#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k54 n ASN 2 N 0.00 4.01 0.04 3.17 3.02 -1.26 -4.67 115.26 119.57 2k54 n ASN 2 Ca 0.00 -3.45 -0.08 0.00 -0.03 0.00 0.00 54.58 51.02 2k54 n ASN 2 Cb 0.00 -0.76 0.07 0.00 -0.61 0.00 0.00 39.78 38.48 2k54 n ASN 2 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2k54 h SER 3 N 1.72 0.50 0.84 6.41 0.02 -2.00 -2.57 113.55 118.46 2k54 h SER 3 Ca 0.39 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 2k54 h SER 3 Cb 2.41 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 64.80 2k54 h SER 3 CO 0.81 0.98 0.00 -1.84 -1.14 0.00 0.00 176.83 175.64 2k54 n GLU 4 N -3.92 0.19 -0.01 3.45 0.00 -1.26 -2.42 120.64 116.68 2k54 n GLU 4 Ca -0.03 0.38 -0.05 0.00 0.00 0.00 0.00 57.16 57.45 2k54 n GLU 4 Cb 0.63 -1.84 -0.12 0.00 0.00 0.00 0.00 31.44 30.11 2k54 n GLU 4 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 2k54 n ILE 5 N -2.19 1.44 0.10 3.84 2.08 -1.00 -3.99 119.36 119.65 2k54 n ILE 5 Ca 0.03 -0.76 -0.02 0.00 0.56 0.00 0.00 62.75 62.56 2k54 n ILE 5 Cb 0.26 -0.90 0.22 0.00 -0.75 0.00 0.00 39.64 38.47 2k54 n ILE 5 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 2k54 h GLU 6 N 0.00 0.20 0.19 0.38 4.39 -1.19 -3.32 114.58 115.24 2k54 h GLU 6 Ca -0.25 -0.10 -0.01 0.00 0.34 0.00 0.00 59.36 59.34 2k54 h GLU 6 Cb 1.87 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.52 2k54 h GLU 6 CO 0.06 0.61 -0.09 -0.07 -1.16 0.00 0.00 179.01 178.36 2k54 h LEU 7 N 0.17 -0.22 0.11 1.33 3.38 -1.63 -2.37 115.31 116.09 2k54 h LEU 7 Ca 0.01 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2k54 h LEU 7 Cb 0.84 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.65 2k54 h LEU 7 CO 0.07 -0.07 -0.05 1.55 0.09 0.00 0.00 178.44 180.02 2k54 h PRO 8 N -0.36 -0.14 -0.14 1.13 0.13 -1.75 -2.75 132.00 128.11 2k54 h PRO 8 Ca -0.03 0.01 -0.09 0.00 -0.87 0.00 0.00 66.00 65.02 2k54 h PRO 8 Cb 0.28 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.43 2k54 h PRO 8 CO 0.04 -0.08 -0.33 -0.39 -0.23 0.00 0.00 178.00 177.01 2k54 h VAL 9 N -0.17 1.28 0.02 1.56 -1.51 -1.65 -0.56 116.25 115.23 2k54 h VAL 9 Ca -0.02 -1.34 -0.00 0.00 -1.23 0.00 0.00 66.70 64.11 2k54 h VAL 9 Cb 0.13 1.54 0.00 0.00 -2.13 0.00 0.00 31.29 30.83 2k54 h VAL 9 CO 0.02 0.41 -0.01 -0.61 -1.23 0.00 0.00 177.57 176.15 2k54 h GLN 10 N 0.24 -0.03 -0.02 5.19 5.75 -1.49 -2.95 115.11 121.80 2k54 h GLN 10 Ca 0.03 0.00 -0.12 0.00 -0.15 0.00 0.00 58.65 58.41 2k54 h GLN 10 Cb 0.71 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.25 2k54 h GLN 10 CO 0.05 0.60 -0.55 0.87 -2.65 0.00 0.00 178.83 177.16 2k54 h LYS 11 N -0.70 0.06 -0.38 1.69 1.79 -1.37 -1.66 116.57 115.99 2k54 h LYS 11 Ca -0.00 -0.04 -0.16 0.00 -2.18 0.00 0.00 60.65 58.28 2k54 h LYS 11 Cb 0.65 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.29 2k54 h LYS 11 CO 0.01 0.59 -0.37 0.37 -1.08 0.00 0.00 179.45 178.96 2k54 h GLN 12 N 0.04 0.92 0.16 3.15 -0.00 -1.22 -1.96 115.11 116.20 2k54 h GLN 12 Ca -0.00 -0.47 -0.00 0.00 -0.00 0.00 0.00 58.65 58.17 2k54 h GLN 12 Cb 0.98 0.01 -0.01 0.00 0.00 0.00 0.00 27.48 28.46 2k54 h GLN 12 CO 0.07 1.13 -0.12 1.25 0.00 0.00 0.00 178.83 181.16 2k54 h LEU 13 N 0.75 -0.32 -2.03 -2.39 7.12 -1.32 -0.78 115.31 116.35 2k54 h LEU 13 Ca 0.06 0.03 0.07 0.00 0.13 0.00 0.00 57.88 58.17 2k54 h LEU 13 Cb 0.96 0.10 -0.01 0.00 -0.53 0.00 0.00 40.66 41.18 2k54 h LEU 13 CO 0.09 -0.20 0.18 -0.33 -0.13 0.00 0.00 178.44 178.06 2k54 h GLU 14 N -0.29 0.00 0.04 1.25 5.08 -1.19 0.35 114.58 119.80 2k54 h GLU 14 Ca -0.01 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.13 2k54 h GLU 14 Cb 0.26 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 2k54 h GLU 14 CO -0.01 0.00 -1.05 0.00 -1.00 0.00 0.00 179.01 176.96 2k54 h ALA 15 N 1.87 0.31 0.11 3.43 0.00 -1.11 -3.24 119.26 120.63 2k54 h ALA 15 Ca 0.12 -0.88 -0.01 0.00 0.00 0.00 0.00 54.91 54.14 2k54 h ALA 15 Cb 0.48 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2k54 h ALA 15 CO -0.00 1.13 -0.05 -0.92 0.00 0.00 0.00 179.25 179.41 2k54 h TYR 16 N 0.03 -0.14 0.00 0.00 3.20 0.60 -0.38 116.97 120.27 2k54 h TYR 16 Ca -0.05 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.80 2k54 h TYR 16 Cb 1.78 0.05 -0.00 0.00 1.54 0.00 0.00 36.73 40.10 2k54 h TYR 16 CO 0.02 0.04 -0.07 -2.95 -1.64 0.00 0.00 178.16 173.56 2k54 h ASN 17 N -0.30 0.00 -0.05 -2.11 7.08 -1.72 -3.13 115.58 115.35 2k54 h ASN 17 Ca -0.02 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.20 2k54 h ASN 17 Cb 0.24 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.48 2k54 h ASN 17 CO 0.03 0.07 0.00 0.00 -2.08 0.00 0.00 177.43 175.45 2k54 n ALA 18 N -2.12 2.58 -1.75 4.14 0.00 -1.02 -4.88 120.51 117.46 2k54 n ALA 18 Ca 0.02 -0.41 -0.18 0.00 0.00 0.00 0.00 53.44 52.87 2k54 n ALA 18 Cb 0.47 -1.21 -0.06 0.00 0.00 0.00 0.00 19.45 18.65 2k54 n ALA 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2k54 n ARG 19 N -0.02 -1.30 -3.23 0.00 5.12 -0.85 -4.99 116.66 111.40 2k54 n ARG 19 Ca 0.19 1.06 -0.39 0.00 -1.93 0.00 0.00 57.85 56.78 2k54 n ARG 19 Cb 0.30 -5.39 -0.06 0.00 -1.16 0.00 0.00 32.46 26.15 2k54 n ARG 19 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2k54 s ASP 20 N -2.64 6.84 -0.12 0.55 -1.08 -0.21 -4.97 116.67 115.04 2k54 s ASP 20 Ca 0.00 1.00 0.15 0.00 -0.52 0.00 0.00 52.55 53.18 2k54 s ASP 20 Cb 0.00 -2.34 -0.22 0.00 -1.46 0.00 0.00 42.92 38.91 2k54 s ASP 20 CO 0.00 0.01 0.14 -0.38 0.52 0.00 0.00 175.17 175.46 2k54 n ILE 21 N 3.37 0.82 -0.03 4.11 2.08 -1.26 -4.06 119.36 124.39 2k54 n ILE 21 Ca -0.06 -0.61 -0.11 0.00 0.56 0.00 0.00 62.75 62.53 2k54 n ILE 21 Cb 0.51 -0.40 -0.05 0.00 -0.75 0.00 0.00 39.64 38.96 2k54 n ILE 21 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 2k54 h ASP 22 N 0.00 0.19 0.70 4.38 5.19 -1.97 0.57 116.42 125.49 2k54 h ASP 22 Ca -0.33 -0.07 -0.26 0.00 -0.62 0.00 0.00 57.03 55.76 2k54 h ASP 22 Cb 1.69 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 41.15 2k54 h ASP 22 CO 0.02 0.20 -1.21 0.00 -3.12 0.00 0.00 179.24 175.12 2k54 h ALA 23 N 1.00 0.18 -0.01 3.45 0.00 -1.94 -0.62 119.26 121.32 2k54 h ALA 23 Ca 0.05 -0.92 0.00 0.00 0.00 0.00 0.00 54.91 54.05 2k54 h ALA 23 Cb 0.05 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2k54 h ALA 23 CO -0.01 1.06 0.01 0.35 0.00 0.00 0.00 179.25 180.66 2k54 h PHE 24 N 0.06 0.00 0.00 0.00 3.57 -1.66 -2.94 116.94 115.96 2k54 h PHE 24 Ca -0.11 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.39 2k54 h PHE 24 Cb 1.93 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.67 2k54 h PHE 24 CO 0.05 0.00 0.00 -1.33 -2.23 0.00 0.00 178.31 174.80 2k54 n MET 25 N -3.76 -0.74 -0.12 1.11 2.81 0.17 -4.75 117.12 111.83 2k54 n MET 25 Ca -0.03 -0.55 -0.13 0.00 -1.81 0.00 0.00 57.70 55.19 2k54 n MET 25 Cb 0.09 -0.99 -0.02 0.00 -0.71 0.00 0.00 33.22 31.59 2k54 n MET 25 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2k54 h ALA 26 N 0.00 0.55 -0.01 3.04 0.00 -0.91 -3.18 119.26 118.75 2k54 h ALA 26 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2k54 h ALA 26 Cb 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2k54 h ALA 26 CO 0.00 0.57 -0.00 0.91 0.00 0.00 0.00 179.25 180.73 2k54 n TRP 27 N -4.17 0.00 -3.40 0.00 7.02 -1.26 -4.87 117.44 110.76 2k54 n TRP 27 Ca -0.02 0.00 -0.36 0.00 -1.02 0.00 0.00 57.50 56.10 2k54 n TRP 27 Cb 0.48 -0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.31 2k54 n TRP 27 CO 0.00 0.00 0.00 -1.58 -2.02 0.00 0.00 177.69 174.09 2k54 s TRP 28 N -2.00 3.66 0.50 -5.99 0.52 -1.20 -0.79 118.94 113.64 2k54 s TRP 28 Ca 0.45 1.05 -0.21 0.00 0.02 0.00 0.00 56.10 57.40 2k54 s TRP 28 Cb 0.22 -2.35 -0.07 0.00 -1.15 0.00 0.00 33.47 30.12 2k54 s TRP 28 CO 0.36 0.51 1.13 0.00 0.02 0.00 0.00 176.95 178.97 2k54 s ALA 29 N -1.32 2.83 0.48 0.98 0.00 -0.39 -4.75 121.76 119.59 2k54 s ALA 29 Ca 0.33 0.84 0.19 0.00 0.00 0.00 0.00 51.96 53.31 2k54 s ALA 29 Cb -0.16 -3.35 1.23 0.00 0.00 0.00 0.00 23.12 20.84 2k54 s ALA 29 CO 0.18 -0.66 2.07 0.22 0.00 0.00 0.00 175.76 177.57 2k54 h ASP 30 N 1.59 0.00 -0.52 0.00 3.58 -1.98 -1.83 116.42 117.26 2k54 h ASP 30 Ca -0.50 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.95 2k54 h ASP 30 Cb 1.25 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.30 2k54 h ASP 30 CO 0.58 0.11 0.00 -0.67 -2.88 0.00 0.00 179.24 176.39 2k54 n ASP 31 N -4.21 5.01 -4.68 2.28 2.03 -1.26 -2.01 116.55 113.71 2k54 n ASP 31 Ca -0.03 -2.74 -0.42 0.00 0.52 0.00 0.00 54.79 52.12 2k54 n ASP 31 Cb 0.19 -0.64 -0.03 0.00 -0.72 0.00 0.00 41.12 39.92 2k54 n ASP 31 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k54 s GLN 33 N 3.20 3.80 -0.05 0.00 -1.52 -0.60 -0.66 119.66 123.83 2k54 s GLN 33 Ca 0.79 0.31 -0.02 0.00 -1.95 0.00 0.00 55.36 54.49 2k54 s GLN 33 Cb -0.42 -2.58 0.03 0.00 -0.22 0.00 0.00 33.01 29.82 2k54 s GLN 33 CO 0.35 0.23 0.05 -0.47 -0.25 0.00 0.00 175.29 175.21 2k54 s TYR 34 N -1.96 0.16 0.18 0.91 5.04 0.55 -0.97 117.35 121.27 2k54 s TYR 34 Ca 0.48 0.15 0.10 0.00 -2.44 0.00 0.00 57.07 55.37 2k54 s TYR 34 Cb -0.11 -0.54 -0.04 0.00 0.35 0.00 0.00 41.96 41.62 2k54 s TYR 34 CO 0.23 -0.23 -0.21 0.71 -1.34 0.00 0.00 175.55 174.71 2k54 s TYR 35 N 2.14 2.08 0.18 4.97 1.51 -0.44 -1.28 117.35 126.50 2k54 s TYR 35 Ca 0.05 -0.41 0.06 0.00 -1.01 0.00 0.00 57.07 55.76 2k54 s TYR 35 Cb -0.12 -1.03 -0.05 0.00 -0.11 0.00 0.00 41.96 40.65 2k54 s TYR 35 CO -0.04 0.43 -0.12 0.00 -1.11 0.00 0.00 175.55 174.71 2k54 s ALA 36 N -1.86 1.78 0.35 3.71 0.00 -0.49 -1.99 121.76 123.26 2k54 s ALA 36 Ca 0.19 -1.59 -0.28 0.00 0.00 0.00 0.00 51.96 50.27 2k54 s ALA 36 Cb -0.07 -0.02 -0.11 0.00 0.00 0.00 0.00 23.12 22.93 2k54 s ALA 36 CO 0.08 -0.01 1.42 -0.59 0.00 0.00 0.00 175.76 176.66 2k54 s PHE 37 N -3.13 2.79 0.05 0.00 -0.71 -0.80 -1.73 117.98 114.45 2k54 s PHE 37 Ca 0.20 1.25 -0.18 0.00 -1.04 0.00 0.00 56.93 57.16 2k54 s PHE 37 Cb 0.01 -3.88 -0.14 0.00 -1.21 0.00 0.00 43.02 37.80 2k54 s PHE 37 CO 0.04 -2.55 1.33 -1.00 -1.34 0.00 0.00 175.22 171.70 2k54 h PRO 38 N 3.26 0.49 -0.84 1.99 0.13 -2.01 -3.43 132.00 131.59 2k54 h PRO 38 Ca -0.50 -0.30 -0.13 0.00 -0.87 0.00 0.00 66.00 64.21 2k54 h PRO 38 Cb 1.23 0.03 -0.16 0.00 0.13 0.00 0.00 31.00 32.23 2k54 h PRO 38 CO 0.65 0.89 -0.43 0.00 -0.23 0.00 0.00 178.00 178.89 2k54 n ALA 39 N -2.48 -2.18 -3.66 -0.56 0.00 -0.88 -5.11 120.51 105.65 2k54 n ALA 39 Ca -0.06 -0.87 -0.30 0.00 0.00 0.00 0.00 53.44 52.21 2k54 n ALA 39 Cb 0.46 -1.77 -0.17 0.00 0.00 0.00 0.00 19.45 17.97 2k54 n ALA 39 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2k54 s THR 40 N 0.87 1.69 -0.44 0.00 2.01 -0.71 -4.96 115.64 114.11 2k54 s THR 40 Ca 0.29 -0.76 -0.26 0.00 0.31 0.00 0.00 61.69 61.27 2k54 s THR 40 Cb 0.03 -1.53 0.02 0.00 0.01 0.00 0.00 72.50 71.04 2k54 s THR 40 CO -0.07 0.48 0.95 -0.22 -0.69 0.00 0.00 174.62 175.07 2k54 s LEU 41 N 0.93 3.96 -0.17 4.42 0.20 -1.26 -1.39 118.68 125.37 2k54 s LEU 41 Ca -0.07 0.25 -0.23 0.00 0.69 0.00 0.00 54.13 54.78 2k54 s LEU 41 Cb -0.15 -3.25 -0.20 0.00 -0.43 0.00 0.00 46.19 42.16 2k54 s LEU 41 CO -0.02 -1.03 0.40 -0.07 -0.29 0.00 0.00 176.35 175.34 2k54 h LEU 42 N 10.54 0.00 -7.32 -0.68 -0.00 -1.56 -3.48 115.31 112.80 2k54 h LEU 42 Ca -0.24 -0.64 -0.36 0.00 -0.00 0.00 0.00 57.88 56.64 2k54 h LEU 42 Cb 1.07 0.00 -0.39 0.00 -0.00 0.00 0.00 40.66 41.35 2k54 h LEU 42 CO 1.03 1.21 -0.74 0.00 -0.00 0.00 0.00 178.44 179.94 2k54 s ALA 43 N -2.34 0.20 -0.51 1.53 0.00 -1.21 -5.02 121.76 114.43 2k54 s ALA 43 Ca -0.23 0.21 0.02 0.00 0.00 0.00 0.00 51.96 51.97 2k54 s ALA 43 Cb 0.02 -0.60 0.49 0.00 0.00 0.00 0.00 23.12 23.03 2k54 s ALA 43 CO 0.58 -0.46 1.75 0.41 0.00 0.00 0.00 175.76 178.04 2k54 n GLY 44 N 5.22 5.70 0.00 0.00 0.00 -1.26 -0.33 105.19 114.52 2k54 n GLY 44 Ca -0.05 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.87 2k54 n GLY 44 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2k54 n ASN 45 N -0.93 0.00 0.26 1.61 0.23 0.17 -4.67 115.26 111.93 2k54 n ASN 45 Ca 0.54 0.00 0.11 0.00 -0.53 0.00 0.00 54.58 54.71 2k54 n ASN 45 Cb 0.92 0.00 0.70 0.00 -2.08 0.00 0.00 39.78 39.32 2k54 n ASN 45 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2k54 h ALA 46 N 0.00 1.39 -0.21 -2.53 0.00 -1.49 -2.80 119.26 113.62 2k54 h ALA 46 Ca 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2k54 h ALA 46 Cb 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2k54 h ALA 46 CO 0.00 0.15 0.07 0.00 0.00 0.00 0.00 179.25 179.47 2k54 h ALA 47 N 1.88 0.27 -0.26 0.00 0.00 -1.92 -1.22 119.26 118.02 2k54 h ALA 47 Ca -0.00 -0.13 -0.17 0.00 0.00 0.00 0.00 54.91 54.61 2k54 h ALA 47 Cb 0.30 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2k54 h ALA 47 CO 0.02 -0.11 -0.51 0.93 0.00 0.00 0.00 179.25 179.58 2k54 h GLU 48 N 0.17 0.72 -0.61 0.00 5.08 -1.91 -2.51 114.58 115.53 2k54 h GLU 48 Ca 0.07 -0.43 -0.01 0.00 -1.00 0.00 0.00 59.36 57.98 2k54 h GLU 48 Cb 0.22 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 2k54 h GLU 48 CO -0.00 1.06 0.33 0.82 -1.00 0.00 0.00 179.01 180.21 2k54 h ILE 49 N 0.57 1.20 0.63 3.13 2.04 -1.46 -2.03 117.51 121.59 2k54 h ILE 49 Ca 0.02 -0.51 -0.03 0.00 1.00 0.00 0.00 64.86 65.34 2k54 h ILE 49 Cb 1.08 0.42 0.01 0.00 -0.74 0.00 0.00 36.82 37.58 2k54 h ILE 49 CO 0.11 0.22 -0.30 -0.09 0.00 0.00 0.00 178.15 178.08 2k54 h ARG 50 N 0.83 -0.82 -0.38 2.37 2.43 -1.12 -2.16 114.38 115.53 2k54 h ARG 50 Ca 0.21 0.06 0.07 0.00 -0.81 0.00 0.00 59.98 59.51 2k54 h ARG 50 Cb 0.05 0.19 -0.06 0.00 -0.42 0.00 0.00 29.97 29.73 2k54 h ARG 50 CO -0.03 -0.54 -0.01 0.28 -1.51 0.00 0.00 179.97 178.15 2k54 h VAL 51 N -0.86 0.71 -0.59 0.20 2.07 -1.41 -0.16 116.25 116.22 2k54 h VAL 51 Ca -0.09 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.39 2k54 h VAL 51 Cb 0.65 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 2k54 h VAL 51 CO 0.14 0.02 0.32 -0.09 0.02 0.00 0.00 177.57 177.98 2k54 h ARG 52 N 0.09 0.80 0.00 1.57 2.43 -1.36 -2.18 114.38 115.74 2k54 h ARG 52 Ca 0.18 -0.08 -0.20 0.00 -0.81 0.00 0.00 59.98 59.08 2k54 h ARG 52 Cb 0.26 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 2k54 h ARG 52 CO -0.32 0.59 -0.87 0.45 -1.51 0.00 0.00 179.97 178.32 2k54 h HIS 53 N 0.81 0.28 -0.52 2.20 3.86 -0.63 -2.28 115.15 118.86 2k54 h HIS 53 Ca 0.21 -0.16 -0.05 0.00 -1.16 0.00 0.00 60.37 59.21 2k54 h HIS 53 Cb 0.02 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.44 2k54 h HIS 53 CO 0.00 0.96 0.12 0.82 0.86 0.00 0.00 177.93 180.70 2k54 h ILE 54 N 0.11 1.24 -0.10 2.45 2.04 -0.53 0.19 117.51 122.90 2k54 h ILE 54 Ca -0.04 -0.87 -0.03 0.00 1.00 0.00 0.00 64.86 64.92 2k54 h ILE 54 Cb 1.49 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 38.37 2k54 h ILE 54 CO 0.13 0.32 -0.09 -0.33 0.00 0.00 0.00 178.15 178.18 2k54 h GLU 55 N 0.74 0.15 0.00 2.37 5.08 -1.43 -1.68 114.58 119.81 2k54 h GLU 55 Ca 0.16 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2k54 h GLU 55 Cb 0.34 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.57 2k54 h GLU 55 CO 0.00 0.25 -0.30 -2.13 -1.00 0.00 0.00 179.01 175.84 2k54 n ARG 56 N -4.35 0.07 0.00 2.33 3.00 -0.76 -3.11 116.66 113.84 2k54 n ARG 56 Ca -0.01 0.03 0.14 0.00 -0.00 0.00 0.00 57.85 58.01 2k54 n ARG 56 Cb 0.21 -1.56 0.51 0.00 0.00 0.00 0.00 32.46 31.62 2k54 n ARG 56 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 2k54 n PHE 57 N -1.66 0.00 1.51 -0.14 3.01 0.59 -3.82 117.46 116.95 2k54 n PHE 57 Ca 0.06 0.00 0.15 0.00 1.01 0.00 0.00 57.45 58.66 2k54 n PHE 57 Cb 0.36 -0.02 0.71 0.00 -0.01 0.00 0.00 39.48 40.52 2k54 n PHE 57 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2k54 n LYS 58 N 0.06 0.69 -2.04 -1.08 4.76 -1.11 -4.83 118.16 114.60 2k54 n LYS 58 Ca 0.18 -0.15 -0.42 0.00 -2.87 0.00 0.00 58.31 55.05 2k54 n LYS 58 Cb 0.35 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 32.02 2k54 n LYS 58 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2k54 s GLU 59 N -2.41 4.19 0.52 1.97 0.41 -1.25 -4.92 118.70 117.21 2k54 s GLU 59 Ca 0.32 2.14 0.28 0.00 -0.41 0.00 0.00 54.97 57.30 2k54 s GLU 59 Cb 0.20 -3.96 1.42 0.00 -1.78 0.00 0.00 34.13 30.02 2k54 s GLU 59 CO 0.45 -0.83 2.05 -1.00 -0.49 0.00 0.00 175.26 175.44 2k54 h PRO 60 N 9.38 0.00 -0.28 0.39 0.13 -1.95 -2.67 132.00 137.00 2k54 h PRO 60 Ca -0.38 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.71 2k54 h PRO 60 Cb 1.17 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 2k54 h PRO 60 CO 0.95 0.12 -0.00 -0.25 -0.23 0.00 0.00 178.00 178.59 2k54 n ASP 61 N -3.57 3.59 -4.61 1.44 9.92 -1.26 -4.99 116.55 117.07 2k54 n ASP 61 Ca -0.02 -3.16 -0.43 0.00 -0.53 0.00 0.00 54.79 50.66 2k54 n ASP 61 Cb 0.26 -0.56 -0.03 0.00 -0.64 0.00 0.00 41.12 40.15 2k54 n ASP 61 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 2k54 s LEU 62 N -2.91 3.63 -0.01 0.64 2.96 -1.01 -4.51 118.68 117.47 2k54 s LEU 62 Ca 0.42 1.51 0.01 0.00 -0.22 0.00 0.00 54.13 55.85 2k54 s LEU 62 Cb 0.35 -3.53 0.01 0.00 0.50 0.00 0.00 46.19 43.53 2k54 s LEU 62 CO 0.07 -1.59 -0.01 -0.47 -1.32 0.00 0.00 176.35 173.03 2k54 s TYR 63 N 6.50 0.24 -0.17 5.38 5.04 -1.25 -4.96 117.35 128.12 2k54 s TYR 63 Ca 0.80 -0.02 -0.05 0.00 -2.44 0.00 0.00 57.07 55.37 2k54 s TYR 63 Cb -0.25 -0.23 -0.03 0.00 0.35 0.00 0.00 41.96 41.80 2k54 s TYR 63 CO 0.33 -0.05 -0.01 0.20 -1.34 0.00 0.00 175.55 174.68 2k54 s GLY 64 N 0.33 1.74 -0.32 8.97 0.00 -1.26 -1.54 107.32 115.23 2k54 s GLY 64 Ca -0.03 -0.87 0.01 0.00 0.00 0.00 0.00 44.72 43.83 2k54 s GLY 64 CO -0.01 0.05 0.08 1.85 0.00 0.00 0.00 173.10 175.08 2k54 s GLU 65 N 0.59 0.98 0.10 2.90 2.12 -1.13 -4.79 118.70 119.46 2k54 s GLU 65 Ca -0.01 -1.36 -0.29 0.00 0.36 0.00 0.00 54.97 53.67 2k54 s GLU 65 Cb -0.14 -2.42 -0.06 0.00 0.26 0.00 0.00 34.13 31.77 2k54 s GLU 65 CO 0.02 -0.97 0.91 -1.17 -0.54 0.00 0.00 175.26 173.51 2k54 s LEU 66 N 1.35 4.49 -0.17 2.70 0.20 -1.26 -0.79 118.68 125.20 2k54 s LEU 66 Ca 0.10 1.70 -0.09 0.00 0.69 0.00 0.00 54.13 56.53 2k54 s LEU 66 Cb -0.18 -3.49 -0.07 0.00 -0.43 0.00 0.00 46.19 42.02 2k54 s LEU 66 CO -0.19 -0.04 -0.23 0.18 -0.29 0.00 0.00 176.35 175.78 2k54 n LEU 67 N 2.76 1.30 -3.68 -0.68 4.77 -0.80 -4.98 117.00 115.69 2k54 n LEU 67 Ca 0.01 0.22 -0.09 0.00 -0.03 0.00 0.00 56.01 56.12 2k54 n LEU 67 Cb 0.49 -0.54 -0.10 0.00 -2.33 0.00 0.00 43.42 40.95 2k54 n LEU 67 CO 0.50 0.32 0.07 -0.89 -1.33 0.00 0.00 177.39 176.05 2k54 s THR 68 N -2.35 -0.29 -0.09 -5.08 2.01 -1.18 -5.08 115.64 103.59 2k54 s THR 68 Ca -0.25 0.12 0.04 0.00 0.31 0.00 0.00 61.69 61.91 2k54 s THR 68 Cb 0.09 -0.66 -0.01 0.00 0.01 0.00 0.00 72.50 71.93 2k54 s THR 68 CO 0.31 0.05 -0.21 0.00 -0.69 0.00 0.00 174.62 174.08 2k54 s ARG 69 N 1.92 2.88 -0.17 4.92 1.70 -1.26 -1.23 118.95 127.72 2k54 s ARG 69 Ca -0.06 -0.83 0.01 0.00 -0.47 0.00 0.00 55.73 54.37 2k54 s ARG 69 Cb -0.10 -2.33 0.01 0.00 -0.57 0.00 0.00 34.95 31.97 2k54 s ARG 69 CO -0.13 0.30 -0.19 0.14 -1.08 0.00 0.00 175.30 174.34 2k54 s VAL 70 N 0.05 2.26 -0.12 4.99 -7.23 -0.25 -4.98 120.40 115.11 2k54 s VAL 70 Ca -0.09 -0.89 -0.04 0.00 -1.81 0.00 0.00 61.98 59.15 2k54 s VAL 70 Cb -0.15 -1.94 -0.03 0.00 0.56 0.00 0.00 36.38 34.81 2k54 s VAL 70 CO 0.06 0.53 0.02 -0.51 -0.31 0.00 0.00 175.10 174.89 2k54 s ILE 71 N 1.07 4.50 -0.19 -0.62 2.07 -1.26 -1.18 121.20 125.59 2k54 s ILE 71 Ca -0.01 -0.16 -0.04 0.00 -1.41 0.00 0.00 60.65 59.03 2k54 s ILE 71 Cb -0.14 -2.94 0.09 0.00 0.13 0.00 0.00 42.46 39.60 2k54 s ILE 71 CO -0.07 0.57 0.25 0.54 -1.91 0.00 0.00 174.94 174.32 2k54 s VAL 72 N -0.50 -0.38 0.00 4.00 0.11 -0.64 -5.03 120.40 117.96 2k54 s VAL 72 Ca 0.09 0.01 0.00 0.00 -2.93 0.00 0.00 61.98 59.15 2k54 s VAL 72 Cb -0.12 -0.63 0.00 0.00 -1.53 0.00 0.00 36.38 34.11 2k54 s VAL 72 CO 0.02 -0.10 0.00 0.61 -3.33 0.00 0.00 175.10 172.30 2k54 n GLY 73 N 5.33 1.10 0.07 6.54 0.00 -1.26 -1.81 105.19 115.16 2k54 n GLY 73 Ca -0.05 0.33 0.05 0.00 0.00 0.00 0.00 46.02 46.34 2k54 n GLY 73 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2k54 n ASN 74 N 9.46 1.92 -3.90 1.61 6.94 -1.26 -4.82 115.26 125.21 2k54 n ASN 74 Ca 0.00 -2.48 -0.18 0.00 -0.02 0.00 0.00 54.58 51.90 2k54 n ASN 74 Cb 0.00 -0.22 -0.16 0.00 -2.36 0.00 0.00 39.78 37.04 2k54 n ASN 74 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2k54 s VAL 75 N -1.79 0.44 -0.00 3.53 0.11 -0.75 -0.73 120.40 121.21 2k54 s VAL 75 Ca 0.16 -0.12 0.08 0.00 -2.93 0.00 0.00 61.98 59.17 2k54 s VAL 75 Cb 0.14 -0.45 -0.02 0.00 -1.53 0.00 0.00 36.38 34.51 2k54 s VAL 75 CO 0.01 0.18 -0.25 -0.69 -3.33 0.00 0.00 175.10 171.03 2k54 s VAL 76 N 0.63 1.97 -0.48 2.04 1.01 -0.71 -1.62 120.40 123.24 2k54 s VAL 76 Ca -0.08 -1.13 -0.15 0.00 0.00 0.00 0.00 61.98 60.62 2k54 s VAL 76 Cb -0.11 -1.65 0.09 0.00 0.00 0.00 0.00 36.38 34.71 2k54 s VAL 76 CO -0.00 0.49 0.41 -0.63 0.00 0.00 0.00 175.10 175.37 2k54 s ILE 77 N -0.64 5.14 -0.50 2.22 1.01 -0.32 -1.14 121.20 126.97 2k54 s ILE 77 Ca 0.10 -1.20 -0.20 0.00 0.00 0.00 0.00 60.65 59.36 2k54 s ILE 77 Cb -0.10 -4.13 0.05 0.00 0.01 0.00 0.00 42.46 38.29 2k54 s ILE 77 CO -0.00 -0.64 0.65 1.51 0.00 0.00 0.00 174.94 176.45 2k54 s ASP 78 N 2.79 6.24 -0.42 3.58 -4.77 0.28 -1.09 116.67 123.28 2k54 s ASP 78 Ca 0.04 -0.79 -0.15 0.00 -3.30 0.00 0.00 52.55 48.35 2k54 s ASP 78 Cb -0.25 -2.30 0.03 0.00 -1.09 0.00 0.00 42.92 39.30 2k54 s ASP 78 CO 0.05 -0.89 0.31 -2.28 0.70 0.00 0.00 175.17 173.06 2k54 s HIS 79 N 2.74 3.24 0.43 2.11 2.46 -0.37 -2.02 115.29 123.89 2k54 s HIS 79 Ca 0.17 -0.64 0.07 0.00 0.47 0.00 0.00 55.06 55.13 2k54 s HIS 79 Cb -0.18 -2.67 -0.02 0.00 -0.13 0.00 0.00 32.58 29.58 2k54 s HIS 79 CO 0.13 -0.62 0.33 -1.21 -2.47 0.00 0.00 174.74 170.90 2k54 s GLU 80 N 1.67 2.41 -0.42 2.88 2.02 -0.86 -1.91 118.70 124.49 2k54 s GLU 80 Ca 0.05 -1.69 -0.07 0.00 0.02 0.00 0.00 54.97 53.28 2k54 s GLU 80 Cb -0.20 -2.23 0.10 0.00 0.10 0.00 0.00 34.13 31.90 2k54 s GLU 80 CO 0.09 -0.23 0.25 0.99 0.02 0.00 0.00 175.26 176.39 2k54 s THR 81 N -2.55 3.87 -0.50 3.63 2.01 0.03 -1.37 115.64 120.77 2k54 s THR 81 Ca 0.45 -1.71 -0.27 0.00 0.31 0.00 0.00 61.69 60.46 2k54 s THR 81 Cb -0.01 -3.50 0.03 0.00 0.01 0.00 0.00 72.50 69.03 2k54 s THR 81 CO 0.26 -0.62 1.07 -0.69 -0.69 0.00 0.00 174.62 173.95 2k54 s VAL 82 N 1.31 4.26 -0.10 3.82 1.01 0.87 -2.84 120.40 128.73 2k54 s VAL 82 Ca 0.05 0.95 -0.29 0.00 0.00 0.00 0.00 61.98 62.68 2k54 s VAL 82 Cb -0.24 -4.58 -0.04 0.00 0.00 0.00 0.00 36.38 31.52 2k54 s VAL 82 CO -0.01 -1.04 1.59 -0.89 0.00 0.00 0.00 175.10 174.76 2k54 s THR 83 N 4.32 3.70 0.00 3.92 2.01 -0.59 -1.00 115.64 128.00 2k54 s THR 83 Ca 0.42 0.84 0.00 0.00 0.31 0.00 0.00 61.69 63.26 2k54 s THR 83 Cb -0.08 -3.58 0.00 0.00 0.01 0.00 0.00 72.50 68.85 2k54 s THR 83 CO 0.28 -0.11 0.00 0.54 -0.69 0.00 0.00 174.62 174.64 2k54 n ARG 84 N 7.16 2.03 -3.98 4.92 5.12 -0.64 -3.93 116.66 127.34 2k54 n ARG 84 Ca 0.17 0.00 -0.32 0.00 -1.93 0.00 0.00 57.85 55.77 2k54 n ARG 84 Cb 0.43 0.00 -0.14 0.00 -1.16 0.00 0.00 32.46 31.59 2k54 n ARG 84 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 2k54 s ASN 85 N -0.85 4.80 -0.11 0.55 0.02 -1.26 -4.01 114.94 114.09 2k54 s ASN 85 Ca 0.00 -1.91 -0.00 0.00 -1.02 0.00 0.00 52.86 49.93 2k54 s ASN 85 Cb 0.00 -1.66 -0.02 0.00 0.02 0.00 0.00 41.25 39.59 2k54 s ASN 85 CO 0.00 -0.36 -0.10 -0.36 0.02 0.00 0.00 177.10 176.30 2k54 s PHE 86 N 1.01 2.87 -0.73 2.20 0.08 -0.92 -4.97 117.98 117.53 2k54 s PHE 86 Ca 0.05 -0.32 0.19 0.00 0.12 0.00 0.00 56.93 56.97 2k54 s PHE 86 Cb -0.20 -1.80 0.80 0.00 -0.57 0.00 0.00 43.02 41.25 2k54 s PHE 86 CO -0.06 0.03 1.59 -0.35 -0.10 0.00 0.00 175.22 176.32 2k54 n PRO 87 N 3.01 0.10 0.02 0.24 -0.04 -1.26 -2.18 135.00 134.88 2k54 n PRO 87 Ca -0.18 0.34 0.13 0.00 -0.04 0.00 0.00 63.50 63.76 2k54 n PRO 87 Cb 0.53 -1.69 0.47 0.00 -0.04 0.00 0.00 33.50 32.76 2k54 n PRO 87 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2k54 n GLU 88 N -1.88 0.05 0.00 0.54 0.00 -1.26 -5.00 120.64 113.09 2k54 n GLU 88 Ca 0.03 0.03 0.00 0.00 0.00 0.00 0.00 57.16 57.22 2k54 n GLU 88 Cb 0.20 -1.55 0.00 0.00 0.00 0.00 0.00 31.44 30.09 2k54 n GLU 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2k54 n GLY 89 N 1.47 -0.38 0.00 -1.84 0.00 -0.93 -5.02 105.19 98.49 2k54 n GLY 89 Ca 0.06 0.36 0.00 0.00 0.00 0.00 0.00 46.02 46.44 2k54 n GLY 89 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2k54 n LYS 90 N 0.00 0.00 0.00 1.61 3.00 -1.26 -4.46 118.16 117.05 2k54 n LYS 90 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2k54 n LYS 90 Cb 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 35.03 34.31 2k54 n LYS 90 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2k54 n GLY 91 N 1.16 1.97 3.56 3.14 0.00 -1.24 -2.16 105.19 111.62 2k54 n GLY 91 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2k54 n GLY 91 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k54 s GLU 92 N 0.00 3.55 -0.07 1.61 1.03 -1.00 -1.62 118.70 122.20 2k54 s GLU 92 Ca 0.00 0.03 -0.02 0.00 0.03 0.00 0.00 54.97 55.01 2k54 s GLU 92 Cb 0.00 -3.87 -0.03 0.00 -0.80 0.00 0.00 34.13 29.42 2k54 s GLU 92 CO 0.00 -0.95 0.02 0.14 -1.33 0.00 0.00 175.26 173.14 2k54 s VAL 93 N 3.07 4.40 -0.16 1.83 -7.23 -0.17 -3.56 120.40 118.58 2k54 s VAL 93 Ca 0.28 -0.28 -0.26 0.00 -1.81 0.00 0.00 61.98 59.91 2k54 s VAL 93 Cb -0.13 -2.88 -0.01 0.00 0.56 0.00 0.00 36.38 33.91 2k54 s VAL 93 CO 0.19 0.55 0.86 1.51 -0.31 0.00 0.00 175.10 177.90 2k54 s ASP 94 N -1.06 7.01 -0.09 4.85 -4.77 -1.24 -0.09 116.67 121.27 2k54 s ASP 94 Ca 0.15 1.24 0.02 0.00 -3.30 0.00 0.00 52.55 50.66 2k54 s ASP 94 Cb -0.11 -2.47 0.01 0.00 -1.09 0.00 0.00 42.92 39.26 2k54 s ASP 94 CO 0.04 -0.40 -0.15 -0.69 0.70 0.00 0.00 175.17 174.67 2k54 s VAL 95 N 2.10 1.42 -0.54 2.11 1.01 -0.47 -0.46 120.40 125.57 2k54 s VAL 95 Ca 0.40 -0.62 -0.18 0.00 0.00 0.00 0.00 61.98 61.58 2k54 s VAL 95 Cb -0.17 -1.29 0.09 0.00 0.00 0.00 0.00 36.38 35.01 2k54 s VAL 95 CO 0.13 0.42 0.63 0.00 0.00 0.00 0.00 175.10 176.28 2k54 s ALA 96 N 0.80 3.44 -0.30 5.51 0.00 -0.20 -2.02 121.76 128.98 2k54 s ALA 96 Ca -0.11 -2.06 -0.13 0.00 0.00 0.00 0.00 51.96 49.66 2k54 s ALA 96 Cb -0.16 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.53 2k54 s ALA 96 CO 0.02 -2.14 0.28 0.00 0.00 0.00 0.00 175.76 173.92 2k54 s ILE 98 N 1.89 3.46 -0.20 0.00 2.07 0.50 -0.56 121.20 128.37 2k54 s ILE 98 Ca 0.10 -1.56 -0.11 0.00 -1.41 0.00 0.00 60.65 57.67 2k54 s ILE 98 Cb -0.16 -3.13 -0.05 0.00 0.13 0.00 0.00 42.46 39.24 2k54 s ILE 98 CO 0.11 -0.39 0.17 -0.31 -1.91 0.00 0.00 174.94 172.61 2k54 s TYR 99 N 1.28 3.40 -0.35 3.50 2.02 -0.29 -1.13 117.35 125.77 2k54 s TYR 99 Ca 0.01 0.36 -0.15 0.00 -0.37 0.00 0.00 57.07 56.92 2k54 s TYR 99 Cb -0.21 -2.21 -0.01 0.00 -0.40 0.00 0.00 41.96 39.13 2k54 s TYR 99 CO -0.01 0.24 0.35 -2.00 -1.57 0.00 0.00 175.55 172.56 2k54 s GLU 100 N 0.52 3.47 -0.39 -0.62 2.12 0.44 -1.73 118.70 122.50 2k54 s GLU 100 Ca 0.09 -0.52 -0.14 0.00 0.36 0.00 0.00 54.97 54.76 2k54 s GLU 100 Cb -0.12 -3.83 0.01 0.00 0.26 0.00 0.00 34.13 30.45 2k54 s GLU 100 CO 0.00 -0.56 0.29 0.08 -0.54 0.00 0.00 175.26 174.53 2k54 s VAL 101 N 1.97 5.26 -0.12 3.70 1.01 0.09 -0.90 120.40 131.41 2k54 s VAL 101 Ca 0.10 -0.51 -0.00 0.00 0.00 0.00 0.00 61.98 61.57 2k54 s VAL 101 Cb -0.17 -3.87 -0.02 0.00 0.00 0.00 0.00 36.38 32.32 2k54 s VAL 101 CO 0.12 -0.22 -0.10 -0.70 0.00 0.00 0.00 175.10 174.20 2k54 s GLU 102 N 1.71 3.24 -1.48 2.72 2.12 0.12 -4.64 118.70 122.49 2k54 s GLU 102 Ca 0.06 -0.62 -0.00 0.00 0.36 0.00 0.00 54.97 54.76 2k54 s GLU 102 Cb -0.18 -2.66 0.00 0.00 0.26 0.00 0.00 34.13 31.54 2k54 s GLU 102 CO 0.10 0.35 0.03 0.09 -0.54 0.00 0.00 175.26 175.30 2k54 n ASN 103 N 3.15 -5.12 -0.26 -1.70 3.02 -1.26 -1.64 115.26 111.45 2k54 n ASN 103 Ca -0.18 -0.03 -0.03 0.00 -0.03 0.00 0.00 54.58 54.31 2k54 n ASN 103 Cb 0.53 -4.19 -0.01 0.00 -0.61 0.00 0.00 39.78 35.49 2k54 n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k54 n GLY 104 N -1.04 0.59 3.04 7.41 0.00 -1.26 -5.02 105.19 108.91 2k54 n GLY 104 Ca -0.20 -0.26 -0.23 0.00 0.00 0.00 0.00 46.02 45.33 2k54 n GLY 104 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k54 s ARG 105 N -1.57 1.32 -0.56 1.61 1.81 -0.65 -4.86 118.95 116.05 2k54 s ARG 105 Ca 0.00 -0.41 -0.26 0.00 -1.72 0.00 0.00 55.73 53.34 2k54 s ARG 105 Cb 0.00 -1.18 -0.05 0.00 -0.45 0.00 0.00 34.95 33.27 2k54 s ARG 105 CO 0.00 0.14 2.20 0.42 -0.68 0.00 0.00 175.30 177.37 2k54 s ILE 106 N 0.23 3.14 -0.19 1.52 1.01 0.03 0.15 121.20 127.10 2k54 s ILE 106 Ca -0.05 0.07 0.17 0.00 0.00 0.00 0.00 60.65 60.83 2k54 s ILE 106 Cb -0.11 -3.38 0.05 0.00 0.01 0.00 0.00 42.46 39.03 2k54 s ILE 106 CO 0.01 -0.37 1.31 0.00 0.00 0.00 0.00 174.94 175.90 2k54 h ALA 107 N 17.45 0.69 -2.66 9.38 0.00 -1.27 -1.01 119.26 141.84 2k54 h ALA 107 Ca -0.23 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.09 2k54 h ALA 107 Cb 1.21 0.01 -0.21 0.00 0.00 0.00 0.00 17.79 18.80 2k54 h ALA 107 CO 1.18 0.58 -0.35 0.15 0.00 0.00 0.00 179.25 180.80 2k54 s LYS 108 N -3.01 0.56 -0.08 0.00 1.02 -0.83 -1.56 119.74 115.86 2k54 s LYS 108 Ca 0.03 -0.17 -0.04 0.00 0.02 0.00 0.00 55.97 55.81 2k54 s LYS 108 Cb 0.08 0.25 0.04 0.00 -0.52 0.00 0.00 37.83 37.67 2k54 s LYS 108 CO 0.75 -0.14 0.18 0.00 -0.92 0.00 0.00 175.35 175.23 2k54 s ALA 109 N -1.12 -0.40 0.05 5.17 0.00 -0.14 -0.42 121.76 124.89 2k54 s ALA 109 Ca -0.12 0.74 0.06 0.00 0.00 0.00 0.00 51.96 52.64 2k54 s ALA 109 Cb -0.05 -0.48 -0.02 0.00 0.00 0.00 0.00 23.12 22.56 2k54 s ALA 109 CO 0.03 -0.15 -0.16 -1.58 0.00 0.00 0.00 175.76 173.89 2k54 s TRP 110 N 0.97 1.39 -0.00 0.00 0.51 -0.29 -1.33 118.94 120.19 2k54 s TRP 110 Ca -0.07 -0.38 -0.04 0.00 -2.12 0.00 0.00 56.10 53.49 2k54 s TRP 110 Cb -0.09 -0.81 -0.00 0.00 -0.81 0.00 0.00 33.47 31.75 2k54 s TRP 110 CO -0.05 0.07 0.07 -0.59 -0.51 0.00 0.00 176.95 175.93 2k54 s PHE 111 N -0.95 0.07 -0.10 -1.98 -0.71 -0.84 -0.37 117.98 113.11 2k54 s PHE 111 Ca 0.03 -0.15 0.00 0.00 -1.04 0.00 0.00 56.93 55.77 2k54 s PHE 111 Cb -0.09 -0.07 0.02 0.00 -1.21 0.00 0.00 43.02 41.68 2k54 s PHE 111 CO 0.02 -0.18 -0.08 0.21 -1.34 0.00 0.00 175.22 173.85 2k54 s LYS 112 N -0.97 1.48 -0.11 1.99 2.20 -0.63 -1.91 119.74 121.80 2k54 s LYS 112 Ca -0.11 -0.26 -0.21 0.00 -0.36 0.00 0.00 55.97 55.04 2k54 s LYS 112 Cb -0.06 -1.49 -0.04 0.00 -1.51 0.00 0.00 37.83 34.73 2k54 s LYS 112 CO 0.00 -0.21 0.59 0.42 -0.36 0.00 0.00 175.35 175.79 2k54 s ILE 113 N 1.51 5.11 0.00 5.43 1.01 -1.26 -1.04 121.20 131.96 2k54 s ILE 113 Ca 0.01 1.18 0.00 0.00 0.00 0.00 0.00 60.65 61.84 2k54 s ILE 113 Cb -0.13 -3.92 0.00 0.00 0.01 0.00 0.00 42.46 38.41 2k54 s ILE 113 CO -0.06 0.26 0.00 0.61 0.00 0.00 0.00 174.94 175.76 2k54 n GLY 114 N 3.29 0.85 3.87 6.18 0.00 0.39 -4.99 105.19 114.78 2k54 n GLY 114 Ca -0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 2k54 n GLY 114 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2k54 s GLU 115 N 0.23 3.58 -0.22 1.61 2.12 -1.26 -4.94 118.70 119.82 2k54 s GLU 115 Ca 0.00 0.00 -0.29 0.00 0.36 0.00 0.00 54.97 55.04 2k54 s GLU 115 Cb 0.00 -3.17 -0.02 0.00 0.26 0.00 0.00 34.13 31.20 2k54 s GLU 115 CO 0.00 0.73 1.51 -1.25 -0.54 0.00 0.00 175.26 175.71 2k54 s PRO 116 N -1.21 3.90 0.18 4.30 0.04 -1.26 -3.72 135.00 137.23 2k54 s PRO 116 Ca 0.20 1.60 0.11 0.00 0.04 0.00 0.00 61.00 62.95 2k54 s PRO 116 Cb -0.13 -3.97 -0.04 0.00 0.04 0.00 0.00 34.50 30.40 2k54 s PRO 116 CO 0.09 -1.16 -0.23 1.03 0.04 0.00 0.00 177.00 176.77 2k54 s ARG 117 N 4.38 1.44 -0.05 4.56 0.52 -1.23 -5.05 118.95 123.53 2k54 s ARG 117 Ca 0.66 -1.47 0.03 0.00 -0.52 0.00 0.00 55.73 54.43 2k54 s ARG 117 Cb -0.23 -1.73 0.01 0.00 0.52 0.00 0.00 34.95 33.52 2k54 s ARG 117 CO 0.26 0.37 -0.12 0.42 0.02 0.00 0.00 175.30 176.26 2k54 s ILE 118 N -1.67 1.03 0.31 1.52 -1.09 -1.26 -2.38 121.20 117.65 2k54 s ILE 118 Ca 0.19 -0.46 0.03 0.00 -2.23 0.00 0.00 60.65 58.18 2k54 s ILE 118 Cb -0.08 -0.93 0.29 0.00 -1.58 0.00 0.00 42.46 40.17 2k54 s ILE 118 CO 0.09 0.32 1.86 0.58 -1.23 0.00 0.00 174.94 176.56 2k54 h VAL 119 N 5.66 0.93 -0.05 2.92 2.07 -1.97 -1.99 116.25 123.83 2k54 h VAL 119 Ca -0.33 -0.32 -0.15 0.00 0.82 0.00 0.00 66.70 66.73 2k54 h VAL 119 Cb 1.18 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 2k54 h VAL 119 CO 0.48 0.17 -0.64 -1.28 0.02 0.00 0.00 177.57 176.32 2k54 h SER 120 N 0.92 0.21 -2.45 0.57 0.87 -1.97 -3.39 113.55 108.32 2k54 h SER 120 Ca 0.46 -0.13 -0.75 0.00 -1.23 0.00 0.00 61.79 60.14 2k54 h SER 120 Cb 0.48 -0.06 -0.20 0.00 -0.44 0.00 0.00 62.40 62.19 2k54 h SER 120 CO -0.22 0.79 1.18 1.67 -0.53 0.00 0.00 176.83 179.72 2k54 n GLN 121 N -3.83 3.41 -4.29 2.24 7.27 -0.75 -4.96 117.38 116.48 2k54 n GLN 121 Ca -0.02 -3.98 -0.18 0.00 0.07 0.00 0.00 57.00 52.89 2k54 n GLN 121 Cb 0.64 -2.94 -0.15 0.00 2.41 0.00 0.00 30.24 30.21 2k54 n GLN 121 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 2k54 s LYS 122 N 0.94 0.65 0.00 3.69 1.02 -1.26 -4.60 119.74 120.18 2k54 s LYS 122 Ca 0.40 -0.26 0.00 0.00 0.02 0.00 0.00 55.97 56.13 2k54 s LYS 122 Cb -0.04 -0.63 0.00 0.00 -0.52 0.00 0.00 37.83 36.64 2k54 s LYS 122 CO -0.01 0.14 0.03 0.43 -0.92 0.00 0.00 175.35 175.01