#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rtb n GLU 2 N 0.00 2.12 -2.52 1.64 1.02 -1.26 -4.98 120.64 116.66 1rtb n GLU 2 Ca 0.00 0.76 -0.39 0.00 -0.02 0.00 0.00 57.16 57.51 1rtb n GLU 2 Cb 0.00 -2.53 -0.04 0.00 -0.02 0.00 0.00 31.44 28.84 1rtb n GLU 2 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1rtb s THR 3 N 1.04 3.60 0.23 2.62 -4.23 -1.26 -4.90 115.64 112.74 1rtb s THR 3 Ca 0.80 1.53 -0.11 0.00 -1.18 0.00 0.00 61.69 62.73 1rtb s THR 3 Cb -0.69 -3.94 0.27 0.00 1.34 0.00 0.00 72.50 69.48 1rtb s THR 3 CO 0.39 0.30 1.62 0.00 -0.54 0.00 0.00 174.62 176.39 1rtb h ALA 4 N 3.58 0.55 -0.88 3.99 0.00 -1.96 -1.32 119.26 123.22 1rtb h ALA 4 Ca -0.47 0.26 0.22 0.00 0.00 0.00 0.00 54.91 54.92 1rtb h ALA 4 Cb 1.21 0.48 -0.05 0.00 0.00 0.00 0.00 17.79 19.43 1rtb h ALA 4 CO 0.66 -0.42 0.60 0.00 0.00 0.00 0.00 179.25 180.09 1rtb h ALA 5 N 1.69 2.44 0.00 0.00 0.00 -1.89 0.18 119.26 121.68 1rtb h ALA 5 Ca 0.35 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 55.04 1rtb h ALA 5 Cb 0.57 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1rtb h ALA 5 CO -0.69 -0.72 -1.38 0.00 0.00 0.00 0.00 179.25 176.47 1rtb h ALA 6 N 1.60 0.66 -0.23 0.00 0.00 -1.61 -3.23 119.26 116.45 1rtb h ALA 6 Ca 0.45 -1.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.23 1rtb h ALA 6 Cb 1.36 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.40 1rtb h ALA 6 CO -0.11 1.23 -0.06 -0.22 0.00 0.00 0.00 179.25 180.09 1rtb h LYS 7 N 0.00 0.44 -0.52 0.00 3.11 0.32 0.32 116.57 120.24 1rtb h LYS 7 Ca -0.17 -0.17 0.11 0.00 -2.81 0.00 0.00 60.65 57.60 1rtb h LYS 7 Cb 1.78 -0.02 -0.09 0.00 -1.00 0.00 0.00 32.23 32.89 1rtb h LYS 7 CO 0.08 0.67 -0.08 0.35 -2.81 0.00 0.00 179.45 177.66 1rtb h PHE 8 N 0.17 -0.18 -0.47 1.91 3.04 -1.20 0.17 116.94 120.39 1rtb h PHE 8 Ca 0.06 0.04 -0.06 0.00 3.98 0.00 0.00 57.97 61.99 1rtb h PHE 8 Cb 0.51 0.16 -0.02 0.00 2.56 0.00 0.00 35.95 39.16 1rtb h PHE 8 CO 0.05 -0.19 0.04 0.93 -2.02 0.00 0.00 178.31 177.13 1rtb h GLU 9 N 0.04 0.80 -0.04 1.11 5.08 -1.48 0.60 114.58 120.71 1rtb h GLU 9 Ca 0.26 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1rtb h GLU 9 Cb 0.40 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1rtb h GLU 9 CO -0.50 0.83 0.01 -0.09 -1.00 0.00 0.00 179.01 178.27 1rtb h ARG 10 N 0.66 0.06 0.00 2.33 2.43 -0.37 -0.34 114.38 119.16 1rtb h ARG 10 Ca 0.14 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 1rtb h ARG 10 Cb 0.44 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1rtb h ARG 10 CO 0.02 0.24 -0.08 1.96 -1.51 0.00 0.00 179.97 180.59 1rtb h GLN 11 N -0.12 0.00 0.00 0.20 4.20 -0.91 -3.39 115.11 115.09 1rtb h GLN 11 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1rtb h GLN 11 Cb 0.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1rtb h GLN 11 CO -0.00 0.08 0.00 0.72 -0.67 0.00 0.00 178.83 178.96 1rtb n HIS 12 N -3.14 0.00 -3.85 2.96 8.25 0.21 -4.61 115.22 115.04 1rtb n HIS 12 Ca 0.03 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.19 1rtb n HIS 12 Cb 0.49 0.00 -0.14 0.00 1.12 0.00 0.00 29.99 31.46 1rtb n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1rtb s MET 13 N -0.43 1.55 -0.65 -0.41 -1.94 -0.14 0.22 119.30 117.49 1rtb s MET 13 Ca 0.00 -2.17 -0.03 0.00 -1.71 0.00 0.00 55.69 51.78 1rtb s MET 13 Cb 0.00 -2.82 0.17 0.00 2.01 0.00 0.00 34.83 34.19 1rtb s MET 13 CO 0.00 -1.10 0.48 0.34 -0.01 0.00 0.00 175.02 174.73 1rtb s ASP 14 N 0.25 5.30 0.35 3.03 2.15 0.14 -4.88 116.67 123.00 1rtb s ASP 14 Ca 0.16 -2.95 0.18 0.00 0.43 0.00 0.00 52.55 50.37 1rtb s ASP 14 Cb -0.24 -1.86 0.47 0.00 -0.30 0.00 0.00 42.92 40.99 1rtb s ASP 14 CO -0.03 -0.35 1.63 0.28 -0.17 0.00 0.00 175.17 176.54 1rtb h SER 15 N 6.91 0.00 0.22 -0.34 0.02 -1.70 -3.31 113.55 115.36 1rtb h SER 15 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1rtb h SER 15 Cb 0.94 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.48 1rtb h SER 15 CO 0.72 0.41 0.00 -1.54 -1.14 0.00 0.00 176.83 175.28 1rtb n SER 16 N -3.39 0.00 -4.19 3.07 3.41 -1.26 -4.68 113.62 106.58 1rtb n SER 16 Ca 0.01 -0.53 -0.27 0.00 -0.26 0.00 0.00 58.87 57.81 1rtb n SER 16 Cb 0.59 -0.13 -0.16 0.00 -0.26 0.00 0.00 64.21 64.25 1rtb n SER 16 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1rtb s THR 17 N -2.25 1.61 0.29 6.66 2.01 -1.24 -5.02 115.64 117.70 1rtb s THR 17 Ca 0.35 -0.84 -0.01 0.00 0.31 0.00 0.00 61.69 61.49 1rtb s THR 17 Cb 0.19 -1.36 0.27 0.00 0.01 0.00 0.00 72.50 71.60 1rtb s THR 17 CO 0.36 0.46 1.94 -1.28 -0.69 0.00 0.00 174.62 175.40 1rtb h SER 18 N 5.97 0.96 -1.87 3.53 0.87 -1.88 -3.44 113.55 117.70 1rtb h SER 18 Ca -0.35 -0.01 0.18 0.00 -1.23 0.00 0.00 61.79 60.38 1rtb h SER 18 Cb 1.16 -0.22 -0.03 0.00 -0.44 0.00 0.00 62.40 62.87 1rtb h SER 18 CO 0.48 0.66 0.54 0.00 -0.53 0.00 0.00 176.83 177.98 1rtb n ALA 19 N -2.40 -2.31 -1.68 6.23 0.00 -1.26 -4.86 120.51 114.23 1rtb n ALA 19 Ca 0.12 -0.70 -0.45 0.00 0.00 0.00 0.00 53.44 52.41 1rtb n ALA 19 Cb 0.10 0.29 -0.03 0.00 0.00 0.00 0.00 19.45 19.81 1rtb n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rtb n ALA 20 N -1.39 1.45 1.10 0.00 0.00 -1.26 -4.94 120.51 115.48 1rtb n ALA 20 Ca -0.09 0.42 0.14 0.00 0.00 0.00 0.00 53.44 53.91 1rtb n ALA 20 Cb 0.43 -2.34 0.60 0.00 0.00 0.00 0.00 19.45 18.14 1rtb n ALA 20 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1rtb n SER 21 N 2.82 0.09 0.00 0.00 3.41 -1.26 -4.96 113.62 113.72 1rtb n SER 21 Ca 0.14 0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.98 1rtb n SER 21 Cb 0.31 -0.35 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 1rtb n SER 21 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1rtb n SER 22 N -1.43 0.00 0.00 4.04 3.41 -1.26 -5.04 113.62 113.34 1rtb n SER 22 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1rtb n SER 22 Cb 0.32 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.27 1rtb n SER 22 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1rtb n SER 23 N 0.00 0.00 -1.89 4.04 3.41 -1.26 -4.67 113.62 113.25 1rtb n SER 23 Ca 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1rtb n SER 23 Cb 0.00 0.00 0.33 0.00 -0.26 0.00 0.00 64.21 64.28 1rtb n SER 23 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1rtb n ASN 24 N 0.00 5.07 0.02 4.04 2.04 -1.26 -3.96 115.26 121.21 1rtb n ASN 24 Ca 0.00 -3.02 -0.12 0.00 -0.44 0.00 0.00 54.58 51.00 1rtb n ASN 24 Cb 0.00 -0.71 -0.06 0.00 -2.53 0.00 0.00 39.78 36.48 1rtb n ASN 24 CO 0.00 0.00 0.00 0.22 -0.44 0.00 0.00 177.26 177.04 1rtb h TYR 25 N 3.12 0.06 -0.74 -2.53 3.20 -1.93 0.59 116.97 118.74 1rtb h TYR 25 Ca 0.14 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.05 1rtb h TYR 25 Cb 2.10 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 40.30 1rtb h TYR 25 CO 1.14 0.07 0.45 0.00 -1.64 0.00 0.00 178.16 178.19 1rtb h ASN 27 N 0.86 0.35 -0.48 0.00 2.35 -1.68 0.25 115.58 117.23 1rtb h ASN 27 Ca 0.31 -0.43 0.10 0.00 -0.55 0.00 0.00 56.30 55.73 1rtb h ASN 27 Cb 0.09 -0.10 -0.10 0.00 0.05 0.00 0.00 38.32 38.27 1rtb h ASN 27 CO -0.14 0.70 -0.19 1.56 -1.65 0.00 0.00 177.43 177.71 1rtb h GLN 28 N -0.00 -0.08 -0.11 0.81 4.20 -0.56 -3.03 115.11 116.34 1rtb h GLN 28 Ca 0.03 0.01 -0.17 0.00 0.06 0.00 0.00 58.65 58.58 1rtb h GLN 28 Cb 0.58 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.37 1rtb h GLN 28 CO 0.03 -0.06 -0.67 0.52 -0.67 0.00 0.00 178.83 177.99 1rtb h MET 29 N -0.09 0.43 -0.42 1.46 2.86 -0.36 0.26 114.93 119.07 1rtb h MET 29 Ca 0.23 -0.32 -0.07 0.00 -2.06 0.00 0.00 59.70 57.48 1rtb h MET 29 Cb 0.44 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 1rtb h MET 29 CO -0.54 0.95 -0.03 0.52 1.06 0.00 0.00 176.91 178.87 1rtb h MET 30 N 0.31 0.69 0.28 1.72 2.86 -0.85 -0.18 114.93 119.76 1rtb h MET 30 Ca -0.02 -0.19 -0.01 0.00 -2.06 0.00 0.00 59.70 57.42 1rtb h MET 30 Cb 1.22 -0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.80 1rtb h MET 30 CO 0.12 0.73 -0.13 -0.22 1.06 0.00 0.00 176.91 178.46 1rtb h LYS 31 N 0.65 -0.36 0.00 1.72 3.64 -1.53 0.16 116.57 120.84 1rtb h LYS 31 Ca 0.13 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1rtb h LYS 31 Cb 0.45 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1rtb h LYS 31 CO 0.02 -0.24 0.00 -1.13 -2.27 0.00 0.00 179.45 175.83 1rtb n SER 32 N -4.27 0.00 -0.12 4.20 3.41 0.92 -1.36 113.62 116.40 1rtb n SER 32 Ca -0.05 -0.16 0.05 0.00 -0.26 0.00 0.00 58.87 58.46 1rtb n SER 32 Cb 0.15 -0.11 0.07 0.00 -0.26 0.00 0.00 64.21 64.06 1rtb n SER 32 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1rtb n ARG 33 N -1.11 1.41 -2.11 4.33 5.12 -0.19 -5.00 116.66 119.10 1rtb n ARG 33 Ca 0.07 -1.91 -0.19 0.00 -1.93 0.00 0.00 57.85 53.89 1rtb n ARG 33 Cb 0.06 -1.15 -0.03 0.00 -1.16 0.00 0.00 32.46 30.18 1rtb n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1rtb n ASN 34 N -0.88 -5.39 0.11 0.55 4.13 -0.47 -4.59 115.26 108.73 1rtb n ASN 34 Ca 0.08 0.13 -0.04 0.00 1.68 0.00 0.00 54.58 56.44 1rtb n ASN 34 Cb 0.54 -4.48 0.10 0.00 -1.54 0.00 0.00 39.78 34.40 1rtb n ASN 34 CO 0.00 0.00 0.00 -0.07 0.28 0.00 0.00 177.26 177.47 1rtb h LEU 35 N 0.00 0.07 -1.78 3.41 3.38 -0.89 -2.82 115.31 116.67 1rtb h LEU 35 Ca -0.43 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.49 1rtb h LEU 35 Cb 1.30 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 42.03 1rtb h LEU 35 CO 0.54 0.75 0.00 0.35 0.09 0.00 0.00 178.44 180.17 1rtb n THR 36 N -3.72 0.84 0.00 0.22 -2.24 -0.90 -3.25 114.28 105.22 1rtb n THR 36 Ca -0.01 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 1rtb n THR 36 Cb 0.69 -0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 1rtb n THR 36 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1rtb n LYS 37 N 0.19 0.00 0.27 -0.78 3.00 -1.07 -4.32 118.16 115.44 1rtb n LYS 37 Ca 0.08 0.00 0.16 0.00 -0.00 0.00 0.00 58.31 58.56 1rtb n LYS 37 Cb 0.54 -0.51 0.59 0.00 0.00 0.00 0.00 35.03 35.64 1rtb n LYS 37 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 1rtb h ASP 38 N 0.00 0.00 -1.93 3.14 3.32 -1.85 -3.46 116.42 115.65 1rtb h ASP 38 Ca 0.00 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.06 1rtb h ASP 38 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 1rtb h ASP 38 CO 0.00 0.01 0.19 -2.11 -1.72 0.00 0.00 179.24 175.61 1rtb n ARG 39 N -3.10 0.53 -3.52 3.56 0.00 -1.26 -5.12 116.66 107.75 1rtb n ARG 39 Ca 0.01 -1.07 -0.37 0.00 -0.00 0.00 0.00 57.85 56.42 1rtb n ARG 39 Cb 0.35 1.36 -0.08 0.00 -0.00 0.00 0.00 32.46 34.09 1rtb n ARG 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1rtb s LYS 41 N 0.95 4.04 0.19 0.00 2.20 -1.20 -4.90 119.74 121.01 1rtb s LYS 41 Ca 0.15 1.97 0.12 0.00 -0.36 0.00 0.00 55.97 57.85 1rtb s LYS 41 Cb -0.14 -3.99 0.66 0.00 -1.51 0.00 0.00 37.83 32.85 1rtb s LYS 41 CO 0.05 -1.00 0.73 -0.35 -0.36 0.00 0.00 175.35 174.43 1rtb n PRO 42 N 7.28 -0.02 -3.63 4.03 -0.04 -1.26 -4.57 135.00 136.78 1rtb n PRO 42 Ca 0.18 0.62 -0.04 0.00 -0.04 0.00 0.00 63.50 64.22 1rtb n PRO 42 Cb 0.44 -1.16 -0.05 0.00 -0.04 0.00 0.00 33.50 32.69 1rtb n PRO 42 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1rtb s VAL 43 N -4.58 0.00 -0.27 0.52 0.11 -1.25 -2.60 120.40 112.33 1rtb s VAL 43 Ca -0.04 0.00 -0.05 0.00 -2.93 0.00 0.00 61.98 58.97 1rtb s VAL 43 Cb 0.15 -1.00 0.15 0.00 -1.53 0.00 0.00 36.38 34.15 1rtb s VAL 43 CO 0.37 0.00 0.53 0.21 -3.33 0.00 0.00 175.10 172.88 1rtb s ASN 44 N -0.67 -0.78 0.02 3.54 2.47 0.32 -4.99 114.94 114.85 1rtb s ASN 44 Ca 0.07 0.93 -0.11 0.00 0.42 0.00 0.00 52.86 54.16 1rtb s ASN 44 Cb -0.02 1.83 -0.05 0.00 -1.45 0.00 0.00 41.25 41.56 1rtb s ASN 44 CO -0.09 -0.25 0.36 0.28 -3.72 0.00 0.00 177.10 173.68 1rtb s THR 45 N 2.76 5.14 -0.19 -5.21 -1.32 -1.26 -1.70 115.64 113.86 1rtb s THR 45 Ca 0.09 0.55 -0.07 0.00 -1.21 0.00 0.00 61.69 61.05 1rtb s THR 45 Cb -0.14 -3.64 -0.04 0.00 -1.51 0.00 0.00 72.50 67.18 1rtb s THR 45 CO -0.18 0.45 0.04 -0.36 -2.21 0.00 0.00 174.62 172.36 1rtb s PHE 46 N -1.22 3.17 -0.08 9.09 0.08 0.10 -4.39 117.98 124.73 1rtb s PHE 46 Ca 0.27 -0.09 -0.04 0.00 0.12 0.00 0.00 56.93 57.19 1rtb s PHE 46 Cb -0.15 -2.08 -0.04 0.00 -0.57 0.00 0.00 43.02 40.18 1rtb s PHE 46 CO 0.14 0.02 0.08 0.08 -0.10 0.00 0.00 175.22 175.44 1rtb s VAL 47 N 0.60 4.93 -0.67 -0.44 1.01 0.13 -1.39 120.40 124.58 1rtb s VAL 47 Ca 0.02 -0.08 0.05 0.00 0.00 0.00 0.00 61.98 61.97 1rtb s VAL 47 Cb -0.13 -3.15 0.24 0.00 0.00 0.00 0.00 36.38 33.33 1rtb s VAL 47 CO 0.02 0.55 0.74 1.41 0.00 0.00 0.00 175.10 177.82 1rtb n HIS 48 N 1.85 3.56 -3.90 5.22 8.25 -0.76 0.28 115.22 129.72 1rtb n HIS 48 Ca -0.18 -4.13 -0.09 0.00 -0.26 0.00 0.00 57.72 53.06 1rtb n HIS 48 Cb 0.54 -0.61 -0.05 0.00 1.12 0.00 0.00 29.99 31.00 1rtb n HIS 48 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1rtb s GLU 49 N -2.32 1.48 0.43 -0.41 0.41 -1.26 -4.45 118.70 112.58 1rtb s GLU 49 Ca 0.37 -1.10 -0.23 0.00 -0.41 0.00 0.00 54.97 53.60 1rtb s GLU 49 Cb 0.11 0.49 -0.08 0.00 -1.78 0.00 0.00 34.13 32.87 1rtb s GLU 49 CO -0.03 -0.62 1.09 -1.54 -0.49 0.00 0.00 175.26 173.66 1rtb s SER 50 N -2.96 6.53 0.15 -0.19 1.04 -1.26 -3.78 113.70 113.22 1rtb s SER 50 Ca 0.17 2.12 -0.18 0.00 0.48 0.00 0.00 55.95 58.54 1rtb s SER 50 Cb -0.01 -2.59 0.04 0.00 0.10 0.00 0.00 66.02 63.56 1rtb s SER 50 CO 0.04 -0.66 1.71 0.25 0.98 0.00 0.00 173.24 175.56 1rtb h LEU 51 N 2.28 -0.15 -0.62 2.42 5.85 -1.98 -1.99 115.31 121.12 1rtb h LEU 51 Ca -0.49 0.07 0.12 0.00 0.84 0.00 0.00 57.88 58.42 1rtb h LEU 51 Cb 1.23 0.13 -0.12 0.00 0.37 0.00 0.00 40.66 42.27 1rtb h LEU 51 CO 0.61 -0.04 -0.25 0.00 -0.34 0.00 0.00 178.44 178.42 1rtb h ALA 52 N 1.26 0.19 0.00 1.25 0.00 -1.98 0.25 119.26 120.23 1rtb h ALA 52 Ca 0.14 0.21 -0.05 0.00 0.00 0.00 0.00 54.91 55.21 1rtb h ALA 52 Cb 0.20 0.64 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1rtb h ALA 52 CO -0.25 -0.55 -0.25 -0.44 0.00 0.00 0.00 179.25 177.75 1rtb h ASP 53 N -0.09 0.00 -0.02 0.00 5.19 -1.80 -2.74 116.42 116.96 1rtb h ASP 53 Ca 0.27 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.61 1rtb h ASP 53 Cb 0.52 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.04 1rtb h ASP 53 CO -0.68 0.25 -0.26 0.58 -3.12 0.00 0.00 179.24 176.02 1rtb h VAL 54 N 0.00 1.50 -0.09 -1.35 2.07 -0.65 -3.32 116.25 114.41 1rtb h VAL 54 Ca -0.00 -1.83 -0.05 0.00 0.82 0.00 0.00 66.70 65.64 1rtb h VAL 54 Cb 0.61 2.59 -0.01 0.00 -1.52 0.00 0.00 31.29 32.96 1rtb h VAL 54 CO 0.03 0.51 -0.17 1.56 0.02 0.00 0.00 177.57 179.52 1rtb h GLN 55 N -0.38 0.14 0.00 1.57 4.20 -0.47 0.13 115.11 120.29 1rtb h GLN 55 Ca -0.03 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1rtb h GLN 55 Cb 0.97 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.73 1rtb h GLN 55 CO 0.05 0.31 0.00 0.00 -0.67 0.00 0.00 178.83 178.52 1rtb n ALA 56 N -2.49 2.05 0.21 3.87 0.00 -1.04 -2.67 120.51 120.43 1rtb n ALA 56 Ca -0.01 -0.10 0.05 0.00 0.00 0.00 0.00 53.44 53.38 1rtb n ALA 56 Cb 0.27 -1.28 0.46 0.00 0.00 0.00 0.00 19.45 18.90 1rtb n ALA 56 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1rtb h VAL 57 N 0.00 1.05 0.00 0.00 2.07 -0.85 -3.05 116.25 115.47 1rtb h VAL 57 Ca 0.00 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.48 1rtb h VAL 57 Cb 0.07 1.59 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1rtb h VAL 57 CO 0.00 0.28 0.05 0.00 0.02 0.00 0.00 177.57 177.92 1rtb n SER 59 N -1.05 1.15 -2.26 0.00 7.64 -1.15 -5.03 113.62 112.92 1rtb n SER 59 Ca 0.00 -1.30 -0.02 0.00 1.01 0.00 0.00 58.87 58.56 1rtb n SER 59 Cb 0.05 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.26 1rtb n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rtb n GLN 60 N -0.15 0.74 -1.68 1.43 6.02 0.13 -4.95 117.38 118.93 1rtb n GLN 60 Ca 0.00 -0.28 -0.47 0.00 -0.01 0.00 0.00 57.00 56.24 1rtb n GLN 60 Cb 0.13 -0.04 -0.04 0.00 1.02 0.00 0.00 30.24 31.30 1rtb n GLN 60 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 1rtb n LYS 61 N -1.15 2.27 -2.90 -1.09 2.85 -0.99 -4.65 118.16 112.50 1rtb n LYS 61 Ca 0.02 0.83 -0.41 0.00 -1.05 0.00 0.00 58.31 57.69 1rtb n LYS 61 Cb 0.06 -2.67 -0.04 0.00 -0.65 0.00 0.00 35.03 31.72 1rtb n LYS 61 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 1rtb s ASN 62 N 3.39 6.92 0.26 -5.58 3.04 -1.26 0.47 114.94 122.19 1rtb s ASN 62 Ca 0.89 1.14 0.07 0.00 0.04 0.00 0.00 52.86 55.00 1rtb s ASN 62 Cb -0.65 -2.45 -0.05 0.00 -1.54 0.00 0.00 41.25 36.56 1rtb s ASN 62 CO 0.47 -0.41 -0.09 0.68 -3.04 0.00 0.00 177.10 174.71 1rtb s VAL 63 N 2.24 1.76 0.20 -5.21 -7.23 0.12 -4.97 120.40 107.31 1rtb s VAL 63 Ca 0.37 -2.17 -0.30 0.00 -1.81 0.00 0.00 61.98 58.07 1rtb s VAL 63 Cb -0.16 -2.34 -0.08 0.00 0.56 0.00 0.00 36.38 34.35 1rtb s VAL 63 CO 0.11 -0.38 1.19 0.00 -0.31 0.00 0.00 175.10 175.71 1rtb s ALA 64 N -2.94 3.43 0.36 1.32 0.00 -1.26 -3.14 121.76 119.53 1rtb s ALA 64 Ca 0.28 0.95 -0.26 0.00 0.00 0.00 0.00 51.96 52.93 1rtb s ALA 64 Cb 0.02 -3.41 -0.09 0.00 0.00 0.00 0.00 23.12 19.64 1rtb s ALA 64 CO 0.11 -0.36 1.09 0.00 0.00 0.00 0.00 175.76 176.60 1rtb n LYS 66 N 0.41 -0.25 0.00 0.00 5.02 -1.26 -0.91 118.16 121.18 1rtb n LYS 66 Ca 0.03 0.99 0.00 0.00 -2.02 0.00 0.00 58.31 57.31 1rtb n LYS 66 Cb 0.47 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 1rtb n LYS 66 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1rtb n ASN 67 N -4.43 0.00 0.00 4.39 6.94 -1.26 -4.78 115.26 116.11 1rtb n ASN 67 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.57 1rtb n ASN 67 Cb 0.15 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.57 1rtb n ASN 67 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1rtb n GLY 68 N -0.20 2.91 0.53 4.83 0.00 -0.08 -5.08 105.19 108.10 1rtb n GLY 68 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1rtb n GLY 68 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1rtb n GLN 69 N -1.83 -0.13 0.00 1.61 6.02 -1.25 -4.78 117.38 117.02 1rtb n GLN 69 Ca 0.00 -0.29 0.00 0.00 -0.01 0.00 0.00 57.00 56.70 1rtb n GLN 69 Cb 0.00 -0.18 0.00 0.00 1.02 0.00 0.00 30.24 31.08 1rtb n GLN 69 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 1rtb n THR 70 N -2.21 0.00 -1.08 5.09 5.66 -1.26 -1.46 114.28 119.02 1rtb n THR 70 Ca 0.02 -0.12 -0.22 0.00 -3.05 0.00 0.00 64.05 60.68 1rtb n THR 70 Cb 0.08 1.30 0.03 0.00 -1.55 0.00 0.00 70.33 70.18 1rtb n THR 70 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 1rtb n ASN 71 N -0.15 6.68 -4.44 1.09 6.94 -1.26 -4.76 115.26 119.36 1rtb n ASN 71 Ca 0.00 -3.21 -0.30 0.00 -0.02 0.00 0.00 54.58 51.04 1rtb n ASN 71 Cb 0.07 -1.08 -0.13 0.00 -2.36 0.00 0.00 39.78 36.29 1rtb n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rtb s TYR 73 N -0.93 1.16 -0.03 0.00 2.02 0.20 0.12 117.35 119.89 1rtb s TYR 73 Ca 0.14 -0.52 0.04 0.00 -0.37 0.00 0.00 57.07 56.36 1rtb s TYR 73 Cb -0.10 -0.64 -0.00 0.00 -0.40 0.00 0.00 41.96 40.81 1rtb s TYR 73 CO 0.05 0.05 -0.15 -1.14 -1.57 0.00 0.00 175.55 172.79 1rtb s GLN 74 N -2.12 1.42 0.35 -0.62 0.74 0.18 -1.01 119.66 118.59 1rtb s GLN 74 Ca 0.01 -0.51 -0.29 0.00 0.05 0.00 0.00 55.36 54.62 1rtb s GLN 74 Cb -0.08 -1.29 -0.11 0.00 1.10 0.00 0.00 33.01 32.64 1rtb s GLN 74 CO 0.02 0.23 1.53 -1.54 -0.55 0.00 0.00 175.29 174.99 1rtb s SER 75 N -0.03 6.33 0.13 6.67 1.04 -0.55 -2.34 113.70 124.95 1rtb s SER 75 Ca -0.01 3.04 -0.16 0.00 0.48 0.00 0.00 55.95 59.30 1rtb s SER 75 Cb -0.09 -2.66 -0.01 0.00 0.10 0.00 0.00 66.02 63.36 1rtb s SER 75 CO 0.01 -0.91 1.67 1.88 0.98 0.00 0.00 173.24 176.87 1rtb h TYR 76 N 3.64 0.63 -4.27 5.02 0.05 -1.94 -3.45 116.97 116.64 1rtb h TYR 76 Ca -0.50 -0.06 -0.51 0.00 0.05 0.00 0.00 58.73 57.72 1rtb h TYR 76 Cb 1.23 -0.18 0.10 0.00 1.01 0.00 0.00 36.73 38.89 1rtb h TYR 76 CO 0.55 0.57 0.35 -1.54 -1.05 0.00 0.00 178.16 177.04 1rtb s SER 77 N -5.90 5.08 0.15 3.88 1.04 -1.26 -5.09 113.70 111.61 1rtb s SER 77 Ca -0.13 1.82 -0.08 0.00 0.48 0.00 0.00 55.95 58.04 1rtb s SER 77 Cb 0.10 -2.53 -0.06 0.00 0.10 0.00 0.00 66.02 63.63 1rtb s SER 77 CO 0.76 -1.64 0.44 -0.89 0.98 0.00 0.00 173.24 172.88 1rtb s THR 78 N -2.71 5.06 -0.03 2.02 2.01 -1.26 -4.44 115.64 116.30 1rtb s THR 78 Ca 0.62 0.30 -0.04 0.00 0.31 0.00 0.00 61.69 62.89 1rtb s THR 78 Cb -0.17 -3.63 0.01 0.00 0.01 0.00 0.00 72.50 68.71 1rtb s THR 78 CO 0.49 0.08 0.10 -0.04 -0.69 0.00 0.00 174.62 174.56 1rtb s MET 79 N -2.48 0.17 0.03 4.92 -1.94 0.73 -4.90 119.30 115.83 1rtb s MET 79 Ca 0.41 0.04 -0.30 0.00 -1.71 0.00 0.00 55.69 54.12 1rtb s MET 79 Cb -0.12 0.08 -0.05 0.00 2.01 0.00 0.00 34.83 36.75 1rtb s MET 79 CO 0.22 -0.03 1.14 0.45 -0.01 0.00 0.00 175.02 176.79 1rtb s SER 80 N -0.20 7.15 0.08 3.03 0.15 -1.26 -0.24 113.70 122.41 1rtb s SER 80 Ca -0.03 1.90 0.05 0.00 0.70 0.00 0.00 55.95 58.57 1rtb s SER 80 Cb -0.02 -2.57 -0.03 0.00 -1.71 0.00 0.00 66.02 61.68 1rtb s SER 80 CO 0.00 -0.43 -0.13 0.27 1.20 0.00 0.00 173.24 174.15 1rtb s ILE 81 N 1.19 1.08 -0.18 6.45 -4.36 -0.76 -1.83 121.20 122.79 1rtb s ILE 81 Ca 0.57 -1.41 0.01 0.00 -0.26 0.00 0.00 60.65 59.56 1rtb s ILE 81 Cb -0.27 -1.15 0.01 0.00 1.25 0.00 0.00 42.46 42.30 1rtb s ILE 81 CO 0.28 -0.32 -0.19 -0.89 0.24 0.00 0.00 174.94 174.06 1rtb s THR 82 N -1.60 2.22 -0.26 8.37 2.01 -0.48 -1.90 115.64 123.98 1rtb s THR 82 Ca 0.00 -0.90 -0.21 0.00 0.31 0.00 0.00 61.69 60.90 1rtb s THR 82 Cb -0.08 -1.93 -0.02 0.00 0.01 0.00 0.00 72.50 70.48 1rtb s THR 82 CO 0.02 0.53 0.64 -1.81 -0.69 0.00 0.00 174.62 173.31 1rtb s ASP 83 N 1.20 6.57 -0.77 3.53 1.11 -0.49 -0.72 116.67 127.10 1rtb s ASP 83 Ca 0.02 0.67 -0.15 0.00 0.18 0.00 0.00 52.55 53.27 1rtb s ASP 83 Cb -0.14 -2.34 0.18 0.00 1.07 0.00 0.00 42.92 41.70 1rtb s ASP 83 CO -0.10 -0.40 0.76 0.00 1.18 0.00 0.00 175.17 176.61 1rtb s ARG 85 N 0.89 4.37 1.08 0.00 3.52 -1.10 -0.52 118.95 127.19 1rtb s ARG 85 Ca 0.17 0.89 -0.14 0.00 -0.13 0.00 0.00 55.73 56.51 1rtb s ARG 85 Cb -0.14 -3.30 0.23 0.00 -1.56 0.00 0.00 34.95 30.18 1rtb s ARG 85 CO -0.06 0.47 1.09 -2.00 -0.81 0.00 0.00 175.30 173.99 1rtb s GLU 86 N -0.62 -0.20 0.00 5.12 2.12 -1.07 -0.72 118.70 123.33 1rtb s GLU 86 Ca 0.33 0.36 0.00 0.00 0.36 0.00 0.00 54.97 56.02 1rtb s GLU 86 Cb -0.20 -1.68 0.00 0.00 0.26 0.00 0.00 34.13 32.51 1rtb s GLU 86 CO 0.21 -3.12 0.00 -2.37 -0.54 0.00 0.00 175.26 169.43 1rtb n THR 87 N -4.42 0.00 -3.63 -1.70 5.66 0.87 -4.61 114.28 106.45 1rtb n THR 87 Ca 0.07 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.69 1rtb n THR 87 Cb 0.58 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.24 1rtb n THR 87 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1rtb s GLY 88 N -0.84 1.89 0.00 1.09 0.00 -1.26 -3.93 107.32 104.28 1rtb s GLY 88 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 44.72 43.60 1rtb s GLY 88 CO 0.00 0.63 0.00 1.44 0.00 0.00 0.00 173.10 175.17 1rtb n SER 89 N 5.03 0.00 -4.59 1.64 7.64 -1.26 -5.08 113.62 117.00 1rtb n SER 89 Ca -0.14 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.31 1rtb n SER 89 Cb 0.52 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.68 1rtb n SER 89 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1rtb s SER 90 N -1.28 6.61 -0.34 6.43 0.15 -1.25 -4.82 113.70 119.20 1rtb s SER 90 Ca 0.00 0.42 -0.00 0.00 0.70 0.00 0.00 55.95 57.06 1rtb s SER 90 Cb 0.00 -2.45 0.11 0.00 -1.71 0.00 0.00 66.02 61.97 1rtb s SER 90 CO 0.00 -0.89 0.14 -0.75 1.20 0.00 0.00 173.24 172.94 1rtb s LYS 91 N 3.49 0.81 -0.34 5.44 2.36 0.36 -4.93 119.74 126.93 1rtb s LYS 91 Ca 0.37 -1.28 -0.28 0.00 -2.55 0.00 0.00 55.97 52.23 1rtb s LYS 91 Cb -0.12 -1.99 -0.07 0.00 -1.05 0.00 0.00 37.83 34.61 1rtb s LYS 91 CO 0.20 -1.04 2.30 0.98 1.55 0.00 0.00 175.35 179.34 1rtb n TYR 92 N 4.52 1.72 0.10 4.03 9.36 -1.26 0.13 117.16 135.77 1rtb n TYR 92 Ca 0.01 -0.00 -0.04 0.00 3.32 0.00 0.00 57.90 61.19 1rtb n TYR 92 Cb 0.40 -2.68 0.05 0.00 -0.63 0.00 0.00 39.34 36.49 1rtb n TYR 92 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1rtb h PRO 93 N 16.34 0.02 -4.42 2.98 0.13 -1.98 -3.49 132.00 141.58 1rtb h PRO 93 Ca -0.33 -0.02 -0.70 0.00 -0.87 0.00 0.00 66.00 64.08 1rtb h PRO 93 Cb 1.26 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 32.06 1rtb h PRO 93 CO 1.04 0.78 -0.51 -0.80 -0.23 0.00 0.00 178.00 178.28 1rtb s ASN 94 N -6.80 5.35 -0.06 1.44 0.01 0.35 -5.04 114.94 110.18 1rtb s ASN 94 Ca -0.01 -2.04 -0.19 0.00 -0.71 0.00 0.00 52.86 49.91 1rtb s ASN 94 Cb 0.12 -1.87 -0.05 0.00 0.41 0.00 0.00 41.25 39.86 1rtb s ASN 94 CO 0.79 -0.57 0.54 0.00 -1.51 0.00 0.00 177.10 176.35 1rtb s ALA 96 N 0.23 1.53 0.04 0.00 0.00 -1.26 -4.95 121.76 117.35 1rtb s ALA 96 Ca 0.29 -0.59 0.05 0.00 0.00 0.00 0.00 51.96 51.71 1rtb s ALA 96 Cb -0.17 -0.68 -0.02 0.00 0.00 0.00 0.00 23.12 22.26 1rtb s ALA 96 CO 0.14 0.10 -0.15 0.71 0.00 0.00 0.00 175.76 176.56 1rtb s TYR 97 N 0.69 1.30 -0.36 0.00 1.51 -1.26 -0.09 117.35 119.14 1rtb s TYR 97 Ca -0.13 -0.36 -0.13 0.00 -1.01 0.00 0.00 57.07 55.43 1rtb s TYR 97 Cb -0.16 -0.77 -0.01 0.00 -0.11 0.00 0.00 41.96 40.92 1rtb s TYR 97 CO 0.03 0.04 0.25 0.21 -1.11 0.00 0.00 175.55 174.98 1rtb s LYS 98 N -1.19 3.34 -0.15 -0.62 2.36 0.10 -4.42 119.74 119.16 1rtb s LYS 98 Ca 0.02 -0.75 -0.29 0.00 -2.55 0.00 0.00 55.97 52.39 1rtb s LYS 98 Cb -0.08 -3.83 -0.04 0.00 -1.05 0.00 0.00 37.83 32.82 1rtb s LYS 98 CO 0.01 -0.53 1.76 0.99 1.55 0.00 0.00 175.35 179.13 1rtb s THR 99 N 1.70 3.48 -0.25 3.43 2.01 -1.26 -2.70 115.64 122.05 1rtb s THR 99 Ca 0.06 0.55 0.03 0.00 0.31 0.00 0.00 61.69 62.63 1rtb s THR 99 Cb -0.18 -3.46 0.06 0.00 0.01 0.00 0.00 72.50 68.93 1rtb s THR 99 CO 0.10 -0.16 -0.11 -0.89 -0.69 0.00 0.00 174.62 172.86 1rtb s THR 100 N 5.27 2.12 0.04 -0.82 2.01 -0.43 -5.00 115.64 118.83 1rtb s THR 100 Ca 0.78 -1.55 -0.01 0.00 0.31 0.00 0.00 61.69 61.22 1rtb s THR 100 Cb -0.30 -2.21 -0.04 0.00 0.01 0.00 0.00 72.50 69.95 1rtb s THR 100 CO 0.32 0.02 0.18 -1.58 -0.69 0.00 0.00 174.62 172.87 1rtb s GLN 101 N 1.13 3.37 0.29 4.92 2.00 -1.26 -1.39 119.66 128.72 1rtb s GLN 101 Ca -0.08 -0.43 -0.20 0.00 -2.00 0.00 0.00 55.36 52.65 1rtb s GLN 101 Cb -0.19 -3.02 0.02 0.00 0.80 0.00 0.00 33.01 30.62 1rtb s GLN 101 CO -0.06 0.63 0.73 0.00 -0.50 0.00 0.00 175.29 176.09 1rtb s ALA 102 N -1.42 -1.16 -0.49 1.58 0.00 -0.80 -5.01 121.76 114.46 1rtb s ALA 102 Ca 0.31 -0.36 0.04 0.00 0.00 0.00 0.00 51.96 51.95 1rtb s ALA 102 Cb -0.13 0.83 0.16 0.00 0.00 0.00 0.00 23.12 23.99 1rtb s ALA 102 CO 0.24 -1.03 0.36 1.21 0.00 0.00 0.00 175.76 176.54 1rtb s ASN 103 N -2.94 2.65 0.34 0.00 2.47 -1.26 -1.83 114.94 114.37 1rtb s ASN 103 Ca 0.12 -3.19 0.01 0.00 0.42 0.00 0.00 52.86 50.22 1rtb s ASN 103 Cb -0.06 -0.82 -0.01 0.00 -1.45 0.00 0.00 41.25 38.92 1rtb s ASN 103 CO 0.07 -0.16 0.05 0.29 -3.72 0.00 0.00 177.10 173.63 1rtb n LYS 104 N 2.74 0.89 -2.72 0.43 5.02 0.67 -4.46 118.16 120.74 1rtb n LYS 104 Ca 0.24 -2.68 -0.42 0.00 -2.02 0.00 0.00 58.31 53.43 1rtb n LYS 104 Cb 0.42 1.06 -0.03 0.00 -0.02 0.00 0.00 35.03 36.46 1rtb n LYS 104 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1rtb s HIS 105 N -2.52 3.51 0.24 2.13 3.76 -1.26 -0.19 115.29 120.95 1rtb s HIS 105 Ca 0.07 1.55 -0.05 0.00 -0.15 0.00 0.00 55.06 56.49 1rtb s HIS 105 Cb 0.00 -3.16 -0.05 0.00 1.11 0.00 0.00 32.58 30.48 1rtb s HIS 105 CO 0.05 -0.22 0.50 0.96 -0.85 0.00 0.00 174.74 175.18 1rtb s ILE 106 N 1.98 5.06 -0.16 0.60 -4.36 -1.26 -1.30 121.20 121.76 1rtb s ILE 106 Ca 0.47 0.06 -0.01 0.00 -0.26 0.00 0.00 60.65 60.90 1rtb s ILE 106 Cb -0.18 -3.70 0.04 0.00 1.25 0.00 0.00 42.46 39.88 1rtb s ILE 106 CO 0.17 -0.20 -0.03 -0.63 0.24 0.00 0.00 174.94 174.50 1rtb s ILE 107 N -1.94 0.88 0.38 8.37 1.09 -0.43 -1.48 121.20 128.07 1rtb s ILE 107 Ca 0.43 -0.51 0.06 0.00 -1.10 0.00 0.00 60.65 59.54 1rtb s ILE 107 Cb -0.11 -1.12 -0.07 0.00 -1.06 0.00 0.00 42.46 40.09 1rtb s ILE 107 CO 0.27 0.08 0.02 0.68 -0.10 0.00 0.00 174.94 175.89 1rtb s VAL 108 N 1.73 1.75 -0.17 2.92 -7.23 -0.18 -1.36 120.40 117.86 1rtb s VAL 108 Ca 0.01 -2.01 -0.05 0.00 -1.81 0.00 0.00 61.98 58.12 1rtb s VAL 108 Cb -0.15 -2.91 -0.03 0.00 0.56 0.00 0.00 36.38 33.85 1rtb s VAL 108 CO -0.07 -0.02 0.00 0.00 -0.31 0.00 0.00 175.10 174.70 1rtb s ALA 109 N -2.89 3.18 0.03 1.32 0.00 -0.31 -0.63 121.76 122.45 1rtb s ALA 109 Ca 0.35 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.55 1rtb s ALA 109 Cb 0.09 -1.71 -0.04 0.00 0.00 0.00 0.00 23.12 21.47 1rtb s ALA 109 CO 0.17 0.21 0.02 0.00 0.00 0.00 0.00 175.76 176.16 1rtb s GLU 111 N -1.90 1.05 0.00 0.00 2.02 -0.14 -4.87 118.70 114.86 1rtb s GLU 111 Ca 0.23 0.04 0.00 0.00 0.02 0.00 0.00 54.97 55.26 1rtb s GLU 111 Cb -0.12 0.49 0.00 0.00 0.10 0.00 0.00 34.13 34.60 1rtb s GLU 111 CO 0.15 -0.35 0.00 0.41 0.02 0.00 0.00 175.26 175.48 1rtb n GLY 112 N 0.69 0.30 3.60 -1.39 0.00 -1.26 -2.69 105.19 104.43 1rtb n GLY 112 Ca -0.19 -1.78 -0.34 0.00 0.00 0.00 0.00 46.02 43.71 1rtb n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1rtb s ASN 113 N -1.65 5.18 0.43 1.61 3.04 -1.26 -1.21 114.94 121.09 1rtb s ASN 113 Ca 0.00 0.02 -0.25 0.00 0.04 0.00 0.00 52.86 52.67 1rtb s ASN 113 Cb 0.00 -1.75 -0.09 0.00 -1.54 0.00 0.00 41.25 37.87 1rtb s ASN 113 CO 0.00 0.23 1.22 -0.81 -3.04 0.00 0.00 177.10 174.71 1rtb n PRO 114 N 3.12 1.79 -2.44 0.43 -0.04 -1.26 -4.99 135.00 131.61 1rtb n PRO 114 Ca -0.17 0.64 -0.38 0.00 -0.04 0.00 0.00 63.50 63.54 1rtb n PRO 114 Cb 0.53 -2.33 -0.03 0.00 -0.04 0.00 0.00 33.50 31.62 1rtb n PRO 114 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1rtb s TYR 115 N -1.22 2.29 0.30 0.54 5.04 -0.35 -4.86 117.35 119.08 1rtb s TYR 115 Ca 0.62 -0.29 0.08 0.00 -2.44 0.00 0.00 57.07 55.04 1rtb s TYR 115 Cb -0.51 -4.53 -0.03 0.00 0.35 0.00 0.00 41.96 37.24 1rtb s TYR 115 CO 0.57 -1.97 0.21 0.14 -1.34 0.00 0.00 175.55 173.16 1rtb s VAL 116 N 6.29 3.84 0.30 3.14 -7.23 -1.09 -4.78 120.40 120.87 1rtb s VAL 116 Ca 0.49 -1.47 -0.29 0.00 -1.81 0.00 0.00 61.98 58.89 1rtb s VAL 116 Cb -0.04 -3.22 -0.10 0.00 0.56 0.00 0.00 36.38 33.59 1rtb s VAL 116 CO -0.00 -0.27 1.18 -2.16 -0.31 0.00 0.00 175.10 173.55 1rtb s PRO 117 N -3.89 4.52 0.00 4.82 0.04 -1.26 -0.97 135.00 138.27 1rtb s PRO 117 Ca 0.36 1.97 0.00 0.00 0.04 0.00 0.00 61.00 63.37 1rtb s PRO 117 Cb -0.06 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 31.33 1rtb s PRO 117 CO 0.25 0.05 0.00 0.28 0.04 0.00 0.00 177.00 177.62 1rtb n VAL 118 N 1.06 0.00 -4.22 -0.36 0.31 -0.24 -4.44 118.33 110.44 1rtb n VAL 118 Ca -0.01 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.13 1rtb n VAL 118 Cb 0.44 -0.37 -0.12 0.00 -0.91 0.00 0.00 33.84 32.87 1rtb n VAL 118 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 1rtb s HIS 119 N -1.68 1.27 -0.20 3.52 5.65 -1.06 -4.57 115.29 118.23 1rtb s HIS 119 Ca 0.00 -0.43 -0.09 0.00 0.25 0.00 0.00 55.06 54.78 1rtb s HIS 119 Cb 0.00 -0.72 -0.05 0.00 -1.18 0.00 0.00 32.58 30.63 1rtb s HIS 119 CO 0.00 0.07 0.11 0.12 -0.65 0.00 0.00 174.74 174.39 1rtb s PHE 120 N -1.17 3.37 -0.01 3.88 2.19 -1.26 -1.16 117.98 123.81 1rtb s PHE 120 Ca -0.00 0.26 -0.01 0.00 0.33 0.00 0.00 56.93 57.50 1rtb s PHE 120 Cb -0.10 -2.14 -0.00 0.00 -1.31 0.00 0.00 43.02 39.47 1rtb s PHE 120 CO 0.02 0.25 -0.03 -3.47 1.83 0.00 0.00 175.22 173.82 1rtb n ASP 121 N 3.55 0.21 -1.17 6.13 2.03 -0.46 -4.91 116.55 121.93 1rtb n ASP 121 Ca -0.16 0.03 -0.01 0.00 0.52 0.00 0.00 54.79 55.17 1rtb n ASP 121 Cb 0.52 -0.34 -0.00 0.00 -0.72 0.00 0.00 41.12 40.58 1rtb n ASP 121 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rtb n ALA 122 N -2.71 -0.06 -3.32 -1.67 0.00 -0.54 -4.98 120.51 107.22 1rtb n ALA 122 Ca -0.01 -0.13 -0.13 0.00 0.00 0.00 0.00 53.44 53.17 1rtb n ALA 122 Cb 0.04 0.11 -0.11 0.00 0.00 0.00 0.00 19.45 19.49 1rtb n ALA 122 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1rtb s SER 123 N -1.19 -0.36 0.00 0.00 1.04 -1.26 -1.32 113.70 110.62 1rtb s SER 123 Ca 0.02 0.68 0.00 0.00 0.48 0.00 0.00 55.95 57.13 1rtb s SER 123 Cb -0.00 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.78 1rtb s SER 123 CO 0.02 -0.13 0.20 0.55 0.98 0.00 0.00 173.24 174.86