#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a90 s ALA 10 N 0.00 -1.54 0.51 4.61 0.00 -1.26 -5.17 121.76 118.92 1a90 s ALA 10 Ca 0.00 0.26 -0.13 0.00 0.00 0.00 0.00 51.96 52.09 1a90 s ALA 10 Cb 0.00 0.74 -0.06 0.00 0.00 0.00 0.00 23.12 23.79 1a90 s ALA 10 CO 0.00 -0.90 0.93 -1.25 0.00 0.00 0.00 175.76 174.54 1a90 s PRO 11 N -3.58 3.78 0.02 0.00 0.04 -1.26 -4.69 135.00 129.31 1a90 s PRO 11 Ca 0.07 0.72 0.06 0.00 0.04 0.00 0.00 61.00 61.89 1a90 s PRO 11 Cb -0.03 -2.21 -0.03 0.00 0.04 0.00 0.00 34.50 32.28 1a90 s PRO 11 CO -0.03 -0.28 -0.17 0.08 0.04 0.00 0.00 177.00 176.64 1a90 s VAL 12 N -2.71 2.82 0.47 -0.36 1.01 -1.25 -4.98 120.40 115.41 1a90 s VAL 12 Ca 0.55 -1.09 -0.12 0.00 0.00 0.00 0.00 61.98 61.33 1a90 s VAL 12 Cb -0.10 -2.16 -0.06 0.00 0.00 0.00 0.00 36.38 34.05 1a90 s VAL 12 CO 0.38 0.40 0.87 -2.16 0.00 0.00 0.00 175.10 174.59 1a90 s PRO 13 N -1.26 3.77 0.35 2.72 0.04 -1.26 -1.26 135.00 138.10 1a90 s PRO 13 Ca 0.14 0.61 0.07 0.00 0.04 0.00 0.00 61.00 61.86 1a90 s PRO 13 Cb -0.10 -2.28 -0.01 0.00 0.04 0.00 0.00 34.50 32.15 1a90 s PRO 13 CO 0.04 -0.20 0.42 0.08 0.04 0.00 0.00 177.00 177.39 1a90 s VAL 14 N -2.60 3.62 0.45 -0.36 1.01 -1.20 -4.84 120.40 116.49 1a90 s VAL 14 Ca 0.53 -1.15 0.03 0.00 0.00 0.00 0.00 61.98 61.39 1a90 s VAL 14 Cb -0.10 -3.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.02 1a90 s VAL 14 CO 0.36 -0.13 0.08 -1.81 0.00 0.00 0.00 175.10 173.61 1a90 s ASP 15 N -4.14 3.35 0.00 3.32 1.01 -1.26 -4.99 116.67 113.96 1a90 s ASP 15 Ca 0.45 -1.69 0.09 0.00 0.71 0.00 0.00 52.55 52.12 1a90 s ASP 15 Cb -0.08 0.55 0.52 0.00 1.01 0.00 0.00 42.92 44.92 1a90 s ASP 15 CO 0.30 -0.92 0.97 -0.62 0.21 0.00 0.00 175.17 175.10 1a90 n GLU 16 N -1.06 0.28 -1.77 8.23 -0.58 -1.26 -2.65 120.64 121.83 1a90 n GLU 16 Ca -0.11 0.00 -0.31 0.00 -0.42 0.00 0.00 57.16 56.32 1a90 n GLU 16 Cb 0.66 -1.48 0.05 0.00 -0.57 0.00 0.00 31.44 30.09 1a90 n GLU 16 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1a90 n ASN 17 N -0.98 6.41 -3.48 1.62 4.13 -1.26 -4.78 115.26 116.91 1a90 n ASN 17 Ca 0.07 -3.78 -0.27 0.00 1.68 0.00 0.00 54.58 52.29 1a90 n ASN 17 Cb 0.03 -0.72 -0.09 0.00 -1.54 0.00 0.00 39.78 37.46 1a90 n ASN 17 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1a90 n ASP 18 N -0.75 1.62 0.17 6.41 2.03 -1.08 -4.92 116.55 120.02 1a90 n ASP 18 Ca 0.53 -2.93 0.15 0.00 0.52 0.00 0.00 54.79 53.06 1a90 n ASP 18 Cb 0.71 -0.65 0.51 0.00 -0.72 0.00 0.00 41.12 40.97 1a90 n ASP 18 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1a90 h GLU 19 N 4.81 0.00 0.17 -0.67 5.08 -1.90 0.21 114.58 122.28 1a90 h GLU 19 Ca 0.17 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 1a90 h GLU 19 Cb 0.80 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1a90 h GLU 19 CO 0.60 0.00 -0.08 0.78 -1.00 0.00 0.00 179.01 179.31 1a90 h GLY 20 N 0.00 -0.23 1.59 -3.84 0.00 -1.98 -2.10 103.07 96.51 1a90 h GLY 20 Ca 0.14 0.09 0.01 0.00 0.00 0.00 0.00 47.33 47.57 1a90 h GLY 20 CO -0.00 -0.08 0.25 -2.00 0.00 0.00 0.00 176.54 174.70 1a90 h LEU 21 N -0.71 0.40 -0.26 3.11 7.12 -1.00 -1.58 115.31 122.39 1a90 h LEU 21 Ca -0.02 -0.01 -0.01 0.00 0.13 0.00 0.00 57.88 57.97 1a90 h LEU 21 Cb 0.50 -0.10 -0.01 0.00 -0.53 0.00 0.00 40.66 40.52 1a90 h LEU 21 CO 0.04 0.28 0.11 1.56 -0.13 0.00 0.00 178.44 180.30 1a90 h GLN 22 N 0.47 0.38 0.00 1.25 4.20 -1.27 0.48 115.11 120.62 1a90 h GLN 22 Ca 0.14 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1a90 h GLN 22 Cb 0.01 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.72 1a90 h GLN 22 CO -0.03 0.41 0.00 0.00 -0.67 0.00 0.00 178.83 178.53 1a90 h ARG 23 N 0.28 0.00 0.08 1.46 3.08 -0.61 -1.83 114.38 116.84 1a90 h ARG 23 Ca 0.09 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 1a90 h ARG 23 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 1a90 h ARG 23 CO -0.01 0.00 -0.04 0.00 -1.07 0.00 0.00 179.97 178.85 1a90 h ALA 24 N 2.05 -0.11 -0.97 0.04 0.00 -0.07 -1.02 119.26 119.18 1a90 h ALA 24 Ca 0.00 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.67 1a90 h ALA 24 Cb 0.17 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1a90 h ALA 24 CO 0.00 -0.17 0.64 1.25 0.00 0.00 0.00 179.25 180.97 1a90 h LEU 25 N -0.89 1.09 -0.51 0.00 5.85 -0.86 -2.11 115.31 117.88 1a90 h LEU 25 Ca -0.01 -0.02 -0.15 0.00 0.84 0.00 0.00 57.88 58.53 1a90 h LEU 25 Cb 0.57 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 1a90 h LEU 25 CO 0.02 0.77 -0.46 -0.61 -0.34 0.00 0.00 178.44 177.82 1a90 h GLN 26 N 1.28 0.70 0.58 1.25 4.15 -1.41 -1.57 115.11 120.09 1a90 h GLN 26 Ca 0.37 -0.39 -0.03 0.00 0.77 0.00 0.00 58.65 59.37 1a90 h GLN 26 Cb -0.08 0.03 0.01 0.00 0.21 0.00 0.00 27.48 27.64 1a90 h GLN 26 CO -0.10 1.01 -0.28 0.35 -1.93 0.00 0.00 178.83 177.88 1a90 h PHE 27 N 0.56 -0.72 -0.03 3.99 3.57 -0.69 -2.07 116.94 121.55 1a90 h PHE 27 Ca 0.03 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.52 1a90 h PHE 27 Cb 1.01 0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.99 1a90 h PHE 27 CO 0.05 -0.39 0.01 0.00 -2.23 0.00 0.00 178.31 175.75 1a90 h ALA 28 N -0.64 0.04 -0.71 2.41 0.00 -1.47 -2.75 119.26 116.14 1a90 h ALA 28 Ca -0.08 -0.08 0.14 0.00 0.00 0.00 0.00 54.91 54.89 1a90 h ALA 28 Cb 0.65 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.33 1a90 h ALA 28 CO 0.13 -0.38 0.21 0.97 0.00 0.00 0.00 179.25 180.18 1a90 h ILE 29 N -0.12 0.59 -0.77 0.00 6.09 -0.63 0.90 117.51 123.58 1a90 h ILE 29 Ca 0.01 -0.11 0.16 0.00 -1.37 0.00 0.00 64.86 63.55 1a90 h ILE 29 Cb 0.16 0.24 -0.11 0.00 0.47 0.00 0.00 36.82 37.58 1a90 h ILE 29 CO -0.00 0.06 0.24 0.00 -3.07 0.00 0.00 178.15 175.38 1a90 h ALA 30 N 1.56 1.05 -0.82 0.18 0.00 -1.09 0.86 119.26 121.00 1a90 h ALA 30 Ca 0.39 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.45 1a90 h ALA 30 Cb 0.63 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1a90 h ALA 30 CO -0.45 -0.30 0.49 0.93 0.00 0.00 0.00 179.25 179.92 1a90 h GLU 31 N 0.34 1.10 -0.11 0.00 3.07 1.00 -2.51 114.58 117.47 1a90 h GLU 31 Ca 0.44 -0.10 0.04 0.00 -0.50 0.00 0.00 59.36 59.24 1a90 h GLU 31 Cb 0.74 -0.23 -0.05 0.00 -0.84 0.00 0.00 28.75 28.37 1a90 h GLU 31 CO -0.49 0.77 -0.17 -0.92 -1.40 0.00 0.00 179.01 176.81 1a90 h TYR 32 N 1.12 -0.43 -0.84 4.33 3.20 0.24 0.47 116.97 125.06 1a90 h TYR 32 Ca 0.29 0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.25 1a90 h TYR 32 Cb -0.05 0.21 -0.06 0.00 1.54 0.00 0.00 36.73 38.37 1a90 h TYR 32 CO 0.00 -0.24 0.51 -0.97 -1.64 0.00 0.00 178.16 175.83 1a90 h ASN 33 N -0.22 0.80 1.22 -2.11 -1.24 -0.95 -1.17 115.58 111.91 1a90 h ASN 33 Ca 0.09 0.02 0.00 0.00 0.71 0.00 0.00 56.30 57.12 1a90 h ASN 33 Cb 0.34 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 39.25 1a90 h ASN 33 CO -0.23 0.51 -0.15 -2.11 -1.29 0.00 0.00 177.43 174.15 1a90 n ARG 34 N -4.65 0.21 0.04 6.67 1.85 -0.82 -3.60 116.66 116.36 1a90 n ARG 34 Ca 0.12 0.14 0.12 0.00 -1.00 0.00 0.00 57.85 57.23 1a90 n ARG 34 Cb 0.19 -1.71 0.09 0.00 -1.05 0.00 0.00 32.46 29.98 1a90 n ARG 34 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1a90 n ALA 35 N -1.73 3.22 -0.03 2.89 0.00 0.16 -4.54 120.51 120.48 1a90 n ALA 35 Ca 0.05 -0.34 -0.02 0.00 0.00 0.00 0.00 53.44 53.14 1a90 n ALA 35 Cb 0.41 -1.06 -0.01 0.00 0.00 0.00 0.00 19.45 18.80 1a90 n ALA 35 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1a90 h SER 36 N 0.00 0.00 0.00 0.00 4.64 -1.42 -3.50 113.55 113.27 1a90 h SER 36 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1a90 h SER 36 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1a90 h SER 36 CO 0.00 0.34 0.00 0.59 -0.87 0.00 0.00 176.83 176.89 1a90 n ASN 37 N -3.39 0.00 0.00 4.97 4.13 -1.26 -5.13 115.26 114.58 1a90 n ASN 37 Ca -0.03 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.23 1a90 n ASN 37 Cb 0.10 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.34 1a90 n ASN 37 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1a90 n ASP 38 N 0.00 0.00 0.00 6.41 2.03 -1.26 -4.72 116.55 119.01 1a90 n ASP 38 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1a90 n ASP 38 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1a90 n ASP 38 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1a90 n LYS 39 N 0.00 0.00 0.00 -0.67 4.76 -1.26 -4.85 118.16 116.14 1a90 n LYS 39 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1a90 n LYS 39 Cb 0.00 -0.11 0.00 0.00 -1.84 0.00 0.00 35.03 33.08 1a90 n LYS 39 CO 0.00 0.00 0.00 2.48 -1.37 0.00 0.00 177.40 178.51 1a90 n TYR 40 N -1.06 -0.72 -4.57 2.13 4.11 -1.26 -4.77 117.16 111.02 1a90 n TYR 40 Ca 0.00 0.00 -0.23 0.00 -0.00 0.00 0.00 57.90 57.67 1a90 n TYR 40 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 39.34 39.20 1a90 n TYR 40 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.86 175.74 1a90 s SER 41 N -3.83 2.08 -0.04 9.48 0.01 -1.05 -5.00 113.70 115.34 1a90 s SER 41 Ca 0.00 -0.45 -0.01 0.00 1.31 0.00 0.00 55.95 56.80 1a90 s SER 41 Cb 0.00 -0.17 0.03 0.00 0.21 0.00 0.00 66.02 66.09 1a90 s SER 41 CO 0.00 0.12 0.02 -0.44 0.41 0.00 0.00 173.24 173.36 1a90 s SER 42 N -1.00 0.95 0.00 2.44 0.01 -1.26 -0.65 113.70 114.20 1a90 s SER 42 Ca 0.05 0.00 0.00 0.00 1.31 0.00 0.00 55.95 57.31 1a90 s SER 42 Cb -0.08 -0.24 0.00 0.00 0.21 0.00 0.00 66.02 65.91 1a90 s SER 42 CO 0.01 -0.18 0.00 0.54 0.41 0.00 0.00 173.24 174.02 1a90 n ARG 43 N 4.81 0.46 -1.80 12.44 1.74 -0.81 -4.86 116.66 128.64 1a90 n ARG 43 Ca -0.13 0.00 -0.30 0.00 -0.77 0.00 0.00 57.85 56.65 1a90 n ARG 43 Cb 0.50 0.00 0.19 0.00 -1.02 0.00 0.00 32.46 32.13 1a90 n ARG 43 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1a90 s VAL 44 N 1.19 1.94 0.03 1.55 1.01 -1.25 -1.02 120.40 123.86 1a90 s VAL 44 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61.98 61.98 1a90 s VAL 44 Cb 0.00 -2.92 0.00 0.00 0.00 0.00 0.00 36.38 33.46 1a90 s VAL 44 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 175.10 175.62 1a90 n VAL 45 N -3.89 0.00 -3.47 2.92 0.31 -1.12 0.30 118.33 113.39 1a90 n VAL 45 Ca 0.14 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.29 1a90 n VAL 45 Cb 0.60 0.00 -0.12 0.00 -0.91 0.00 0.00 33.84 33.41 1a90 n VAL 45 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 1a90 s ARG 46 N -1.36 0.23 0.06 5.55 3.52 -1.26 -4.79 118.95 120.91 1a90 s ARG 46 Ca 0.00 0.13 -0.06 0.00 -0.13 0.00 0.00 55.73 55.67 1a90 s ARG 46 Cb 0.00 -1.05 -0.05 0.00 -1.56 0.00 0.00 34.95 32.29 1a90 s ARG 46 CO 0.00 -0.74 0.31 0.08 -0.81 0.00 0.00 175.30 174.14 1a90 s VAL 47 N 2.34 5.24 0.00 7.11 1.01 -1.26 -1.38 120.40 133.46 1a90 s VAL 47 Ca 0.08 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.18 1a90 s VAL 47 Cb -0.15 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.62 1a90 s VAL 47 CO -0.17 0.24 0.02 -0.38 0.00 0.00 0.00 175.10 174.81 1a90 n ILE 48 N 0.72 0.00 0.00 2.22 -0.00 -1.25 -4.89 119.36 116.16 1a90 n ILE 48 Ca -0.08 -0.24 0.00 0.00 -0.00 0.00 0.00 62.75 62.44 1a90 n ILE 48 Cb 0.52 1.04 0.00 0.00 -0.00 0.00 0.00 39.64 41.20 1a90 n ILE 48 CO 0.00 0.00 0.00 -1.20 -0.00 0.00 0.00 176.55 175.35 1a90 n SER 49 N -0.44 0.00 -3.15 4.38 7.64 -1.25 -4.84 113.62 115.96 1a90 n SER 49 Ca 0.00 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.93 1a90 n SER 49 Cb 0.01 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.20 1a90 n SER 49 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1a90 s ALA 50 N -2.00 -3.13 0.08 -0.43 0.00 -1.26 -1.73 121.76 113.29 1a90 s ALA 50 Ca 0.00 1.46 -0.03 0.00 0.00 0.00 0.00 51.96 53.39 1a90 s ALA 50 Cb 0.00 -2.49 -0.03 0.00 0.00 0.00 0.00 23.12 20.60 1a90 s ALA 50 CO 0.00 -1.61 0.05 0.15 0.00 0.00 0.00 175.76 174.35 1a90 s LYS 51 N 2.91 0.74 -0.46 0.00 1.02 -0.46 -3.21 119.74 120.29 1a90 s LYS 51 Ca 0.11 -1.20 0.03 0.00 0.02 0.00 0.00 55.97 54.94 1a90 s LYS 51 Cb -0.10 0.25 0.12 0.00 -0.52 0.00 0.00 37.83 37.59 1a90 s LYS 51 CO -0.18 -0.19 0.21 -0.98 -0.92 0.00 0.00 175.35 173.30 1a90 s ARG 52 N -3.93 1.67 0.84 1.68 1.70 -0.39 -1.39 118.95 119.13 1a90 s ARG 52 Ca 0.10 -2.28 -0.13 0.00 -0.47 0.00 0.00 55.73 52.95 1a90 s ARG 52 Cb 0.07 -3.00 0.07 0.00 -0.57 0.00 0.00 34.95 31.52 1a90 s ARG 52 CO -0.08 -1.09 0.98 1.04 -1.08 0.00 0.00 175.30 175.07 1a90 n GLN 53 N 3.48 0.01 -3.96 3.89 6.02 0.30 -3.85 117.38 123.26 1a90 n GLN 53 Ca 0.05 0.08 -0.31 0.00 -0.01 0.00 0.00 57.00 56.81 1a90 n GLN 53 Cb 0.35 -2.26 -0.15 0.00 1.02 0.00 0.00 30.24 29.20 1a90 n GLN 53 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1a90 s LEU 54 N -4.38 4.14 -0.44 1.08 1.02 -1.26 -1.47 118.68 117.36 1a90 s LEU 54 Ca 0.69 -1.99 0.08 0.00 0.02 0.00 0.00 54.13 52.93 1a90 s LEU 54 Cb -0.28 -1.46 0.40 0.00 0.02 0.00 0.00 46.19 44.87 1a90 s LEU 54 CO 0.56 -0.37 0.99 0.52 0.02 0.00 0.00 176.35 178.06 1a90 n VAL 55 N 4.39 1.96 0.00 -1.59 0.31 -1.26 -4.89 118.33 117.25 1a90 n VAL 55 Ca 0.01 -4.69 0.00 0.00 -0.01 0.00 0.00 64.34 59.66 1a90 n VAL 55 Cb 0.42 -0.79 0.00 0.00 -0.91 0.00 0.00 33.84 32.56 1a90 n VAL 55 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1a90 n SER 56 N -0.24 0.00 -4.51 4.52 3.41 -1.26 -4.87 113.62 110.67 1a90 n SER 56 Ca 0.29 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.63 1a90 n SER 56 Cb 0.62 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.47 1a90 n SER 56 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1a90 s GLY 57 N 0.00 1.72 0.57 5.00 0.00 -1.26 -4.95 107.32 108.40 1a90 s GLY 57 Ca 0.00 -1.54 -0.14 0.00 0.00 0.00 0.00 44.72 43.04 1a90 s GLY 57 CO 0.00 -1.57 1.01 -0.42 0.00 0.00 0.00 173.10 172.13 1a90 s ILE 58 N -1.70 4.61 -0.10 0.90 1.09 -0.84 -4.54 121.20 120.61 1a90 s ILE 58 Ca 0.23 1.03 0.02 0.00 -1.10 0.00 0.00 60.65 60.84 1a90 s ILE 58 Cb -0.08 -3.79 0.01 0.00 -1.06 0.00 0.00 42.46 37.54 1a90 s ILE 58 CO 0.13 -0.93 -0.17 -0.54 -0.10 0.00 0.00 174.94 173.33 1a90 s LYS 59 N -4.67 2.38 -0.71 2.79 1.02 -0.54 -0.88 119.74 119.14 1a90 s LYS 59 Ca 0.57 -0.63 -0.17 0.00 0.02 0.00 0.00 55.97 55.76 1a90 s LYS 59 Cb -0.11 -1.95 0.15 0.00 -0.52 0.00 0.00 37.83 35.41 1a90 s LYS 59 CO 0.44 -0.00 0.74 0.71 -0.92 0.00 0.00 175.35 176.32 1a90 s TYR 60 N 0.80 3.32 -0.29 3.18 2.02 0.30 -0.54 117.35 126.14 1a90 s TYR 60 Ca -0.10 -1.44 -0.18 0.00 -0.37 0.00 0.00 57.07 54.98 1a90 s TYR 60 Cb -0.16 -3.94 -0.02 0.00 -0.40 0.00 0.00 41.96 37.44 1a90 s TYR 60 CO 0.01 -1.16 0.52 0.42 -1.57 0.00 0.00 175.55 173.77 1a90 s ILE 61 N 1.62 5.04 0.06 2.71 -1.09 -0.49 -1.56 121.20 127.49 1a90 s ILE 61 Ca 0.15 0.71 0.05 0.00 -2.23 0.00 0.00 60.65 59.33 1a90 s ILE 61 Cb -0.18 -3.88 -0.03 0.00 -1.58 0.00 0.00 42.46 36.79 1a90 s ILE 61 CO -0.02 -0.03 -0.15 -0.22 -1.23 0.00 0.00 174.94 173.29 1a90 s LEU 62 N 2.37 2.24 0.12 2.97 0.20 -0.04 -1.35 118.68 125.19 1a90 s LEU 62 Ca 0.21 -0.57 0.07 0.00 0.69 0.00 0.00 54.13 54.53 1a90 s LEU 62 Cb -0.15 -0.59 -0.04 0.00 -0.43 0.00 0.00 46.19 44.97 1a90 s LEU 62 CO 0.11 -0.02 -0.06 -1.10 -0.29 0.00 0.00 176.35 174.98 1a90 s GLN 63 N -1.54 2.24 0.18 1.98 -1.52 -0.71 -1.09 119.66 119.21 1a90 s GLN 63 Ca 0.00 -1.04 -0.05 0.00 -1.95 0.00 0.00 55.36 52.33 1a90 s GLN 63 Cb -0.09 -2.34 -0.03 0.00 -0.22 0.00 0.00 33.01 30.33 1a90 s GLN 63 CO 0.02 0.49 0.20 0.14 -0.25 0.00 0.00 175.29 175.89 1a90 s VAL 64 N -1.39 0.05 -0.20 1.09 -7.23 0.54 -3.83 120.40 109.42 1a90 s VAL 64 Ca 0.24 -1.73 -0.04 0.00 -1.81 0.00 0.00 61.98 58.64 1a90 s VAL 64 Cb -0.11 -2.15 -0.01 0.00 0.56 0.00 0.00 36.38 34.67 1a90 s VAL 64 CO 0.16 -0.21 -0.05 -1.83 -0.31 0.00 0.00 175.10 172.86 1a90 s GLU 65 N -4.06 3.42 -0.10 4.82 -1.05 -0.48 -1.23 118.70 120.02 1a90 s GLU 65 Ca 0.27 -0.61 -0.04 0.00 -0.15 0.00 0.00 54.97 54.43 1a90 s GLU 65 Cb 0.05 -2.97 0.05 0.00 -0.44 0.00 0.00 34.13 30.82 1a90 s GLU 65 CO 0.05 -0.11 0.21 0.96 0.95 0.00 0.00 175.26 177.33 1a90 s ILE 66 N 1.24 -0.31 0.51 1.83 -4.36 -0.30 -2.77 121.20 117.04 1a90 s ILE 66 Ca 0.03 0.30 0.04 0.00 -0.26 0.00 0.00 60.65 60.76 1a90 s ILE 66 Cb -0.14 -0.36 0.03 0.00 1.25 0.00 0.00 42.46 43.23 1a90 s ILE 66 CO -0.01 0.13 0.70 -0.83 0.24 0.00 0.00 174.94 175.17 1a90 s GLY 67 N 2.23 1.87 0.16 6.27 0.00 0.15 -2.16 107.32 115.84 1a90 s GLY 67 Ca 0.01 -1.46 -0.23 0.00 0.00 0.00 0.00 44.72 43.04 1a90 s GLY 67 CO -0.07 -1.21 0.60 -1.60 0.00 0.00 0.00 173.10 170.82 1a90 s ARG 68 N -4.62 1.27 -0.44 2.90 3.52 -1.26 -1.93 118.95 118.39 1a90 s ARG 68 Ca 0.57 -0.47 0.05 0.00 -0.13 0.00 0.00 55.73 55.75 1a90 s ARG 68 Cb -0.10 0.59 0.17 0.00 -1.56 0.00 0.00 34.95 34.05 1a90 s ARG 68 CO 0.37 -0.55 0.53 0.95 -0.81 0.00 0.00 175.30 175.78 1a90 s THR 69 N -3.73 -0.52 0.00 4.11 -4.23 0.18 0.25 115.64 111.70 1a90 s THR 69 Ca 0.01 -1.22 0.00 0.00 -1.18 0.00 0.00 61.69 59.30 1a90 s THR 69 Cb -0.01 -0.46 0.00 0.00 1.34 0.00 0.00 72.50 73.37 1a90 s THR 69 CO -0.13 -0.44 0.00 1.07 -0.54 0.00 0.00 174.62 174.58 1a90 n THR 70 N 3.48 0.00 -3.95 3.99 5.66 -0.39 -2.54 114.28 120.53 1a90 n THR 70 Ca 0.18 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.83 1a90 n THR 70 Cb 0.51 -0.19 0.01 0.00 -1.55 0.00 0.00 70.33 69.11 1a90 n THR 70 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1a90 n PRO 72 N -3.94 0.00 -0.15 0.00 -0.04 -1.26 -4.38 135.00 125.23 1a90 n PRO 72 Ca -0.11 0.24 -0.05 0.00 -0.04 0.00 0.00 63.50 63.54 1a90 n PRO 72 Cb 0.46 -0.73 0.04 0.00 -0.04 0.00 0.00 33.50 33.23 1a90 n PRO 72 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1a90 h LYS 73 N 0.00 0.41 0.00 0.54 3.64 -2.01 -3.43 116.57 115.72 1a90 h LYS 73 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1a90 h LYS 73 Cb 0.00 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 1a90 h LYS 73 CO 0.00 0.27 0.00 0.43 -2.27 0.00 0.00 179.45 177.88 1a90 n SER 74 N -4.93 0.00 -3.15 4.20 7.64 -1.26 -4.73 113.62 111.39 1a90 n SER 74 Ca 0.04 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.75 1a90 n SER 74 Cb 0.14 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.32 1a90 n SER 74 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1a90 n SER 75 N 2.79 -2.32 0.00 6.43 2.88 -1.26 -4.15 113.62 118.00 1a90 n SER 75 Ca 0.00 -0.14 0.00 0.00 -1.33 0.00 0.00 58.87 57.40 1a90 n SER 75 Cb 0.00 -2.01 0.00 0.00 -0.75 0.00 0.00 64.21 61.45 1a90 n SER 75 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1a90 n GLY 76 N -0.84 -0.26 7.00 0.46 0.00 -1.26 -5.15 105.19 105.13 1a90 n GLY 76 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1a90 n GLY 76 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1a90 n ASP 77 N -2.03 -0.34 0.00 1.61 2.03 -1.26 -4.90 116.55 111.66 1a90 n ASP 77 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1a90 n ASP 77 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1a90 n ASP 77 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 1a90 n LEU 78 N 0.00 0.00 -4.63 -2.67 7.94 -1.26 -4.91 117.00 111.47 1a90 n LEU 78 Ca 0.00 0.00 -0.52 0.00 -1.11 0.00 0.00 56.01 54.38 1a90 n LEU 78 Cb 0.00 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.89 1a90 n LEU 78 CO 0.00 0.00 1.06 0.00 -1.11 0.00 0.00 177.39 177.34 1a90 n GLN 79 N 0.00 1.33 0.15 1.96 3.00 -1.26 -4.72 117.38 117.84 1a90 n GLN 79 Ca 0.00 0.48 0.16 0.00 -0.01 0.00 0.00 57.00 57.63 1a90 n GLN 79 Cb 0.00 -2.16 0.53 0.00 0.00 0.00 0.00 30.24 28.61 1a90 n GLN 79 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1a90 h SER 80 N 5.52 0.00 -4.26 1.08 4.64 -1.94 -3.46 113.55 115.13 1a90 h SER 80 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1a90 h SER 80 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1a90 h SER 80 CO 0.84 0.00 -0.91 0.00 -0.87 0.00 0.00 176.83 175.88 1a90 n GLU 82 N 0.43 0.66 -0.30 0.00 1.02 -1.26 -4.81 120.64 116.37 1a90 n GLU 82 Ca 0.00 -1.44 0.27 0.00 -0.02 0.00 0.00 57.16 55.97 1a90 n GLU 82 Cb 0.00 1.91 0.47 0.00 -0.02 0.00 0.00 31.44 33.81 1a90 n GLU 82 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1a90 n PHE 83 N -0.62 0.66 -2.70 -0.32 3.72 0.69 -1.27 117.46 117.63 1a90 n PHE 83 Ca -0.03 0.67 -0.06 0.00 -0.05 0.00 0.00 57.45 57.98 1a90 n PHE 83 Cb 0.52 -1.08 0.10 0.00 -0.94 0.00 0.00 39.48 38.08 1a90 n PHE 83 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1a90 n HIS 84 N -4.37 -1.39 -3.81 1.38 8.25 -1.25 -3.98 115.22 110.05 1a90 n HIS 84 Ca 0.29 -2.07 -0.26 0.00 -0.26 0.00 0.00 57.72 55.42 1a90 n HIS 84 Cb 1.07 1.06 0.03 0.00 1.12 0.00 0.00 29.99 33.27 1a90 n HIS 84 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1a90 n ASP 85 N -0.68 -3.07 0.00 0.41 2.03 -0.83 -4.60 116.55 109.81 1a90 n ASP 85 Ca -0.03 -0.80 0.00 0.00 0.52 0.00 0.00 54.79 54.49 1a90 n ASP 85 Cb 0.85 -3.98 0.00 0.00 -0.72 0.00 0.00 41.12 37.27 1a90 n ASP 85 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1a90 n GLU 86 N -4.50 0.00 -0.04 -0.67 1.02 -1.26 -4.86 120.64 110.33 1a90 n GLU 86 Ca -0.13 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 56.88 1a90 n GLU 86 Cb 0.60 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 31.93 1a90 n GLU 86 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1a90 h PRO 87 N 0.00 0.25 -3.61 3.49 0.13 -1.90 1.14 132.00 131.50 1a90 h PRO 87 Ca 0.00 -0.17 -0.70 0.00 -0.87 0.00 0.00 66.00 64.26 1a90 h PRO 87 Cb 0.00 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.14 1a90 h PRO 87 CO 0.00 0.77 3.37 -1.91 -0.23 0.00 0.00 178.00 180.00 1a90 n GLU 88 N -4.57 3.20 0.00 0.86 2.13 -1.26 -1.87 120.64 119.13 1a90 n GLU 88 Ca -0.08 -2.49 0.00 0.00 0.66 0.00 0.00 57.16 55.25 1a90 n GLU 88 Cb 0.40 -3.10 0.00 0.00 0.27 0.00 0.00 31.44 29.02 1a90 n GLU 88 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1a90 n LEU 89 N 5.08 0.00 -2.95 4.31 4.32 -1.24 -4.98 117.00 121.54 1a90 n LEU 89 Ca 0.62 0.00 -0.39 0.00 -0.02 0.00 0.00 56.01 56.21 1a90 n LEU 89 Cb 0.33 0.00 0.04 0.00 -1.62 0.00 0.00 43.42 42.17 1a90 n LEU 89 CO 0.88 0.00 1.47 0.00 -1.22 0.00 0.00 177.39 178.52 1a90 n ALA 90 N 0.00 6.42 -1.00 -1.18 0.00 0.39 -3.90 120.51 121.24 1a90 n ALA 90 Ca 0.00 -4.16 0.00 0.00 0.00 0.00 0.00 53.44 49.28 1a90 n ALA 90 Cb 0.00 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 17.51 1a90 n ALA 90 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1a90 n LYS 91 N -0.50 2.13 -4.03 0.00 5.02 -1.23 -4.63 118.16 114.90 1a90 n LYS 91 Ca 0.53 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.71 1a90 n LYS 91 Cb 0.25 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.21 1a90 n LYS 91 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1a90 s TYR 92 N 0.00 0.57 0.05 2.13 2.02 -1.26 -4.78 117.35 116.08 1a90 s TYR 92 Ca 0.00 -0.90 -0.03 0.00 -0.37 0.00 0.00 57.07 55.78 1a90 s TYR 92 Cb 0.00 0.07 -0.03 0.00 -0.40 0.00 0.00 41.96 41.60 1a90 s TYR 92 CO 0.00 -0.98 0.02 -0.08 -1.57 0.00 0.00 175.55 172.94 1a90 s THR 93 N -3.85 0.19 -0.18 -0.71 -1.32 -0.92 -5.04 115.64 103.81 1a90 s THR 93 Ca 0.26 -1.54 -0.02 0.00 -1.21 0.00 0.00 61.69 59.17 1a90 s THR 93 Cb 0.00 -1.31 -0.01 0.00 -1.51 0.00 0.00 72.50 69.67 1a90 s THR 93 CO 0.11 -0.85 -0.08 -0.89 -2.21 0.00 0.00 174.62 170.70 1a90 s THR 94 N -3.55 3.28 0.08 5.08 2.01 -1.26 -1.15 115.64 120.13 1a90 s THR 94 Ca 0.03 -0.55 0.08 0.00 0.31 0.00 0.00 61.69 61.56 1a90 s THR 94 Cb 0.05 -2.44 -0.04 0.00 0.01 0.00 0.00 72.50 70.08 1a90 s THR 94 CO -0.09 0.47 -0.16 0.00 -0.69 0.00 0.00 174.62 174.16 1a90 s THR 96 N -1.08 5.33 -0.07 0.00 2.01 -0.60 0.20 115.64 121.43 1a90 s THR 96 Ca 0.17 0.35 0.03 0.00 0.31 0.00 0.00 61.69 62.56 1a90 s THR 96 Cb -0.11 -3.53 0.01 0.00 0.01 0.00 0.00 72.50 68.88 1a90 s THR 96 CO 0.09 0.53 -0.17 -0.36 -0.69 0.00 0.00 174.62 174.03 1a90 s PHE 97 N -1.12 1.85 -0.22 4.92 0.08 -0.25 0.28 117.98 123.52 1a90 s PHE 97 Ca 0.21 -0.70 0.02 0.00 0.12 0.00 0.00 56.93 56.57 1a90 s PHE 97 Cb -0.14 -1.29 0.05 0.00 -0.57 0.00 0.00 43.02 41.07 1a90 s PHE 97 CO 0.10 -0.31 -0.12 0.08 -0.10 0.00 0.00 175.22 174.87 1a90 s VAL 98 N 0.50 1.91 -0.04 -0.44 1.01 -1.02 -0.86 120.40 121.44 1a90 s VAL 98 Ca -0.15 -1.26 0.00 0.00 0.00 0.00 0.00 61.98 60.57 1a90 s VAL 98 Cb -0.16 -1.97 0.02 0.00 0.00 0.00 0.00 36.38 34.27 1a90 s VAL 98 CO 0.05 0.13 -0.02 -0.69 0.00 0.00 0.00 175.10 174.57 1a90 s VAL 99 N 1.26 0.36 0.33 2.92 1.01 -0.60 -0.43 120.40 125.25 1a90 s VAL 99 Ca -0.04 0.02 -0.27 0.00 0.00 0.00 0.00 61.98 61.69 1a90 s VAL 99 Cb -0.17 -0.44 -0.09 0.00 0.00 0.00 0.00 36.38 35.67 1a90 s VAL 99 CO -0.08 0.20 1.01 -0.47 0.00 0.00 0.00 175.10 175.77 1a90 s TYR 100 N 1.21 3.57 -0.27 5.22 5.04 -0.51 0.11 117.35 131.72 1a90 s TYR 100 Ca -0.07 1.74 -0.03 0.00 -2.44 0.00 0.00 57.07 56.27 1a90 s TYR 100 Cb -0.14 -3.08 0.09 0.00 0.35 0.00 0.00 41.96 39.18 1a90 s TYR 100 CO -0.02 -0.20 0.10 -1.54 -1.34 0.00 0.00 175.55 172.55 1a90 s SER 101 N -1.36 3.43 -0.51 4.32 1.04 -0.06 -1.60 113.70 118.96 1a90 s SER 101 Ca 0.50 -1.23 -0.20 0.00 0.48 0.00 0.00 55.95 55.50 1a90 s SER 101 Cb -0.24 -0.51 0.06 0.00 0.10 0.00 0.00 66.02 65.43 1a90 s SER 101 CO 0.30 -0.40 0.67 -0.63 0.98 0.00 0.00 173.24 174.16 1a90 s ILE 102 N 1.94 4.80 0.03 -1.02 1.01 -0.82 -1.99 121.20 125.15 1a90 s ILE 102 Ca 0.07 -0.38 -0.26 0.00 0.00 0.00 0.00 60.65 60.07 1a90 s ILE 102 Cb -0.16 -4.34 -0.17 0.00 0.01 0.00 0.00 42.46 37.80 1a90 s ILE 102 CO -0.26 -0.85 1.35 1.55 0.00 0.00 0.00 174.94 176.72 1a90 h PRO 103 N 9.04 -0.45 0.00 2.79 0.13 -1.92 0.56 132.00 142.15 1a90 h PRO 103 Ca -0.27 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 1a90 h PRO 103 Cb 1.09 0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1a90 h PRO 103 CO 0.98 -0.16 0.04 -2.67 -0.23 0.00 0.00 178.00 175.97 1a90 n TRP 104 N -5.19 0.00 -0.93 1.56 2.14 -1.26 -1.61 117.44 112.14 1a90 n TRP 104 Ca -0.10 0.00 0.01 0.00 2.07 0.00 0.00 57.50 59.48 1a90 n TRP 104 Cb 0.26 -0.45 0.01 0.00 -0.81 0.00 0.00 31.31 30.32 1a90 n TRP 104 CO 0.00 0.00 0.00 -0.11 2.07 0.00 0.00 177.69 179.65 1a90 n LEU 105 N -1.45 0.66 -3.87 5.67 -0.00 -1.08 -5.02 117.00 111.91 1a90 n LEU 105 Ca 0.00 -0.89 -0.28 0.00 -0.00 0.00 0.00 56.01 54.84 1a90 n LEU 105 Cb 0.04 -0.03 -0.02 0.00 -0.00 0.00 0.00 43.42 43.41 1a90 n LEU 105 CO 0.00 0.22 -0.20 -3.20 -0.00 0.00 0.00 177.39 174.21 1a90 n ASN 106 N -0.23 -1.37 -4.03 1.96 2.85 0.19 -4.87 115.26 109.76 1a90 n ASN 106 Ca 0.01 -0.87 -0.32 0.00 -0.11 0.00 0.00 54.58 53.29 1a90 n ASN 106 Cb 0.48 -1.06 -0.14 0.00 1.24 0.00 0.00 39.78 40.30 1a90 n ASN 106 CO 0.00 0.00 0.00 -1.58 -2.11 0.00 0.00 177.26 173.57 1a90 s GLN 107 N -6.39 1.59 -0.12 1.20 0.74 -0.53 -4.95 119.66 111.20 1a90 s GLN 107 Ca 0.20 -1.94 -0.09 0.00 0.05 0.00 0.00 55.36 53.58 1a90 s GLN 107 Cb -0.11 -3.27 -0.04 0.00 1.10 0.00 0.00 33.01 30.69 1a90 s GLN 107 CO 0.66 -0.97 0.19 -1.50 -0.55 0.00 0.00 175.29 173.12 1a90 s ILE 108 N 0.82 5.41 -0.05 -2.34 2.07 -1.26 -1.95 121.20 123.90 1a90 s ILE 108 Ca 0.11 0.33 -0.03 0.00 -1.41 0.00 0.00 60.65 59.65 1a90 s ILE 108 Cb -0.20 -3.47 0.03 0.00 0.13 0.00 0.00 42.46 38.95 1a90 s ILE 108 CO -0.07 0.57 0.12 -0.75 -1.91 0.00 0.00 174.94 172.90 1a90 s LYS 109 N -0.74 0.08 0.84 3.50 2.20 -0.63 -4.98 119.74 120.00 1a90 s LYS 109 Ca 0.15 0.30 -0.11 0.00 -0.36 0.00 0.00 55.97 55.95 1a90 s LYS 109 Cb -0.13 -0.14 0.09 0.00 -1.51 0.00 0.00 37.83 36.15 1a90 s LYS 109 CO 0.05 -0.13 1.09 -1.17 -0.36 0.00 0.00 175.35 174.83 1a90 s LEU 110 N 0.92 2.68 0.00 5.43 2.96 -1.26 -1.43 118.68 127.99 1a90 s LEU 110 Ca -0.07 1.71 0.00 0.00 -0.22 0.00 0.00 54.13 55.55 1a90 s LEU 110 Cb -0.09 -4.27 0.00 0.00 0.50 0.00 0.00 46.19 42.32 1a90 s LEU 110 CO -0.04 -2.38 0.00 0.18 -1.32 0.00 0.00 176.35 172.79 1a90 n LEU 111 N -3.73 0.00 -4.03 -0.68 4.77 0.43 -4.80 117.00 108.96 1a90 n LEU 111 Ca 0.08 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.73 1a90 n LEU 111 Cb 0.54 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.51 1a90 n LEU 111 CO 0.54 0.00 -0.11 -0.70 -1.33 0.00 0.00 177.39 175.79 1a90 s GLU 112 N 0.00 2.16 -0.67 3.23 2.12 -1.20 -4.93 118.70 119.41 1a90 s GLU 112 Ca 0.00 -2.43 -0.18 0.00 0.36 0.00 0.00 54.97 52.72 1a90 s GLU 112 Cb 0.00 -3.50 0.12 0.00 0.26 0.00 0.00 34.13 31.01 1a90 s GLU 112 CO 0.00 -1.11 0.77 -1.54 -0.54 0.00 0.00 175.26 172.84 1a90 s SER 113 N 0.44 6.32 -1.10 -1.70 1.04 -1.26 -2.44 113.70 115.00 1a90 s SER 113 Ca 0.15 -1.68 -0.15 0.00 0.48 0.00 0.00 55.95 54.76 1a90 s SER 113 Cb -0.23 -2.30 0.17 0.00 0.10 0.00 0.00 66.02 63.76 1a90 s SER 113 CO -0.03 -1.04 1.29 -0.54 0.98 0.00 0.00 173.24 173.90 1a90 s LYS 114 N 2.38 3.93 -0.43 4.02 -0.14 0.14 -4.85 119.74 124.79 1a90 s LYS 114 Ca 0.15 -2.38 -0.21 0.00 -1.36 0.00 0.00 55.97 52.17 1a90 s LYS 114 Cb -0.20 -4.95 0.02 0.00 -1.68 0.00 0.00 37.83 31.02 1a90 s LYS 114 CO 0.02 -1.71 0.69 0.00 -0.76 0.00 0.00 175.35 173.59