#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2spc n ASN 1 N 0.00 0.70 0.28 1.69 3.02 -1.26 -4.75 115.26 114.93 2spc n ASN 1 Ca 0.00 1.17 0.11 0.00 -0.03 0.00 0.00 54.58 55.83 2spc n ASN 1 Cb 0.00 -1.21 0.76 0.00 -0.61 0.00 0.00 39.78 38.72 2spc n ASN 1 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2spc h LEU 2 N 1.82 0.00 -0.36 3.41 3.38 -2.06 -1.33 115.31 120.16 2spc h LEU 2 Ca -0.37 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.55 2spc h LEU 2 Cb 1.36 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 2spc h LEU 2 CO 0.60 0.01 0.04 -2.24 0.09 0.00 0.00 178.44 176.93 2spc h ASP 3 N 0.00 0.60 -0.44 -0.43 2.03 -2.00 0.16 116.42 116.33 2spc h ASP 3 Ca -0.00 -0.28 -0.05 0.00 -0.73 0.00 0.00 57.03 55.97 2spc h ASP 3 Cb 0.02 -0.16 -0.02 0.00 -0.83 0.00 0.00 39.33 38.33 2spc h ASP 3 CO 0.00 0.73 0.12 0.25 -1.03 0.00 0.00 179.24 179.31 2spc h LEU 4 N 0.44 0.72 -0.64 0.15 5.85 -1.70 -2.36 115.31 117.77 2spc h LEU 4 Ca 0.11 -0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.65 2spc h LEU 4 Cb 0.40 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 2spc h LEU 4 CO 0.01 0.71 0.19 1.56 -0.34 0.00 0.00 178.44 180.57 2spc h GLN 5 N 0.75 1.01 -0.36 1.25 4.20 -0.18 -1.28 115.11 120.50 2spc h GLN 5 Ca 0.17 -0.22 -0.00 0.00 0.06 0.00 0.00 58.65 58.65 2spc h GLN 5 Cb 0.28 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 2spc h GLN 5 CO -0.00 0.89 0.22 1.25 -0.67 0.00 0.00 178.83 180.52 2spc h LEU 6 N 0.93 0.43 -0.66 1.46 5.85 -0.34 -1.64 115.31 121.34 2spc h LEU 6 Ca 0.20 -0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.92 2spc h LEU 6 Cb 0.32 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.19 2spc h LEU 6 CO -0.00 0.36 0.39 0.22 -0.34 0.00 0.00 178.44 179.06 2spc h TYR 7 N 0.47 0.71 -0.46 1.25 3.20 -1.25 0.26 116.97 121.16 2spc h TYR 7 Ca 0.13 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 2spc h TYR 7 Cb 0.01 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.03 2spc h TYR 7 CO -0.04 0.37 0.20 0.52 -1.64 0.00 0.00 178.16 177.57 2spc h MET 8 N 0.73 0.67 0.10 1.82 2.86 -0.83 0.81 114.93 121.09 2spc h MET 8 Ca 0.28 -0.11 0.01 0.00 -2.06 0.00 0.00 59.70 57.82 2spc h MET 8 Cb 0.12 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 2spc h MET 8 CO -0.15 0.59 -0.17 -0.09 1.06 0.00 0.00 176.91 178.15 2spc h ARG 9 N 0.59 -0.32 -0.94 1.72 2.43 -0.99 0.75 114.38 117.63 2spc h ARG 9 Ca 0.15 0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.43 2spc h ARG 9 Cb 0.16 0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 29.71 2spc h ARG 9 CO -0.02 -0.21 0.59 -0.44 -1.51 0.00 0.00 179.97 178.38 2spc h ASP 10 N -0.33 0.90 -0.29 -3.80 3.32 -0.74 0.85 116.42 116.33 2spc h ASP 10 Ca 0.02 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.07 2spc h ASP 10 Cb 0.35 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 2spc h ASP 10 CO -0.09 0.55 0.08 0.00 -1.72 0.00 0.00 179.24 178.05 2spc h GLU 12 N 0.30 1.07 -0.55 0.00 5.08 0.16 0.28 114.58 120.92 2spc h GLU 12 Ca 0.09 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2spc h GLU 12 Cb 0.26 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 2spc h GLU 12 CO -0.00 0.73 0.26 -0.07 -1.00 0.00 0.00 179.01 178.93 2spc h LEU 13 N 1.09 0.71 -0.80 1.33 3.38 -0.74 -1.41 115.31 118.88 2spc h LEU 13 Ca 0.29 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 2spc h LEU 13 Cb -0.09 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 2spc h LEU 13 CO -0.06 0.64 0.28 0.00 0.09 0.00 0.00 178.44 179.39 2spc h ALA 14 N 1.10 1.03 -0.66 1.53 0.00 -0.76 -1.01 119.26 120.50 2spc h ALA 14 Ca 0.19 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2spc h ALA 14 Cb 0.11 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 2spc h ALA 14 CO -0.02 0.67 0.22 0.93 0.00 0.00 0.00 179.25 181.05 2spc h GLU 15 N 1.14 1.01 -0.43 0.00 5.08 -0.59 -1.15 114.58 119.64 2spc h GLU 15 Ca 0.25 -0.21 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 2spc h GLU 15 Cb 0.26 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2spc h GLU 15 CO -0.02 0.87 0.06 1.03 -1.00 0.00 0.00 179.01 179.95 2spc h SER 16 N 0.94 0.70 -0.87 1.42 0.87 -0.98 0.43 113.55 116.06 2spc h SER 16 Ca 0.21 -0.27 -0.02 0.00 -1.23 0.00 0.00 61.79 60.48 2spc h SER 16 Cb 0.27 -0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 62.00 2spc h SER 16 CO -0.01 0.79 0.45 -0.25 -0.53 0.00 0.00 176.83 177.28 2spc h TRP 17 N 0.58 1.23 -0.90 2.24 -0.00 -1.01 -1.38 115.95 116.71 2spc h TRP 17 Ca 0.13 -0.04 0.00 0.00 -0.00 0.00 0.00 58.89 58.98 2spc h TRP 17 Cb 0.40 -0.39 -0.04 0.00 -0.00 0.00 0.00 29.16 29.12 2spc h TRP 17 CO 0.03 0.87 0.57 0.52 -0.00 0.00 0.00 178.44 180.42 2spc h MET 18 N 1.23 1.20 -0.70 2.65 2.86 -0.75 -2.33 114.93 119.09 2spc h MET 18 Ca 0.30 -0.09 -0.04 0.00 -2.06 0.00 0.00 59.70 57.81 2spc h MET 18 Cb 0.07 -0.26 -0.03 0.00 0.06 0.00 0.00 31.60 31.44 2spc h MET 18 CO -0.04 0.82 0.29 0.77 1.06 0.00 0.00 176.91 179.81 2spc h SER 19 N 1.23 0.95 -0.31 1.22 0.02 -0.18 -0.17 113.55 116.32 2spc h SER 19 Ca 0.33 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 2spc h SER 19 Cb -0.09 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.19 2spc h SER 19 CO -0.07 0.84 0.16 0.00 -1.14 0.00 0.00 176.83 176.62 2spc h ALA 20 N 1.30 0.39 -0.85 3.77 0.00 -0.91 -2.12 119.26 120.83 2spc h ALA 20 Ca 0.24 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2spc h ALA 20 Cb 0.18 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 2spc h ALA 20 CO -0.02 -0.06 0.53 -0.09 0.00 0.00 0.00 179.25 179.61 2spc h ARG 21 N 0.37 1.14 -0.48 0.00 9.65 -1.07 -0.88 114.38 123.11 2spc h ARG 21 Ca 0.11 -0.09 -0.03 0.00 -1.10 0.00 0.00 59.98 58.86 2spc h ARG 21 Cb 0.09 -0.25 -0.02 0.00 -1.39 0.00 0.00 29.97 28.40 2spc h ARG 21 CO -0.02 0.78 0.16 0.93 2.80 0.00 0.00 179.97 184.63 2spc h GLU 22 N 1.17 0.71 -0.44 0.20 4.39 -0.62 -1.70 114.58 118.29 2spc h GLU 22 Ca 0.31 -0.11 -0.11 0.00 0.34 0.00 0.00 59.36 59.79 2spc h GLU 22 Cb -0.08 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.43 2spc h GLU 22 CO -0.06 0.61 -0.15 0.00 -1.16 0.00 0.00 179.01 178.25 2spc h ALA 23 N 1.48 0.61 -0.56 3.43 0.00 -0.55 -2.97 119.26 120.70 2spc h ALA 23 Ca 0.16 -0.35 0.05 0.00 0.00 0.00 0.00 54.91 54.77 2spc h ALA 23 Cb 0.19 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.78 2spc h ALA 23 CO -0.01 0.54 0.29 0.35 0.00 0.00 0.00 179.25 180.42 2spc h PHE 24 N 0.71 0.53 -0.54 0.00 3.57 -0.99 -0.71 116.94 119.52 2spc h PHE 24 Ca 0.11 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.63 2spc h PHE 24 Cb 0.70 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.26 2spc h PHE 24 CO 0.05 0.25 0.36 -0.07 -2.23 0.00 0.00 178.31 176.67 2spc h LEU 25 N 0.55 0.62 -0.16 0.59 3.38 -1.26 -1.36 115.31 117.67 2spc h LEU 25 Ca 0.25 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 58.09 2spc h LEU 25 Cb 0.16 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2spc h LEU 25 CO -0.17 0.45 -0.35 -1.13 0.09 0.00 0.00 178.44 177.33 2spc h ASN 26 N 0.73 0.59 -0.63 -0.43 -1.24 -1.00 -1.87 115.58 111.73 2spc h ASN 26 Ca 0.20 -0.56 -0.00 0.00 0.71 0.00 0.00 56.30 56.64 2spc h ASN 26 Cb -0.08 -0.17 -0.03 0.00 0.73 0.00 0.00 38.32 38.77 2spc h ASN 26 CO -0.04 1.04 0.39 0.00 -1.29 0.00 0.00 177.43 177.53 2spc h ALA 27 N 0.56 0.80 -0.39 1.57 0.00 -0.92 -2.47 119.26 118.41 2spc h ALA 27 Ca 0.00 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 54.92 2spc h ALA 27 Cb 0.95 -0.25 -0.07 0.00 0.00 0.00 0.00 17.79 18.42 2spc h ALA 27 CO 0.08 0.26 -0.08 0.22 0.00 0.00 0.00 179.25 179.74 2spc h ASP 28 N 0.85 -0.32 0.25 0.00 3.58 -1.20 0.16 116.42 119.74 2spc h ASP 28 Ca 0.23 0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.79 2spc h ASP 28 Cb -0.04 0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.24 2spc h ASP 28 CO -0.04 -0.11 0.00 -2.24 -2.88 0.00 0.00 179.24 173.96 2spc h ASP 29 N 0.02 0.00 1.69 2.28 2.03 -0.90 3.73 116.42 125.27 2spc h ASP 29 Ca 0.19 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.49 2spc h ASP 29 Cb 0.28 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.78 2spc h ASP 29 CO -0.38 0.00 -0.20 0.44 -1.03 0.00 0.00 179.24 178.07 2spc h ASP 30 N 0.00 0.00 0.00 4.15 3.32 -0.27 -3.43 116.42 120.19 2spc h ASP 30 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2spc h ASP 30 Cb 0.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.68 2spc h ASP 30 CO 0.00 0.01 0.00 0.00 -1.72 0.00 0.00 179.24 177.53 2spc n ALA 31 N -2.05 2.62 -0.28 3.45 0.00 0.07 -5.12 120.51 119.19 2spc n ALA 31 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2spc n ALA 31 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 2spc n ALA 31 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2spc n ASN 32 N -2.79 -0.25 0.00 0.00 3.02 1.21 -4.89 115.26 111.56 2spc n ASN 32 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 2spc n ASN 32 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2spc n ASN 32 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2spc n ALA 33 N 4.10 0.00 -3.64 5.41 0.00 -1.26 -5.03 120.51 120.09 2spc n ALA 33 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2spc n ALA 33 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.38 2spc n ALA 33 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2spc s GLY 34 N 0.00 0.17 0.00 0.00 0.00 -1.26 -5.06 107.32 101.17 2spc s GLY 34 Ca 0.00 3.27 0.00 0.00 0.00 0.00 0.00 44.72 47.99 2spc s GLY 34 CO 0.00 2.36 0.00 0.61 0.00 0.00 0.00 173.10 176.07 2spc n GLY 35 N 2.89 0.00 3.76 0.20 0.00 -1.26 -4.33 105.19 106.45 2spc n GLY 35 Ca -0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.47 2spc n GLY 35 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2spc s ASN 36 N -0.58 7.14 0.11 1.61 3.84 -1.26 -4.99 114.94 120.81 2spc s ASN 36 Ca 0.00 1.36 -0.28 0.00 0.21 0.00 0.00 52.86 54.16 2spc s ASN 36 Cb 0.00 -2.43 -0.09 0.00 -0.55 0.00 0.00 41.25 38.18 2spc s ASN 36 CO 0.00 0.08 1.64 0.58 -2.79 0.00 0.00 177.10 176.61 2spc h VAL 37 N 4.01 0.41 -0.65 -5.21 2.07 -1.99 -0.58 116.25 114.32 2spc h VAL 37 Ca -0.45 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.21 2spc h VAL 37 Cb 1.20 0.41 -0.10 0.00 -1.52 0.00 0.00 31.29 31.28 2spc h VAL 37 CO 0.69 0.00 0.06 -0.08 0.02 0.00 0.00 177.57 178.26 2spc h GLU 38 N -0.50 0.16 -0.01 1.57 4.81 -1.95 -2.56 114.58 116.11 2spc h GLU 38 Ca 0.02 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2spc h GLU 38 Cb 0.51 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.86 2spc h GLU 38 CO -0.13 0.11 -0.25 0.00 -0.73 0.00 0.00 179.01 178.00 2spc n ALA 39 N -2.75 3.07 0.07 2.92 0.00 -1.15 -1.46 120.51 121.20 2spc n ALA 39 Ca 0.10 -0.41 -0.14 0.00 0.00 0.00 0.00 53.44 53.00 2spc n ALA 39 Cb 0.38 -1.13 -0.14 0.00 0.00 0.00 0.00 19.45 18.56 2spc n ALA 39 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2spc h LEU 40 N 1.25 0.29 -0.12 0.00 3.38 -0.74 -2.77 115.31 116.59 2spc h LEU 40 Ca 0.00 -0.36 -0.08 0.00 0.09 0.00 0.00 57.88 57.53 2spc h LEU 40 Cb 0.51 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.16 2spc h LEU 40 CO 0.00 1.30 -0.23 0.40 0.09 0.00 0.00 178.44 180.00 2spc h ILE 41 N 0.05 1.38 -0.76 1.22 2.04 -1.47 -1.34 117.51 118.63 2spc h ILE 41 Ca -0.17 -1.49 0.01 0.00 1.00 0.00 0.00 64.86 64.21 2spc h ILE 41 Cb 1.95 2.04 -0.04 0.00 -0.74 0.00 0.00 36.82 40.04 2spc h ILE 41 CO 0.16 0.44 0.50 0.50 0.00 0.00 0.00 178.15 179.75 2spc h LYS 42 N -0.04 0.97 -0.41 2.37 1.63 -1.31 -1.31 116.57 118.47 2spc h LYS 42 Ca 0.01 -0.06 -0.13 0.00 -0.85 0.00 0.00 60.65 59.62 2spc h LYS 42 Cb 0.81 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 32.21 2spc h LYS 42 CO 0.05 0.64 -0.25 -0.22 -3.45 0.00 0.00 179.45 176.22 2spc h LYS 43 N 1.00 0.90 -0.33 1.90 3.64 -1.48 -2.53 116.57 119.67 2spc h LYS 43 Ca 0.28 -0.42 0.05 0.00 -1.27 0.00 0.00 60.65 59.30 2spc h LYS 43 Cb -0.08 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.68 2spc h LYS 43 CO -0.07 1.07 0.05 1.25 -2.27 0.00 0.00 179.45 179.48 2spc h HIS 44 N 0.73 0.08 -0.22 1.91 2.76 -0.35 -1.08 115.15 118.98 2spc h HIS 44 Ca 0.09 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.25 2spc h HIS 44 Cb 0.83 0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.79 2spc h HIS 44 CO 0.06 -0.00 -0.00 1.05 -1.30 0.00 0.00 177.93 177.73 2spc h GLU 45 N 0.16 0.32 -0.60 5.26 4.11 -1.18 -1.90 114.58 120.74 2spc h GLU 45 Ca 0.16 -0.05 -0.05 0.00 0.07 0.00 0.00 59.36 59.48 2spc h GLU 45 Cb 0.18 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 2spc h GLU 45 CO -0.22 0.35 0.16 -0.44 0.07 0.00 0.00 179.01 178.93 2spc h ASP 46 N 0.31 0.89 -0.36 3.06 3.32 -0.82 -0.91 116.42 121.92 2spc h ASP 46 Ca 0.07 -0.22 -0.07 0.00 0.02 0.00 0.00 57.03 56.83 2spc h ASP 46 Cb 0.22 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2spc h ASP 46 CO 0.01 0.88 -0.04 -0.26 -1.72 0.00 0.00 179.24 178.10 2spc h PHE 47 N 0.86 0.73 -0.73 4.55 -1.00 -0.50 -0.59 116.94 120.27 2spc h PHE 47 Ca 0.19 -0.14 0.08 0.00 2.81 0.00 0.00 57.97 60.91 2spc h PHE 47 Cb 0.33 -0.18 -0.07 0.00 3.61 0.00 0.00 35.95 39.64 2spc h PHE 47 CO 0.02 0.79 0.40 -0.44 -1.61 0.00 0.00 178.31 177.47 2spc h ASP 48 N 0.46 0.57 -0.23 2.17 5.19 -1.32 0.33 116.42 123.59 2spc h ASP 48 Ca 0.10 0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.53 2spc h ASP 48 Cb 0.53 -0.06 -0.01 0.00 0.18 0.00 0.00 39.33 39.97 2spc h ASP 48 CO 0.03 0.34 0.09 0.11 -3.12 0.00 0.00 179.24 176.68 2spc h LYS 49 N 0.70 0.35 0.59 3.56 1.57 -0.96 0.05 116.57 122.42 2spc h LYS 49 Ca 0.35 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 59.04 2spc h LYS 49 Cb 0.29 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 2spc h LYS 49 CO -0.23 0.41 -0.36 0.00 -0.57 0.00 0.00 179.45 178.70 2spc h ALA 50 N 0.92 -0.91 -0.94 3.86 0.00 -0.05 -1.35 119.26 120.80 2spc h ALA 50 Ca 0.08 -0.18 0.16 0.00 0.00 0.00 0.00 54.91 54.96 2spc h ALA 50 Cb 0.19 0.44 -0.10 0.00 0.00 0.00 0.00 17.79 18.33 2spc h ALA 50 CO -0.01 -1.03 0.54 0.82 0.00 0.00 0.00 179.25 179.58 2spc h ILE 51 N -0.89 0.77 -0.20 0.00 2.04 -0.37 -0.68 117.51 118.17 2spc h ILE 51 Ca -0.07 -0.26 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 2spc h ILE 51 Cb 0.73 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 2spc h ILE 51 CO 0.07 0.14 0.02 -1.13 0.00 0.00 0.00 178.15 177.25 2spc h ASN 52 N 0.76 0.33 -0.87 1.72 -0.73 -0.55 -1.82 115.58 114.42 2spc h ASN 52 Ca 0.51 -0.28 -0.00 0.00 1.87 0.00 0.00 56.30 58.40 2spc h ASN 52 Cb 0.70 -0.09 -0.04 0.00 0.27 0.00 0.00 38.32 39.16 2spc h ASN 52 CO -0.35 0.53 0.53 1.23 -0.37 0.00 0.00 177.43 179.01 2spc h GLY 53 N 0.12 1.25 0.93 1.57 0.00 -0.61 -1.25 103.07 105.09 2spc h GLY 53 Ca 0.06 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 46.88 2spc h GLY 53 CO 0.01 0.50 0.06 0.45 0.00 0.00 0.00 176.54 177.55 2spc h HIS 54 N 1.19 0.16 -0.93 5.60 3.86 -1.01 -1.30 115.15 122.72 2spc h HIS 54 Ca 0.31 -0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.53 2spc h HIS 54 Cb -0.07 -0.05 -0.05 0.00 1.06 0.00 0.00 27.41 28.31 2spc h HIS 54 CO -0.00 0.19 0.62 0.93 0.86 0.00 0.00 177.93 180.52 2spc h GLU 55 N 0.08 1.20 -0.24 2.45 5.08 -0.92 -0.93 114.58 121.31 2spc h GLU 55 Ca 0.04 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.27 2spc h GLU 55 Cb 0.09 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 2spc h GLU 55 CO -0.01 0.80 -0.06 1.96 -1.00 0.00 0.00 179.01 180.70 2spc h GLN 56 N 1.24 0.46 -0.70 2.33 4.20 -1.06 -1.04 115.11 120.54 2spc h GLN 56 Ca 0.35 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.86 2spc h GLN 56 Cb -0.10 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.62 2spc h GLN 56 CO -0.09 0.70 0.36 -0.22 -0.67 0.00 0.00 178.83 178.91 2spc h LYS 57 N 0.20 0.99 -0.20 1.46 1.63 -0.82 -0.85 116.57 118.99 2spc h LYS 57 Ca 0.06 -0.13 0.02 0.00 -0.85 0.00 0.00 60.65 59.75 2spc h LYS 57 Cb 0.53 -0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 31.95 2spc h LYS 57 CO 0.02 0.76 0.06 0.82 -3.45 0.00 0.00 179.45 177.67 2spc h ILE 58 N 0.97 0.94 -0.58 2.00 5.03 -1.02 -2.03 117.51 122.82 2spc h ILE 58 Ca 0.24 -0.05 -0.04 0.00 -0.12 0.00 0.00 64.86 64.89 2spc h ILE 58 Cb 0.08 0.78 -0.03 0.00 -3.03 0.00 0.00 36.82 34.62 2spc h ILE 58 CO -0.04 0.03 0.20 0.00 -0.68 0.00 0.00 178.15 177.66 2spc h ALA 59 N 1.13 1.26 -0.34 1.87 0.00 -0.75 -1.40 119.26 121.01 2spc h ALA 59 Ca 0.09 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 2spc h ALA 59 Cb 0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2spc h ALA 59 CO -0.09 0.53 -0.09 0.00 0.00 0.00 0.00 179.25 179.60 2spc h ALA 60 N 1.37 1.21 -0.42 0.00 0.00 -0.61 -1.81 119.26 119.00 2spc h ALA 60 Ca 0.20 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 2spc h ALA 60 Cb 0.22 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2spc h ALA 60 CO -0.01 0.51 -0.17 -0.07 0.00 0.00 0.00 179.25 179.51 2spc h LEU 61 N 0.53 0.80 -1.70 0.00 3.38 -0.61 -1.53 115.31 116.19 2spc h LEU 61 Ca 0.10 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 2spc h LEU 61 Cb 0.48 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2spc h LEU 61 CO 0.03 0.97 -0.18 -0.61 0.09 0.00 0.00 178.44 178.74 2spc h GLN 62 N 0.71 0.00 -0.18 1.13 4.15 -0.96 0.00 115.11 119.96 2spc h GLN 62 Ca 0.11 0.00 -0.17 0.00 0.77 0.00 0.00 58.65 59.35 2spc h GLN 62 Cb 0.68 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.36 2spc h GLN 62 CO 0.05 0.18 -0.60 1.15 -1.93 0.00 0.00 178.83 177.69 2spc h THR 63 N 0.00 1.32 -0.27 2.39 2.02 -0.43 -2.03 112.91 115.90 2spc h THR 63 Ca -0.00 -1.85 -0.15 0.00 0.77 0.00 0.00 66.41 65.17 2spc h THR 63 Cb 0.37 1.82 -0.00 0.00 -1.74 0.00 0.00 68.15 68.60 2spc h THR 63 CO 0.02 0.58 -0.41 0.58 0.37 0.00 0.00 175.52 176.66 2spc h VAL 64 N 0.45 1.30 -0.52 3.16 2.07 -0.79 -2.56 116.25 119.35 2spc h VAL 64 Ca -0.00 -1.61 0.06 0.00 0.82 0.00 0.00 66.70 65.97 2spc h VAL 64 Cb 1.16 1.66 -0.05 0.00 -1.52 0.00 0.00 31.29 32.54 2spc h VAL 64 CO 0.11 0.52 0.24 0.00 0.02 0.00 0.00 177.57 178.46 2spc h ALA 65 N 0.67 0.67 -0.77 1.67 0.00 -0.95 -1.58 119.26 118.97 2spc h ALA 65 Ca 0.03 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.00 2spc h ALA 65 Cb 1.01 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.73 2spc h ALA 65 CO 0.10 -0.13 0.51 -0.44 0.00 0.00 0.00 179.25 179.29 2spc h ASP 66 N 0.46 0.83 -0.19 0.00 3.32 -1.32 -0.59 116.42 118.92 2spc h ASP 66 Ca 0.24 -0.01 -0.15 0.00 0.02 0.00 0.00 57.03 57.13 2spc h ASP 66 Cb 0.19 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2spc h ASP 66 CO -0.20 0.57 -0.45 1.56 -1.72 0.00 0.00 179.24 179.01 2spc h GLN 67 N 0.96 0.64 -0.35 3.56 4.20 -0.89 -1.85 115.11 121.38 2spc h GLN 67 Ca 0.30 -0.44 -0.07 0.00 0.06 0.00 0.00 58.65 58.50 2spc h GLN 67 Cb 0.01 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 2spc h GLN 67 CO -0.08 1.06 -0.06 -0.07 -0.67 0.00 0.00 178.83 179.00 2spc h LEU 68 N 0.32 0.66 -0.64 1.46 3.38 -1.01 -0.81 115.31 118.67 2spc h LEU 68 Ca -0.00 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.59 2spc h LEU 68 Cb 1.06 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.60 2spc h LEU 68 CO 0.10 0.86 0.30 0.40 0.09 0.00 0.00 178.44 180.18 2spc h ILE 69 N 0.45 1.22 -0.54 1.22 2.04 -1.16 -1.87 117.51 118.88 2spc h ILE 69 Ca 0.09 -0.64 -0.04 0.00 1.00 0.00 0.00 64.86 65.27 2spc h ILE 69 Cb 0.56 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 2spc h ILE 69 CO 0.03 0.26 0.18 0.00 0.00 0.00 0.00 178.15 178.62 2spc h ALA 70 N 1.13 1.29 -0.35 1.87 0.00 -1.16 0.93 119.26 122.97 2spc h ALA 70 Ca 0.22 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 2spc h ALA 70 Cb 0.14 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2spc h ALA 70 CO -0.03 0.51 -0.11 1.96 0.00 0.00 0.00 179.25 181.59 2spc h GLN 71 N 0.79 0.69 -0.48 0.00 4.20 -0.79 -1.02 115.11 118.50 2spc h GLN 71 Ca 0.18 -0.28 -0.01 0.00 0.06 0.00 0.00 58.65 58.60 2spc h GLN 71 Cb 0.22 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.94 2spc h GLN 71 CO -0.01 0.87 0.25 -0.91 -0.67 0.00 0.00 178.83 178.35 2spc h ASN 72 N 0.48 0.62 -0.75 1.46 2.35 -0.98 -1.50 115.58 117.26 2spc h ASN 72 Ca 0.09 -0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.71 2spc h ASN 72 Cb 0.62 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.80 2spc h ASN 72 CO 0.04 0.55 0.40 0.45 -1.65 0.00 0.00 177.43 177.23 2spc h HIS 73 N 0.64 1.03 -0.60 1.19 3.86 -0.70 -1.00 115.15 119.57 2spc h HIS 73 Ca 0.17 -0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.31 2spc h HIS 73 Cb 0.09 -0.33 -0.03 0.00 1.06 0.00 0.00 27.41 28.20 2spc h HIS 73 CO -0.01 0.73 0.21 -0.92 0.86 0.00 0.00 177.93 178.80 2spc h TYR 74 N 1.04 0.94 -0.16 2.45 3.20 -0.81 -1.26 116.97 122.37 2spc h TYR 74 Ca 0.26 -0.08 -0.03 0.00 3.14 0.00 0.00 58.73 62.02 2spc h TYR 74 Cb 0.04 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.03 2spc h TYR 74 CO 0.00 0.76 -0.00 0.00 -1.64 0.00 0.00 178.16 177.28 2spc h ALA 75 N 1.07 0.21 -0.75 1.82 0.00 -0.88 -2.19 119.26 118.54 2spc h ALA 75 Ca 0.20 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.95 2spc h ALA 75 Cb 0.25 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 2spc h ALA 75 CO -0.01 -0.09 0.46 0.77 0.00 0.00 0.00 179.25 180.39 2spc h SER 76 N 0.02 0.74 -0.82 0.00 0.02 -1.15 -1.30 113.55 111.07 2spc h SER 76 Ca 0.04 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.97 2spc h SER 76 Cb 0.38 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.73 2spc h SER 76 CO 0.01 0.50 0.39 0.78 -1.14 0.00 0.00 176.83 177.37 2spc h ASN 77 N 0.88 1.07 -0.14 3.07 2.35 -1.10 -0.70 115.58 121.02 2spc h ASN 77 Ca 0.31 -0.14 -0.02 0.00 -0.55 0.00 0.00 56.30 55.91 2spc h ASN 77 Cb 0.08 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.17 2spc h ASN 77 CO -0.14 0.91 -0.00 0.25 -1.65 0.00 0.00 177.43 176.80 2spc h LEU 78 N 1.16 0.24 -0.06 1.61 5.85 -0.93 -1.20 115.31 121.97 2spc h LEU 78 Ca 0.28 -0.32 0.04 0.00 0.84 0.00 0.00 57.88 58.73 2spc h LEU 78 Cb 0.12 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 2spc h LEU 78 CO -0.04 0.50 -0.26 0.58 -0.34 0.00 0.00 178.44 178.89 2spc h VAL 79 N -0.03 0.41 -0.45 1.05 2.07 -1.06 -0.84 116.25 117.41 2spc h VAL 79 Ca 0.04 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.49 2spc h VAL 79 Cb 0.38 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 2spc h VAL 79 CO 0.01 0.00 0.01 -0.78 0.02 0.00 0.00 177.57 176.83 2spc h ASP 80 N -0.36 0.76 -0.51 0.57 3.58 -1.16 -1.21 116.42 118.09 2spc h ASP 80 Ca 0.08 -0.30 -0.11 0.00 0.42 0.00 0.00 57.03 57.13 2spc h ASP 80 Cb 0.48 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.30 2spc h ASP 80 CO -0.27 0.87 -0.08 -0.08 -2.88 0.00 0.00 179.24 176.80 2spc h GLU 81 N 0.63 0.99 -0.40 0.28 4.57 -1.07 -1.29 114.58 118.29 2spc h GLU 81 Ca 0.13 -0.35 -0.01 0.00 -1.18 0.00 0.00 59.36 57.96 2spc h GLU 81 Cb 0.48 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.97 2spc h GLU 81 CO 0.02 1.02 0.23 -0.22 -1.18 0.00 0.00 179.01 178.88 2spc h LYS 82 N 0.89 0.56 -0.34 1.92 1.63 -0.96 -1.92 116.57 118.34 2spc h LYS 82 Ca 0.15 -0.06 0.06 0.00 -0.85 0.00 0.00 60.65 59.94 2spc h LYS 82 Cb 0.63 -0.11 -0.05 0.00 -0.60 0.00 0.00 32.23 32.10 2spc h LYS 82 CO 0.04 0.44 0.01 -0.09 -3.45 0.00 0.00 179.45 176.40 2spc h ARG 83 N 0.52 0.11 -0.85 1.90 1.12 -0.77 -0.89 114.38 115.52 2spc h ARG 83 Ca 0.14 -0.01 0.02 0.00 -1.11 0.00 0.00 59.98 59.02 2spc h ARG 83 Cb 0.04 -0.02 -0.05 0.00 -0.01 0.00 0.00 29.97 29.93 2spc h ARG 83 CO -0.02 0.07 0.56 0.87 -3.11 0.00 0.00 179.97 178.34 2spc h LYS 84 N 0.11 1.09 -0.56 0.20 1.57 -0.97 -0.28 116.57 117.74 2spc h LYS 84 Ca 0.17 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 2spc h LYS 84 Cb 0.22 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 2spc h LYS 84 CO -0.27 0.72 0.08 1.96 -0.57 0.00 0.00 179.45 181.37 2spc h GLN 85 N 1.13 0.93 -0.15 3.15 4.20 -0.74 -1.25 115.11 122.38 2spc h GLN 85 Ca 0.32 -0.26 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 2spc h GLN 85 Cb -0.08 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.59 2spc h GLN 85 CO -0.09 0.90 0.07 0.28 -0.67 0.00 0.00 178.83 179.32 2spc h VAL 86 N 0.82 1.13 -0.80 -0.54 2.07 -0.94 -2.06 116.25 115.93 2spc h VAL 86 Ca 0.17 -0.39 0.03 0.00 0.82 0.00 0.00 66.70 67.33 2spc h VAL 86 Cb 0.43 1.12 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 2spc h VAL 86 CO 0.01 0.12 0.52 -0.07 0.02 0.00 0.00 177.57 178.17 2spc h LEU 87 N 0.10 0.86 -0.92 2.57 3.38 -0.95 -0.51 115.31 119.85 2spc h LEU 87 Ca 0.05 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 2spc h LEU 87 Cb 0.13 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2spc h LEU 87 CO -0.01 0.60 -0.43 -0.08 0.09 0.00 0.00 178.44 178.61 2spc h GLU 88 N 1.01 0.24 -0.01 1.13 4.57 -1.14 -1.03 114.58 119.35 2spc h GLU 88 Ca 0.32 -0.12 -0.13 0.00 -1.18 0.00 0.00 59.36 58.25 2spc h GLU 88 Cb -0.01 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 2spc h GLU 88 CO -0.11 0.63 -0.62 0.00 -1.18 0.00 0.00 179.01 177.73 2spc h ARG 89 N 0.20 0.04 -0.04 1.92 3.08 -0.89 -2.73 114.38 115.95 2spc h ARG 89 Ca 0.02 -0.03 -0.18 0.00 0.07 0.00 0.00 59.98 59.86 2spc h ARG 89 Cb 0.84 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 2spc h ARG 89 CO 0.07 0.65 -0.75 2.35 -1.07 0.00 0.00 179.97 181.21 2spc h TRP 90 N 0.03 0.37 -0.22 3.04 -0.00 -0.67 -1.92 115.95 116.58 2spc h TRP 90 Ca -0.01 -0.17 -0.04 0.00 -0.00 0.00 0.00 58.89 58.68 2spc h TRP 90 Cb 1.10 -0.05 -0.01 0.00 -0.00 0.00 0.00 29.16 30.19 2spc h TRP 90 CO 0.00 0.92 -0.03 -0.09 -0.00 0.00 0.00 178.44 179.24 2spc h ARG 91 N 0.18 0.32 0.17 2.65 2.43 -0.91 0.80 114.38 120.02 2spc h ARG 91 Ca -0.03 -0.06 -0.31 0.00 -0.81 0.00 0.00 59.98 58.77 2spc h ARG 91 Cb 1.32 -0.05 0.01 0.00 -0.42 0.00 0.00 29.97 30.83 2spc h ARG 91 CO 0.12 0.38 -1.46 1.25 -1.51 0.00 0.00 179.97 178.74 2spc h HIS 92 N 0.31 0.64 0.47 2.20 2.76 -1.36 -2.72 115.15 117.45 2spc h HIS 92 Ca 0.07 -0.47 -0.02 0.00 -2.20 0.00 0.00 60.37 57.76 2spc h HIS 92 Cb 0.26 -0.03 -0.00 0.00 1.55 0.00 0.00 27.41 29.19 2spc h HIS 92 CO 0.01 1.44 -0.32 1.25 -1.30 0.00 0.00 177.93 179.01 2spc h LEU 93 N 0.10 -0.82 -0.99 0.26 5.85 -1.03 -2.69 115.31 116.00 2spc h LEU 93 Ca -0.23 0.05 0.36 0.00 0.84 0.00 0.00 57.88 58.90 2spc h LEU 93 Cb 2.06 0.24 -0.17 0.00 0.37 0.00 0.00 40.66 43.16 2spc h LEU 93 CO 0.21 -0.47 0.44 0.50 -0.34 0.00 0.00 178.44 178.78 2spc h LYS 94 N -0.75 0.10 -0.90 1.25 3.64 -0.96 0.61 116.57 119.56 2spc h LYS 94 Ca -0.06 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.29 2spc h LYS 94 Cb 0.61 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.36 2spc h LYS 94 CO 0.05 0.06 0.49 0.93 -2.27 0.00 0.00 179.45 178.71 2spc h GLU 95 N 0.10 1.25 0.57 1.90 5.08 -1.15 -2.69 114.58 119.64 2spc h GLU 95 Ca 0.76 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.94 2spc h GLU 95 Cb 1.86 -0.24 0.01 0.00 0.50 0.00 0.00 28.75 30.87 2spc h GLU 95 CO -0.74 0.92 -0.28 0.78 -1.00 0.00 0.00 179.01 178.69 2spc h GLY 96 N 1.26 -0.80 -0.67 -3.84 0.00 0.41 -2.46 103.07 96.95 2spc h GLY 96 Ca 0.31 0.30 0.06 0.00 0.00 0.00 0.00 47.33 48.00 2spc h GLY 96 CO -0.05 -0.29 -0.40 1.04 0.00 0.00 0.00 176.54 176.84 2spc n LEU 97 N -5.31 -0.71 0.01 3.11 4.77 -0.69 -0.62 117.00 117.55 2spc n LEU 97 Ca -0.11 1.36 -0.10 0.00 -0.03 0.00 0.00 56.01 57.13 2spc n LEU 97 Cb 0.33 -0.24 -0.05 0.00 -2.33 0.00 0.00 43.42 41.14 2spc n LEU 97 CO 0.28 -1.06 0.83 0.40 -1.33 0.00 0.00 177.39 176.51 2spc h ILE 98 N 0.00 0.82 0.32 -0.08 2.04 -1.56 -0.81 117.51 118.25 2spc h ILE 98 Ca 0.11 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.96 2spc h ILE 98 Cb 0.28 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 2spc h ILE 98 CO -0.63 0.00 -0.24 -0.08 0.00 0.00 0.00 178.15 177.20 2spc h GLU 99 N -0.06 -0.54 -0.63 2.37 4.57 -0.84 -1.00 114.58 118.45 2spc h GLU 99 Ca 0.05 0.04 0.13 0.00 -1.18 0.00 0.00 59.36 58.40 2spc h GLU 99 Cb 0.14 0.12 -0.04 0.00 -0.16 0.00 0.00 28.75 28.82 2spc h GLU 99 CO -0.12 -0.36 0.43 0.87 -1.18 0.00 0.00 179.01 178.64 2spc h LYS 100 N -0.56 0.27 0.00 1.92 1.79 -0.78 0.41 116.57 119.63 2spc h LYS 100 Ca -0.03 -0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 58.37 2spc h LYS 100 Cb 0.48 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.06 2spc h LYS 100 CO -0.00 0.18 -0.28 -0.09 -1.08 0.00 0.00 179.45 178.18 2spc h ARG 101 N 0.28 0.00 0.01 3.15 2.43 -0.30 -2.43 114.38 117.53 2spc h ARG 101 Ca 0.30 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.47 2spc h ARG 101 Cb 0.79 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 2spc h ARG 101 CO -0.07 0.28 -0.01 0.77 -1.51 0.00 0.00 179.97 179.44 2spc h SER 102 N 0.00 -0.02 0.00 -3.80 0.02 0.96 -3.31 113.55 107.40 2spc h SER 102 Ca -0.00 -0.75 0.00 0.00 -0.84 0.00 0.00 61.79 60.19 2spc h SER 102 Cb 0.63 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.17 2spc h SER 102 CO 0.04 0.83 0.31 0.03 -1.14 0.00 0.00 176.83 176.89 2spc h ARG 103 N -0.95 0.00 -0.54 3.45 3.08 -0.57 -2.38 114.38 116.46 2spc h ARG 103 Ca -0.00 0.00 0.16 0.00 0.07 0.00 0.00 59.98 60.21 2spc h ARG 103 Cb 0.77 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.80 2spc h ARG 103 CO 0.00 0.00 0.77 -0.07 -1.07 0.00 0.00 179.97 179.60 2spc h LEU 104 N 0.00 0.00 0.00 3.04 4.07 -1.53 -3.42 115.31 117.47 2spc h LEU 104 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 2spc h LEU 104 Cb 0.61 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.35 2spc h LEU 104 CO 0.00 0.00 0.00 0.61 -1.08 0.00 0.00 178.44 177.97 2spc n GLY 105 N -1.54 3.55 0.00 0.83 0.00 -0.90 -5.15 105.19 101.99 2spc n GLY 105 Ca 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2spc n GLY 105 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41