.02 -1.26 -4.90 120.64 119.78 1wrs n GLU 13 Ca 0.00 -3.97 0.00 0.00 -0.02 0.00 0.00 57.16 53.17 1wrs n GLU 13 Cb 0.00 -2.40 0.00 0.00 -0.02 0.00 0.00 31.44 29.02 1wrs n GLU 13 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1wrs n GLN 14 N 0.11 3.08 0.00 3.49 1.13 -1.26 -5.15 117.38 118.78 1wrs n GLN 14 Ca 0.51 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.57 1wrs n GLN 14 Cb 0.27 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.62 1wrs n GLN 14 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 1wrs n ARG 15 N 0.00 0.00 -1.12 -1.09 0.63 -1.26 -5.04 116.66 108.78 1wrs n ARG 15 Ca 0.00 0.00 -0.08 0.00 -0.92 0.00 0.00 57.85 56.85 1wrs n ARG 15 Cb 0.00 0.00 -0.08 0.00 0.45 0.00 0.00 32.46 32.83 1wrs n ARG 15 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1wrs n HIS 16 N 0.00 0.00 0.00 -0.14 -0.00 -1.26 -4.54 115.22 109.28 1wrs n HIS 16 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1wrs n HIS 16 Cb 0.00 -0.47 0.00 0.00 -0.00 0.00 0.00 29.99 29.52 1wrs n HIS 16 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 1wrs n GLN 17 N 4.58 0.00 0.25 -0.41 6.02 -1.26 -4.49 117.38 122.08 1wrs n GLN 17 Ca 0.25 0.00 0.18 0.00 -0.01 0.00 0.00 57.00 57.41 1wrs n GLN 17 Cb 0.34 0.00 0.90 0.00 1.02 0.00 0.00 30.24 32.50 1wrs n GLN 17 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1wrs h GLU 18 N 0.00 0.00 -0.33 -1.09 4.39 -2.01 0.86 114.58 116.39 1wrs h GLU 18 Ca 0.00 0.00 0.01 0.00 0.34 0.00 0.00 59.36 59.71 1wrs h GLU 18 Cb 0.00 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 1wrs h GLU 18 CO 0.00 0.00 0.19 2.35 -1.16 0.00 0.00 179.01 180.39 1wrs h TRP 19 N 0.00 0.36 -0.41 4.33 2.91 -1.86 -1.97 115.95 119.30 1wrs h TRP 19 Ca 0.05 0.01 0.05 0.00 1.13 0.00 0.00 58.89 60.14 1wrs h TRP 19 Cb 0.38 -0.12 -0.05 0.00 -0.51 0.00 0.00 29.16 28.87 1wrs h TRP 19 CO 0.00 0.21 0.15 1.25 -1.03 0.00 0.00 178.44 179.02 1wrs h LEU 20 N 0.40 0.16 -0.00 0.65 5.85 0.51 -3.12 115.31 119.75 1wrs h LEU 20 Ca 0.13 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.90 1wrs h LEU 20 Cb 0.00 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 1wrs h LEU 20 CO -0.06 0.13 -0.00 0.03 -0.34 0.00 0.00 178.44 178.19 1wrs h ARG 21 N 0.31 -0.00 -0.37 1.25 -0.00 -0.96 0.15 114.38 114.77 1wrs h ARG 21 Ca 0.19 0.00 0.07 0.00 -0.50 0.00 0.00 59.98 59.74 1wrs h ARG 21 Cb 0.17 0.00 -0.07 0.00 0.00 0.00 0.00 29.97 30.08 1wrs h ARG 21 CO -0.19 -0.00 -0.11 0.34 0.00 0.00 0.00 179.97 180.01 1wrs n PHE 22 N -2.60 0.10 -0.06 3.04 7.35 -1.11 0.24 117.46 124.42 1wrs n PHE 22 Ca -0.00 0.45 -0.13 0.00 -0.76 0.00 0.00 57.45 57.02 1wrs n PHE 22 Cb 0.00 -0.69 -0.06 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 1.32 -0.95 -2.13 2.07 -1.27 -2.89 116.25 112.40 1wrs h VAL 23 Ca 0.16 -1.18 0.29 0.00 0.82 0.00 0.00 66.70 66.79 1wrs h VAL 23 Cb 0.26 1.73 -0.18 0.00 -1.52 0.00 0.00 31.29 31.58 1wrs h VAL 23 CO -0.38 0.35 0.11 -0.67 0.02 0.00 0.00 177.57 177.00 1wrs n ASP 24 N -4.59 -0.03 0.07 0.57 -0.08 0.66 0.16 116.55 113.31 1wrs n ASP 24 Ca -0.05 1.61 -0.12 0.00 -1.51 0.00 0.00 54.79 54.72 1wrs n ASP 24 Cb 0.32 -0.62 -0.03 0.00 2.34 0.00 0.00 41.12 43.13 1wrs n ASP 24 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1wrs h LEU 25 N 0.00 0.45 -1.82 -2.67 3.38 -1.45 -3.17 115.31 110.03 1wrs h LEU 25 Ca 0.62 -0.36 0.12 0.00 0.09 0.00 0.00 57.88 58.35 1wrs h LEU 25 Cb 1.36 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.95 1wrs h LEU 25 CO -0.87 1.16 0.38 0.25 0.09 0.00 0.00 178.44 179.45 1wrs h LEU 26 N 0.20 0.18 0.24 1.67 6.46 0.18 0.64 115.31 124.88 1wrs h LEU 26 Ca -0.07 0.01 -0.33 0.00 -0.12 0.00 0.00 57.88 57.37 1wrs h LEU 26 Cb 1.55 -0.03 0.04 0.00 -0.73 0.00 0.00 40.66 41.49 1wrs h LEU 26 CO 0.15 0.10 -1.46 0.11 -0.62 0.00 0.00 178.44 176.72 1wrs h LYS 27 N 0.19 0.53 0.00 1.25 1.57 -1.29 -3.05 116.57 115.76 1wrs h LYS 27 Ca 0.26 -0.89 0.00 0.00 -1.87 0.00 0.00 60.65 58.15 1wrs h LYS 27 Cb 0.76 0.33 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1wrs h LYS 27 CO -0.04 1.43 -0.53 -0.91 -0.57 0.00 0.00 179.45 178.82 1wrs h ASN 28 N 0.15 0.00 0.00 0.86 4.21 -1.43 -3.34 115.58 116.02 1wrs h ASN 28 Ca -0.25 -0.05 -0.01 0.00 1.21 0.00 0.00 56.30 57.20 1wrs h ASN 28 Cb 2.15 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 39.35 1wrs h ASN 28 CO 0.27 0.03 -0.14 0.00 -1.29 0.00 0.00 177.43 176.30 1wrs h ALA 29 N 2.18 0.01 -1.36 -0.83 0.00 0.18 -3.33 119.26 116.11 1wrs h ALA 29 Ca 0.00 -0.18 0.40 0.00 0.00 0.00 0.00 54.91 55.12 1wrs h ALA 29 Cb 0.91 0.13 -0.08 0.00 0.00 0.00 0.00 17.79 18.75 1wrs h ALA 29 CO 0.00 0.12 0.95 -0.92 0.00 0.00 0.00 179.25 179.40 1wrs h TYR 30 N -1.00 0.20 -0.98 0.00 5.03 -1.72 0.55 116.97 119.05 1wrs h TYR 30 Ca -0.01 0.01 0.27 0.00 2.58 0.00 0.00 58.73 61.58 1wrs h TYR 30 Cb 0.23 -0.05 -0.14 0.00 1.55 0.00 0.00 36.73 38.32 1wrs h TYR 30 CO -0.02 -0.03 0.53 0.37 -1.32 0.00 0.00 178.16 177.69 1wrs h GLN 31 N 0.08 0.42 0.00 1.82 -0.00 -1.68 -3.34 115.11 112.41 1wrs h GLN 31 Ca 0.70 -0.03 0.00 0.00 -0.00 0.00 0.00 58.65 59.32 1wrs h GLN 31 Cb 2.52 -0.09 0.00 0.00 0.00 0.00 0.00 27.48 29.91 1wrs h GLN 31 CO -0.13 0.28 0.00 -1.71 0.00 0.00 0.00 178.83 177.27 1wrs n ASN 32 N -5.00 0.00 0.00 -0.69 5.15 0.18 -5.06 115.26 109.84 1wrs n ASN 32 Ca 0.28 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.26 1wrs n ASN 32 Cb 0.82 -0.22 0.00 0.00 -0.53 0.00 0.00 39.78 39.85 1wrs n ASN 32 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 1wrs n ASP 33 N -2.09 0.00 0.04 1.20 5.68 -0.72 -4.99 116.55 115.67 1wrs n ASP 33 Ca 0.00 0.00 0.12 0.00 -0.50 0.00 0.00 54.79 54.41 1wrs n ASP 33 Cb 0.00 0.00 0.20 0.00 -1.14 0.00 0.00 41.12 40.18 1wrs n ASP 33 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1wrs n LEU 34 N 0.00 0.62 -0.03 -2.12 7.99 -1.23 -4.02 117.00 118.21 1wrs n LEU 34 Ca 0.00 0.17 0.24 0.00 -0.01 0.00 0.00 56.01 56.41 1wrs n LEU 34 Cb 0.00 -0.21 0.72 0.00 -0.11 0.00 0.00 43.42 43.82 1wrs n LEU 34 CO 0.00 -0.00 1.22 1.12 -1.51 0.00 0.00 177.39 178.22 1wrs h HIS 35 N 0.00 0.00 0.38 -1.77 2.07 -1.91 -2.43 115.15 111.48 1wrs h HIS 35 Ca 0.00 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.50 1wrs h HIS 35 Cb 0.67 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.66 1wrs h HIS 35 CO 0.00 0.00 -0.18 -0.07 -3.07 0.00 0.00 177.93 174.61 1wrs h LEU 36 N 0.00 -0.43 -1.88 6.12 3.38 -1.95 0.34 115.31 120.89 1wrs h LEU 36 Ca 0.30 0.01 0.13 0.00 0.09 0.00 0.00 57.88 58.41 1wrs h LEU 36 Cb 1.42 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 42.27 1wrs h LEU 36 CO -0.00 -0.12 0.51 -0.65 0.09 0.00 0.00 178.44 178.28 1wrs h PRO 37 N -0.88 0.00 0.22 1.13 0.10 -1.78 0.27 132.00 131.05 1wrs h PRO 37 Ca -0.05 0.00 -0.33 0.00 0.10 0.00 0.00 66.00 65.72 1wrs h PRO 37 Cb 0.39 0.00 0.03 0.00 0.10 0.00 0.00 31.00 31.51 1wrs h PRO 37 CO 0.08 0.00 -1.49 -0.07 0.10 0.00 0.00 178.00 176.63 1wrs h LEU 38 N 0.00 0.72 -2.88 2.35 3.38 -1.37 -3.17 115.31 114.34 1wrs h LEU 38 Ca 0.21 -0.82 0.00 0.00 0.09 0.00 0.00 57.88 57.36 1wrs h LEU 38 Cb 1.23 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.75 1wrs h LEU 38 CO -0.00 1.65 0.00 -0.07 0.09 0.00 0.00 178.44 180.11 1wrs h LEU 39 N 0.13 0.00 -2.91 1.67 4.07 0.18 0.40 115.31 118.84 1wrs h LEU 39 Ca -0.25 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.71 1wrs h LEU 39 Cb 2.12 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.86 1wrs h LEU 39 CO 0.24 0.00 0.00 -0.46 -1.08 0.00 0.00 178.44 177.14 1wrs n ASN 40 N -3.24 3.89 -0.00 -0.43 6.94 -0.96 -4.23 115.26 117.22 1wrs n ASN 40 Ca -0.03 -2.16 -0.00 0.00 -0.02 0.00 0.00 54.58 52.37 1wrs n ASN 40 Cb 0.08 -0.45 -0.00 0.00 -2.36 0.00 0.00 39.78 37.05 1wrs n ASN 40 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 1wrs n LEU 41 N 1.11 0.03 0.00 -4.53 7.94 0.14 -4.66 117.00 117.04 1wrs n LEU 41 Ca 0.21 0.00 0.03 0.00 -1.11 0.00 0.00 56.01 55.15 1wrs n LEU 41 Cb 0.65 -0.33 0.19 0.00 0.53 0.00 0.00 43.42 44.46 1wrs n LEU 41 CO 0.16 -0.50 0.56 0.23 -1.11 0.00 0.00 177.39 176.73 1wrs n MET 42 N -2.53 0.87 -3.47 1.96 0.00 -1.07 -4.79 117.12 108.09 1wrs n MET 42 Ca -0.00 0.00 -0.20 0.00 0.00 0.00 0.00 57.70 57.50 1wrs n MET 42 Cb 0.01 -1.11 -0.03 0.00 0.00 0.00 0.00 33.22 32.09 1wrs n MET 42 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1wrs n LEU 43 N -0.61 0.00 0.00 4.03 4.32 -1.26 -5.05 117.00 118.43 1wrs n LEU 43 Ca 0.05 -1.98 0.00 0.00 -0.02 0.00 0.00 56.01 54.06 1wrs n LEU 43 Cb 0.02 0.14 0.00 0.00 -1.62 0.00 0.00 43.42 41.96 1wrs n LEU 43 CO 0.04 -0.35 0.00 0.41 -1.22 0.00 0.00 177.39 176.26 1wrs n THR 44 N -0.99 0.00 -0.10 -5.08 -1.04 -1.26 -4.91 114.28 100.89 1wrs n THR 44 Ca -0.09 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.74 1wrs n THR 44 Cb 0.41 0.00 -0.13 0.00 -1.82 0.00 0.00 70.33 68.79 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 0.67 0.30 -2.82 -0.04 -1.26 -4.13 135.00 127.73 1wrs n PRO 45 Ca 0.00 0.15 0.17 0.00 -0.04 0.00 0.00 63.50 63.78 1wrs n PRO 45 Cb 0.00 -1.56 0.91 0.00 -0.04 0.00 0.00 33.50 32.80 1wrs n PRO 45 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 1wrs h ASP 46 N 0.01 0.00 0.00 3.54 3.04 -1.99 -2.65 116.42 118.37 1wrs h ASP 46 Ca -0.54 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.25 1wrs h ASP 46 Cb 1.98 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 40.27 1wrs h ASP 46 CO -0.04 0.00 0.00 -0.62 -2.04 0.00 0.00 179.24 176.54 1wrs n GLU 47 N -2.81 0.00 -0.31 4.15 4.71 -1.26 -1.02 120.64 124.09 1wrs n GLU 47 Ca -0.02 0.43 0.15 0.00 -0.01 0.00 0.00 57.16 57.72 1wrs n GLU 47 Cb 0.22 -1.42 0.32 0.00 -1.01 0.00 0.00 31.44 29.56 1wrs n GLU 47 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1wrs h ARG 48 N 0.00 0.14 0.00 3.49 -0.00 -1.70 0.81 114.38 117.11 1wrs h ARG 48 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.98 59.47 1wrs h ARG 48 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 29.97 29.94 1wrs h ARG 48 CO 0.00 0.09 0.00 0.39 0.00 0.00 0.00 179.97 180.45 1wrs n GLU 49 N -5.29 0.00 0.34 0.04 -0.58 -1.13 -2.45 120.64 111.57 1wrs n GLU 49 Ca 0.24 0.22 -0.14 0.00 -0.42 0.00 0.00 57.16 57.06 1wrs n GLU 49 Cb 0.77 -1.13 -0.07 0.00 -0.57 0.00 0.00 31.44 30.44 1wrs n GLU 49 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wrs h ALA 50 N -1.95 -0.91 -0.70 0.62 0.00 -0.61 -2.97 119.26 112.74 1wrs h ALA 50 Ca 0.00 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 54.79 1wrs h ALA 50 Cb 0.00 0.35 -0.09 0.00 0.00 0.00 0.00 17.79 18.05 1wrs h ALA 50 CO 0.00 -0.84 -0.38 -0.11 0.00 0.00 0.00 179.25 177.92 1wrs n LEU 51 N -5.35 -0.67 -0.15 0.00 0.00 0.28 0.17 117.00 111.28 1wrs n LEU 51 Ca -0.11 1.24 -0.03 0.00 0.00 0.00 0.00 56.01 57.11 1wrs n LEU 51 Cb 0.36 -0.19 0.05 0.00 0.00 0.00 0.00 43.42 43.64 1wrs n LEU 51 CO 0.27 -1.04 0.88 1.23 0.00 0.00 0.00 177.39 178.73 1wrs h GLY 52 N 0.00 0.53 0.00 -3.96 0.00 -1.49 -2.63 103.07 95.51 1wrs h GLY 52 Ca 0.15 0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.49 1wrs h GLY 52 CO -0.67 -0.09 0.00 2.41 0.00 0.00 0.00 176.54 178.19 1wrs n THR 53 N -5.16 0.00 -0.14 4.70 -1.04 0.45 0.17 114.28 113.27 1wrs n THR 53 Ca 0.05 1.04 0.24 0.00 -2.04 0.00 0.00 64.05 63.34 1wrs n THR 53 Cb 0.24 -1.75 0.37 0.00 -1.82 0.00 0.00 70.33 67.36 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 -0.94 0.02 -0.01 -2.82 0.00 -0.87 0.24 116.66 112.28 1wrs n ARG 54 Ca 0.00 1.01 -0.09 0.00 -0.00 0.00 0.00 57.85 58.77 1wrs n ARG 54 Cb 0.00 -2.53 -0.14 0.00 -0.00 0.00 0.00 32.46 29.79 1wrs n ARG 54 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1wrs h VAL 55 N 0.00 0.99 0.03 8.89 2.07 -0.83 -2.73 116.25 124.68 1wrs h VAL 55 Ca 0.42 -2.82 -0.25 0.00 0.82 0.00 0.00 66.70 64.87 1wrs h VAL 55 Cb 2.79 2.49 0.01 0.00 -1.52 0.00 0.00 31.29 35.07 1wrs h VAL 55 CO -0.00 0.57 -1.05 0.08 0.02 0.00 0.00 177.57 177.19 1wrs h ARG 56 N 0.00 0.51 0.04 1.57 -0.00 0.73 -2.65 114.38 114.58 1wrs h ARG 56 Ca -0.24 -0.59 -0.00 0.00 -0.00 0.00 0.00 59.98 59.15 1wrs h ARG 56 Cb 1.97 0.18 0.00 0.00 -0.00 0.00 0.00 29.97 32.12 1wrs h ARG 56 CO 0.09 1.22 -0.02 0.97 -0.00 0.00 0.00 179.97 182.23 1wrs h ILE 57 N 0.27 1.27 -0.74 0.08 2.10 -1.37 -2.23 117.51 116.89 1wrs h ILE 57 Ca -0.11 -1.70 0.13 0.00 1.08 0.00 0.00 64.86 64.26 1wrs h ILE 57 Cb 1.70 2.29 -0.09 0.00 -1.09 0.00 0.00 36.82 39.62 1wrs h ILE 57 CO 0.19 0.39 0.30 1.62 -1.08 0.00 0.00 178.15 179.57 1wrs h VAL 58 N -0.89 0.69 0.00 2.19 3.04 -1.61 0.21 116.25 119.87 1wrs h VAL 58 Ca -0.01 -0.16 -0.07 0.00 -1.01 0.00 0.00 66.70 65.46 1wrs h VAL 58 Cb 0.68 0.19 -0.01 0.00 -2.01 0.00 0.00 31.29 30.14 1wrs h VAL 58 CO 0.01 0.08 -0.32 -0.08 -1.01 0.00 0.00 177.57 176.25 1wrs h GLU 59 N 0.46 0.00 -0.00 4.17 4.22 -1.54 -1.55 114.58 120.34 1wrs h GLU 59 Ca 0.40 0.00 -0.03 0.00 0.08 0.00 0.00 59.36 59.81 1wrs h GLU 59 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1wrs h GLU 59 CO -0.38 0.32 -0.12 0.93 -2.18 0.00 0.00 179.01 177.58 1wrs h GLU 60 N 0.00 0.09 0.00 1.92 4.39 -0.05 -3.28 114.58 117.64 1wrs h GLU 60 Ca -0.00 -0.09 -0.03 0.00 0.34 0.00 0.00 59.36 59.58 1wrs h GLU 60 Cb 0.58 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1wrs h GLU 60 CO 0.04 0.84 -0.14 -0.07 -1.16 0.00 0.00 179.01 178.52 1wrs h LEU 61 N -0.63 0.00 -1.20 1.33 3.38 -0.91 -2.95 115.31 114.32 1wrs h LEU 61 Ca -0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1wrs h LEU 61 Cb 0.88 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 1wrs h LEU 61 CO 0.02 0.14 0.32 0.25 0.09 0.00 0.00 178.44 179.26 1wrs h LEU 62 N 0.00 0.78 -0.64 1.67 5.85 -1.34 0.48 115.31 122.11 1wrs h LEU 62 Ca -0.00 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1wrs h LEU 62 Cb 0.65 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.48 1wrs h LEU 62 CO 0.02 0.65 0.00 -1.14 -0.34 0.00 0.00 178.44 177.63 1wrs n ARG 63 N -4.37 1.03 -1.07 1.25 0.63 -1.11 -4.85 116.66 108.18 1wrs n ARG 63 Ca 0.06 -0.03 0.00 0.00 -0.92 0.00 0.00 57.85 56.96 1wrs n ARG 63 Cb 0.12 -1.31 0.00 0.00 0.45 0.00 0.00 32.46 31.71 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 0.20 0.00 0.38 5.14 0.00 0.16 -4.61 105.19 106.46 1wrs n GLY 64 Ca 0.00 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.23 1wrs n GLY 64 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1wrs h GLU 65 N 0.00 0.00 -3.36 1.61 4.39 -1.83 -3.42 114.58 111.97 1wrs h GLU 65 Ca 0.00 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.63 1wrs h GLU 65 Cb 0.00 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 28.50 1wrs h GLU 65 CO 0.00 0.00 -0.16 -1.64 -1.16 0.00 0.00 179.01 176.05 1wrs s MET 66 N -4.99 0.95 -0.40 2.33 -1.94 -1.26 -5.10 119.30 108.88 1wrs s MET 66 Ca -0.05 -0.63 0.01 0.00 -1.71 0.00 0.00 55.69 53.31 1wrs s MET 66 Cb 0.20 0.41 0.25 0.00 2.01 0.00 0.00 34.83 37.70 1wrs s MET 66 CO 0.72 -0.34 1.07 0.45 -0.01 0.00 0.00 175.02 176.92 1wrs n SER 67 N 0.13 -2.04 0.00 3.03 2.88 -1.26 -5.02 113.62 111.33 1wrs n SER 67 Ca -0.17 -2.42 0.00 0.00 -1.33 0.00 0.00 58.87 54.95 1wrs n SER 67 Cb 0.62 1.21 0.00 0.00 -0.75 0.00 0.00 64.21 65.29 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 1.66 0.00 -1.12 -1.46 10.64 -1.26 -4.93 117.38 120.91 1wrs n GLN 68 Ca 0.05 0.00 -0.22 0.00 -1.83 0.00 0.00 57.00 55.01 1wrs n GLN 68 Cb 0.67 0.00 0.16 0.00 -0.86 0.00 0.00 30.24 30.21 1wrs n GLN 68 CO 0.00 0.00 0.00 -2.13 -1.83 0.00 0.00 177.06 173.10 1wrs n ARG 69 N 0.00 2.14 -1.51 2.61 3.00 -1.26 -4.19 116.66 117.45 1wrs n ARG 69 Ca 0.00 -2.73 -0.01 0.00 -0.00 0.00 0.00 57.85 55.11 1wrs n ARG 69 Cb 0.00 -2.07 0.09 0.00 0.00 0.00 0.00 32.46 30.48 1wrs n ARG 69 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1wrs n GLU 70 N -0.99 1.41 -0.73 -0.14 1.02 -1.26 -4.79 120.64 115.15 1wrs n GLU 70 Ca 0.54 -3.04 0.08 0.00 -0.02 0.00 0.00 57.16 54.72 1wrs n GLU 70 Cb 1.56 -1.18 0.36 0.00 -0.02 0.00 0.00 31.44 32.15 1wrs n GLU 70 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1wrs n LEU 71 N -0.42 5.08 0.04 -4.62 4.77 -1.26 -4.55 117.00 116.04 1wrs n LEU 71 Ca 0.17 -2.92 0.00 0.00 -0.03 0.00 0.00 56.01 53.23 1wrs n LEU 71 Cb 0.91 -0.63 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 1wrs n LEU 71 CO 0.05 0.66 0.00 0.29 -1.33 0.00 0.00 177.39 177.06 1wrs n LYS 72 N 0.31 0.00 0.00 3.23 5.02 -1.26 -4.91 118.16 120.54 1wrs n LYS 72 Ca 0.26 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.68 1wrs n LYS 72 Cb 1.08 0.00 0.82 0.00 -0.02 0.00 0.00 35.03 36.91 1wrs n LYS 72 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1wrs n ASN 73 N -2.65 0.00 0.27 4.39 4.13 -1.26 -2.17 115.26 117.97 1wrs n ASN 73 Ca 0.00 -0.87 0.10 0.00 1.68 0.00 0.00 54.58 55.49 1wrs n ASN 73 Cb 0.00 0.00 0.71 0.00 -1.54 0.00 0.00 39.78 38.95 1wrs n ASN 73 CO 0.00 0.00 0.00 1.05 0.28 0.00 0.00 177.26 178.59 1wrs h GLU 74 N 0.00 0.00 0.00 3.52 4.11 -1.88 -2.74 114.58 117.59 1wrs h GLU 74 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1wrs h GLU 74 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1wrs h GLU 74 CO 0.00 0.01 -0.20 -0.11 0.07 0.00 0.00 179.01 178.77 1wrs n LEU 75 N -4.34 0.43 -1.59 3.06 7.94 -1.16 -5.00 117.00 116.34 1wrs n LEU 75 Ca -0.03 -0.91 -0.03 0.00 -1.11 0.00 0.00 56.01 53.93 1wrs n LEU 75 Cb 0.09 -0.04 -0.00 0.00 0.53 0.00 0.00 43.42 44.00 1wrs n LEU 75 CO 0.32 0.22 -0.01 0.61 -1.11 0.00 0.00 177.39 177.43 1wrs n GLY 76 N -0.19 -0.03 0.00 -3.96 0.00 -0.92 -4.73 105.19 95.36 1wrs n GLY 76 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.68 -0.01 0.00 4.61 0.00 -1.26 -5.04 120.51 118.13 1wrs n ALA 77 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1wrs n ALA 77 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.48 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 1.75 1.82 0.95 0.00 0.00 -1.26 -4.97 105.19 103.48 1wrs n GLY 78 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1wrs n GLY 78 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1wrs n ILE 79 N -0.44 0.61 -0.06 -0.61 2.08 -1.26 -2.74 119.36 116.94 1wrs n ILE 79 Ca 0.00 0.00 -0.08 0.00 0.56 0.00 0.00 62.75 63.23 1wrs n ILE 79 Cb 0.00 -0.79 -0.07 0.00 -0.75 0.00 0.00 39.64 38.04 1wrs n ILE 79 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1wrs n ALA 80 N 0.61 1.73 -0.10 -1.39 0.00 -1.26 -4.59 120.51 115.51 1wrs n ALA 80 Ca 0.00 -0.59 -0.14 0.00 0.00 0.00 0.00 53.44 52.71 1wrs n ALA 80 Cb 0.32 0.16 -0.05 0.00 0.00 0.00 0.00 19.45 19.87 1wrs n ALA 80 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1wrs n THR 81 N -2.75 1.49 0.13 0.00 -2.24 -1.11 -4.23 114.28 105.58 1wrs n THR 81 Ca -0.21 0.03 0.03 0.00 -2.27 0.00 0.00 64.05 61.63 1wrs n THR 81 Cb 0.77 -2.22 0.18 0.00 -2.10 0.00 0.00 70.33 66.96 1wrs n THR 81 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 1wrs n ILE 82 N -4.45 0.45 0.00 2.28 -6.64 -1.17 -2.23 119.36 107.59 1wrs n ILE 82 Ca -0.23 0.70 0.00 0.00 -1.77 0.00 0.00 62.75 61.45 1wrs n ILE 82 Cb 0.55 -1.70 0.00 0.00 -1.44 0.00 0.00 39.64 37.05 1wrs n ILE 82 CO 0.00 0.00 0.00 0.35 -1.77 0.00 0.00 176.55 175.13 1wrs n THR 83 N -1.80 0.00 0.32 7.28 -2.24 -1.26 -2.86 114.28 113.72 1wrs n THR 83 Ca -0.00 0.67 0.17 0.00 -2.27 0.00 0.00 64.05 62.61 1wrs n THR 83 Cb 0.45 -1.36 0.86 0.00 -2.10 0.00 0.00 70.33 68.18 1wrs n THR 83 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 1wrs h ARG 84 N 0.00 0.00 -0.43 -0.78 -0.00 -1.75 0.14 114.38 111.56 1wrs h ARG 84 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 59.98 60.02 1wrs h ARG 84 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 29.97 29.93 1wrs h ARG 84 CO 0.00 0.00 0.19 0.78 -0.00 0.00 0.00 179.97 180.94 1wrs h GLY 85 N 0.00 0.58 0.00 0.08 0.00 -1.43 -2.96 103.07 99.35 1wrs h GLY 85 Ca 0.01 -0.12 -0.09 0.00 0.00 0.00 0.00 47.33 47.13 1wrs h GLY 85 CO -0.00 0.07 -1.40 -1.14 0.00 0.00 0.00 176.54 174.07 1wrs n SER 86 N -4.95 3.48 -0.08 0.19 3.41 -0.52 -4.42 113.62 110.74 1wrs n SER 86 Ca 0.03 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.54 1wrs n SER 86 Cb 0.13 0.79 -0.05 0.00 -0.26 0.00 0.00 64.21 64.82 1wrs n SER 86 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1wrs h ASN 87 N 0.00 0.00 0.00 4.04 -0.73 -0.90 -3.46 115.58 114.52 1wrs h ASN 87 Ca -0.13 -0.22 0.00 0.00 1.87 0.00 0.00 56.30 57.82 1wrs h ASN 87 Cb 1.16 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.75 1wrs h ASN 87 CO 0.01 0.97 0.00 -0.24 -0.37 0.00 0.00 177.43 177.80 1wrs n SER 88 N -4.58 0.00 -1.74 1.15 2.88 -1.12 -3.72 113.62 106.50 1wrs n SER 88 Ca -0.14 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.35 1wrs n SER 88 Cb 0.38 -1.90 -0.01 0.00 -0.75 0.00 0.00 64.21 61.93 1wrs n SER 88 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1wrs n LEU 89 N 0.00 -0.09 -0.37 2.46 7.99 -1.26 -2.60 117.00 123.12 1wrs n LEU 89 Ca 0.00 0.03 0.00 0.00 -0.01 0.00 0.00 56.01 56.03 1wrs n LEU 89 Cb 0.00 -0.50 0.00 0.00 -0.11 0.00 0.00 43.42 42.81 1wrs n LEU 89 CO 0.00 0.01 0.00 1.17 -1.51 0.00 0.00 177.39 177.06 1wrs n LYS 90 N -1.34 -0.73 0.00 3.23 3.00 -1.24 -4.51 118.16 116.57 1wrs n LYS 90 Ca 0.01 0.00 0.14 0.00 -0.00 0.00 0.00 58.31 58.46 1wrs n LYS 90 Cb 0.21 -0.04 0.52 0.00 0.00 0.00 0.00 35.03 35.72 1wrs n LYS 90 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1wrs n ALA 91 N -0.02 2.82 -1.23 3.14 0.00 -1.07 -4.89 120.51 119.26 1wrs n ALA 91 Ca 0.00 -0.37 -0.29 0.00 0.00 0.00 0.00 53.44 52.78 1wrs n ALA 91 Cb 0.00 -1.22 0.18 0.00 0.00 0.00 0.00 19.45 18.42 1wrs n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wrs s ALA 92 N -2.31 1.02 0.03 0.00 0.00 -1.26 -4.91 121.76 114.33 1wrs s ALA 92 Ca 0.31 -0.50 -0.31 0.00 0.00 0.00 0.00 51.96 51.46 1wrs s ALA 92 Cb 0.20 -3.06 -0.09 0.00 0.00 0.00 0.00 23.12 20.17 1wrs s ALA 92 CO 0.44 -2.88 1.96 -2.30 0.00 0.00 0.00 175.76 172.98 1wrs n PRO 93 N -4.20 2.79 -0.21 0.00 -0.02 -1.26 -4.86 135.00 127.24 1wrs n PRO 93 Ca 0.06 1.02 -0.01 0.00 -2.02 0.00 0.00 63.50 62.56 1wrs n PRO 93 Cb 0.58 -2.96 0.22 0.00 -0.02 0.00 0.00 33.50 31.31 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 5.55 1.21 0.00 -1.45 2.07 -1.91 -0.20 116.25 121.52 1wrs h VAL 94 Ca -0.50 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 66.54 1wrs h VAL 94 Cb 1.24 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1wrs h VAL 94 CO 0.94 0.22 0.00 -0.62 0.02 0.00 0.00 177.57 178.13 1wrs n GLU 95 N -4.38 0.00 0.08 1.57 1.02 -1.26 -2.21 120.64 115.46 1wrs n GLU 95 Ca 0.07 0.49 -0.11 0.00 -0.02 0.00 0.00 57.16 57.60 1wrs n GLU 95 Cb 0.08 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 29.92 1wrs n GLU 95 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1wrs h LEU 96 N 0.00 -0.22 -0.52 -4.62 6.46 -1.40 -3.07 115.31 111.94 1wrs h LEU 96 Ca 0.00 -0.30 0.00 0.00 -0.12 0.00 0.00 57.88 57.46 1wrs h LEU 96 Cb 0.01 0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.00 1wrs h LEU 96 CO 0.00 0.30 0.00 0.54 -0.62 0.00 0.00 178.44 178.66 1wrs n ARG 97 N -4.96 0.07 0.09 1.25 3.00 -0.94 -1.81 116.66 113.36 1wrs n ARG 97 Ca -0.08 0.49 -0.14 0.00 -0.01 0.00 0.00 57.85 58.10 1wrs n ARG 97 Cb 0.26 -1.69 -0.14 0.00 0.00 0.00 0.00 32.46 30.89 1wrs n ARG 97 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.63 179.59 1wrs h GLN 98 N 0.00 0.22 0.00 5.56 4.20 -1.52 -2.60 115.11 120.96 1wrs h GLN 98 Ca 0.00 -0.38 -0.00 0.00 0.06 0.00 0.00 58.65 58.33 1wrs h GLN 98 Cb 0.09 0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.01 1wrs h GLN 98 CO 0.00 1.15 -0.03 2.35 -0.67 0.00 0.00 178.83 181.63 1wrs h TRP 99 N 0.06 0.00 0.00 2.96 7.01 -1.30 -3.36 115.95 121.32 1wrs h TRP 99 Ca -0.14 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.86 1wrs h TRP 99 Cb 1.95 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 29.01 1wrs h TRP 99 CO 0.05 0.12 0.00 1.25 -2.79 0.00 0.00 178.44 177.07 1wrs h LEU 100 N -1.00 0.00 -2.34 0.65 6.46 -1.68 -1.10 115.31 116.30 1wrs h LEU 100 Ca -0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1wrs h LEU 100 Cb 0.14 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.07 1wrs h LEU 100 CO -0.00 0.00 0.10 -0.33 -0.62 0.00 0.00 178.44 177.59 1wrs h GLU 101 N 0.00 0.00 0.01 1.25 4.39 -1.60 -1.44 114.58 117.18 1wrs h GLU 101 Ca 0.00 0.00 -0.38 0.00 0.34 0.00 0.00 59.36 59.32 1wrs h GLU 101 Cb 0.40 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.98 1wrs h GLU 101 CO 0.00 0.00 -2.39 0.39 -1.16 0.00 0.00 179.01 175.85 1wrs n GLU 102 N -2.82 0.67 0.11 2.33 1.02 -0.44 -2.81 120.64 118.70 1wrs n GLU 102 Ca -0.02 0.10 0.12 0.00 -0.02 0.00 0.00 57.16 57.33 1wrs n GLU 102 Cb 0.15 -1.54 0.46 0.00 -0.02 0.00 0.00 31.44 30.49 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 -3.06 0.73 -0.07 2.62 0.31 -0.68 -2.55 118.33 115.63 1wrs n VAL 103 Ca -0.39 0.06 -0.06 0.00 -0.01 0.00 0.00 64.34 63.94 1wrs n VAL 103 Cb 1.06 -0.94 -0.03 0.00 -0.91 0.00 0.00 33.84 33.02 1wrs n VAL 103 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1wrs h LEU 104 N 0.00 0.00 0.00 7.52 3.38 -1.47 -3.32 115.31 121.42 1wrs h LEU 104 Ca 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1wrs h LEU 104 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1wrs h LEU 104 CO 0.00 0.82 0.00 0.18 0.09 0.00 0.00 178.44 179.53 1wrs n LEU 105 N -4.62 0.30 0.00 1.67 4.77 -1.12 -4.30 117.00 113.70 1wrs n LEU 105 Ca -0.09 0.54 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 1wrs n LEU 105 Cb 0.29 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1wrs n LEU 105 CO 0.11 -0.11 0.22 1.17 -1.33 0.00 0.00 177.39 177.45 1wrs n LYS 106 N -0.82 0.00 0.00 3.23 3.00 -1.06 -5.07 118.16 117.45 1wrs n LYS 106 Ca 0.00 0.36 0.00 0.00 -0.00 0.00 0.00 58.31 58.67 1wrs n LYS 106 Cb 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 35.03 34.09 1wrs n LYS 106 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83