#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rbb s GLU 2 N 0.00 4.18 0.64 1.64 2.12 -1.26 -4.98 118.70 121.05 1rbb s GLU 2 Ca 0.00 2.44 -0.11 0.00 0.36 0.00 0.00 54.97 57.66 1rbb s GLU 2 Cb 0.00 -3.18 -0.02 0.00 0.26 0.00 0.00 34.13 31.19 1rbb s GLU 2 CO 0.00 -0.67 1.04 0.95 -0.54 0.00 0.00 175.26 176.04 1rbb s THR 3 N 1.32 4.48 0.20 -1.70 -4.23 -1.26 -4.91 115.64 109.54 1rbb s THR 3 Ca 0.72 0.81 -0.09 0.00 -1.18 0.00 0.00 61.69 61.95 1rbb s THR 3 Cb -0.45 -3.72 0.13 0.00 1.34 0.00 0.00 72.50 69.79 1rbb s THR 3 CO 0.32 -1.05 1.75 0.00 -0.54 0.00 0.00 174.62 175.09 1rbb h ALA 4 N -0.45 0.95 -0.69 3.99 0.00 -1.94 -0.77 119.26 120.36 1rbb h ALA 4 Ca -0.44 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.23 1rbb h ALA 4 Cb 1.20 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 1rbb h ALA 4 CO 0.60 0.61 0.29 0.00 0.00 0.00 0.00 179.25 180.75 1rbb h ALA 5 N 1.12 1.21 0.07 0.00 0.00 -1.87 -1.91 119.26 117.89 1rbb h ALA 5 Ca 0.24 -0.16 -0.25 0.00 0.00 0.00 0.00 54.91 54.73 1rbb h ALA 5 Cb 0.27 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1rbb h ALA 5 CO -0.01 0.58 -1.10 0.00 0.00 0.00 0.00 179.25 178.71 1rbb h ALA 6 N 1.33 0.22 -0.63 0.00 0.00 -1.85 -3.16 119.26 115.17 1rbb h ALA 6 Ca 0.23 -0.80 0.03 0.00 0.00 0.00 0.00 54.91 54.38 1rbb h ALA 6 Cb 0.16 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1rbb h ALA 6 CO -0.02 0.88 0.38 -0.22 0.00 0.00 0.00 179.25 180.27 1rbb h LYS 7 N 0.15 0.72 -0.05 0.00 1.63 -0.95 -1.01 116.57 117.06 1rbb h LYS 7 Ca -0.11 -0.04 0.01 0.00 -0.85 0.00 0.00 60.65 59.66 1rbb h LYS 7 Cb 1.79 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 33.24 1rbb h LYS 7 CO 0.19 0.48 -0.02 0.35 -3.45 0.00 0.00 179.45 176.99 1rbb h PHE 8 N 0.74 -0.05 -0.55 1.91 3.57 -1.35 0.22 116.94 121.42 1rbb h PHE 8 Ca 0.26 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.81 1rbb h PHE 8 Cb 0.05 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 1rbb h PHE 8 CO -0.06 -0.04 0.36 0.93 -2.23 0.00 0.00 178.31 177.28 1rbb h GLU 9 N -0.02 0.55 -0.05 1.11 5.08 -1.48 1.28 114.58 121.05 1rbb h GLU 9 Ca 0.03 -0.03 -0.23 0.00 -1.00 0.00 0.00 59.36 58.12 1rbb h GLU 9 Cb 0.06 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.20 1rbb h GLU 9 CO -0.06 0.36 -0.91 -0.09 -1.00 0.00 0.00 179.01 177.30 1rbb h ARG 10 N 0.56 0.60 0.01 2.33 2.43 -0.15 -2.23 114.38 117.94 1rbb h ARG 10 Ca 0.23 -0.59 -0.29 0.00 -0.81 0.00 0.00 59.98 58.52 1rbb h ARG 10 Cb 0.20 0.15 -0.05 0.00 -0.42 0.00 0.00 29.97 29.86 1rbb h ARG 10 CO -0.06 1.20 -1.70 1.96 -1.51 0.00 0.00 179.97 179.85 1rbb h GLN 11 N 0.37 0.02 -0.00 0.20 4.20 -0.32 -3.42 115.11 116.15 1rbb h GLN 11 Ca -0.08 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1rbb h GLN 11 Cb 1.55 0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.34 1rbb h GLN 11 CO 0.17 0.55 -0.01 0.72 -0.67 0.00 0.00 178.83 179.60 1rbb n HIS 12 N -3.08 0.00 -3.66 2.96 8.25 0.44 -4.74 115.22 115.39 1rbb n HIS 12 Ca -0.17 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 56.93 1rbb n HIS 12 Cb 1.05 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 32.07 1rbb n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1rbb s MET 13 N -0.49 4.12 -0.43 -0.41 -1.94 -0.84 0.19 119.30 119.51 1rbb s MET 13 Ca 0.00 -0.21 0.04 0.00 -1.71 0.00 0.00 55.69 53.82 1rbb s MET 13 Cb 0.00 -3.50 0.17 0.00 2.01 0.00 0.00 34.83 33.52 1rbb s MET 13 CO 0.01 0.13 0.41 0.34 -0.01 0.00 0.00 175.02 175.91 1rbb s ASP 14 N 0.83 0.90 0.00 3.03 2.15 0.36 -4.87 116.67 119.06 1rbb s ASP 14 Ca 0.09 -2.70 0.32 0.00 0.43 0.00 0.00 52.55 50.69 1rbb s ASP 14 Cb -0.13 0.08 1.84 0.00 -0.30 0.00 0.00 42.92 44.41 1rbb s ASP 14 CO 0.03 -0.16 2.20 -1.20 -0.17 0.00 0.00 175.17 175.87 1rbb n SER 15 N 2.98 0.00 0.03 -0.34 7.64 -1.26 -3.39 113.62 119.29 1rbb n SER 15 Ca 0.26 -0.85 0.11 0.00 1.01 0.00 0.00 58.87 59.40 1rbb n SER 15 Cb 0.49 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 1rbb n SER 15 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1rbb n SER 16 N -1.05 0.59 -4.88 6.43 3.41 -1.26 -4.84 113.62 112.02 1rbb n SER 16 Ca 0.22 -0.11 -0.36 0.00 -0.26 0.00 0.00 58.87 58.36 1rbb n SER 16 Cb 0.13 0.85 -0.06 0.00 -0.26 0.00 0.00 64.21 64.88 1rbb n SER 16 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1rbb s THR 17 N -3.25 5.50 -0.15 6.66 2.01 -1.22 -5.01 115.64 120.17 1rbb s THR 17 Ca 0.02 0.14 0.24 0.00 0.31 0.00 0.00 61.69 62.40 1rbb s THR 17 Cb 0.14 -3.43 0.28 0.00 0.01 0.00 0.00 72.50 69.50 1rbb s THR 17 CO 0.81 0.56 1.71 -1.28 -0.69 0.00 0.00 174.62 175.73 1rbb h SER 18 N 4.75 0.00 -5.79 3.53 0.87 -1.85 -3.44 113.55 111.61 1rbb h SER 18 Ca -0.54 0.00 0.38 0.00 -1.23 0.00 0.00 61.79 60.40 1rbb h SER 18 Cb 1.22 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 63.04 1rbb h SER 18 CO 0.60 0.13 0.97 0.00 -0.53 0.00 0.00 176.83 178.00 1rbb s ALA 19 N -3.36 -2.45 0.25 6.23 0.00 -1.26 -4.81 121.76 116.35 1rbb s ALA 19 Ca 0.04 1.01 -0.31 0.00 0.00 0.00 0.00 51.96 52.70 1rbb s ALA 19 Cb 0.07 0.19 -0.13 0.00 0.00 0.00 0.00 23.12 23.26 1rbb s ALA 19 CO 0.65 -1.02 1.45 0.00 0.00 0.00 0.00 175.76 176.85 1rbb n ALA 20 N -0.46 1.48 0.75 0.00 0.00 -1.26 -4.84 120.51 116.19 1rbb n ALA 20 Ca -0.08 0.40 0.09 0.00 0.00 0.00 0.00 53.44 53.85 1rbb n ALA 20 Cb 0.63 -2.32 0.08 0.00 0.00 0.00 0.00 19.45 17.83 1rbb n ALA 20 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1rbb n SER 21 N 2.14 2.51 -3.65 0.00 3.41 -1.26 -4.93 113.62 111.84 1rbb n SER 21 Ca 0.11 -1.75 -0.04 0.00 -0.26 0.00 0.00 58.87 56.93 1rbb n SER 21 Cb 0.33 -0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.26 1rbb n SER 21 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1rbb s SER 22 N -1.51 -0.19 0.01 4.04 1.04 -1.26 -5.02 113.70 110.81 1rbb s SER 22 Ca 0.21 -0.20 0.04 0.00 0.48 0.00 0.00 55.95 56.48 1rbb s SER 22 Cb 0.15 0.35 0.18 0.00 0.10 0.00 0.00 66.02 66.80 1rbb s SER 22 CO 0.23 -0.61 1.13 -1.54 0.98 0.00 0.00 173.24 173.42 1rbb n SER 23 N -0.38 0.02 -0.49 7.02 3.41 -1.26 -1.28 113.62 120.67 1rbb n SER 23 Ca -0.06 0.51 0.13 0.00 -0.26 0.00 0.00 58.87 59.18 1rbb n SER 23 Cb 0.61 -0.51 0.27 0.00 -0.26 0.00 0.00 64.21 64.32 1rbb n SER 23 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1rbb n ASN 24 N -1.53 1.73 -0.25 4.04 4.13 -1.26 -4.36 115.26 117.76 1rbb n ASN 24 Ca 0.01 -1.38 0.06 0.00 1.68 0.00 0.00 54.58 54.95 1rbb n ASN 24 Cb 0.04 0.17 0.18 0.00 -1.54 0.00 0.00 39.78 38.63 1rbb n ASN 24 CO 0.00 0.00 0.00 0.22 0.28 0.00 0.00 177.26 177.76 1rbb h TYR 25 N 2.39 0.19 0.01 3.10 3.20 -1.59 -2.87 116.97 121.39 1rbb h TYR 25 Ca 0.00 0.05 -0.00 0.00 3.14 0.00 0.00 58.73 61.92 1rbb h TYR 25 Cb 0.65 0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.96 1rbb h TYR 25 CO 0.00 -0.14 -0.00 0.00 -1.64 0.00 0.00 178.16 176.38 1rbb h ASN 27 N -0.48 0.14 0.00 0.00 2.35 -1.81 0.20 115.58 115.98 1rbb h ASN 27 Ca -0.00 0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.84 1rbb h ASN 27 Cb 0.47 0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.94 1rbb h ASN 27 CO 0.00 0.07 -0.08 0.06 -1.65 0.00 0.00 177.43 175.83 1rbb h GLN 28 N 0.35 0.00 -0.98 0.81 3.07 -1.51 -3.29 115.11 113.56 1rbb h GLN 28 Ca 0.33 0.00 0.34 0.00 0.09 0.00 0.00 58.65 59.41 1rbb h GLN 28 Cb 0.46 0.00 -0.17 0.00 0.08 0.00 0.00 27.48 27.85 1rbb h GLN 28 CO -0.36 0.34 0.42 0.52 0.09 0.00 0.00 178.83 179.84 1rbb h MET 29 N -1.00 0.11 -0.15 0.06 2.86 0.60 0.12 114.93 117.54 1rbb h MET 29 Ca -0.01 -0.01 -0.22 0.00 -2.06 0.00 0.00 59.70 57.40 1rbb h MET 29 Cb 0.39 -0.03 0.01 0.00 0.06 0.00 0.00 31.60 32.03 1rbb h MET 29 CO -0.01 0.07 -0.78 0.52 1.06 0.00 0.00 176.91 177.78 1rbb h MET 30 N 0.11 0.76 0.07 1.72 2.86 -0.75 -2.53 114.93 117.17 1rbb h MET 30 Ca 0.74 -0.62 -0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1rbb h MET 30 Cb 1.78 0.13 0.00 0.00 0.06 0.00 0.00 31.60 33.57 1rbb h MET 30 CO -0.74 1.23 -0.03 -0.22 1.06 0.00 0.00 176.91 178.21 1rbb h LYS 31 N 0.52 -0.09 -1.00 1.72 3.64 -1.47 0.95 116.57 120.84 1rbb h LYS 31 Ca -0.05 0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.44 1rbb h LYS 31 Cb 1.40 0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 33.17 1rbb h LYS 31 CO 0.16 0.37 0.63 0.66 -2.27 0.00 0.00 179.45 179.01 1rbb h SER 32 N -0.59 0.95 0.00 4.20 4.64 -0.89 0.50 113.55 122.35 1rbb h SER 32 Ca -0.01 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1rbb h SER 32 Cb 0.50 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1rbb h SER 32 CO 0.02 0.54 0.00 0.54 -0.87 0.00 0.00 176.83 177.05 1rbb n ARG 33 N -4.58 0.59 -2.28 4.77 5.12 -0.95 -4.85 116.66 114.48 1rbb n ARG 33 Ca 0.18 0.00 -0.08 0.00 -1.93 0.00 0.00 57.85 56.01 1rbb n ARG 33 Cb 0.31 -1.19 -0.01 0.00 -1.16 0.00 0.00 32.46 30.41 1rbb n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1rbb n ASN 34 N -0.04 -2.88 -0.11 0.55 4.13 0.17 -4.84 115.26 112.26 1rbb n ASN 34 Ca 0.00 0.28 0.15 0.00 1.68 0.00 0.00 54.58 56.69 1rbb n ASN 34 Cb 0.10 -2.54 0.73 0.00 -1.54 0.00 0.00 39.78 36.53 1rbb n ASN 34 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1rbb n LEU 35 N -2.54 0.37 -1.60 3.41 4.77 0.33 -3.26 117.00 118.49 1rbb n LEU 35 Ca -0.10 -0.01 -0.14 0.00 -0.03 0.00 0.00 56.01 55.73 1rbb n LEU 35 Cb 0.53 -0.12 0.16 0.00 -2.33 0.00 0.00 43.42 41.66 1rbb n LEU 35 CO 0.12 0.07 0.83 0.35 -1.33 0.00 0.00 177.39 177.42 1rbb n THR 36 N -0.89 2.80 -0.06 -5.08 -2.24 -1.22 -2.82 114.28 104.77 1rbb n THR 36 Ca 0.18 -2.82 -0.15 0.00 -2.27 0.00 0.00 64.05 58.99 1rbb n THR 36 Cb 0.23 -0.55 -0.13 0.00 -2.10 0.00 0.00 70.33 67.78 1rbb n THR 36 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1rbb h LYS 37 N 1.26 0.02 0.00 -0.78 1.63 -1.90 -3.36 116.57 113.44 1rbb h LYS 37 Ca 0.36 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.13 1rbb h LYS 37 Cb 1.76 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 33.40 1rbb h LYS 37 CO 0.71 1.02 -1.95 -0.25 -3.45 0.00 0.00 179.45 175.52 1rbb n ASP 38 N -4.57 0.14 -3.61 4.20 9.92 -1.26 -5.07 116.55 116.30 1rbb n ASP 38 Ca -0.11 -0.02 -0.01 0.00 -0.53 0.00 0.00 54.79 54.12 1rbb n ASP 38 Cb 0.51 1.95 -0.01 0.00 -0.64 0.00 0.00 41.12 42.93 1rbb n ASP 38 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1rbb s ARG 39 N -3.47 0.29 -0.59 -1.24 1.70 -1.26 -5.08 118.95 109.30 1rbb s ARG 39 Ca -0.07 -0.14 -0.26 0.00 -0.47 0.00 0.00 55.73 54.78 1rbb s ARG 39 Cb 0.14 0.11 -0.09 0.00 -0.57 0.00 0.00 34.95 34.54 1rbb s ARG 39 CO 0.89 -0.13 2.40 0.00 -1.08 0.00 0.00 175.30 177.38 1rbb n LYS 41 N 8.96 2.44 0.09 0.00 4.81 -1.13 -4.91 118.16 128.41 1rbb n LYS 41 Ca 0.40 0.87 -0.08 0.00 -0.87 0.00 0.00 58.31 58.63 1rbb n LYS 41 Cb 0.51 -2.64 -0.00 0.00 0.02 0.00 0.00 35.03 32.93 1rbb n LYS 41 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 1rbb h PRO 42 N 5.36 0.19 -3.41 1.64 0.13 -1.92 -3.43 132.00 130.56 1rbb h PRO 42 Ca -0.45 -0.20 -0.19 0.00 -0.87 0.00 0.00 66.00 64.29 1rbb h PRO 42 Cb 1.24 0.06 -0.26 0.00 0.13 0.00 0.00 31.00 32.17 1rbb h PRO 42 CO 0.84 0.94 -0.55 0.08 -0.23 0.00 0.00 178.00 179.08 1rbb s VAL 43 N -3.23 0.01 -0.20 1.56 1.01 -1.26 0.86 120.40 119.14 1rbb s VAL 43 Ca -0.03 -0.07 -0.17 0.00 0.00 0.00 0.00 61.98 61.71 1rbb s VAL 43 Cb 0.10 -0.23 0.05 0.00 0.00 0.00 0.00 36.38 36.31 1rbb s VAL 43 CO 0.82 -0.04 0.52 0.21 0.00 0.00 0.00 175.10 176.62 1rbb s ASN 44 N -0.08 -0.57 -0.09 3.32 2.47 0.19 -5.00 114.94 115.18 1rbb s ASN 44 Ca -0.02 1.07 -0.02 0.00 0.42 0.00 0.00 52.86 54.32 1rbb s ASN 44 Cb -0.02 1.06 -0.03 0.00 -1.45 0.00 0.00 41.25 40.81 1rbb s ASN 44 CO 0.00 -0.19 -0.00 -0.89 -3.72 0.00 0.00 177.10 172.30 1rbb s THR 45 N 0.50 4.27 -0.06 -5.21 2.01 -1.26 0.14 115.64 116.03 1rbb s THR 45 Ca -0.02 -0.26 0.05 0.00 0.31 0.00 0.00 61.69 61.77 1rbb s THR 45 Cb -0.04 -2.79 -0.02 0.00 0.01 0.00 0.00 72.50 69.66 1rbb s THR 45 CO -0.02 0.60 -0.21 -0.36 -0.69 0.00 0.00 174.62 173.94 1rbb s PHE 46 N -0.83 2.54 -0.20 4.92 0.08 0.29 -4.37 117.98 120.41 1rbb s PHE 46 Ca 0.13 -0.52 -0.06 0.00 0.12 0.00 0.00 56.93 56.60 1rbb s PHE 46 Cb -0.11 -1.62 -0.03 0.00 -0.57 0.00 0.00 43.02 40.68 1rbb s PHE 46 CO 0.02 -0.08 0.03 0.08 -0.10 0.00 0.00 175.22 175.17 1rbb s VAL 47 N -0.32 4.33 -0.87 -0.44 1.01 0.51 0.59 120.40 125.20 1rbb s VAL 47 Ca 0.02 -0.19 0.01 0.00 0.00 0.00 0.00 61.98 61.82 1rbb s VAL 47 Cb -0.13 -2.96 0.32 0.00 0.00 0.00 0.00 36.38 33.61 1rbb s VAL 47 CO 0.02 0.43 1.40 1.41 0.00 0.00 0.00 175.10 178.37 1rbb n HIS 48 N 4.01 3.12 -4.15 5.22 -0.00 -0.57 0.14 115.22 122.99 1rbb n HIS 48 Ca -0.17 -3.14 -0.11 0.00 -0.00 0.00 0.00 57.72 54.31 1rbb n HIS 48 Cb 0.52 -0.94 -0.09 0.00 -0.00 0.00 0.00 29.99 29.47 1rbb n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1rbb s GLU 49 N -3.61 1.19 0.67 -0.41 0.41 -1.26 -4.70 118.70 111.00 1rbb s GLU 49 Ca 0.40 -1.52 -0.17 0.00 -0.41 0.00 0.00 54.97 53.27 1rbb s GLU 49 Cb 0.18 0.30 0.00 0.00 -1.78 0.00 0.00 34.13 32.83 1rbb s GLU 49 CO -0.07 -0.40 1.24 -1.54 -0.49 0.00 0.00 175.26 173.99 1rbb s SER 50 N -3.11 4.56 0.24 -0.19 1.04 -1.26 -4.49 113.70 110.49 1rbb s SER 50 Ca 0.33 2.46 -0.06 0.00 0.48 0.00 0.00 55.95 59.16 1rbb s SER 50 Cb 0.06 -2.60 0.25 0.00 0.10 0.00 0.00 66.02 63.83 1rbb s SER 50 CO 0.09 -2.02 1.92 0.25 0.98 0.00 0.00 173.24 174.46 1rbb h LEU 51 N 0.27 1.10 -0.11 2.42 5.85 -1.98 0.32 115.31 123.17 1rbb h LEU 51 Ca -0.49 -0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.18 1rbb h LEU 51 Cb 1.31 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 42.07 1rbb h LEU 51 CO 0.52 0.79 0.00 0.00 -0.34 0.00 0.00 178.44 179.41 1rbb h ALA 52 N 1.36 0.15 -0.61 1.25 0.00 -1.98 1.89 119.26 121.33 1rbb h ALA 52 Ca 0.36 -0.18 0.18 0.00 0.00 0.00 0.00 54.91 55.26 1rbb h ALA 52 Cb -0.13 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1rbb h ALA 52 CO -0.08 -0.16 0.44 -0.44 0.00 0.00 0.00 179.25 179.00 1rbb h ASP 53 N -0.06 0.01 0.00 0.00 3.32 -1.79 0.99 116.42 118.88 1rbb h ASP 53 Ca 0.03 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.92 1rbb h ASP 53 Cb 0.35 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 1rbb h ASP 53 CO 0.01 0.00 -0.88 0.58 -1.72 0.00 0.00 179.24 177.23 1rbb h VAL 54 N 0.01 1.15 -0.51 -1.35 2.07 0.41 -3.30 116.25 114.73 1rbb h VAL 54 Ca 0.29 -2.20 0.15 0.00 0.82 0.00 0.00 66.70 65.76 1rbb h VAL 54 Cb 1.15 2.52 -0.02 0.00 -1.52 0.00 0.00 31.29 33.42 1rbb h VAL 54 CO -0.01 0.39 0.45 1.56 0.02 0.00 0.00 177.57 179.98 1rbb h GLN 55 N -1.00 0.00 0.00 1.57 4.20 0.31 0.40 115.11 120.59 1rbb h GLN 55 Ca -0.24 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.41 1rbb h GLN 55 Cb 1.20 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.97 1rbb h GLN 55 CO -0.15 0.00 -0.29 0.00 -0.67 0.00 0.00 178.83 177.72 1rbb h ALA 56 N 1.58 1.03 -0.02 3.87 0.00 -0.91 -1.51 119.26 123.31 1rbb h ALA 56 Ca 0.24 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1rbb h ALA 56 Cb 1.14 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1rbb h ALA 56 CO -0.00 0.37 0.03 0.28 0.00 0.00 0.00 179.25 179.93 1rbb h VAL 57 N 0.00 0.27 0.00 0.00 2.07 -0.27 -0.58 116.25 117.73 1rbb h VAL 57 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1rbb h VAL 57 Cb 0.80 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 31.54 1rbb h VAL 57 CO 0.04 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.63 1rbb n SER 59 N -1.42 2.87 0.00 0.00 7.64 -0.23 -4.97 113.62 117.51 1rbb n SER 59 Ca 0.03 -2.72 0.00 0.00 1.01 0.00 0.00 58.87 57.19 1rbb n SER 59 Cb 0.10 -0.36 0.00 0.00 -1.01 0.00 0.00 64.21 62.93 1rbb n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rbb n GLN 60 N -0.70 3.09 -2.38 1.43 6.02 0.02 -4.95 117.38 119.91 1rbb n GLN 60 Ca 0.14 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.70 1rbb n GLN 60 Cb 0.62 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.86 1rbb n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1rbb s LYS 61 N 4.06 3.91 0.01 -1.09 2.20 -1.12 -4.81 119.74 122.91 1rbb s LYS 61 Ca 0.00 1.33 -0.30 0.00 -0.36 0.00 0.00 55.97 56.64 1rbb s LYS 61 Cb 0.00 -3.90 -0.06 0.00 -1.51 0.00 0.00 37.83 32.37 1rbb s LYS 61 CO 0.00 -1.12 1.36 1.21 -0.36 0.00 0.00 175.35 176.43 1rbb s ASN 62 N 2.96 6.89 0.12 1.43 3.84 -1.26 0.10 114.94 129.01 1rbb s ASN 62 Ca 0.58 2.09 0.04 0.00 0.21 0.00 0.00 52.86 55.79 1rbb s ASN 62 Cb -0.18 -2.56 -0.04 0.00 -0.55 0.00 0.00 41.25 37.91 1rbb s ASN 62 CO 0.24 -0.67 -0.10 0.68 -2.79 0.00 0.00 177.10 174.45 1rbb s VAL 63 N 2.10 1.02 0.34 -5.21 -7.23 0.18 -4.89 120.40 106.71 1rbb s VAL 63 Ca 0.62 -1.83 -0.27 0.00 -1.81 0.00 0.00 61.98 58.70 1rbb s VAL 63 Cb -0.31 -1.59 -0.09 0.00 0.56 0.00 0.00 36.38 34.95 1rbb s VAL 63 CO 0.27 -0.65 1.08 0.00 -0.31 0.00 0.00 175.10 175.48 1rbb s ALA 64 N -2.88 3.24 0.60 1.32 0.00 -1.26 -2.73 121.76 120.06 1rbb s ALA 64 Ca 0.10 0.81 -0.09 0.00 0.00 0.00 0.00 51.96 52.78 1rbb s ALA 64 Cb -0.00 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.80 1rbb s ALA 64 CO -0.00 -0.20 0.97 0.00 0.00 0.00 0.00 175.76 176.52 1rbb h LYS 66 N -0.25 0.16 0.00 0.00 2.10 -1.92 -1.30 116.57 115.36 1rbb h LYS 66 Ca -0.45 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 1rbb h LYS 66 Cb 1.22 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 32.51 1rbb h LYS 66 CO 0.62 0.11 0.00 0.27 -2.00 0.00 0.00 179.45 178.45 1rbb n ASN 67 N -4.45 0.00 0.00 7.07 6.94 -1.26 -4.87 115.26 118.69 1rbb n ASN 67 Ca 0.07 -1.57 0.00 0.00 -0.02 0.00 0.00 54.58 53.06 1rbb n ASN 67 Cb 0.38 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.80 1rbb n ASN 67 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1rbb n GLY 68 N 0.38 2.72 3.87 4.83 0.00 -0.49 -5.02 105.19 111.49 1rbb n GLY 68 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1rbb n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rbb s GLN 69 N -0.11 3.81 0.00 1.61 -0.21 -1.26 -4.79 119.66 118.71 1rbb s GLN 69 Ca 0.00 0.43 0.21 0.00 0.02 0.00 0.00 55.36 56.01 1rbb s GLN 69 Cb 0.00 -2.46 0.50 0.00 1.00 0.00 0.00 33.01 32.05 1rbb s GLN 69 CO 0.00 0.07 1.42 -2.37 -2.12 0.00 0.00 175.29 172.29 1rbb n THR 70 N -0.95 0.79 0.72 -0.19 5.66 -1.26 0.17 114.28 119.21 1rbb n THR 70 Ca 0.02 -0.90 -0.02 0.00 -3.05 0.00 0.00 64.05 60.11 1rbb n THR 70 Cb 0.54 0.70 0.04 0.00 -1.55 0.00 0.00 70.33 70.05 1rbb n THR 70 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1rbb n ASN 71 N 1.39 2.52 -4.92 1.09 6.94 -1.26 -4.77 115.26 116.25 1rbb n ASN 71 Ca 0.20 -2.18 -0.24 0.00 -0.02 0.00 0.00 54.58 52.34 1rbb n ASN 71 Cb 0.58 -0.54 -0.03 0.00 -2.36 0.00 0.00 39.78 37.43 1rbb n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rbb s TYR 73 N -1.89 -0.19 -0.13 0.00 2.02 -0.63 -0.65 117.35 115.88 1rbb s TYR 73 Ca 0.34 0.46 -0.03 0.00 -0.37 0.00 0.00 57.07 57.47 1rbb s TYR 73 Cb -0.10 0.06 -0.03 0.00 -0.40 0.00 0.00 41.96 41.50 1rbb s TYR 73 CO 0.28 -0.09 -0.04 -1.14 -1.57 0.00 0.00 175.55 172.98 1rbb s GLN 74 N 0.09 3.45 -0.13 -0.62 0.74 0.28 -2.37 119.66 121.10 1rbb s GLN 74 Ca -0.00 -0.52 -0.36 0.00 0.05 0.00 0.00 55.36 54.53 1rbb s GLN 74 Cb -0.01 -2.84 -0.13 0.00 1.10 0.00 0.00 33.01 31.13 1rbb s GLN 74 CO 0.00 0.35 1.83 -1.13 -0.55 0.00 0.00 175.29 175.80 1rbb n SER 75 N 3.19 3.14 -0.20 6.67 3.41 -0.58 -2.80 113.62 126.45 1rbb n SER 75 Ca -0.18 1.00 -0.05 0.00 -0.26 0.00 0.00 58.87 59.39 1rbb n SER 75 Cb 0.53 -1.31 0.05 0.00 -0.26 0.00 0.00 64.21 63.22 1rbb n SER 75 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 1rbb h TYR 76 N 8.53 0.68 -3.00 7.33 0.05 -1.94 -3.43 116.97 125.20 1rbb h TYR 76 Ca -0.48 0.02 -0.51 0.00 0.05 0.00 0.00 58.73 57.81 1rbb h TYR 76 Cb 1.28 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 38.79 1rbb h TYR 76 CO 0.84 0.40 -0.21 -1.12 -1.05 0.00 0.00 178.16 177.02 1rbb s SER 77 N -5.66 6.39 0.55 3.88 0.01 -1.26 -5.05 113.70 112.56 1rbb s SER 77 Ca -0.13 0.56 -0.14 0.00 1.31 0.00 0.00 55.95 57.55 1rbb s SER 77 Cb 0.14 -2.08 -0.06 0.00 0.21 0.00 0.00 66.02 64.23 1rbb s SER 77 CO 0.75 -0.17 0.99 0.42 0.41 0.00 0.00 173.24 175.64 1rbb s THR 78 N -2.07 4.62 0.07 1.44 -4.23 -1.26 -4.48 115.64 109.74 1rbb s THR 78 Ca 0.41 1.04 0.04 0.00 -1.18 0.00 0.00 61.69 62.00 1rbb s THR 78 Cb -0.11 -3.78 -0.03 0.00 1.34 0.00 0.00 72.50 69.92 1rbb s THR 78 CO 0.31 -0.86 -0.11 -0.04 -0.54 0.00 0.00 174.62 173.38 1rbb s MET 79 N -4.50 0.75 -0.04 3.99 -1.94 -0.72 -4.83 119.30 112.01 1rbb s MET 79 Ca 0.57 -0.99 -0.30 0.00 -1.71 0.00 0.00 55.69 53.26 1rbb s MET 79 Cb -0.10 -0.57 -0.05 0.00 2.01 0.00 0.00 34.83 36.11 1rbb s MET 79 CO 0.40 0.11 1.55 -1.54 -0.01 0.00 0.00 175.02 175.53 1rbb s SER 80 N -1.98 6.73 0.13 3.03 1.04 -1.26 -2.18 113.70 119.21 1rbb s SER 80 Ca -0.01 2.17 0.07 0.00 0.48 0.00 0.00 55.95 58.66 1rbb s SER 80 Cb -0.07 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.47 1rbb s SER 80 CO 0.01 -0.86 -0.16 0.27 0.98 0.00 0.00 173.24 173.48 1rbb s ILE 81 N 3.47 1.53 -0.18 -1.02 -4.36 0.03 -1.51 121.20 119.14 1rbb s ILE 81 Ca 0.69 -1.72 -0.00 0.00 -0.26 0.00 0.00 60.65 59.36 1rbb s ILE 81 Cb -0.32 -1.60 0.01 0.00 1.25 0.00 0.00 42.46 41.80 1rbb s ILE 81 CO 0.27 -0.31 -0.15 -0.89 0.24 0.00 0.00 174.94 174.10 1rbb s THR 82 N -1.89 2.57 -0.05 8.37 2.01 0.20 -1.09 115.64 125.76 1rbb s THR 82 Ca 0.10 -0.78 -0.20 0.00 0.31 0.00 0.00 61.69 61.12 1rbb s THR 82 Cb -0.06 -2.11 -0.05 0.00 0.01 0.00 0.00 72.50 70.29 1rbb s THR 82 CO 0.04 0.50 0.56 -0.62 -0.69 0.00 0.00 174.62 174.41 1rbb s ASP 83 N 1.19 6.88 -0.13 3.53 2.15 0.20 0.10 116.67 130.59 1rbb s ASP 83 Ca 0.02 1.04 0.01 0.00 0.43 0.00 0.00 52.55 54.05 1rbb s ASP 83 Cb -0.14 -2.34 0.02 0.00 -0.30 0.00 0.00 42.92 40.16 1rbb s ASP 83 CO -0.06 0.06 -0.14 0.00 -0.17 0.00 0.00 175.17 174.85 1rbb s ARG 85 N 1.33 1.81 0.21 0.00 6.06 -0.70 0.55 118.95 128.21 1rbb s ARG 85 Ca 0.01 -0.50 -0.32 0.00 -2.50 0.00 0.00 55.73 52.42 1rbb s ARG 85 Cb -0.14 -1.50 -0.12 0.00 0.06 0.00 0.00 34.95 33.26 1rbb s ARG 85 CO -0.07 0.10 1.67 -1.91 -2.50 0.00 0.00 175.30 172.59 1rbb n GLU 86 N 3.60 2.64 -2.49 5.12 2.13 0.25 0.08 120.64 131.97 1rbb n GLU 86 Ca -0.21 0.95 -0.32 0.00 0.66 0.00 0.00 57.16 58.24 1rbb n GLU 86 Cb 0.52 -2.77 -0.04 0.00 0.27 0.00 0.00 31.44 29.42 1rbb n GLU 86 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 1rbb s THR 87 N 0.91 4.46 1.02 6.31 -1.32 -0.60 -4.85 115.64 121.56 1rbb s THR 87 Ca 0.74 1.27 -0.14 0.00 -1.21 0.00 0.00 61.69 62.35 1rbb s THR 87 Cb -0.54 -3.67 0.09 0.00 -1.51 0.00 0.00 72.50 66.87 1rbb s THR 87 CO 0.36 -0.58 0.42 0.61 -2.21 0.00 0.00 174.62 173.22 1rbb n GLY 88 N -1.30 -1.98 2.58 6.08 0.00 -1.26 -0.45 105.19 108.86 1rbb n GLY 88 Ca 0.07 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1rbb n GLY 88 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rbb n SER 89 N -2.04 0.00 -4.74 1.61 7.64 -1.26 -4.99 113.62 109.83 1rbb n SER 89 Ca 0.05 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.52 1rbb n SER 89 Cb 0.56 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.74 1rbb n SER 89 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1rbb s SER 90 N 0.03 6.45 -0.22 6.43 0.15 0.41 -4.84 113.70 122.11 1rbb s SER 90 Ca 0.00 2.85 -0.04 0.00 0.70 0.00 0.00 55.95 59.47 1rbb s SER 90 Cb 0.00 -2.62 0.11 0.00 -1.71 0.00 0.00 66.02 61.80 1rbb s SER 90 CO 0.00 -0.87 0.31 -1.59 1.20 0.00 0.00 173.24 172.29 1rbb s LYS 91 N -0.15 0.27 0.21 5.44 -2.85 0.24 -4.84 119.74 118.06 1rbb s LYS 91 Ca 0.64 0.45 -0.24 0.00 -1.00 0.00 0.00 55.97 55.83 1rbb s LYS 91 Cb -0.46 -0.68 -0.15 0.00 -2.06 0.00 0.00 37.83 34.48 1rbb s LYS 91 CO 0.44 -0.60 0.40 0.98 0.10 0.00 0.00 175.35 176.67 1rbb n TYR 92 N 5.35 -0.66 1.09 1.78 9.36 -1.26 0.29 117.16 133.10 1rbb n TYR 92 Ca -0.05 0.81 0.11 0.00 3.32 0.00 0.00 57.90 62.09 1rbb n TYR 92 Cb 0.50 -1.71 0.58 0.00 -0.63 0.00 0.00 39.34 38.08 1rbb n TYR 92 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1rbb n PRO 93 N 0.93 0.34 -3.34 2.98 -0.04 -1.26 -4.88 135.00 129.74 1rbb n PRO 93 Ca 0.15 0.07 -0.42 0.00 -0.04 0.00 0.00 63.50 63.26 1rbb n PRO 93 Cb 0.24 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.19 1rbb n PRO 93 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1rbb n ASN 94 N -1.27 5.35 -4.78 3.54 4.13 0.14 -5.03 115.26 117.34 1rbb n ASN 94 Ca 0.11 -3.16 -0.39 0.00 1.68 0.00 0.00 54.58 52.82 1rbb n ASN 94 Cb 0.18 -1.25 -0.06 0.00 -1.54 0.00 0.00 39.78 37.10 1rbb n ASN 94 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1rbb s ALA 96 N -1.20 0.57 0.02 0.00 0.00 -1.26 -4.85 121.76 115.03 1rbb s ALA 96 Ca 0.37 -0.36 0.03 0.00 0.00 0.00 0.00 51.96 51.99 1rbb s ALA 96 Cb -0.22 -0.11 -0.01 0.00 0.00 0.00 0.00 23.12 22.77 1rbb s ALA 96 CO 0.26 0.12 -0.09 0.71 0.00 0.00 0.00 175.76 176.75 1rbb s TYR 97 N -0.34 0.78 -0.15 0.00 2.02 -1.26 -1.56 117.35 116.85 1rbb s TYR 97 Ca 0.01 -0.27 -0.20 0.00 -0.37 0.00 0.00 57.07 56.23 1rbb s TYR 97 Cb -0.04 -0.48 -0.03 0.00 -0.40 0.00 0.00 41.96 41.01 1rbb s TYR 97 CO -0.00 -0.02 0.58 0.21 -1.57 0.00 0.00 175.55 174.75 1rbb s LYS 98 N -0.76 4.29 -0.30 -0.62 2.47 0.11 -4.65 119.74 120.29 1rbb s LYS 98 Ca -0.01 0.59 -0.11 0.00 -1.56 0.00 0.00 55.97 54.88 1rbb s LYS 98 Cb -0.06 -3.51 -0.03 0.00 -1.46 0.00 0.00 37.83 32.78 1rbb s LYS 98 CO 0.00 -0.04 0.18 0.99 0.16 0.00 0.00 175.35 176.64 1rbb s THR 99 N 1.25 5.01 -0.17 3.43 2.01 -1.26 -1.72 115.64 124.19 1rbb s THR 99 Ca 0.29 -0.11 -0.02 0.00 0.31 0.00 0.00 61.69 62.16 1rbb s THR 99 Cb -0.16 -3.47 -0.01 0.00 0.01 0.00 0.00 72.50 68.87 1rbb s THR 99 CO 0.12 0.15 -0.10 -0.89 -0.69 0.00 0.00 174.62 173.21 1rbb s THR 100 N 1.70 3.09 0.05 -0.82 2.01 0.04 -4.90 115.64 116.81 1rbb s THR 100 Ca 0.06 -0.62 -0.22 0.00 0.31 0.00 0.00 61.69 61.23 1rbb s THR 100 Cb -0.16 -2.34 -0.06 0.00 0.01 0.00 0.00 72.50 69.94 1rbb s THR 100 CO 0.09 0.49 0.65 -1.58 -0.69 0.00 0.00 174.62 173.58 1rbb s GLN 101 N 0.89 4.36 0.25 4.92 2.00 -1.26 0.62 119.66 131.44 1rbb s GLN 101 Ca -0.02 0.87 -0.11 0.00 -2.00 0.00 0.00 55.36 54.10 1rbb s GLN 101 Cb -0.15 -3.31 -0.01 0.00 0.80 0.00 0.00 33.01 30.34 1rbb s GLN 101 CO 0.00 0.45 0.44 0.00 -0.50 0.00 0.00 175.29 175.68 1rbb s ALA 102 N -0.52 -0.02 -0.21 1.58 0.00 -0.25 -4.98 121.76 117.36 1rbb s ALA 102 Ca 0.33 -1.02 -0.01 0.00 0.00 0.00 0.00 51.96 51.26 1rbb s ALA 102 Cb -0.20 1.11 0.06 0.00 0.00 0.00 0.00 23.12 24.09 1rbb s ALA 102 CO 0.20 -0.82 -0.01 -0.80 0.00 0.00 0.00 175.76 174.33 1rbb s ASN 103 N -3.05 3.30 0.21 0.00 -0.87 -1.26 -0.79 114.94 112.48 1rbb s ASN 103 Ca 0.25 -0.96 -0.17 0.00 -1.57 0.00 0.00 52.86 50.41 1rbb s ASN 103 Cb 0.00 -0.86 0.02 0.00 -0.02 0.00 0.00 41.25 40.40 1rbb s ASN 103 CO 0.10 -0.27 0.52 -0.54 -2.57 0.00 0.00 177.10 174.34 1rbb s LYS 104 N 1.65 1.42 0.30 -0.60 -0.14 -0.93 -4.77 119.74 116.68 1rbb s LYS 104 Ca -0.03 -0.93 -0.28 0.00 -1.36 0.00 0.00 55.97 53.37 1rbb s LYS 104 Cb -0.18 0.51 -0.09 0.00 -1.68 0.00 0.00 37.83 36.39 1rbb s LYS 104 CO -0.07 -0.60 1.01 -1.01 -0.76 0.00 0.00 175.35 173.92 1rbb s HIS 105 N -3.90 3.66 0.09 3.18 3.76 -1.26 -1.76 115.29 119.06 1rbb s HIS 105 Ca 0.11 1.77 0.04 0.00 -0.15 0.00 0.00 55.06 56.83 1rbb s HIS 105 Cb -0.01 -3.10 -0.04 0.00 1.11 0.00 0.00 32.58 30.54 1rbb s HIS 105 CO -0.01 -0.13 0.07 0.96 -0.85 0.00 0.00 174.74 174.78 1rbb s ILE 106 N -1.35 4.41 -0.22 0.60 -4.36 -1.26 0.23 121.20 119.25 1rbb s ILE 106 Ca 0.47 -0.85 -0.01 0.00 -0.26 0.00 0.00 60.65 60.00 1rbb s ILE 106 Cb -0.26 -3.13 0.02 0.00 1.25 0.00 0.00 42.46 40.34 1rbb s ILE 106 CO 0.33 0.10 -0.10 -0.63 0.24 0.00 0.00 174.94 174.87 1rbb s ILE 107 N -1.41 2.71 0.14 8.37 1.09 1.36 -1.52 121.20 131.94 1rbb s ILE 107 Ca 0.29 -0.89 0.09 0.00 -1.10 0.00 0.00 60.65 59.04 1rbb s ILE 107 Cb -0.12 -2.28 -0.04 0.00 -1.06 0.00 0.00 42.46 38.96 1rbb s ILE 107 CO 0.21 0.35 -0.15 0.68 -0.10 0.00 0.00 174.94 175.93 1rbb s VAL 108 N 1.34 2.94 -0.09 2.92 -7.23 -1.00 0.35 120.40 119.63 1rbb s VAL 108 Ca 0.03 -1.59 -0.06 0.00 -1.81 0.00 0.00 61.98 58.54 1rbb s VAL 108 Cb -0.15 -2.39 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 1rbb s VAL 108 CO -0.07 0.01 0.16 0.00 -0.31 0.00 0.00 175.10 174.89 1rbb s ALA 109 N -1.38 3.89 0.16 1.32 0.00 0.25 -1.61 121.76 124.39 1rbb s ALA 109 Ca 0.21 -0.66 0.10 0.00 0.00 0.00 0.00 51.96 51.61 1rbb s ALA 109 Cb -0.10 -1.96 -0.04 0.00 0.00 0.00 0.00 23.12 21.02 1rbb s ALA 109 CO 0.12 0.65 -0.22 0.00 0.00 0.00 0.00 175.76 176.30 1rbb s GLU 111 N -2.50 0.66 2.77 0.00 2.12 -0.86 -4.90 118.70 115.99 1rbb s GLU 111 Ca 0.16 -0.19 0.00 0.00 0.36 0.00 0.00 54.97 55.30 1rbb s GLU 111 Cb -0.08 0.30 0.00 0.00 0.26 0.00 0.00 34.13 34.62 1rbb s GLU 111 CO 0.07 -0.28 0.00 0.41 -0.54 0.00 0.00 175.26 174.93 1rbb n GLY 112 N -0.07 0.48 3.58 -1.50 0.00 -1.26 -3.35 105.19 103.07 1rbb n GLY 112 Ca -0.07 -0.90 -0.27 0.00 0.00 0.00 0.00 46.02 44.78 1rbb n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1rbb s ASN 113 N -4.00 4.34 0.18 1.61 3.04 -1.26 -3.22 114.94 115.63 1rbb s ASN 113 Ca 0.00 -0.51 -0.07 0.00 0.04 0.00 0.00 52.86 52.32 1rbb s ASN 113 Cb 0.00 -0.78 -0.06 0.00 -1.54 0.00 0.00 41.25 38.87 1rbb s ASN 113 CO 0.00 0.12 -0.02 -0.81 -3.04 0.00 0.00 177.10 173.35 1rbb n PRO 114 N 0.19 0.00 -2.88 0.43 -0.04 -1.26 -4.99 135.00 126.44 1rbb n PRO 114 Ca -0.11 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.92 1rbb n PRO 114 Cb 0.55 -0.38 -0.04 0.00 -0.04 0.00 0.00 33.50 33.58 1rbb n PRO 114 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1rbb s TYR 115 N -0.72 3.06 0.26 0.54 5.04 -1.20 -4.89 117.35 119.44 1rbb s TYR 115 Ca 0.22 0.58 0.01 0.00 -2.44 0.00 0.00 57.07 55.44 1rbb s TYR 115 Cb -0.21 -3.59 -0.03 0.00 0.35 0.00 0.00 41.96 38.48 1rbb s TYR 115 CO 0.25 -0.84 0.24 0.14 -1.34 0.00 0.00 175.55 174.01 1rbb s VAL 116 N 3.34 0.00 0.09 3.14 -7.23 -1.21 -4.87 120.40 113.65 1rbb s VAL 116 Ca 0.34 -1.91 -0.30 0.00 -1.81 0.00 0.00 61.98 58.31 1rbb s VAL 116 Cb -0.12 -2.49 -0.05 0.00 0.56 0.00 0.00 36.38 34.28 1rbb s VAL 116 CO 0.19 0.00 0.96 -2.84 -0.31 0.00 0.00 175.10 173.10 1rbb s PRO 117 N -3.80 4.67 0.00 4.82 0.02 -1.26 -2.03 135.00 137.42 1rbb s PRO 117 Ca 0.37 1.44 0.00 0.00 0.02 0.00 0.00 61.00 62.83 1rbb s PRO 117 Cb 0.04 -3.39 0.00 0.00 0.02 0.00 0.00 34.50 31.17 1rbb s PRO 117 CO 0.18 0.17 0.00 0.28 -0.33 0.00 0.00 177.00 177.29 1rbb n VAL 118 N 3.00 0.00 -3.80 3.83 0.31 0.17 -4.61 118.33 117.24 1rbb n VAL 118 Ca 0.03 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.23 1rbb n VAL 118 Cb 0.50 0.33 -0.11 0.00 -0.91 0.00 0.00 33.84 33.65 1rbb n VAL 118 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 1rbb s HIS 119 N -1.70 -0.22 -0.32 3.52 -3.43 -1.09 -4.51 115.29 107.54 1rbb s HIS 119 Ca 0.00 0.53 -0.16 0.00 -0.80 0.00 0.00 55.06 54.62 1rbb s HIS 119 Cb 0.00 0.07 -0.01 0.00 -1.43 0.00 0.00 32.58 31.21 1rbb s HIS 119 CO 0.00 -0.15 0.44 0.12 -2.00 0.00 0.00 174.74 173.14 1rbb s PHE 120 N -0.10 3.21 -0.23 0.38 2.19 -1.26 0.84 117.98 123.00 1rbb s PHE 120 Ca -0.02 0.19 -0.19 0.00 0.33 0.00 0.00 56.93 57.24 1rbb s PHE 120 Cb -0.02 -2.76 -0.16 0.00 -1.31 0.00 0.00 43.02 38.77 1rbb s PHE 120 CO 0.01 -0.42 -0.01 -3.47 1.83 0.00 0.00 175.22 173.15 1rbb n ASP 121 N 5.53 1.89 -3.61 6.13 2.03 1.07 -4.95 116.55 124.64 1rbb n ASP 121 Ca -0.07 0.40 -0.00 0.00 0.52 0.00 0.00 54.79 55.63 1rbb n ASP 121 Cb 0.49 -0.91 -0.01 0.00 -0.72 0.00 0.00 41.12 39.97 1rbb n ASP 121 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rbb s ALA 122 N -2.43 -2.27 0.06 -1.67 0.00 -0.27 -4.93 121.76 110.24 1rbb s ALA 122 Ca -0.32 1.40 0.07 0.00 0.00 0.00 0.00 51.96 53.11 1rbb s ALA 122 Cb 0.09 -0.05 -0.03 0.00 0.00 0.00 0.00 23.12 23.12 1rbb s ALA 122 CO 0.54 -0.78 -0.17 -1.54 0.00 0.00 0.00 175.76 173.82 1rbb s SER 123 N -2.48 3.92 0.00 0.00 1.04 -1.26 0.41 113.70 115.33 1rbb s SER 123 Ca 0.13 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.12 1rbb s SER 123 Cb 0.02 -0.64 0.00 0.00 0.10 0.00 0.00 66.02 65.50 1rbb s SER 123 CO -0.04 0.23 0.12 0.52 0.98 0.00 0.00 173.24 175.06