#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3srn s GLU 2 N 0.00 2.75 0.77 1.64 2.12 -1.26 -5.06 118.70 119.67 3srn s GLU 2 Ca 0.00 -1.02 -0.11 0.00 0.36 0.00 0.00 54.97 54.20 3srn s GLU 2 Cb 0.00 -2.88 0.06 0.00 0.26 0.00 0.00 34.13 31.57 3srn s GLU 2 CO 0.00 -0.39 1.10 0.95 -0.54 0.00 0.00 175.26 176.37 3srn s THR 3 N 1.27 3.21 0.38 -1.70 -4.23 -1.26 -4.83 115.64 108.48 3srn s THR 3 Ca -0.01 0.41 0.07 0.00 -1.18 0.00 0.00 61.69 60.98 3srn s THR 3 Cb -0.17 -2.86 0.21 0.00 1.34 0.00 0.00 72.50 71.03 3srn s THR 3 CO -0.06 -0.50 1.98 0.00 -0.54 0.00 0.00 174.62 175.50 3srn h ALA 4 N -1.09 1.57 -0.31 3.99 0.00 -2.00 -2.17 119.26 119.24 3srn h ALA 4 Ca -0.44 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.30 3srn h ALA 4 Cb 1.24 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 3srn h ALA 4 CO 0.51 0.33 -0.03 0.00 0.00 0.00 0.00 179.25 180.06 3srn h ALA 5 N 1.65 0.43 -0.06 0.00 0.00 -2.00 -2.62 119.26 116.66 3srn h ALA 5 Ca 0.12 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.66 3srn h ALA 5 Cb 0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3srn h ALA 5 CO -0.01 0.21 -0.46 0.00 0.00 0.00 0.00 179.25 178.99 3srn h ALA 6 N 0.82 1.12 -0.51 0.00 0.00 -1.90 -2.32 119.26 116.48 3srn h ALA 6 Ca 0.09 -0.44 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 3srn h ALA 6 Cb 0.49 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 3srn h ALA 6 CO 0.02 0.61 0.32 -0.22 0.00 0.00 0.00 179.25 179.98 3srn h LYS 7 N 0.11 0.68 -0.36 0.00 3.64 -1.27 0.21 116.57 119.57 3srn h LYS 7 Ca 0.01 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.35 3srn h LYS 7 Cb 0.86 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.51 3srn h LYS 7 CO 0.07 0.48 0.21 0.35 -2.27 0.00 0.00 179.45 178.29 3srn h PHE 8 N 0.68 0.39 -0.15 1.91 3.04 -1.16 0.35 116.94 122.01 3srn h PHE 8 Ca 0.18 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.10 3srn h PHE 8 Cb -0.03 -0.12 -0.00 0.00 2.56 0.00 0.00 35.95 38.35 3srn h PHE 8 CO -0.03 0.23 -0.07 0.93 -2.02 0.00 0.00 178.31 177.34 3srn h GLU 9 N 0.43 0.31 -0.57 1.11 5.08 -1.26 -1.43 114.58 118.24 3srn h GLU 9 Ca 0.14 -0.14 0.03 0.00 -1.00 0.00 0.00 59.36 58.40 3srn h GLU 9 Cb 0.01 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 3srn h GLU 9 CO -0.07 0.63 0.33 -0.09 -1.00 0.00 0.00 179.01 178.82 3srn h ARG 10 N -0.03 0.63 0.01 2.33 2.43 -0.33 -2.09 114.38 117.33 3srn h ARG 10 Ca 0.03 -0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 3srn h ARG 10 Cb 0.54 -0.14 0.01 0.00 -0.42 0.00 0.00 29.97 29.96 3srn h ARG 10 CO 0.02 0.42 -0.24 1.96 -1.51 0.00 0.00 179.97 180.62 3srn h GLN 11 N 0.65 0.14 -0.01 0.20 4.20 -0.88 -3.41 115.11 116.00 3srn h GLN 11 Ca 0.24 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.78 3srn h GLN 11 Cb 0.07 0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.90 3srn h GLN 11 CO -0.12 0.95 -0.30 0.72 -0.67 0.00 0.00 178.83 179.41 3srn n HIS 12 N -4.51 0.00 -3.64 2.96 8.25 -0.54 -4.73 115.22 113.02 3srn n HIS 12 Ca -0.10 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.00 3srn n HIS 12 Cb 0.52 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.55 3srn n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 3srn s MET 13 N -1.69 4.19 -0.42 -0.41 -1.94 -0.79 0.35 119.30 118.59 3srn s MET 13 Ca 0.11 -0.11 0.06 0.00 -1.71 0.00 0.00 55.69 54.04 3srn s MET 13 Cb 0.11 -3.45 0.21 0.00 2.01 0.00 0.00 34.83 33.71 3srn s MET 13 CO 0.35 0.21 0.52 -3.47 -0.01 0.00 0.00 175.02 172.62 3srn n ASP 14 N 3.75 -0.87 -0.13 3.03 2.03 -0.26 -4.87 116.55 119.23 3srn n ASP 14 Ca -0.14 -2.68 0.15 0.00 0.52 0.00 0.00 54.79 52.65 3srn n ASP 14 Cb 0.52 -0.02 0.82 0.00 -0.72 0.00 0.00 41.12 41.71 3srn n ASP 14 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 3srn n SER 15 N 2.14 0.41 -0.17 1.67 7.64 -1.26 -3.77 113.62 120.28 3srn n SER 15 Ca 0.22 -1.09 0.13 0.00 1.01 0.00 0.00 58.87 59.14 3srn n SER 15 Cb 0.53 -0.01 0.66 0.00 -1.01 0.00 0.00 64.21 64.37 3srn n SER 15 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 3srn n SER 16 N -0.70 0.52 -3.85 6.43 2.88 -1.26 -4.80 113.62 112.84 3srn n SER 16 Ca 0.22 -1.33 -0.12 0.00 -1.33 0.00 0.00 58.87 56.31 3srn n SER 16 Cb 0.18 -0.02 -0.12 0.00 -0.75 0.00 0.00 64.21 63.51 3srn n SER 16 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 3srn s THR 17 N -1.97 0.03 -0.22 2.46 2.01 -1.25 -5.05 115.64 111.66 3srn s THR 17 Ca 0.37 -0.22 0.18 0.00 0.31 0.00 0.00 61.69 62.33 3srn s THR 17 Cb 0.18 -0.25 0.08 0.00 0.01 0.00 0.00 72.50 72.52 3srn s THR 17 CO 0.30 -0.12 1.33 0.77 -0.69 0.00 0.00 174.62 176.21 3srn h SER 18 N 5.48 0.00 -4.91 3.53 4.64 -1.87 -3.43 113.55 116.99 3srn h SER 18 Ca -0.27 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.10 3srn h SER 18 Cb 1.20 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.17 3srn h SER 18 CO 0.42 0.36 0.33 0.00 -0.87 0.00 0.00 176.83 177.07 3srn s ALA 19 N -3.05 -1.64 0.16 5.18 0.00 -1.26 -4.79 121.76 116.36 3srn s ALA 19 Ca 0.03 0.54 -0.34 0.00 0.00 0.00 0.00 51.96 52.19 3srn s ALA 19 Cb 0.07 0.71 -0.14 0.00 0.00 0.00 0.00 23.12 23.76 3srn s ALA 19 CO 0.75 -0.80 1.51 0.00 0.00 0.00 0.00 175.76 177.22 3srn n ALA 20 N -0.35 0.93 -0.96 0.00 0.00 -1.26 -4.93 120.51 113.94 3srn n ALA 20 Ca -0.12 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.78 3srn n ALA 20 Cb 0.63 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.79 3srn n ALA 20 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3srn n SER 21 N 3.12 0.00 -2.38 0.00 3.41 -1.26 -4.95 113.62 111.56 3srn n SER 21 Ca 0.17 0.05 -0.10 0.00 -0.26 0.00 0.00 58.87 58.73 3srn n SER 21 Cb 0.27 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.21 3srn n SER 21 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3srn n SER 22 N -0.10 -1.08 0.14 4.04 3.41 -1.26 -5.05 113.62 113.73 3srn n SER 22 Ca 0.00 -2.29 0.06 0.00 -0.26 0.00 0.00 58.87 56.38 3srn n SER 22 Cb 0.00 1.95 0.33 0.00 -0.26 0.00 0.00 64.21 66.23 3srn n SER 22 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3srn n SER 23 N -1.70 0.32 -0.68 4.04 3.41 -1.26 -1.75 113.62 116.00 3srn n SER 23 Ca -0.01 0.54 0.10 0.00 -0.26 0.00 0.00 58.87 59.24 3srn n SER 23 Cb 0.41 -0.51 0.05 0.00 -0.26 0.00 0.00 64.21 63.91 3srn n SER 23 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3srn n ASN 24 N -1.97 2.38 -0.24 4.04 5.15 -1.26 -4.32 115.26 119.04 3srn n ASN 24 Ca -0.01 -1.69 0.04 0.00 -0.60 0.00 0.00 54.58 52.32 3srn n ASN 24 Cb 0.28 0.16 0.15 0.00 -0.53 0.00 0.00 39.78 39.84 3srn n ASN 24 CO 0.00 0.00 0.00 0.22 1.40 0.00 0.00 177.26 178.88 3srn h TYR 25 N 3.32 0.12 0.00 1.20 5.03 -1.75 -0.09 116.97 124.80 3srn h TYR 25 Ca 0.00 0.05 -0.06 0.00 2.58 0.00 0.00 58.73 61.30 3srn h TYR 25 Cb 0.77 0.06 -0.01 0.00 1.55 0.00 0.00 36.73 39.10 3srn h TYR 25 CO 0.00 -0.14 -0.29 0.00 -1.32 0.00 0.00 178.16 176.42 3srn h ASN 27 N 0.00 0.07 0.02 0.00 -0.26 -1.31 -2.01 115.58 112.09 3srn h ASN 27 Ca -0.00 -0.42 -0.00 0.00 -0.56 0.00 0.00 56.30 55.32 3srn h ASN 27 Cb 0.51 -0.02 0.00 0.00 -1.06 0.00 0.00 38.32 37.75 3srn h ASN 27 CO 0.04 0.47 -0.01 1.56 -1.06 0.00 0.00 177.43 178.43 3srn h GLN 28 N -0.33 -0.02 -0.61 0.81 4.20 -1.28 -2.98 115.11 114.90 3srn h GLN 28 Ca 0.01 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 3srn h GLN 28 Cb 0.45 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.20 3srn h GLN 28 CO 0.00 0.49 0.35 0.52 -0.67 0.00 0.00 178.83 179.53 3srn h MET 29 N -0.55 0.85 -0.47 1.46 2.86 -1.02 -0.44 114.93 117.63 3srn h MET 29 Ca -0.00 -0.09 -0.05 0.00 -2.06 0.00 0.00 59.70 57.50 3srn h MET 29 Cb 0.52 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 3srn h MET 29 CO 0.00 0.63 0.09 0.52 1.06 0.00 0.00 176.91 179.21 3srn h MET 30 N 0.83 0.72 0.38 1.72 2.86 -1.47 -2.62 114.93 117.35 3srn h MET 30 Ca 0.22 -0.15 -0.02 0.00 -2.06 0.00 0.00 59.70 57.69 3srn h MET 30 Cb 0.02 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.57 3srn h MET 30 CO -0.04 0.68 -0.18 -0.22 1.06 0.00 0.00 176.91 178.21 3srn h LYS 31 N 0.69 -0.49 -0.62 1.72 3.64 -1.25 -0.90 116.57 119.36 3srn h LYS 31 Ca 0.15 0.03 0.13 0.00 -1.27 0.00 0.00 60.65 59.69 3srn h LYS 31 Cb 0.30 0.11 -0.10 0.00 -0.41 0.00 0.00 32.23 32.13 3srn h LYS 31 CO 0.00 -0.20 0.04 0.77 -2.27 0.00 0.00 179.45 177.80 3srn h SER 32 N -0.76 -0.19 -0.20 4.20 0.02 -1.02 -2.08 113.55 113.52 3srn h SER 32 Ca -0.05 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 3srn h SER 32 Cb 0.52 0.24 0.00 0.00 0.14 0.00 0.00 62.40 63.29 3srn h SER 32 CO 0.09 -0.08 0.00 0.54 -1.14 0.00 0.00 176.83 176.23 3srn n ARG 33 N -5.24 1.49 -4.05 3.45 5.12 -1.00 -4.90 116.66 111.54 3srn n ARG 33 Ca 0.09 -0.72 -0.32 0.00 -1.93 0.00 0.00 57.85 54.98 3srn n ARG 33 Cb 0.36 -1.19 -0.01 0.00 -1.16 0.00 0.00 32.46 30.46 3srn n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 3srn n ASN 34 N 0.08 -3.00 -0.94 0.55 5.03 -0.78 -4.86 115.26 111.34 3srn n ASN 34 Ca 0.07 -0.93 0.06 0.00 0.87 0.00 0.00 54.58 54.64 3srn n ASN 34 Cb 0.19 -3.21 0.21 0.00 -1.02 0.00 0.00 39.78 35.94 3srn n ASN 34 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3srn n LEU 35 N -4.47 2.72 -0.93 3.41 4.77 -0.35 -3.87 117.00 118.28 3srn n LEU 35 Ca -0.04 -1.37 0.01 0.00 -0.03 0.00 0.00 56.01 54.59 3srn n LEU 35 Cb 0.55 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 3srn n LEU 35 CO 0.80 0.55 0.18 0.35 -1.33 0.00 0.00 177.39 177.94 3srn n THR 36 N 0.67 0.00 0.06 -5.08 -2.24 -1.22 -1.45 114.28 105.02 3srn n THR 36 Ca 0.15 -0.40 -0.09 0.00 -2.27 0.00 0.00 64.05 61.44 3srn n THR 36 Cb 0.49 0.66 -0.06 0.00 -2.10 0.00 0.00 70.33 69.31 3srn n THR 36 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3srn h LYS 37 N 0.40 -0.23 0.15 -0.78 6.56 -1.92 -3.39 116.57 117.36 3srn h LYS 37 Ca -0.13 0.02 -0.33 0.00 -1.06 0.00 0.00 60.65 59.15 3srn h LYS 37 Cb 1.57 0.05 0.00 0.00 -0.57 0.00 0.00 32.23 33.28 3srn h LYS 37 CO 0.02 0.13 -1.67 -0.44 -2.06 0.00 0.00 179.45 175.43 3srn h ASP 38 N -0.95 0.50 -5.53 0.86 3.32 -1.93 -3.49 116.42 109.20 3srn h ASP 38 Ca -0.02 -0.91 -0.25 0.00 0.02 0.00 0.00 57.03 55.87 3srn h ASP 38 Cb 0.46 -0.16 -0.11 0.00 0.22 0.00 0.00 39.33 39.74 3srn h ASP 38 CO 0.04 1.74 -0.32 0.00 -1.72 0.00 0.00 179.24 178.97 3srn s ARG 39 N -2.54 1.63 -0.64 3.56 1.70 -1.26 -5.02 118.95 116.38 3srn s ARG 39 Ca -0.18 -1.65 -0.20 0.00 -0.47 0.00 0.00 55.73 53.22 3srn s ARG 39 Cb 0.05 0.39 0.09 0.00 -0.57 0.00 0.00 34.95 34.91 3srn s ARG 39 CO 0.81 -0.64 0.84 0.00 -1.08 0.00 0.00 175.30 175.23 3srn n LYS 41 N 6.91 2.18 0.07 0.00 4.81 -0.53 -4.87 118.16 126.72 3srn n LYS 41 Ca -0.05 0.78 -0.07 0.00 -0.87 0.00 0.00 58.31 58.09 3srn n LYS 41 Cb 0.44 -2.48 0.07 0.00 0.02 0.00 0.00 35.03 33.08 3srn n LYS 41 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 3srn h PRO 42 N 4.69 0.32 -3.19 1.64 0.13 -1.95 -3.45 132.00 130.19 3srn h PRO 42 Ca -0.45 -0.24 -0.23 0.00 -0.87 0.00 0.00 66.00 64.20 3srn h PRO 42 Cb 1.26 0.05 -0.31 0.00 0.13 0.00 0.00 31.00 32.13 3srn h PRO 42 CO 0.79 0.87 -0.57 0.08 -0.23 0.00 0.00 178.00 178.95 3srn s VAL 43 N -3.67 -0.05 -0.22 1.56 1.01 -1.26 -1.44 120.40 116.33 3srn s VAL 43 Ca -0.05 0.17 -0.15 0.00 0.00 0.00 0.00 61.98 61.95 3srn s VAL 43 Cb 0.11 -0.28 0.06 0.00 0.00 0.00 0.00 36.38 36.28 3srn s VAL 43 CO 0.82 0.07 0.55 0.21 0.00 0.00 0.00 175.10 176.75 3srn s ASN 44 N 1.18 -0.67 -0.15 3.32 2.47 0.18 -5.01 114.94 116.25 3srn s ASN 44 Ca -0.09 1.18 -0.05 0.00 0.42 0.00 0.00 52.86 54.32 3srn s ASN 44 Cb -0.11 1.11 -0.03 0.00 -1.45 0.00 0.00 41.25 40.76 3srn s ASN 44 CO -0.07 -0.21 0.02 -0.89 -3.72 0.00 0.00 177.10 172.23 3srn s THR 45 N 1.04 4.40 -0.10 -5.21 2.01 -1.26 0.64 115.64 117.16 3srn s THR 45 Ca -0.06 -0.18 -0.02 0.00 0.31 0.00 0.00 61.69 61.73 3srn s THR 45 Cb -0.06 -2.93 -0.03 0.00 0.01 0.00 0.00 72.50 69.49 3srn s THR 45 CO -0.10 0.51 -0.00 -0.36 -0.69 0.00 0.00 174.62 173.98 3srn s PHE 46 N 0.03 3.14 -0.20 4.92 0.08 -0.20 -4.26 117.98 121.50 3srn s PHE 46 Ca 0.03 0.12 -0.04 0.00 0.12 0.00 0.00 56.93 57.17 3srn s PHE 46 Cb -0.13 -1.82 -0.01 0.00 -0.57 0.00 0.00 43.02 40.49 3srn s PHE 46 CO 0.02 0.39 -0.05 0.08 -0.10 0.00 0.00 175.22 175.56 3srn s VAL 47 N -0.66 3.49 -0.97 -0.44 1.01 0.16 0.15 120.40 123.14 3srn s VAL 47 Ca 0.11 -0.47 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 3srn s VAL 47 Cb -0.12 -2.56 0.27 0.00 0.00 0.00 0.00 36.38 33.97 3srn s VAL 47 CO 0.02 0.45 2.07 1.41 0.00 0.00 0.00 175.10 179.04 3srn n HIS 48 N 4.38 2.69 -4.27 5.22 -0.00 -0.82 -1.10 115.22 121.31 3srn n HIS 48 Ca -0.18 -2.47 -0.15 0.00 -0.00 0.00 0.00 57.72 54.92 3srn n HIS 48 Cb 0.51 -1.31 -0.10 0.00 -0.00 0.00 0.00 29.99 29.09 3srn n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 3srn s GLU 49 N -3.52 1.16 0.47 -0.41 0.41 -1.26 -4.61 118.70 110.93 3srn s GLU 49 Ca 0.47 -1.55 -0.22 0.00 -0.41 0.00 0.00 54.97 53.26 3srn s GLU 49 Cb 0.28 -0.43 -0.08 0.00 -1.78 0.00 0.00 34.13 32.12 3srn s GLU 49 CO -0.22 -0.08 1.10 -1.54 -0.49 0.00 0.00 175.26 174.03 3srn s SER 50 N -3.21 6.29 0.25 -0.19 1.04 -1.26 -4.13 113.70 112.49 3srn s SER 50 Ca 0.24 2.11 -0.12 0.00 0.48 0.00 0.00 55.95 58.66 3srn s SER 50 Cb 0.05 -2.58 0.34 0.00 0.10 0.00 0.00 66.02 63.93 3srn s SER 50 CO 0.04 -0.83 1.57 0.25 0.98 0.00 0.00 173.24 175.26 3srn h LEU 51 N 1.88 -1.00 -1.09 2.42 5.85 -1.97 1.38 115.31 122.79 3srn h LEU 51 Ca -0.49 0.27 -0.03 0.00 0.84 0.00 0.00 57.88 58.47 3srn h LEU 51 Cb 1.23 0.60 -0.03 0.00 0.37 0.00 0.00 40.66 42.84 3srn h LEU 51 CO 0.60 -0.30 0.27 0.00 -0.34 0.00 0.00 178.44 178.67 3srn h ALA 52 N 1.70 1.28 -0.84 1.25 0.00 -1.99 0.16 119.26 120.84 3srn h ALA 52 Ca 0.40 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 3srn h ALA 52 Cb 0.64 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 3srn h ALA 52 CO -0.92 0.54 0.38 -0.44 0.00 0.00 0.00 179.25 178.81 3srn h ASP 53 N 0.91 1.11 0.33 0.00 5.19 0.14 -2.02 116.42 122.08 3srn h ASP 53 Ca 0.22 -0.15 -0.17 0.00 -0.62 0.00 0.00 57.03 56.30 3srn h ASP 53 Cb 0.15 -0.29 -0.01 0.00 0.18 0.00 0.00 39.33 39.37 3srn h ASP 53 CO -0.02 0.95 -0.71 0.58 -3.12 0.00 0.00 179.24 176.93 3srn h VAL 54 N 1.20 1.40 -0.51 -1.35 2.07 -0.46 -3.06 116.25 115.54 3srn h VAL 54 Ca 0.28 -2.15 -0.08 0.00 0.82 0.00 0.00 66.70 65.58 3srn h VAL 54 Cb 0.16 2.12 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 3srn h VAL 54 CO -0.03 0.64 0.01 1.56 0.02 0.00 0.00 177.57 179.77 3srn h GLN 55 N 0.23 0.86 0.00 1.57 4.20 -0.43 -1.79 115.11 119.75 3srn h GLN 55 Ca -0.02 -0.23 0.00 0.00 0.06 0.00 0.00 58.65 58.45 3srn h GLN 55 Cb 1.27 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.95 3srn h GLN 55 CO 0.12 0.85 0.14 0.00 -0.67 0.00 0.00 178.83 179.26 3srn n ALA 56 N -2.47 0.84 0.19 3.87 0.00 -0.78 -1.57 120.51 120.58 3srn n ALA 56 Ca 0.03 0.14 0.04 0.00 0.00 0.00 0.00 53.44 53.65 3srn n ALA 56 Cb 0.30 -1.03 0.39 0.00 0.00 0.00 0.00 19.45 19.12 3srn n ALA 56 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3srn h VAL 57 N 0.00 1.08 0.00 0.00 2.07 -1.38 -2.90 116.25 115.13 3srn h VAL 57 Ca 0.00 -1.29 0.00 0.00 0.82 0.00 0.00 66.70 66.23 3srn h VAL 57 Cb 0.27 1.73 0.00 0.00 -1.52 0.00 0.00 31.29 31.78 3srn h VAL 57 CO 0.00 0.35 0.00 0.00 0.02 0.00 0.00 177.57 177.94 3srn n SER 59 N -0.79 0.98 0.00 0.00 3.41 -1.09 -5.03 113.62 111.10 3srn n SER 59 Ca 0.06 -2.49 0.00 0.00 -0.26 0.00 0.00 58.87 56.19 3srn n SER 59 Cb 0.03 -0.31 0.00 0.00 -0.26 0.00 0.00 64.21 63.67 3srn n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3srn n GLN 60 N -0.42 3.37 -2.54 4.33 6.02 -0.29 -5.03 117.38 122.82 3srn n GLN 60 Ca 0.07 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.63 3srn n GLN 60 Cb 0.76 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 32.00 3srn n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 3srn s LYS 61 N 4.56 4.15 -0.05 -1.09 2.47 -0.72 -4.83 119.74 124.24 3srn s LYS 61 Ca 0.00 1.38 -0.28 0.00 -1.56 0.00 0.00 55.97 55.51 3srn s LYS 61 Cb 0.00 -3.74 -0.03 0.00 -1.46 0.00 0.00 37.83 32.60 3srn s LYS 61 CO 0.00 -0.80 0.91 1.21 0.16 0.00 0.00 175.35 176.84 3srn s ASN 62 N 1.82 7.23 0.11 1.43 3.04 -1.26 0.25 114.94 127.56 3srn s ASN 62 Ca 0.50 1.50 -0.06 0.00 0.04 0.00 0.00 52.86 54.84 3srn s ASN 62 Cb -0.17 -2.52 -0.02 0.00 -1.54 0.00 0.00 41.25 37.00 3srn s ASN 62 CO 0.14 -0.28 0.15 0.68 -3.04 0.00 0.00 177.10 174.75 3srn s VAL 63 N 1.25 0.13 0.48 -5.21 -7.23 0.55 -4.92 120.40 105.45 3srn s VAL 63 Ca 0.47 -1.50 -0.21 0.00 -1.81 0.00 0.00 61.98 58.94 3srn s VAL 63 Cb -0.19 -1.65 -0.08 0.00 0.56 0.00 0.00 36.38 35.01 3srn s VAL 63 CO 0.23 -0.58 1.05 0.00 -0.31 0.00 0.00 175.10 175.49 3srn s ALA 64 N -3.94 2.88 0.58 1.32 0.00 -1.26 -2.70 121.76 118.64 3srn s ALA 64 Ca 0.12 0.65 -0.03 0.00 0.00 0.00 0.00 51.96 52.70 3srn s ALA 64 Cb 0.06 -3.27 0.02 0.00 0.00 0.00 0.00 23.12 19.93 3srn s ALA 64 CO -0.05 -0.35 0.85 0.00 0.00 0.00 0.00 175.76 176.21 3srn s LYS 66 N -4.90 3.91 0.00 0.00 2.20 -1.26 -1.41 119.74 118.27 3srn s LYS 66 Ca 0.55 -2.02 0.00 0.00 -0.36 0.00 0.00 55.97 54.14 3srn s LYS 66 Cb -0.10 -5.27 0.00 0.00 -1.51 0.00 0.00 37.83 30.94 3srn s LYS 66 CO 0.42 -2.03 0.00 0.27 -0.36 0.00 0.00 175.35 173.65 3srn n ASN 67 N 7.34 0.00 0.00 1.43 6.94 -1.26 -4.97 115.26 124.74 3srn n ASN 67 Ca 0.39 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.95 3srn n ASN 67 Cb 0.46 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.88 3srn n ASN 67 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3srn n GLY 68 N 0.00 1.55 3.74 4.83 0.00 -0.50 -5.10 105.19 109.71 3srn n GLY 68 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 3srn n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3srn s GLN 69 N -0.30 2.61 0.00 1.61 1.11 -1.26 -4.62 119.66 118.81 3srn s GLN 69 Ca 0.00 1.74 0.19 0.00 0.01 0.00 0.00 55.36 57.30 3srn s GLN 69 Cb 0.00 -1.89 0.53 0.00 -1.01 0.00 0.00 33.01 30.64 3srn s GLN 69 CO 0.00 -1.47 1.44 -2.37 0.01 0.00 0.00 175.29 172.90 3srn n THR 70 N -2.17 0.78 -1.36 -0.19 5.66 -1.26 0.45 114.28 116.19 3srn n THR 70 Ca 0.13 -0.79 -0.19 0.00 -3.05 0.00 0.00 64.05 60.15 3srn n THR 70 Cb 0.50 0.43 0.17 0.00 -1.55 0.00 0.00 70.33 69.88 3srn n THR 70 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 3srn n ASN 71 N 1.25 3.91 -4.77 1.09 6.94 -1.26 -4.80 115.26 117.63 3srn n ASN 71 Ca 0.20 -3.70 -0.34 0.00 -0.02 0.00 0.00 54.58 50.72 3srn n ASN 71 Cb 0.51 -0.77 -0.07 0.00 -2.36 0.00 0.00 39.78 37.08 3srn n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3srn s TYR 73 N -1.11 0.92 -0.14 0.00 2.02 -0.29 -0.33 117.35 118.43 3srn s TYR 73 Ca 0.20 -0.18 -0.03 0.00 -0.37 0.00 0.00 57.07 56.69 3srn s TYR 73 Cb -0.12 -0.60 -0.03 0.00 -0.40 0.00 0.00 41.96 40.81 3srn s TYR 73 CO 0.10 -0.02 -0.02 -1.14 -1.57 0.00 0.00 175.55 172.90 3srn s GLN 74 N -0.21 3.51 0.34 -0.62 0.74 0.69 -2.00 119.66 122.12 3srn s GLN 74 Ca 0.03 -0.48 -0.29 0.00 0.05 0.00 0.00 55.36 54.68 3srn s GLN 74 Cb -0.04 -2.90 -0.11 0.00 1.10 0.00 0.00 33.01 31.06 3srn s GLN 74 CO -0.00 0.37 1.45 -1.54 -0.55 0.00 0.00 175.29 175.01 3srn s SER 75 N 0.04 6.50 0.13 6.67 1.04 -0.66 -1.75 113.70 125.67 3srn s SER 75 Ca 0.01 2.90 -0.17 0.00 0.48 0.00 0.00 55.95 59.17 3srn s SER 75 Cb -0.13 -2.65 -0.02 0.00 0.10 0.00 0.00 66.02 63.31 3srn s SER 75 CO 0.02 -0.77 1.72 1.88 0.98 0.00 0.00 173.24 177.07 3srn h TYR 76 N 3.59 0.47 -0.94 5.02 0.05 -1.94 -3.44 116.97 119.78 3srn h TYR 76 Ca -0.49 -0.02 -0.56 0.00 0.05 0.00 0.00 58.73 57.71 3srn h TYR 76 Cb 1.23 -0.15 -0.05 0.00 1.01 0.00 0.00 36.73 38.77 3srn h TYR 76 CO 0.55 0.39 -0.35 -1.54 -1.05 0.00 0.00 178.16 176.17 3srn s SER 77 N -5.66 4.69 0.64 3.88 1.04 -1.26 -5.07 113.70 111.97 3srn s SER 77 Ca -0.13 -1.11 -0.11 0.00 0.48 0.00 0.00 55.95 55.08 3srn s SER 77 Cb 0.10 0.05 -0.02 0.00 0.10 0.00 0.00 66.02 66.25 3srn s SER 77 CO 0.73 -0.92 1.04 0.42 0.98 0.00 0.00 173.24 175.49 3srn s THR 78 N -2.68 4.43 0.03 2.02 -4.23 -1.26 -4.45 115.64 109.50 3srn s THR 78 Ca 0.38 0.81 0.02 0.00 -1.18 0.00 0.00 61.69 61.73 3srn s THR 78 Cb -0.01 -3.68 -0.02 0.00 1.34 0.00 0.00 72.50 70.13 3srn s THR 78 CO 0.23 -1.01 -0.08 -0.04 -0.54 0.00 0.00 174.62 173.18 3srn s MET 79 N -5.06 0.56 0.16 3.99 -1.94 0.46 -4.86 119.30 112.61 3srn s MET 79 Ca 0.56 -0.64 -0.30 0.00 -1.71 0.00 0.00 55.69 53.61 3srn s MET 79 Cb -0.12 -0.42 -0.08 0.00 2.01 0.00 0.00 34.83 36.23 3srn s MET 79 CO 0.53 0.09 1.19 0.45 -0.01 0.00 0.00 175.02 177.27 3srn s SER 80 N -1.21 7.11 0.06 3.03 0.15 -1.26 -0.42 113.70 121.15 3srn s SER 80 Ca -0.06 2.18 -0.08 0.00 0.70 0.00 0.00 55.95 58.69 3srn s SER 80 Cb -0.08 -2.60 -0.00 0.00 -1.71 0.00 0.00 66.02 61.63 3srn s SER 80 CO 0.00 -0.37 0.17 0.27 1.20 0.00 0.00 173.24 174.51 3srn s ILE 81 N 0.12 0.13 -0.12 6.45 -4.36 0.15 -1.95 121.20 121.61 3srn s ILE 81 Ca 0.53 -1.06 0.01 0.00 -0.26 0.00 0.00 60.65 59.87 3srn s ILE 81 Cb -0.32 -1.08 0.02 0.00 1.25 0.00 0.00 42.46 42.34 3srn s ILE 81 CO 0.35 -0.58 -0.12 -0.89 0.24 0.00 0.00 174.94 173.94 3srn s THR 82 N -3.06 1.33 -0.31 8.37 2.01 0.12 -1.29 115.64 122.82 3srn s THR 82 Ca -0.01 -0.50 -0.20 0.00 0.31 0.00 0.00 61.69 61.29 3srn s THR 82 Cb 0.01 -1.27 -0.01 0.00 0.01 0.00 0.00 72.50 71.25 3srn s THR 82 CO -0.07 0.41 0.60 -0.62 -0.69 0.00 0.00 174.62 174.26 3srn s ASP 83 N 1.38 6.46 -0.20 3.53 2.15 0.63 -1.03 116.67 129.60 3srn s ASP 83 Ca 0.01 0.37 -0.05 0.00 0.43 0.00 0.00 52.55 53.31 3srn s ASP 83 Cb -0.13 -2.32 -0.03 0.00 -0.30 0.00 0.00 42.92 40.14 3srn s ASP 83 CO -0.07 -0.46 0.01 0.00 -0.17 0.00 0.00 175.17 174.48 3srn s ARG 85 N 1.00 0.20 0.19 0.00 3.52 -1.20 0.48 118.95 123.14 3srn s ARG 85 Ca 0.02 0.38 -0.32 0.00 -0.13 0.00 0.00 55.73 55.68 3srn s ARG 85 Cb -0.14 -0.02 -0.12 0.00 -1.56 0.00 0.00 34.95 33.10 3srn s ARG 85 CO 0.02 -0.10 1.72 0.39 -0.81 0.00 0.00 175.30 176.52 3srn n GLU 86 N 3.63 2.71 -2.90 5.12 1.02 -0.52 -0.24 120.64 129.46 3srn n GLU 86 Ca -0.20 0.98 -0.40 0.00 -0.02 0.00 0.00 57.16 57.52 3srn n GLU 86 Cb 0.55 -2.82 -0.05 0.00 -0.02 0.00 0.00 31.44 29.10 3srn n GLU 86 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3srn s THR 87 N 1.30 4.62 0.32 2.62 -4.23 -1.19 -4.86 115.64 114.21 3srn s THR 87 Ca 0.76 1.79 0.21 0.00 -1.18 0.00 0.00 61.69 63.27 3srn s THR 87 Cb -0.52 -4.19 0.31 0.00 1.34 0.00 0.00 72.50 69.44 3srn s THR 87 CO 0.33 0.36 0.79 0.61 -0.54 0.00 0.00 174.62 176.18 3srn n GLY 88 N 2.27 -0.48 2.77 3.99 0.00 -1.26 -0.30 105.19 112.16 3srn n GLY 88 Ca -0.01 0.29 -0.35 0.00 0.00 0.00 0.00 46.02 45.95 3srn n GLY 88 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3srn n SER 89 N -2.70 5.92 -3.86 1.61 3.41 -1.26 -4.97 113.62 111.77 3srn n SER 89 Ca 0.19 -3.63 -0.20 0.00 -0.26 0.00 0.00 58.87 54.96 3srn n SER 89 Cb 0.98 -0.92 -0.17 0.00 -0.26 0.00 0.00 64.21 63.84 3srn n SER 89 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3srn s SER 90 N -2.25 0.97 -0.01 4.04 0.15 0.58 -4.74 113.70 112.44 3srn s SER 90 Ca 0.42 -0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.97 3srn s SER 90 Cb 0.20 -0.40 0.01 0.00 -1.71 0.00 0.00 66.02 64.11 3srn s SER 90 CO -0.09 -0.09 -0.00 -0.54 1.20 0.00 0.00 173.24 173.71 3srn s LYS 91 N 1.13 0.12 0.36 5.44 -0.14 -1.22 -4.93 119.74 120.52 3srn s LYS 91 Ca -0.08 0.01 -0.28 0.00 -1.36 0.00 0.00 55.97 54.26 3srn s LYS 91 Cb -0.14 -0.20 -0.11 0.00 -1.68 0.00 0.00 37.83 35.71 3srn s LYS 91 CO -0.01 -0.03 1.49 -0.47 -0.76 0.00 0.00 175.35 175.57 3srn s TYR 92 N 0.32 2.63 -0.63 3.18 5.04 -1.26 -0.17 117.35 126.46 3srn s TYR 92 Ca -0.03 1.13 -0.01 0.00 -2.44 0.00 0.00 57.07 55.73 3srn s TYR 92 Cb -0.05 -4.01 0.48 0.00 0.35 0.00 0.00 41.96 38.73 3srn s TYR 92 CO -0.01 -3.01 1.99 -0.35 -1.34 0.00 0.00 175.55 172.83 3srn n PRO 93 N 0.69 2.67 -3.49 4.97 -0.04 -1.26 -4.98 135.00 133.56 3srn n PRO 93 Ca 0.02 -3.29 -0.27 0.00 -0.04 0.00 0.00 63.50 59.92 3srn n PRO 93 Cb 0.39 -2.27 -0.09 0.00 -0.04 0.00 0.00 33.50 31.49 3srn n PRO 93 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3srn n ASN 94 N -0.94 2.82 -4.66 3.54 5.03 0.75 -5.07 115.26 116.74 3srn n ASN 94 Ca 0.62 -3.22 -0.43 0.00 0.87 0.00 0.00 54.58 52.42 3srn n ASN 94 Cb 0.79 -0.68 -0.02 0.00 -1.02 0.00 0.00 39.78 38.85 3srn n ASN 94 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3srn s ALA 96 N 3.78 3.32 0.05 0.00 0.00 -1.26 -4.95 121.76 122.70 3srn s ALA 96 Ca 0.59 -0.98 0.02 0.00 0.00 0.00 0.00 51.96 51.59 3srn s ALA 96 Cb -0.23 -1.33 -0.03 0.00 0.00 0.00 0.00 23.12 21.53 3srn s ALA 96 CO 0.19 0.67 -0.07 0.71 0.00 0.00 0.00 175.76 177.26 3srn s TYR 97 N -1.15 0.65 -0.40 0.00 1.51 -1.26 -3.17 117.35 113.52 3srn s TYR 97 Ca 0.21 -0.61 -0.14 0.00 -1.01 0.00 0.00 57.07 55.52 3srn s TYR 97 Cb -0.12 -0.39 0.02 0.00 -0.11 0.00 0.00 41.96 41.36 3srn s TYR 97 CO 0.13 -0.13 0.29 0.21 -1.11 0.00 0.00 175.55 174.94 3srn s LYS 98 N -2.09 2.96 -0.07 -0.62 2.20 0.66 -4.72 119.74 118.07 3srn s LYS 98 Ca -0.06 -1.02 -0.27 0.00 -0.36 0.00 0.00 55.97 54.25 3srn s LYS 98 Cb -0.06 -3.94 -0.03 0.00 -1.51 0.00 0.00 37.83 32.29 3srn s LYS 98 CO -0.01 -0.74 0.89 -0.08 -0.36 0.00 0.00 175.35 175.05 3srn s THR 99 N 1.66 4.90 -0.25 3.43 -1.32 -1.26 -3.25 115.64 119.54 3srn s THR 99 Ca 0.05 1.83 0.03 0.00 -1.21 0.00 0.00 61.69 62.38 3srn s THR 99 Cb -0.19 -4.22 0.06 0.00 -1.51 0.00 0.00 72.50 66.64 3srn s THR 99 CO 0.10 0.13 -0.10 -0.89 -2.21 0.00 0.00 174.62 171.64 3srn s THR 100 N 1.37 2.07 0.27 5.08 2.01 -0.05 -4.94 115.64 121.45 3srn s THR 100 Ca 0.45 -1.55 -0.19 0.00 0.31 0.00 0.00 61.69 60.71 3srn s THR 100 Cb -0.19 -2.19 -0.09 0.00 0.01 0.00 0.00 72.50 70.04 3srn s THR 100 CO 0.21 -0.02 0.77 -1.58 -0.69 0.00 0.00 174.62 173.30 3srn s GLN 101 N 1.15 4.23 0.30 4.92 2.00 -1.26 -0.27 119.66 130.73 3srn s GLN 101 Ca -0.08 0.89 -0.20 0.00 -2.00 0.00 0.00 55.36 53.97 3srn s GLN 101 Cb -0.20 -2.73 0.02 0.00 0.80 0.00 0.00 33.01 30.91 3srn s GLN 101 CO -0.05 0.30 0.72 0.00 -0.50 0.00 0.00 175.29 175.76 3srn s ALA 102 N -1.68 -1.11 -0.32 1.58 0.00 -0.41 -4.96 121.76 114.86 3srn s ALA 102 Ca 0.47 -0.40 0.01 0.00 0.00 0.00 0.00 51.96 52.05 3srn s ALA 102 Cb -0.15 0.83 0.10 0.00 0.00 0.00 0.00 23.12 23.90 3srn s ALA 102 CO 0.20 -1.03 0.08 -0.80 0.00 0.00 0.00 175.76 174.21 3srn s ASN 103 N -2.95 4.38 0.14 0.00 0.01 -1.26 0.30 114.94 115.56 3srn s ASN 103 Ca 0.12 -1.88 -0.04 0.00 -0.71 0.00 0.00 52.86 50.35 3srn s ASN 103 Cb -0.06 -1.22 -0.03 0.00 0.41 0.00 0.00 41.25 40.35 3srn s ASN 103 CO 0.08 -0.40 0.14 -0.54 -1.51 0.00 0.00 177.10 174.87 3srn s LYS 104 N 1.28 0.99 -0.12 -0.60 1.02 0.44 -4.72 119.74 118.03 3srn s LYS 104 Ca 0.10 -1.33 -0.30 0.00 0.02 0.00 0.00 55.97 54.47 3srn s LYS 104 Cb -0.18 0.29 -0.01 0.00 -0.52 0.00 0.00 37.83 37.41 3srn s LYS 104 CO -0.17 -0.31 1.09 -1.01 -0.92 0.00 0.00 175.35 174.02 3srn s HIS 105 N -4.01 3.34 0.10 3.18 3.76 -1.26 -0.41 115.29 119.99 3srn s HIS 105 Ca 0.21 1.42 -0.04 0.00 -0.15 0.00 0.00 55.06 56.49 3srn s HIS 105 Cb 0.06 -3.29 -0.05 0.00 1.11 0.00 0.00 32.58 30.41 3srn s HIS 105 CO 0.00 -0.69 0.32 0.96 -0.85 0.00 0.00 174.74 174.49 3srn s ILE 106 N 2.39 5.23 -0.15 0.60 -4.36 -1.26 -4.91 121.20 118.74 3srn s ILE 106 Ca 0.50 -0.00 0.02 0.00 -0.26 0.00 0.00 60.65 60.91 3srn s ILE 106 Cb -0.20 -3.62 0.01 0.00 1.25 0.00 0.00 42.46 39.91 3srn s ILE 106 CO 0.17 0.13 -0.20 -0.63 0.24 0.00 0.00 174.94 174.65 3srn s ILE 107 N -1.55 1.98 0.16 8.37 1.01 -1.26 -1.65 121.20 128.27 3srn s ILE 107 Ca 0.37 -0.92 0.08 0.00 0.00 0.00 0.00 60.65 60.18 3srn s ILE 107 Cb -0.13 -1.78 -0.04 0.00 0.01 0.00 0.00 42.46 40.53 3srn s ILE 107 CO 0.23 0.53 -0.18 0.68 0.00 0.00 0.00 174.94 176.21 3srn s VAL 108 N 1.04 1.75 -0.19 2.92 -7.23 -0.85 -4.95 120.40 112.89 3srn s VAL 108 Ca -0.02 -1.89 -0.09 0.00 -1.81 0.00 0.00 61.98 58.17 3srn s VAL 108 Cb -0.14 -1.80 -0.05 0.00 0.56 0.00 0.00 36.38 34.95 3srn s VAL 108 CO -0.06 -0.33 0.12 0.00 -0.31 0.00 0.00 175.10 174.52 3srn s ALA 109 N -2.05 3.66 0.15 1.32 0.00 -1.26 -1.14 121.76 122.43 3srn s ALA 109 Ca 0.15 -0.69 0.11 0.00 0.00 0.00 0.00 51.96 51.52 3srn s ALA 109 Cb -0.06 -2.12 -0.04 0.00 0.00 0.00 0.00 23.12 20.90 3srn s ALA 109 CO 0.06 0.20 -0.25 0.00 0.00 0.00 0.00 175.76 175.77 3srn s GLU 111 N -2.24 1.07 -0.07 0.00 2.02 -1.26 -4.85 118.70 113.37 3srn s GLU 111 Ca 0.16 -1.13 -0.26 0.00 0.02 0.00 0.00 54.97 53.76 3srn s GLU 111 Cb -0.10 0.36 -0.03 0.00 0.10 0.00 0.00 34.13 34.47 3srn s GLU 111 CO 0.08 -0.38 0.84 0.20 0.02 0.00 0.00 175.26 176.02 3srn s GLY 112 N -2.94 2.58 0.00 -1.39 0.00 -1.26 -5.13 107.32 99.17 3srn s GLY 112 Ca 0.14 0.26 0.21 0.00 0.00 0.00 0.00 44.72 45.33 3srn s GLY 112 CO -0.03 1.50 1.16 -2.01 0.00 0.00 0.00 173.10 173.73