#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rbj s GLU 2 N 0.00 2.60 0.93 -1.58 2.56 -1.26 -4.91 118.70 117.04 1rbj s GLU 2 Ca 0.00 -0.42 -0.13 0.00 0.00 0.00 0.00 54.97 54.43 1rbj s GLU 2 Cb 0.00 -5.10 0.15 0.00 2.00 0.00 0.00 34.13 31.18 1rbj s GLU 2 CO 0.00 -3.37 1.14 0.95 -0.56 0.00 0.00 175.26 173.42 1rbj s THR 3 N 9.90 1.99 0.05 -1.70 -4.23 -1.26 -4.71 115.64 115.68 1rbj s THR 3 Ca 0.69 0.00 -0.26 0.00 -1.18 0.00 0.00 61.69 60.94 1rbj s THR 3 Cb -0.06 -2.74 -0.17 0.00 1.34 0.00 0.00 72.50 70.87 1rbj s THR 3 CO 0.00 0.00 1.53 0.00 -0.54 0.00 0.00 174.62 175.61 1rbj h ALA 4 N -1.56 -0.30 0.14 3.99 0.00 -1.95 4.15 119.26 123.74 1rbj h ALA 4 Ca -0.50 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.30 1rbj h ALA 4 Cb 1.33 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 19.19 1rbj h ALA 4 CO 0.60 -0.59 -0.34 0.00 0.00 0.00 0.00 179.25 178.91 1rbj h ALA 5 N 0.29 -0.61 -0.95 0.00 0.00 -1.90 0.28 119.26 116.37 1rbj h ALA 5 Ca -0.03 -0.06 0.12 0.00 0.00 0.00 0.00 54.91 54.94 1rbj h ALA 5 Cb 0.34 0.56 -0.08 0.00 0.00 0.00 0.00 17.79 18.62 1rbj h ALA 5 CO 0.05 -0.90 0.61 0.00 0.00 0.00 0.00 179.25 179.01 1rbj h ALA 6 N 0.01 1.62 0.00 0.00 0.00 -1.83 0.36 119.26 119.42 1rbj h ALA 6 Ca 0.02 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1rbj h ALA 6 Cb 0.61 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 1rbj h ALA 6 CO -0.19 0.15 -0.16 -0.22 0.00 0.00 0.00 179.25 178.84 1rbj h LYS 7 N 0.91 0.00 -0.36 0.00 3.64 1.15 -2.70 116.57 119.21 1rbj h LYS 7 Ca 0.47 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.69 1rbj h LYS 7 Cb 0.52 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 1rbj h LYS 7 CO -0.23 0.16 -0.40 0.35 -2.27 0.00 0.00 179.45 177.06 1rbj h PHE 8 N 0.00 1.07 0.00 1.91 3.04 0.16 -2.64 116.94 120.48 1rbj h PHE 8 Ca -0.00 -0.32 -0.08 0.00 3.98 0.00 0.00 57.97 61.54 1rbj h PHE 8 Cb 0.29 -0.22 -0.01 0.00 2.56 0.00 0.00 35.95 38.56 1rbj h PHE 8 CO 0.00 1.14 -0.39 0.93 -2.02 0.00 0.00 178.31 177.97 1rbj h GLU 9 N 0.72 0.00 -0.06 1.11 5.08 -1.18 -0.91 114.58 119.34 1rbj h GLU 9 Ca 0.06 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.28 1rbj h GLU 9 Cb 0.98 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.24 1rbj h GLU 9 CO 0.10 0.39 -0.51 -0.09 -1.00 0.00 0.00 179.01 177.89 1rbj h ARG 10 N 0.00 0.46 0.15 2.33 2.43 -1.33 -2.87 114.38 115.55 1rbj h ARG 10 Ca -0.00 -0.41 -0.27 0.00 -0.81 0.00 0.00 59.98 58.48 1rbj h ARG 10 Cb 0.89 0.10 0.01 0.00 -0.42 0.00 0.00 29.97 30.54 1rbj h ARG 10 CO 0.05 1.05 -1.33 1.96 -1.51 0.00 0.00 179.97 180.19 1rbj h GLN 11 N 0.01 0.32 -0.34 0.20 4.20 -1.41 -3.39 115.11 114.69 1rbj h GLN 11 Ca -0.05 -0.54 0.00 0.00 0.06 0.00 0.00 58.65 58.12 1rbj h GLN 11 Cb 1.18 0.20 0.00 0.00 0.30 0.00 0.00 27.48 29.16 1rbj h GLN 11 CO 0.10 1.26 0.00 0.72 -0.67 0.00 0.00 178.83 180.24 1rbj n HIS 12 N -3.90 0.44 -3.94 2.96 8.25 -0.35 -4.76 115.22 113.92 1rbj n HIS 12 Ca -0.21 -0.27 -0.28 0.00 -0.26 0.00 0.00 57.72 56.69 1rbj n HIS 12 Cb 0.93 -0.01 -0.17 0.00 1.12 0.00 0.00 29.99 31.87 1rbj n HIS 12 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 1rbj s MET 13 N -1.28 1.74 -0.45 -0.41 1.75 -1.08 -2.59 119.30 116.98 1rbj s MET 13 Ca 0.32 -0.42 0.02 0.00 -1.25 0.00 0.00 55.69 54.36 1rbj s MET 13 Cb 0.19 -1.86 0.14 0.00 2.84 0.00 0.00 34.83 36.14 1rbj s MET 13 CO 0.26 -0.30 0.27 0.34 -0.65 0.00 0.00 175.02 174.94 1rbj s ASP 14 N 1.62 3.41 0.00 1.11 -1.08 -0.81 -4.79 116.67 116.13 1rbj s ASP 14 Ca 0.04 -2.75 0.25 0.00 -0.52 0.00 0.00 52.55 49.56 1rbj s ASP 14 Cb -0.13 -0.95 1.19 0.00 -1.46 0.00 0.00 42.92 41.57 1rbj s ASP 14 CO -0.09 -0.24 1.80 -1.20 0.52 0.00 0.00 175.17 175.96 1rbj n SER 15 N 3.36 0.81 -0.30 -0.34 7.64 -1.26 -3.70 113.62 119.82 1rbj n SER 15 Ca 0.13 -1.41 0.14 0.00 1.01 0.00 0.00 58.87 58.73 1rbj n SER 15 Cb 0.37 -0.03 0.52 0.00 -1.01 0.00 0.00 64.21 64.06 1rbj n SER 15 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1rbj n SER 16 N -0.31 1.05 -4.03 6.43 7.64 -1.26 -4.85 113.62 118.29 1rbj n SER 16 Ca 0.18 -1.10 -0.11 0.00 1.01 0.00 0.00 58.87 58.85 1rbj n SER 16 Cb 0.22 0.03 -0.11 0.00 -1.01 0.00 0.00 64.21 63.34 1rbj n SER 16 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1rbj s THR 17 N -2.25 0.36 0.03 0.44 -4.23 -1.24 -4.97 115.64 103.78 1rbj s THR 17 Ca 0.33 -1.00 0.14 0.00 -1.18 0.00 0.00 61.69 59.97 1rbj s THR 17 Cb 0.20 -0.46 0.01 0.00 1.34 0.00 0.00 72.50 73.59 1rbj s THR 17 CO 0.42 -0.43 1.50 0.77 -0.54 0.00 0.00 174.62 176.34 1rbj h SER 18 N 4.57 0.00 -2.43 3.99 4.64 -1.88 -3.44 113.55 119.00 1rbj h SER 18 Ca -0.34 0.00 0.20 0.00 -0.47 0.00 0.00 61.79 61.18 1rbj h SER 18 Cb 1.21 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.26 1rbj h SER 18 CO 0.41 0.60 0.66 0.00 -0.87 0.00 0.00 176.83 177.63 1rbj n ALA 19 N -2.29 -2.88 -1.60 5.18 0.00 -1.26 -4.78 120.51 112.88 1rbj n ALA 19 Ca 0.01 -0.96 -0.48 0.00 0.00 0.00 0.00 53.44 52.01 1rbj n ALA 19 Cb 0.71 0.47 -0.05 0.00 0.00 0.00 0.00 19.45 20.58 1rbj n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rbj n ALA 20 N -0.83 1.13 -0.00 0.00 0.00 -1.26 -4.81 120.51 114.73 1rbj n ALA 20 Ca -0.13 0.08 -0.03 0.00 0.00 0.00 0.00 53.44 53.36 1rbj n ALA 20 Cb 0.58 -2.61 0.22 0.00 0.00 0.00 0.00 19.45 17.64 1rbj n ALA 20 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1rbj h SER 21 N 11.31 0.51 -1.74 0.00 4.64 -1.98 -3.47 113.55 122.83 1rbj h SER 21 Ca -0.42 -0.15 -0.02 0.00 -0.47 0.00 0.00 61.79 60.74 1rbj h SER 21 Cb 1.28 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1rbj h SER 21 CO 0.97 0.70 -0.01 -1.54 -0.87 0.00 0.00 176.83 176.08 1rbj n SER 22 N -4.17 -0.08 -0.00 4.97 3.41 -1.26 -5.01 113.62 111.48 1rbj n SER 22 Ca 0.00 -1.11 0.13 0.00 -0.26 0.00 0.00 58.87 57.63 1rbj n SER 22 Cb 0.36 0.14 0.43 0.00 -0.26 0.00 0.00 64.21 64.88 1rbj n SER 22 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1rbj n SER 23 N -2.17 0.26 -0.15 4.04 3.41 -1.26 -2.72 113.62 115.03 1rbj n SER 23 Ca 0.00 0.11 0.13 0.00 -0.26 0.00 0.00 58.87 58.85 1rbj n SER 23 Cb 0.03 -0.12 0.41 0.00 -0.26 0.00 0.00 64.21 64.28 1rbj n SER 23 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1rbj n ASN 24 N -1.50 0.74 -0.33 4.04 3.02 -1.26 -3.94 115.26 116.03 1rbj n ASN 24 Ca 0.06 -0.61 0.35 0.00 -0.03 0.00 0.00 54.58 54.35 1rbj n ASN 24 Cb 0.34 0.08 0.61 0.00 -0.61 0.00 0.00 39.78 40.20 1rbj n ASN 24 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1rbj h TYR 25 N 0.74 0.00 0.11 3.10 3.20 -1.90 0.44 116.97 122.65 1rbj h TYR 25 Ca 0.00 0.00 -0.34 0.00 3.14 0.00 0.00 58.73 61.53 1rbj h TYR 25 Cb 0.47 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.72 1rbj h TYR 25 CO 0.00 0.00 -1.85 0.00 -1.64 0.00 0.00 178.16 174.67 1rbj h ASN 27 N 0.06 0.00 -0.00 0.00 2.35 -1.01 -2.14 115.58 114.84 1rbj h ASN 27 Ca -0.36 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.38 1rbj h ASN 27 Cb 2.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.41 1rbj h ASN 27 CO 0.11 0.70 -0.02 1.56 -1.65 0.00 0.00 177.43 178.13 1rbj h GLN 28 N 0.00 0.02 0.42 0.81 7.50 -0.37 -3.32 115.11 120.18 1rbj h GLN 28 Ca -0.01 -0.02 -0.02 0.00 0.50 0.00 0.00 58.65 59.10 1rbj h GLN 28 Cb 1.48 0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.02 1rbj h GLN 28 CO 0.09 0.70 -0.20 0.52 -1.50 0.00 0.00 178.83 178.44 1rbj h MET 29 N -0.65 -0.55 -0.37 1.46 2.86 -1.47 -3.01 114.93 113.21 1rbj h MET 29 Ca -0.00 0.04 0.03 0.00 -2.06 0.00 0.00 59.70 57.71 1rbj h MET 29 Cb 0.71 0.12 -0.05 0.00 0.06 0.00 0.00 31.60 32.45 1rbj h MET 29 CO 0.00 -0.36 -0.22 0.52 1.06 0.00 0.00 176.91 177.91 1rbj h MET 30 N -0.66 -0.01 -0.71 1.72 2.86 -1.59 0.74 114.93 117.29 1rbj h MET 30 Ca -0.06 0.00 0.13 0.00 -2.06 0.00 0.00 59.70 57.71 1rbj h MET 30 Cb 0.43 0.00 -0.13 0.00 0.06 0.00 0.00 31.60 31.97 1rbj h MET 30 CO 0.09 -0.00 -0.21 1.17 1.06 0.00 0.00 176.91 179.02 1rbj n LYS 31 N -3.85 -0.10 0.08 1.72 3.00 -1.25 -0.61 118.16 117.15 1rbj n LYS 31 Ca 0.01 1.10 -0.21 0.00 -0.00 0.00 0.00 58.31 59.21 1rbj n LYS 31 Cb 0.10 -1.64 -0.15 0.00 0.00 0.00 0.00 35.03 33.34 1rbj n LYS 31 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1rbj h SER 32 N 0.00 0.54 0.00 3.14 4.64 -0.98 -3.25 113.55 117.65 1rbj h SER 32 Ca 0.31 -0.76 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1rbj h SER 32 Cb 0.49 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1rbj h SER 32 CO -0.72 1.64 0.00 0.54 -0.87 0.00 0.00 176.83 177.42 1rbj n ARG 33 N -3.54 0.94 -2.24 4.77 5.12 0.24 -4.77 116.66 117.18 1rbj n ARG 33 Ca -0.20 0.00 -0.15 0.00 -1.93 0.00 0.00 57.85 55.56 1rbj n ARG 33 Cb 1.07 -1.24 -0.02 0.00 -1.16 0.00 0.00 32.46 31.10 1rbj n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1rbj n ASN 34 N 0.28 -4.44 0.07 0.55 5.03 -1.13 -4.68 115.26 110.94 1rbj n ASN 34 Ca 0.00 0.17 0.12 0.00 0.87 0.00 0.00 54.58 55.74 1rbj n ASN 34 Cb 0.36 -3.80 0.16 0.00 -1.02 0.00 0.00 39.78 35.47 1rbj n ASN 34 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 1rbj h LEU 35 N 0.00 0.00 -1.64 3.41 4.07 -1.03 -2.94 115.31 117.17 1rbj h LEU 35 Ca -0.35 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 57.44 1rbj h LEU 35 Cb 1.21 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.95 1rbj h LEU 35 CO 0.43 0.09 0.00 0.41 -1.08 0.00 0.00 178.44 178.28 1rbj n THR 36 N -2.22 0.38 0.00 0.22 -1.04 -1.20 -2.98 114.28 107.44 1rbj n THR 36 Ca 0.03 -0.53 0.00 0.00 -2.04 0.00 0.00 64.05 61.50 1rbj n THR 36 Cb 0.46 0.59 0.00 0.00 -1.82 0.00 0.00 70.33 69.55 1rbj n THR 36 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1rbj n LYS 37 N 0.84 0.00 -2.40 -2.82 3.00 -1.11 -2.38 118.16 113.28 1rbj n LYS 37 Ca 0.17 0.00 -0.15 0.00 -0.00 0.00 0.00 58.31 58.33 1rbj n LYS 37 Cb 0.44 0.00 0.03 0.00 0.00 0.00 0.00 35.03 35.50 1rbj n LYS 37 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 1rbj n ASP 38 N -0.04 3.49 0.00 3.14 5.75 -1.26 -5.02 116.55 122.60 1rbj n ASP 38 Ca 0.00 -3.07 0.00 0.00 -0.01 0.00 0.00 54.79 51.71 1rbj n ASP 38 Cb 0.00 -0.41 0.00 0.00 -1.03 0.00 0.00 41.12 39.68 1rbj n ASP 38 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1rbj n ARG 39 N -0.61 -1.10 -3.48 0.11 1.85 -1.00 -5.09 116.66 107.34 1rbj n ARG 39 Ca 0.28 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.71 1rbj n ARG 39 Cb 0.87 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 32.20 1rbj n ARG 39 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1rbj s LYS 41 N 1.49 3.37 0.31 0.00 2.20 -1.16 -4.79 119.74 121.16 1rbj s LYS 41 Ca 0.04 1.75 0.02 0.00 -0.36 0.00 0.00 55.97 57.41 1rbj s LYS 41 Cb -0.26 -4.24 0.56 0.00 -1.51 0.00 0.00 37.83 32.39 1rbj s LYS 41 CO 0.02 -1.82 1.90 -1.00 -0.36 0.00 0.00 175.35 174.10 1rbj h PRO 42 N 13.24 0.96 -3.06 4.03 0.13 -1.93 -3.43 132.00 141.93 1rbj h PRO 42 Ca -0.37 -0.06 -0.17 0.00 -0.87 0.00 0.00 66.00 64.53 1rbj h PRO 42 Cb 1.20 -0.22 -0.27 0.00 0.13 0.00 0.00 31.00 31.84 1rbj h PRO 42 CO 1.00 0.63 -0.44 0.54 -0.23 0.00 0.00 178.00 179.50 1rbj s VAL 43 N -5.88 -0.02 -0.22 1.56 0.11 -1.26 -0.29 120.40 114.40 1rbj s VAL 43 Ca -0.11 0.06 -0.19 0.00 -2.93 0.00 0.00 61.98 58.81 1rbj s VAL 43 Cb 0.20 -0.38 0.06 0.00 -1.53 0.00 0.00 36.38 34.73 1rbj s VAL 43 CO 0.80 0.03 0.58 0.21 -3.33 0.00 0.00 175.10 173.39 1rbj s ASN 44 N 0.66 -0.63 -0.12 3.54 2.47 -0.07 -4.99 114.94 115.79 1rbj s ASN 44 Ca -0.04 1.19 -0.01 0.00 0.42 0.00 0.00 52.86 54.42 1rbj s ASN 44 Cb -0.06 1.18 -0.02 0.00 -1.45 0.00 0.00 41.25 40.90 1rbj s ASN 44 CO -0.04 -0.21 -0.08 -0.89 -3.72 0.00 0.00 177.10 172.16 1rbj s THR 45 N 0.50 3.53 -0.14 -5.21 2.01 -1.26 0.93 115.64 116.00 1rbj s THR 45 Ca -0.02 -0.51 -0.09 0.00 0.31 0.00 0.00 61.69 61.39 1rbj s THR 45 Cb -0.04 -2.49 -0.04 0.00 0.01 0.00 0.00 72.50 69.93 1rbj s THR 45 CO -0.02 0.53 0.16 -0.36 -0.69 0.00 0.00 174.62 174.24 1rbj s PHE 46 N 0.01 3.54 0.06 4.92 0.08 0.50 -4.54 117.98 122.55 1rbj s PHE 46 Ca -0.01 0.49 -0.01 0.00 0.12 0.00 0.00 56.93 57.52 1rbj s PHE 46 Cb -0.14 -2.05 -0.04 0.00 -0.57 0.00 0.00 43.02 40.22 1rbj s PHE 46 CO 0.03 0.56 0.23 0.08 -0.10 0.00 0.00 175.22 176.02 1rbj s VAL 47 N -0.49 5.37 -0.29 -0.44 1.01 -1.07 0.22 120.40 124.72 1rbj s VAL 47 Ca 0.13 -0.32 0.13 0.00 0.00 0.00 0.00 61.98 61.92 1rbj s VAL 47 Cb -0.12 -3.62 0.48 0.00 0.00 0.00 0.00 36.38 33.12 1rbj s VAL 47 CO 0.02 0.15 1.15 1.41 0.00 0.00 0.00 175.10 177.84 1rbj n HIS 48 N 0.34 2.23 -3.85 5.22 -0.00 0.15 -1.93 115.22 117.37 1rbj n HIS 48 Ca -0.05 -2.23 -0.12 0.00 -0.00 0.00 0.00 57.72 55.31 1rbj n HIS 48 Cb 0.51 -0.29 -0.01 0.00 -0.00 0.00 0.00 29.99 30.20 1rbj n HIS 48 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 1rbj n GLU 49 N -0.65 1.24 -0.66 -0.41 -0.58 -1.26 -4.70 120.64 113.62 1rbj n GLU 49 Ca 0.30 -1.50 -0.12 0.00 -0.42 0.00 0.00 57.16 55.43 1rbj n GLU 49 Cb 0.90 0.23 0.08 0.00 -0.57 0.00 0.00 31.44 32.08 1rbj n GLU 49 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1rbj n SER 50 N -1.71 -0.35 0.03 1.62 3.41 -1.26 -4.38 113.62 110.98 1rbj n SER 50 Ca -0.03 -1.08 -0.20 0.00 -0.26 0.00 0.00 58.87 57.30 1rbj n SER 50 Cb 0.27 -0.40 -0.14 0.00 -0.26 0.00 0.00 64.21 63.68 1rbj n SER 50 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1rbj h LEU 51 N 0.00 0.44 -2.29 1.04 5.85 -1.99 -3.07 115.31 115.29 1rbj h LEU 51 Ca -0.17 -0.83 -0.01 0.00 0.84 0.00 0.00 57.88 57.71 1rbj h LEU 51 Cb 0.47 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 1rbj h LEU 51 CO 0.12 1.73 -0.05 0.00 -0.34 0.00 0.00 178.44 179.90 1rbj h ALA 52 N 0.20 1.36 0.10 1.25 0.00 -1.98 0.37 119.26 120.56 1rbj h ALA 52 Ca -0.37 -0.04 -0.31 0.00 0.00 0.00 0.00 54.91 54.19 1rbj h ALA 52 Cb 2.05 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.82 1rbj h ALA 52 CO 0.12 0.06 -1.59 -0.44 0.00 0.00 0.00 179.25 177.40 1rbj h ASP 53 N 0.00 0.33 0.47 0.00 3.32 -1.94 -3.03 116.42 115.57 1rbj h ASP 53 Ca -0.00 -0.50 -0.25 0.00 0.02 0.00 0.00 57.03 56.30 1rbj h ASP 53 Cb 0.14 -0.11 0.01 0.00 0.22 0.00 0.00 39.33 39.59 1rbj h ASP 53 CO 0.01 1.42 -1.10 0.58 -1.72 0.00 0.00 179.24 178.42 1rbj h VAL 54 N 0.06 1.44 0.00 -1.35 2.07 -1.28 -3.08 116.25 114.11 1rbj h VAL 54 Ca -0.26 -2.74 -0.10 0.00 0.82 0.00 0.00 66.70 64.42 1rbj h VAL 54 Cb 2.01 2.69 -0.01 0.00 -1.52 0.00 0.00 31.29 34.46 1rbj h VAL 54 CO 0.14 0.81 -0.47 1.56 0.02 0.00 0.00 177.57 179.64 1rbj h GLN 55 N 0.15 0.00 -0.96 1.57 4.20 -0.44 -2.62 115.11 117.01 1rbj h GLN 55 Ca -0.11 0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.68 1rbj h GLN 55 Cb 1.78 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 29.49 1rbj h GLN 55 CO 0.19 0.47 0.60 0.00 -0.67 0.00 0.00 178.83 179.41 1rbj h ALA 56 N 1.53 1.37 0.00 3.87 0.00 -1.44 -1.30 119.26 123.30 1rbj h ALA 56 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rbj h ALA 56 Cb 0.83 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1rbj h ALA 56 CO 0.06 0.30 0.74 0.28 0.00 0.00 0.00 179.25 180.63 1rbj h VAL 57 N 1.04 0.00 -0.04 0.00 2.07 -1.50 1.35 116.25 119.17 1rbj h VAL 57 Ca 0.44 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.96 1rbj h VAL 57 Cb 0.30 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 1rbj h VAL 57 CO -0.21 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.38 1rbj n SER 59 N -0.53 1.10 -1.77 0.00 7.64 0.46 -5.03 113.62 115.49 1rbj n SER 59 Ca 0.13 -2.51 0.00 0.00 1.01 0.00 0.00 58.87 57.50 1rbj n SER 59 Cb 0.11 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.01 1rbj n SER 59 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1rbj n GLN 60 N -0.67 1.76 -1.43 1.43 -0.06 -0.69 -5.02 117.38 112.71 1rbj n GLN 60 Ca 0.07 0.00 -0.52 0.00 -2.00 0.00 0.00 57.00 54.55 1rbj n GLN 60 Cb 0.67 0.00 -0.08 0.00 -4.06 0.00 0.00 30.24 26.78 1rbj n GLN 60 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 1rbj n LYS 61 N -0.41 0.94 -2.57 3.69 4.81 -1.06 -4.76 118.16 118.79 1rbj n LYS 61 Ca 0.00 0.26 -0.42 0.00 -0.87 0.00 0.00 58.31 57.28 1rbj n LYS 61 Cb 0.00 -2.31 -0.03 0.00 0.02 0.00 0.00 35.03 32.71 1rbj n LYS 61 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 1rbj s ASN 62 N 6.93 7.14 0.23 3.14 3.04 -1.26 0.55 114.94 134.72 1rbj s ASN 62 Ca 1.10 1.66 0.02 0.00 0.04 0.00 0.00 52.86 55.69 1rbj s ASN 62 Cb -0.96 -2.56 -0.05 0.00 -1.54 0.00 0.00 41.25 36.15 1rbj s ASN 62 CO 0.52 -0.53 0.05 0.68 -3.04 0.00 0.00 177.10 174.79 1rbj s VAL 63 N 2.18 0.68 0.71 -5.21 -7.23 -0.83 -4.89 120.40 105.81 1rbj s VAL 63 Ca 0.52 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.58 1rbj s VAL 63 Cb -0.21 -2.45 0.02 0.00 0.56 0.00 0.00 36.38 34.30 1rbj s VAL 63 CO 0.19 -0.19 1.07 0.00 -0.31 0.00 0.00 175.10 175.87 1rbj s ALA 64 N -3.67 2.54 0.51 1.32 0.00 -1.26 -2.95 121.76 118.25 1rbj s ALA 64 Ca 0.32 0.17 -0.05 0.00 0.00 0.00 0.00 51.96 52.40 1rbj s ALA 64 Cb 0.07 -3.21 -0.02 0.00 0.00 0.00 0.00 23.12 19.95 1rbj s ALA 64 CO 0.10 -1.37 0.81 0.00 0.00 0.00 0.00 175.76 175.30 1rbj h LYS 66 N 0.13 0.00 -0.89 0.00 1.57 -1.91 -1.28 116.57 114.18 1rbj h LYS 66 Ca -0.46 0.00 0.13 0.00 -1.87 0.00 0.00 60.65 58.45 1rbj h LYS 66 Cb 1.22 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.44 1rbj h LYS 66 CO 0.61 0.00 0.51 -0.91 -0.57 0.00 0.00 179.45 179.09 1rbj h ASN 67 N 0.00 0.69 0.00 0.86 2.35 -1.99 -3.46 115.58 114.03 1rbj h ASN 67 Ca 0.01 0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1rbj h ASN 67 Cb 0.04 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.36 1rbj h ASN 67 CO -0.00 0.33 0.00 0.61 -1.65 0.00 0.00 177.43 176.72 1rbj n GLY 68 N -1.33 1.54 3.71 2.83 0.00 -0.48 -5.08 105.19 106.37 1rbj n GLY 68 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 1rbj n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rbj s GLN 69 N -0.48 1.44 0.00 1.61 -0.21 -1.26 -4.70 119.66 116.07 1rbj s GLN 69 Ca 0.00 1.32 0.17 0.00 0.02 0.00 0.00 55.36 56.87 1rbj s GLN 69 Cb 0.00 -1.79 0.12 0.00 1.00 0.00 0.00 33.01 32.34 1rbj s GLN 69 CO 0.00 -2.26 1.01 0.25 -2.12 0.00 0.00 175.29 172.17 1rbj n THR 70 N -3.96 0.00 -2.37 -0.19 -2.24 -1.26 -1.72 114.28 102.53 1rbj n THR 70 Ca 0.10 -0.49 -0.40 0.00 -2.27 0.00 0.00 64.05 61.00 1rbj n THR 70 Cb 0.53 1.33 0.03 0.00 -2.10 0.00 0.00 70.33 70.11 1rbj n THR 70 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1rbj n ASN 71 N 0.84 7.31 -4.70 3.42 6.94 -1.26 -4.72 115.26 123.09 1rbj n ASN 71 Ca 0.09 -3.75 -0.24 0.00 -0.02 0.00 0.00 54.58 50.67 1rbj n ASN 71 Cb 0.41 -1.10 -0.07 0.00 -2.36 0.00 0.00 39.78 36.66 1rbj n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1rbj s TYR 73 N -2.10 -0.41 0.30 0.00 1.51 0.63 -1.97 117.35 115.32 1rbj s TYR 73 Ca 0.31 0.93 -0.11 0.00 -1.01 0.00 0.00 57.07 57.19 1rbj s TYR 73 Cb -0.08 0.10 -0.07 0.00 -0.11 0.00 0.00 41.96 41.80 1rbj s TYR 73 CO 0.21 -0.27 0.65 -1.14 -1.11 0.00 0.00 175.55 173.89 1rbj s GLN 74 N 1.38 3.83 0.12 -0.62 0.74 0.19 -2.43 119.66 122.87 1rbj s GLN 74 Ca -0.09 0.39 -0.30 0.00 0.05 0.00 0.00 55.36 55.41 1rbj s GLN 74 Cb -0.10 -2.53 -0.06 0.00 1.10 0.00 0.00 33.01 31.42 1rbj s GLN 74 CO -0.10 0.18 1.06 -1.54 -0.55 0.00 0.00 175.29 174.35 1rbj s SER 75 N -2.62 7.32 0.14 6.67 1.04 0.11 -2.57 113.70 123.79 1rbj s SER 75 Ca 0.50 1.94 -0.16 0.00 0.48 0.00 0.00 55.95 58.70 1rbj s SER 75 Cb -0.11 -2.59 -0.00 0.00 0.10 0.00 0.00 66.02 63.42 1rbj s SER 75 CO 0.23 -0.22 1.74 1.88 0.98 0.00 0.00 173.24 177.86 1rbj h TYR 76 N 5.72 0.54 -1.05 5.02 0.05 -1.94 -3.42 116.97 121.89 1rbj h TYR 76 Ca -0.43 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.33 1rbj h TYR 76 Cb 1.21 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 38.78 1rbj h TYR 76 CO 0.65 0.42 0.00 0.43 -1.05 0.00 0.00 178.16 178.61 1rbj n SER 77 N -4.74 0.00 -3.81 3.88 7.64 -1.26 -5.05 113.62 110.27 1rbj n SER 77 Ca -0.00 0.00 -0.14 0.00 1.01 0.00 0.00 58.87 59.74 1rbj n SER 77 Cb 0.08 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.13 1rbj n SER 77 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1rbj s THR 78 N 0.33 -0.03 0.31 0.44 2.01 -1.26 -4.42 115.64 113.02 1rbj s THR 78 Ca 0.00 0.12 0.09 0.00 0.31 0.00 0.00 61.69 62.20 1rbj s THR 78 Cb 0.00 -0.06 -0.04 0.00 0.01 0.00 0.00 72.50 72.41 1rbj s THR 78 CO 0.00 0.05 0.10 -0.04 -0.69 0.00 0.00 174.62 174.03 1rbj s MET 79 N 0.58 2.39 -0.24 4.92 -1.94 0.15 -4.84 119.30 120.33 1rbj s MET 79 Ca -0.05 -1.46 -0.22 0.00 -1.71 0.00 0.00 55.69 52.25 1rbj s MET 79 Cb -0.07 -2.20 -0.01 0.00 2.01 0.00 0.00 34.83 34.55 1rbj s MET 79 CO -0.02 0.22 0.71 0.45 -0.01 0.00 0.00 175.02 176.38 1rbj s SER 80 N -3.79 6.70 0.08 3.03 0.15 -1.26 -0.88 113.70 117.73 1rbj s SER 80 Ca 0.35 0.86 0.05 0.00 0.70 0.00 0.00 55.95 57.91 1rbj s SER 80 Cb -0.04 -2.38 -0.03 0.00 -1.71 0.00 0.00 66.02 61.86 1rbj s SER 80 CO 0.22 -0.42 -0.14 0.27 1.20 0.00 0.00 173.24 174.36 1rbj s ILE 81 N 2.58 1.16 -0.21 6.45 -4.36 0.44 -0.68 121.20 126.59 1rbj s ILE 81 Ca 0.30 -1.38 -0.02 0.00 -0.26 0.00 0.00 60.65 59.30 1rbj s ILE 81 Cb -0.15 -1.16 0.01 0.00 1.25 0.00 0.00 42.46 42.40 1rbj s ILE 81 CO 0.08 -0.25 -0.10 -0.89 0.24 0.00 0.00 174.94 174.02 1rbj s THR 82 N -1.40 2.85 0.04 8.37 2.01 0.61 -1.93 115.64 126.19 1rbj s THR 82 Ca -0.00 -0.71 -0.21 0.00 0.31 0.00 0.00 61.69 61.07 1rbj s THR 82 Cb -0.09 -2.29 -0.06 0.00 0.01 0.00 0.00 72.50 70.07 1rbj s THR 82 CO 0.02 0.44 0.63 -0.62 -0.69 0.00 0.00 174.62 174.40 1rbj s ASP 83 N 1.39 7.08 -0.16 3.53 -1.08 0.16 0.19 116.67 127.78 1rbj s ASP 83 Ca 0.05 1.29 0.01 0.00 -0.52 0.00 0.00 52.55 53.37 1rbj s ASP 83 Cb -0.14 -2.39 0.03 0.00 -1.46 0.00 0.00 42.92 38.95 1rbj s ASP 83 CO -0.07 0.15 -0.14 0.00 0.52 0.00 0.00 175.17 175.63 1rbj s ARG 85 N 1.44 2.25 0.46 0.00 3.52 -1.19 -0.89 118.95 124.55 1rbj s ARG 85 Ca 0.04 -0.94 -0.12 0.00 -0.13 0.00 0.00 55.73 54.58 1rbj s ARG 85 Cb -0.13 -2.36 -0.06 0.00 -1.56 0.00 0.00 34.95 30.83 1rbj s ARG 85 CO -0.11 0.53 0.86 -1.83 -0.81 0.00 0.00 175.30 173.94 1rbj s GLU 86 N -2.02 3.79 0.32 5.12 -1.05 0.60 0.14 118.70 125.60 1rbj s GLU 86 Ca 0.21 0.61 -0.04 0.00 -0.15 0.00 0.00 54.97 55.60 1rbj s GLU 86 Cb -0.11 -2.29 -0.05 0.00 -0.44 0.00 0.00 34.13 31.25 1rbj s GLU 86 CO 0.12 -0.17 0.57 0.95 0.95 0.00 0.00 175.26 177.68 1rbj s THR 87 N -2.55 5.04 0.00 1.83 -4.23 0.76 -4.65 115.64 111.84 1rbj s THR 87 Ca 0.53 -0.06 -0.01 0.00 -1.18 0.00 0.00 61.69 60.97 1rbj s THR 87 Cb -0.10 -3.77 -0.04 0.00 1.34 0.00 0.00 72.50 69.92 1rbj s THR 87 CO 0.34 -0.42 1.09 0.61 -0.54 0.00 0.00 174.62 175.71 1rbj n GLY 88 N -1.24 1.41 0.00 3.99 0.00 -1.26 0.79 105.19 108.88 1rbj n GLY 88 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1rbj n GLY 88 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rbj n SER 89 N 2.33 0.00 -4.71 1.61 7.64 -1.26 -5.05 113.62 114.17 1rbj n SER 89 Ca 0.07 -0.85 -0.42 0.00 1.01 0.00 0.00 58.87 58.68 1rbj n SER 89 Cb 0.23 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.40 1rbj n SER 89 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1rbj s SER 90 N 0.00 7.07 -0.27 6.43 0.15 0.24 -4.73 113.70 122.58 1rbj s SER 90 Ca 0.00 2.03 0.00 0.00 0.70 0.00 0.00 55.95 58.69 1rbj s SER 90 Cb 0.00 -2.58 0.15 0.00 -1.71 0.00 0.00 66.02 61.88 1rbj s SER 90 CO 0.00 -0.48 0.42 -0.75 1.20 0.00 0.00 173.24 173.63 1rbj s LYS 91 N 1.03 0.41 0.37 5.44 2.20 -0.94 -4.96 119.74 123.28 1rbj s LYS 91 Ca 0.59 0.36 -0.26 0.00 -0.36 0.00 0.00 55.97 56.30 1rbj s LYS 91 Cb -0.30 -0.29 -0.12 0.00 -1.51 0.00 0.00 37.83 35.61 1rbj s LYS 91 CO 0.29 -0.86 1.06 0.98 -0.36 0.00 0.00 175.35 176.47 1rbj n TYR 92 N 5.37 1.41 0.79 4.03 9.36 -1.26 0.23 117.16 137.08 1rbj n TYR 92 Ca -0.01 0.60 0.09 0.00 3.32 0.00 0.00 57.90 61.90 1rbj n TYR 92 Cb 0.50 -2.27 0.45 0.00 -0.63 0.00 0.00 39.34 37.39 1rbj n TYR 92 CO 0.00 0.00 0.00 -2.30 0.22 0.00 0.00 176.86 174.78 1rbj n PRO 93 N 0.39 0.13 -0.92 2.98 -0.01 -1.26 -4.93 135.00 131.39 1rbj n PRO 93 Ca 0.08 0.14 -0.27 0.00 -0.01 0.00 0.00 63.50 63.45 1rbj n PRO 93 Cb 0.36 -1.50 -0.03 0.00 -0.01 0.00 0.00 33.50 32.33 1rbj n PRO 93 CO 0.00 0.00 0.00 0.27 -0.01 0.00 0.00 175.50 175.76 1rbj n ASN 94 N -1.40 6.12 -4.69 2.55 2.04 0.61 -4.95 115.26 115.55 1rbj n ASN 94 Ca 0.07 -2.39 -0.42 0.00 -0.44 0.00 0.00 54.58 51.39 1rbj n ASN 94 Cb 0.19 -1.24 -0.03 0.00 -2.53 0.00 0.00 39.78 36.17 1rbj n ASN 94 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1rbj s ALA 96 N 2.74 0.14 0.28 0.00 0.00 -1.26 -4.96 121.76 118.69 1rbj s ALA 96 Ca 0.74 0.27 0.10 0.00 0.00 0.00 0.00 51.96 53.07 1rbj s ALA 96 Cb -0.40 -0.45 -0.04 0.00 0.00 0.00 0.00 23.12 22.23 1rbj s ALA 96 CO 0.32 -0.31 -0.03 0.71 0.00 0.00 0.00 175.76 176.46 1rbj s TYR 97 N 1.65 2.62 -0.56 0.00 1.51 -1.26 -0.17 117.35 121.14 1rbj s TYR 97 Ca -0.02 -0.26 -0.09 0.00 -1.01 0.00 0.00 57.07 55.70 1rbj s TYR 97 Cb -0.12 -1.20 0.14 0.00 -0.11 0.00 0.00 41.96 40.67 1rbj s TYR 97 CO -0.03 0.62 0.43 0.21 -1.11 0.00 0.00 175.55 175.67 1rbj s LYS 98 N -3.66 2.67 -0.02 -0.62 2.20 0.37 -4.70 119.74 115.98 1rbj s LYS 98 Ca 0.32 -2.03 -0.30 0.00 -0.36 0.00 0.00 55.97 53.60 1rbj s LYS 98 Cb -0.06 -3.97 -0.06 0.00 -1.51 0.00 0.00 37.83 32.23 1rbj s LYS 98 CO 0.19 -1.21 1.64 0.99 -0.36 0.00 0.00 175.35 176.61 1rbj s THR 99 N 0.89 3.45 -0.08 3.43 2.01 -1.25 -3.14 115.64 120.95 1rbj s THR 99 Ca 0.10 0.67 0.05 0.00 0.31 0.00 0.00 61.69 62.82 1rbj s THR 99 Cb -0.23 -3.43 -0.01 0.00 0.01 0.00 0.00 72.50 68.85 1rbj s THR 99 CO -0.03 -0.04 -0.24 -0.89 -0.69 0.00 0.00 174.62 172.73 1rbj s THR 100 N 3.58 2.05 -0.01 -0.82 2.01 -0.26 -4.97 115.64 117.21 1rbj s THR 100 Ca 0.73 -1.04 0.06 0.00 0.31 0.00 0.00 61.69 61.75 1rbj s THR 100 Cb -0.35 -1.75 -0.03 0.00 0.01 0.00 0.00 72.50 70.39 1rbj s THR 100 CO 0.30 0.56 -0.18 -1.58 -0.69 0.00 0.00 174.62 173.03 1rbj s GLN 101 N 0.05 2.27 0.12 4.92 2.00 -1.26 -0.66 119.66 127.09 1rbj s GLN 101 Ca -0.10 -0.84 -0.25 0.00 -2.00 0.00 0.00 55.36 52.17 1rbj s GLN 101 Cb -0.16 -2.23 0.08 0.00 0.80 0.00 0.00 33.01 31.50 1rbj s GLN 101 CO 0.06 0.58 0.71 0.00 -0.50 0.00 0.00 175.29 176.14 1rbj s ALA 102 N -0.76 -1.64 -0.34 1.58 0.00 -0.82 -4.98 121.76 114.79 1rbj s ALA 102 Ca 0.12 0.58 -0.05 0.00 0.00 0.00 0.00 51.96 52.60 1rbj s ALA 102 Cb -0.10 0.73 0.05 0.00 0.00 0.00 0.00 23.12 23.80 1rbj s ALA 102 CO 0.02 -0.78 0.11 1.21 0.00 0.00 0.00 175.76 176.32 1rbj s ASN 103 N -2.69 5.26 0.16 0.00 3.84 -1.26 -0.42 114.94 119.83 1rbj s ASN 103 Ca 0.03 -1.27 -0.02 0.00 0.21 0.00 0.00 52.86 51.81 1rbj s ASN 103 Cb -0.01 -1.85 -0.04 0.00 -0.55 0.00 0.00 41.25 38.80 1rbj s ASN 103 CO -0.10 -0.35 0.11 -0.54 -2.79 0.00 0.00 177.10 173.44 1rbj s LYS 104 N 1.35 1.07 0.56 0.43 1.02 -0.06 -4.89 119.74 119.22 1rbj s LYS 104 Ca -0.01 -1.48 -0.17 0.00 0.02 0.00 0.00 55.97 54.33 1rbj s LYS 104 Cb -0.20 0.27 -0.05 0.00 -0.52 0.00 0.00 37.83 37.33 1rbj s LYS 104 CO 0.01 -0.33 1.04 -1.01 -0.92 0.00 0.00 175.35 174.14 1rbj s HIS 105 N -4.08 3.11 0.18 3.18 3.76 -0.21 0.32 115.29 121.54 1rbj s HIS 105 Ca 0.29 1.51 0.08 0.00 -0.15 0.00 0.00 55.06 56.79 1rbj s HIS 105 Cb 0.07 -2.96 -0.04 0.00 1.11 0.00 0.00 32.58 30.75 1rbj s HIS 105 CO 0.06 -0.88 -0.05 0.96 -0.85 0.00 0.00 174.74 173.97 1rbj s ILE 106 N -2.43 3.43 -0.12 0.60 -4.36 -1.26 -1.58 121.20 115.48 1rbj s ILE 106 Ca 0.63 -1.54 0.01 0.00 -0.26 0.00 0.00 60.65 59.49 1rbj s ILE 106 Cb -0.14 -2.71 0.02 0.00 1.25 0.00 0.00 42.46 40.87 1rbj s ILE 106 CO 0.33 -0.10 -0.14 -0.63 0.24 0.00 0.00 174.94 174.63 1rbj s ILE 107 N -1.70 1.49 0.14 8.37 1.01 0.01 -0.71 121.20 129.81 1rbj s ILE 107 Ca 0.26 -0.62 0.07 0.00 0.00 0.00 0.00 60.65 60.36 1rbj s ILE 107 Cb -0.09 -1.39 -0.04 0.00 0.01 0.00 0.00 42.46 40.95 1rbj s ILE 107 CO 0.17 0.44 -0.17 0.68 0.00 0.00 0.00 174.94 176.06 1rbj s VAL 108 N 1.20 1.60 -0.22 2.92 -7.23 -1.02 -0.80 120.40 116.85 1rbj s VAL 108 Ca -0.02 -1.81 -0.18 0.00 -1.81 0.00 0.00 61.98 58.16 1rbj s VAL 108 Cb -0.14 -1.69 -0.03 0.00 0.56 0.00 0.00 36.38 35.08 1rbj s VAL 108 CO -0.05 -0.34 0.52 0.00 -0.31 0.00 0.00 175.10 174.92 1rbj s ALA 109 N -2.03 3.56 0.33 1.32 0.00 0.34 0.23 121.76 125.50 1rbj s ALA 109 Ca 0.12 -0.45 0.03 0.00 0.00 0.00 0.00 51.96 51.66 1rbj s ALA 109 Cb -0.06 -2.84 -0.02 0.00 0.00 0.00 0.00 23.12 20.20 1rbj s ALA 109 CO 0.05 -0.53 0.49 0.00 0.00 0.00 0.00 175.76 175.77 1rbj s GLU 111 N -4.22 0.18 0.00 0.00 2.12 0.16 -4.86 118.70 112.09 1rbj s GLU 111 Ca 0.40 0.15 0.00 0.00 0.36 0.00 0.00 54.97 55.88 1rbj s GLU 111 Cb -0.09 0.09 0.00 0.00 0.26 0.00 0.00 34.13 34.38 1rbj s GLU 111 CO 0.33 -0.04 0.00 0.41 -0.54 0.00 0.00 175.26 175.42 1rbj n GLY 112 N 1.33 -1.28 2.76 -1.50 0.00 -1.26 -1.57 105.19 103.67 1rbj n GLY 112 Ca -0.08 -2.14 -0.17 0.00 0.00 0.00 0.00 46.02 43.62 1rbj n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1rbj s ASN 113 N -3.55 1.69 0.44 1.61 2.47 -1.26 -2.48 114.94 113.86 1rbj s ASN 113 Ca 0.00 -0.75 -0.25 0.00 0.42 0.00 0.00 52.86 52.28 1rbj s ASN 113 Cb 0.00 0.50 -0.09 0.00 -1.45 0.00 0.00 41.25 40.21 1rbj s ASN 113 CO 0.00 -0.39 1.31 -0.81 -3.72 0.00 0.00 177.10 173.50 1rbj n PRO 114 N 5.31 1.98 -2.65 0.43 -0.04 -1.26 -5.08 135.00 133.69 1rbj n PRO 114 Ca -0.02 0.71 -0.42 0.00 -0.04 0.00 0.00 63.50 63.72 1rbj n PRO 114 Cb 0.46 -2.46 -0.03 0.00 -0.04 0.00 0.00 33.50 31.44 1rbj n PRO 114 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1rbj s TYR 115 N -1.21 2.65 0.24 0.54 5.04 -1.03 -4.85 117.35 118.73 1rbj s TYR 115 Ca 0.62 0.30 0.03 0.00 -2.44 0.00 0.00 57.07 55.57 1rbj s TYR 115 Cb -0.48 -4.40 -0.05 0.00 0.35 0.00 0.00 41.96 37.37 1rbj s TYR 115 CO 0.57 -1.53 0.04 0.14 -1.34 0.00 0.00 175.55 173.43 1rbj s VAL 116 N 4.70 0.85 0.36 3.14 -7.23 -0.61 -4.74 120.40 116.88 1rbj s VAL 116 Ca 0.40 -2.01 -0.28 0.00 -1.81 0.00 0.00 61.98 58.27 1rbj s VAL 116 Cb -0.09 -2.46 -0.11 0.00 0.56 0.00 0.00 36.38 34.29 1rbj s VAL 116 CO 0.24 -0.21 1.43 -2.84 -0.31 0.00 0.00 175.10 173.41 1rbj s PRO 117 N -3.93 4.19 0.00 4.82 0.02 -1.26 0.38 135.00 139.22 1rbj s PRO 117 Ca 0.32 2.46 0.00 0.00 0.02 0.00 0.00 61.00 63.79 1rbj s PRO 117 Cb 0.07 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.59 1rbj s PRO 117 CO 0.10 -0.42 0.00 1.55 -0.33 0.00 0.00 177.00 177.90 1rbj n VAL 118 N 0.56 0.00 -3.64 3.83 3.14 -0.46 -4.42 118.33 117.34 1rbj n VAL 118 Ca 0.01 0.00 -0.08 0.00 -2.96 0.00 0.00 64.34 61.30 1rbj n VAL 118 Cb 0.40 1.48 -0.07 0.00 -1.06 0.00 0.00 33.84 34.59 1rbj n VAL 118 CO 0.00 0.00 0.00 -2.28 -6.46 0.00 0.00 176.83 168.09 1rbj s HIS 119 N 0.00 -0.53 -0.33 1.45 5.65 -1.21 -4.71 115.29 115.61 1rbj s HIS 119 Ca 0.00 1.24 -0.09 0.00 0.25 0.00 0.00 55.06 56.46 1rbj s HIS 119 Cb 0.00 0.37 0.01 0.00 -1.18 0.00 0.00 32.58 31.78 1rbj s HIS 119 CO 0.00 -0.26 0.15 0.12 -0.65 0.00 0.00 174.74 174.10 1rbj s PHE 120 N 0.49 3.20 -0.10 3.88 2.19 -1.26 -0.51 117.98 125.88 1rbj s PHE 120 Ca 0.00 -0.87 -0.06 0.00 0.33 0.00 0.00 56.93 56.34 1rbj s PHE 120 Cb -0.05 -2.35 -0.02 0.00 -1.31 0.00 0.00 43.02 39.29 1rbj s PHE 120 CO -0.08 -0.57 -0.11 0.22 1.83 0.00 0.00 175.22 176.51 1rbj h ASP 121 N 8.34 0.00 -0.41 6.13 3.58 -1.30 -3.48 116.42 129.28 1rbj h ASP 121 Ca -0.29 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.16 1rbj h ASP 121 Cb 1.12 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.17 1rbj h ASP 121 CO 0.63 0.53 0.00 0.00 -2.88 0.00 0.00 179.24 177.52 1rbj n ALA 122 N -3.15 0.00 -3.62 -0.78 0.00 -0.19 -4.93 120.51 107.84 1rbj n ALA 122 Ca -0.04 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.28 1rbj n ALA 122 Cb 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.54 1rbj n ALA 122 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1rbj s SER 123 N 0.59 -0.55 0.00 0.00 1.04 -1.26 -0.81 113.70 112.72 1rbj s SER 123 Ca 0.00 0.96 0.00 0.00 0.48 0.00 0.00 55.95 57.39 1rbj s SER 123 Cb 0.00 0.94 0.00 0.00 0.10 0.00 0.00 66.02 67.06 1rbj s SER 123 CO 0.00 -0.25 0.00 1.33 0.98 0.00 0.00 173.24 175.30