#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rjv n SER 2 N 0.00 0.00 -3.88 6.12 3.41 -1.26 -5.03 113.62 112.98 1rjv n SER 2 Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.20 1rjv n SER 2 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1rjv n SER 2 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 1rjv n MET 3 N 0.00 2.14 0.00 4.33 0.00 -1.26 -1.67 117.12 120.66 1rjv n MET 3 Ca 0.00 -2.33 0.00 0.00 0.00 0.00 0.00 57.70 55.37 1rjv n MET 3 Cb 0.00 -3.20 0.00 0.00 0.00 0.00 0.00 33.22 30.02 1rjv n MET 3 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 1rjv n THR 4 N 5.97 0.00 0.03 1.12 -1.04 -1.26 -4.71 114.28 114.39 1rjv n THR 4 Ca 0.50 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 62.41 1rjv n THR 4 Cb 0.41 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.85 1rjv n THR 4 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 1rjv h ASP 5 N 0.00 -0.15 -0.35 8.00 3.58 -1.70 -2.82 116.42 122.98 1rjv h ASP 5 Ca 0.00 -0.38 -0.05 0.00 0.42 0.00 0.00 57.03 57.02 1rjv h ASP 5 Cb 0.00 0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.08 1rjv h ASP 5 CO 0.00 0.44 0.04 -0.07 -2.88 0.00 0.00 179.24 176.77 1rjv h LEU 6 N -0.89 0.58 0.00 2.28 3.38 -1.88 -3.41 115.31 115.36 1rjv h LEU 6 Ca -0.02 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1rjv h LEU 6 Cb 0.52 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1rjv h LEU 6 CO 0.03 0.71 0.00 0.18 0.09 0.00 0.00 178.44 179.45 1rjv n LEU 7 N -4.55 0.57 0.00 1.67 7.99 -1.26 -5.04 117.00 116.38 1rjv n LEU 7 Ca -0.01 0.02 0.00 0.00 -0.01 0.00 0.00 56.01 56.01 1rjv n LEU 7 Cb 0.24 -0.09 0.00 0.00 -0.11 0.00 0.00 43.42 43.46 1rjv n LEU 7 CO 0.39 -0.09 0.00 0.59 -1.51 0.00 0.00 177.39 176.77 1rjv n ASN 8 N -1.47 0.00 -0.30 -1.43 3.02 -1.07 -4.98 115.26 109.04 1rjv n ASN 8 Ca 0.00 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.66 1rjv n ASN 8 Cb 0.00 0.00 0.34 0.00 -0.61 0.00 0.00 39.78 39.51 1rjv n ASN 8 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rjv h ALA 9 N 0.00 1.75 -0.14 5.41 0.00 -1.82 -0.70 119.26 123.76 1rjv h ALA 9 Ca 0.00 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1rjv h ALA 9 Cb 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1rjv h ALA 9 CO 0.00 -0.00 -0.06 1.49 0.00 0.00 0.00 179.25 180.68 1rjv h GLU 10 N 0.77 0.21 0.00 0.00 4.81 -1.96 0.49 114.58 118.90 1rjv h GLU 10 Ca 0.47 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.66 1rjv h GLU 10 Cb 0.68 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.02 1rjv h GLU 10 CO -0.23 0.28 -0.00 -0.44 -0.73 0.00 0.00 179.01 177.89 1rjv h ASP 11 N 0.20 -0.00 -0.81 1.04 5.19 -1.59 -3.25 116.42 117.21 1rjv h ASP 11 Ca 0.05 -0.90 0.19 0.00 -0.62 0.00 0.00 57.03 55.74 1rjv h ASP 11 Cb 0.24 0.00 -0.12 0.00 0.18 0.00 0.00 39.33 39.63 1rjv h ASP 11 CO 0.01 0.94 0.25 0.40 -3.12 0.00 0.00 179.24 177.72 1rjv h ILE 12 N -0.98 0.48 -0.32 0.35 5.03 -1.06 -1.05 117.51 119.96 1rjv h ILE 12 Ca -0.00 -0.11 0.03 0.00 -0.12 0.00 0.00 64.86 64.67 1rjv h ILE 12 Cb 0.90 0.14 -0.03 0.00 -3.03 0.00 0.00 36.82 34.80 1rjv h ILE 12 CO 0.00 0.06 0.11 0.50 -0.68 0.00 0.00 178.15 178.14 1rjv h LYS 13 N 0.31 0.25 -0.19 2.37 1.63 -0.98 0.36 116.57 120.33 1rjv h LYS 13 Ca 0.48 -0.01 -0.14 0.00 -0.85 0.00 0.00 60.65 60.12 1rjv h LYS 13 Cb 0.86 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.42 1rjv h LYS 13 CO -0.53 0.16 -0.48 0.87 -3.45 0.00 0.00 179.45 176.02 1rjv h LYS 14 N 0.25 0.50 0.26 1.90 6.56 -1.48 -3.28 116.57 121.28 1rjv h LYS 14 Ca 0.14 -0.28 -0.01 0.00 -1.06 0.00 0.00 60.65 59.44 1rjv h LYS 14 Cb 0.11 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 31.79 1rjv h LYS 14 CO -0.14 0.87 -0.12 0.00 -2.06 0.00 0.00 179.45 178.00 1rjv h ALA 15 N 1.08 -0.34 -0.54 3.86 0.00 -0.61 -3.01 119.26 119.70 1rjv h ALA 15 Ca 0.02 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 54.90 1rjv h ALA 15 Cb 0.99 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1rjv h ALA 15 CO 0.09 -0.60 0.37 0.28 0.00 0.00 0.00 179.25 179.39 1rjv h VAL 16 N -0.53 0.86 0.00 0.00 2.07 -1.06 0.59 116.25 118.19 1rjv h VAL 16 Ca -0.04 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.39 1rjv h VAL 16 Cb 0.39 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1rjv h VAL 16 CO 0.06 0.05 0.00 1.23 0.02 0.00 0.00 177.57 178.93 1rjv h GLY 17 N 0.28 0.00 0.55 2.17 0.00 -1.59 -2.29 103.07 102.19 1rjv h GLY 17 Ca 0.25 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.32 1rjv h GLY 17 CO -0.06 0.00 -1.37 0.00 0.00 0.00 0.00 176.54 175.11 1rjv h ALA 18 N 2.03 0.16 0.00 3.60 0.00 -0.90 -3.31 119.26 120.83 1rjv h ALA 18 Ca 0.00 -1.07 -0.01 0.00 0.00 0.00 0.00 54.91 53.83 1rjv h ALA 18 Cb 0.10 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1rjv h ALA 18 CO 0.00 0.80 -0.06 0.74 0.00 0.00 0.00 179.25 180.73 1rjv h PHE 19 N -0.32 0.00 -0.04 0.00 -1.00 -1.61 -3.43 116.94 110.54 1rjv h PHE 19 Ca -0.29 0.00 -0.57 0.00 2.81 0.00 0.00 57.97 59.91 1rjv h PHE 19 Cb 1.74 0.00 0.08 0.00 3.61 0.00 0.00 35.95 41.38 1rjv h PHE 19 CO 0.13 0.06 1.74 0.43 -1.61 0.00 0.00 178.31 179.06 1rjv n SER 20 N -3.17 1.91 -2.39 2.17 7.64 -0.87 -4.65 113.62 114.26 1rjv n SER 20 Ca 0.01 -2.60 -0.08 0.00 1.01 0.00 0.00 58.87 57.21 1rjv n SER 20 Cb 0.35 -0.95 0.01 0.00 -1.01 0.00 0.00 64.21 62.62 1rjv n SER 20 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rjv n ALA 21 N 9.17 -1.09 0.04 -0.43 0.00 -1.26 -5.00 120.51 121.93 1rjv n ALA 21 Ca 0.48 -1.02 -0.02 0.00 0.00 0.00 0.00 53.44 52.87 1rjv n ALA 21 Cb 0.42 0.82 -0.01 0.00 0.00 0.00 0.00 19.45 20.68 1rjv n ALA 21 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1rjv h THR 22 N 1.75 0.00 0.00 0.00 1.35 -1.92 -3.44 112.91 110.66 1rjv h THR 22 Ca -0.24 -0.40 0.00 0.00 -0.55 0.00 0.00 66.41 65.22 1rjv h THR 22 Cb 0.93 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.35 1rjv h THR 22 CO 0.31 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 176.05 1rjv n ASP 23 N -3.52 1.29 -0.23 5.36 9.92 -1.26 -1.12 116.55 126.99 1rjv n ASP 23 Ca -0.02 -1.44 -0.06 0.00 -0.53 0.00 0.00 54.79 52.73 1rjv n ASP 23 Cb 0.06 0.00 0.04 0.00 -0.64 0.00 0.00 41.12 40.58 1rjv n ASP 23 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 1rjv h SER 24 N 0.00 0.81 0.00 -2.24 0.87 -1.87 -3.42 113.55 107.70 1rjv h SER 24 Ca 0.00 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1rjv h SER 24 Cb 0.34 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1rjv h SER 24 CO 0.00 0.67 0.00 0.33 -0.53 0.00 0.00 176.83 177.30 1rjv n PHE 25 N -4.53 0.00 -2.12 2.24 7.35 -1.26 -4.81 117.46 114.33 1rjv n PHE 25 Ca 0.05 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.63 1rjv n PHE 25 Cb 0.09 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 39.91 1rjv n PHE 25 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 1rjv n ASP 26 N 0.01 -3.28 -0.25 -2.13 -0.08 -1.26 -4.14 116.55 105.42 1rjv n ASP 26 Ca 0.00 0.25 0.08 0.00 -1.51 0.00 0.00 54.79 53.60 1rjv n ASP 26 Cb 0.00 -2.90 0.33 0.00 2.34 0.00 0.00 41.12 40.89 1rjv n ASP 26 CO 0.00 0.00 0.00 -0.74 0.12 0.00 0.00 177.20 176.58 1rjv h HIS 27 N 0.00 0.87 -0.15 -0.67 -0.00 -1.94 0.33 115.15 113.60 1rjv h HIS 27 Ca -0.24 0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.17 1rjv h HIS 27 Cb 1.04 -0.28 -0.01 0.00 -0.00 0.00 0.00 27.41 28.16 1rjv h HIS 27 CO 0.60 0.41 0.10 0.87 -0.00 0.00 0.00 177.93 179.91 1rjv h LYS 28 N 0.82 0.11 0.01 5.26 6.56 -1.88 0.55 116.57 128.00 1rjv h LYS 28 Ca 0.39 -0.01 -0.08 0.00 -1.06 0.00 0.00 60.65 59.89 1rjv h LYS 28 Cb 0.41 -0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 32.04 1rjv h LYS 28 CO -0.16 0.08 -0.42 -0.22 -2.06 0.00 0.00 179.45 176.67 1rjv h LYS 29 N 0.12 0.02 -0.57 3.15 3.64 -0.82 -3.30 116.57 118.81 1rjv h LYS 29 Ca 0.06 -0.04 0.08 0.00 -1.27 0.00 0.00 60.65 59.48 1rjv h LYS 29 Cb 0.10 0.01 -0.10 0.00 -0.41 0.00 0.00 32.23 31.83 1rjv h LYS 29 CO -0.01 1.02 -0.48 0.35 -2.27 0.00 0.00 179.45 178.05 1rjv h PHE 30 N -0.95 -1.46 -0.50 1.91 3.04 -0.60 0.19 116.94 118.57 1rjv h PHE 30 Ca -0.11 0.09 0.07 0.00 3.98 0.00 0.00 57.97 62.00 1rjv h PHE 30 Cb 1.14 0.72 -0.03 0.00 2.56 0.00 0.00 35.95 40.33 1rjv h PHE 30 CO 0.22 -0.44 0.34 0.74 -2.02 0.00 0.00 178.31 177.15 1rjv h PHE 31 N -0.25 0.39 0.04 0.41 -1.00 -1.06 0.29 116.94 115.76 1rjv h PHE 31 Ca 0.15 0.01 -0.00 0.00 2.81 0.00 0.00 57.97 60.94 1rjv h PHE 31 Cb 0.56 -0.13 0.00 0.00 3.61 0.00 0.00 35.95 39.99 1rjv h PHE 31 CO -0.75 0.20 -0.02 1.96 -1.61 0.00 0.00 178.31 178.10 1rjv h GLN 32 N 0.38 -0.05 -0.84 1.51 7.50 -1.40 0.84 115.11 123.06 1rjv h GLN 32 Ca 0.22 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 59.34 1rjv h GLN 32 Cb 0.39 0.01 -0.04 0.00 0.05 0.00 0.00 27.48 27.89 1rjv h GLN 32 CO -0.06 0.60 0.39 0.52 -1.50 0.00 0.00 178.83 178.78 1rjv h MET 33 N -0.83 1.22 0.00 1.46 2.86 -0.11 -2.12 114.93 117.41 1rjv h MET 33 Ca -0.01 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 57.45 1rjv h MET 33 Cb 0.68 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 32.12 1rjv h MET 33 CO 0.01 0.94 0.00 1.55 1.06 0.00 0.00 176.91 180.47 1rjv n VAL 34 N -4.30 0.63 -1.74 -2.22 3.14 0.96 -4.67 118.33 110.14 1rjv n VAL 34 Ca 0.08 -0.14 -0.09 0.00 -2.96 0.00 0.00 64.34 61.23 1rjv n VAL 34 Cb 0.15 -0.73 -0.02 0.00 -1.06 0.00 0.00 33.84 32.18 1rjv n VAL 34 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1rjv n GLY 35 N 0.98 0.50 0.11 7.55 0.00 -0.80 -4.56 105.19 108.98 1rjv n GLY 35 Ca 0.05 -0.58 -0.13 0.00 0.00 0.00 0.00 46.02 45.36 1rjv n GLY 35 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1rjv h LEU 36 N 0.00 -0.15 -2.15 0.99 3.38 -1.10 -1.54 115.31 114.75 1rjv h LEU 36 Ca -0.19 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1rjv h LEU 36 Cb 0.88 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.67 1rjv h LEU 36 CO 0.25 0.24 0.18 0.11 0.09 0.00 0.00 178.44 179.32 1rjv h LYS 37 N -0.56 0.00 -0.00 1.13 1.57 -1.89 0.10 116.57 116.92 1rjv h LYS 37 Ca -0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1rjv h LYS 37 Cb 0.44 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.75 1rjv h LYS 37 CO 0.03 0.00 -0.24 1.17 -0.57 0.00 0.00 179.45 179.84 1rjv n LYS 38 N -2.79 0.31 -3.39 3.15 4.81 -0.63 -4.93 118.16 114.69 1rjv n LYS 38 Ca -0.02 -0.13 -0.19 0.00 -0.87 0.00 0.00 58.31 57.10 1rjv n LYS 38 Cb 0.23 -1.50 -0.00 0.00 0.02 0.00 0.00 35.03 33.78 1rjv n LYS 38 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1rjv s LYS 39 N -2.78 3.04 0.76 1.64 2.47 0.36 -5.10 119.74 120.13 1rjv s LYS 39 Ca 0.19 -1.07 -0.11 0.00 -1.56 0.00 0.00 55.97 53.42 1rjv s LYS 39 Cb 0.19 -2.79 0.05 0.00 -1.46 0.00 0.00 37.83 33.81 1rjv s LYS 39 CO 0.57 -0.01 1.08 -1.12 0.16 0.00 0.00 175.35 176.04 1rjv s SER 40 N -4.20 4.69 0.15 1.43 0.01 -1.26 -4.84 113.70 109.67 1rjv s SER 40 Ca 0.47 1.71 -0.17 0.00 1.31 0.00 0.00 55.95 59.27 1rjv s SER 40 Cb -0.09 -2.46 0.04 0.00 0.21 0.00 0.00 66.02 63.71 1rjv s SER 40 CO 0.31 -1.90 1.73 0.00 0.41 0.00 0.00 173.24 173.79 1rjv h ALA 41 N -1.04 0.33 0.00 1.44 0.00 -1.99 -0.14 119.26 117.87 1rjv h ALA 41 Ca -0.44 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.50 1rjv h ALA 41 Cb 1.23 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.10 1rjv h ALA 41 CO 0.54 -0.35 -0.13 -0.44 0.00 0.00 0.00 179.25 178.86 1rjv h ASP 42 N 0.17 0.00 0.35 0.00 5.19 -1.99 0.36 116.42 120.49 1rjv h ASP 42 Ca 0.15 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.54 1rjv h ASP 42 Cb 0.16 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.68 1rjv h ASP 42 CO -0.20 0.13 -0.17 -0.78 -3.12 0.00 0.00 179.24 175.11 1rjv h ASP 43 N 0.00 -0.40 -1.05 6.45 1.82 -1.73 -2.69 116.42 118.82 1rjv h ASP 43 Ca -0.00 -0.16 0.28 0.00 -0.39 0.00 0.00 57.03 56.76 1rjv h ASP 43 Cb 0.32 0.10 -0.11 0.00 0.68 0.00 0.00 39.33 40.33 1rjv h ASP 43 CO 0.02 0.03 0.66 0.58 -1.61 0.00 0.00 179.24 178.92 1rjv h VAL 44 N -0.92 0.48 0.31 2.25 2.07 -0.44 0.33 116.25 120.34 1rjv h VAL 44 Ca -0.05 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 1rjv h VAL 44 Cb 0.53 0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.31 1rjv h VAL 44 CO 0.08 0.07 -0.51 0.11 0.02 0.00 0.00 177.57 177.34 1rjv h LYS 45 N 0.41 -0.84 0.00 1.57 1.57 -0.96 -1.30 116.57 117.01 1rjv h LYS 45 Ca 0.63 0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 59.46 1rjv h LYS 45 Cb 1.54 0.19 -0.00 0.00 0.08 0.00 0.00 32.23 34.04 1rjv h LYS 45 CO -0.36 -0.56 -0.05 0.87 -0.57 0.00 0.00 179.45 178.78 1rjv h LYS 46 N -0.88 0.00 0.35 3.15 1.57 -0.47 -2.54 116.57 117.76 1rjv h LYS 46 Ca -0.03 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1rjv h LYS 46 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.13 1rjv h LYS 46 CO -0.18 0.05 -0.17 0.28 -0.57 0.00 0.00 179.45 178.86 1rjv h VAL 47 N 0.00 0.00 -0.91 0.50 2.07 -0.16 0.27 116.25 118.01 1rjv h VAL 47 Ca -0.00 -0.21 0.23 0.00 0.82 0.00 0.00 66.70 67.54 1rjv h VAL 47 Cb 0.15 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 29.79 1rjv h VAL 47 CO 0.01 0.00 0.43 0.15 0.02 0.00 0.00 177.57 178.17 1rjv h PHE 48 N -0.67 0.71 -0.03 1.57 3.57 -1.20 0.24 116.94 121.13 1rjv h PHE 48 Ca -0.05 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.50 1rjv h PHE 48 Cb 0.36 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 38.93 1rjv h PHE 48 CO 0.07 -0.03 0.20 0.45 -2.23 0.00 0.00 178.31 176.76 1rjv h HIS 49 N 0.43 0.00 0.06 0.41 3.86 -1.54 -0.20 115.15 118.17 1rjv h HIS 49 Ca 0.58 0.00 -0.28 0.00 -1.16 0.00 0.00 60.37 59.51 1rjv h HIS 49 Cb 1.10 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.54 1rjv h HIS 49 CO -0.11 0.00 -1.44 1.98 0.86 0.00 0.00 177.93 179.21 1rjv h MET 50 N 0.00 0.13 0.01 2.45 1.85 -0.50 -3.37 114.93 115.49 1rjv h MET 50 Ca 0.01 -0.22 -0.13 0.00 -0.61 0.00 0.00 59.70 58.75 1rjv h MET 50 Cb 0.41 0.08 0.01 0.00 0.43 0.00 0.00 31.60 32.53 1rjv h MET 50 CO -0.00 0.95 -0.51 -0.07 -0.40 0.00 0.00 176.91 176.87 1rjv h LEU 51 N 0.04 0.43 -6.91 3.39 -0.00 -1.26 -3.36 115.31 107.63 1rjv h LEU 51 Ca -0.20 -0.79 -0.56 0.00 -0.00 0.00 0.00 57.88 56.34 1rjv h LEU 51 Cb 1.95 -0.13 0.04 0.00 -0.00 0.00 0.00 40.66 42.52 1rjv h LEU 51 CO 0.13 1.16 1.87 -0.67 -0.00 0.00 0.00 178.44 180.94 1rjv n ASP 52 N -4.30 2.47 0.16 -0.43 2.03 -0.18 -4.74 116.55 111.56 1rjv n ASP 52 Ca -0.11 -2.66 0.19 0.00 0.52 0.00 0.00 54.79 52.73 1rjv n ASP 52 Cb 0.64 -1.21 0.79 0.00 -0.72 0.00 0.00 41.12 40.62 1rjv n ASP 52 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 1rjv h LYS 53 N 8.60 0.00 0.00 -0.67 2.10 -1.79 -0.17 116.57 124.64 1rjv h LYS 53 Ca 0.35 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.00 1rjv h LYS 53 Cb 0.74 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.07 1rjv h LYS 53 CO 1.78 0.00 0.00 -0.44 -2.00 0.00 0.00 179.45 178.79 1rjv h ASP 54 N 0.00 0.00 -6.04 7.07 3.32 -1.91 -3.47 116.42 115.38 1rjv h ASP 54 Ca 0.13 0.00 -0.46 0.00 0.02 0.00 0.00 57.03 56.72 1rjv h ASP 54 Cb 0.76 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.23 1rjv h ASP 54 CO -0.00 0.00 -0.70 0.29 -1.72 0.00 0.00 179.24 177.10 1rjv n LYS 55 N -2.51 -4.36 0.00 3.56 4.76 -0.08 -4.91 118.16 114.62 1rjv n LYS 55 Ca 0.04 0.53 0.12 0.00 -2.87 0.00 0.00 58.31 56.13 1rjv n LYS 55 Cb 0.39 -5.34 0.32 0.00 -1.84 0.00 0.00 35.03 28.56 1rjv n LYS 55 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1rjv n SER 56 N -2.61 0.60 0.00 4.39 3.41 -1.26 -4.96 113.62 113.19 1rjv n SER 56 Ca 0.03 -0.38 0.00 0.00 -0.26 0.00 0.00 58.87 58.25 1rjv n SER 56 Cb 0.53 0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.65 1rjv n SER 56 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rjv n GLY 57 N 1.45 0.75 3.12 5.00 0.00 -1.26 -5.05 105.19 109.20 1rjv n GLY 57 Ca 0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.00 1rjv n GLY 57 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1rjv s PHE 58 N -2.48 0.14 -0.10 1.61 0.08 -1.26 -4.84 117.98 111.13 1rjv s PHE 58 Ca 0.00 -0.38 -0.00 0.00 0.12 0.00 0.00 56.93 56.67 1rjv s PHE 58 Cb 0.00 -0.10 -0.03 0.00 -0.57 0.00 0.00 43.02 42.32 1rjv s PHE 58 CO 0.00 -0.36 -0.08 0.42 -0.10 0.00 0.00 175.22 175.10 1rjv s ILE 59 N -2.31 3.52 0.41 0.64 1.01 -1.01 -4.76 121.20 118.71 1rjv s ILE 59 Ca -0.07 -0.52 0.04 0.00 0.00 0.00 0.00 60.65 60.09 1rjv s ILE 59 Cb -0.03 -2.47 -0.02 0.00 0.01 0.00 0.00 42.46 39.95 1rjv s ILE 59 CO -0.03 0.56 0.12 -1.61 0.00 0.00 0.00 174.94 173.98 1rjv s GLU 60 N -0.27 1.94 0.43 2.79 8.01 -1.26 -2.66 118.70 127.67 1rjv s GLU 60 Ca 0.03 -2.18 0.21 0.00 0.01 0.00 0.00 54.97 53.04 1rjv s GLU 60 Cb -0.13 -0.66 1.17 0.00 -4.31 0.00 0.00 34.13 30.21 1rjv s GLU 60 CO 0.03 -0.47 1.80 1.05 0.01 0.00 0.00 175.26 177.68 1rjv h GLU 61 N 1.78 0.32 -0.30 1.61 4.11 -1.97 0.07 114.58 120.19 1rjv h GLU 61 Ca -0.36 -0.02 0.07 0.00 0.07 0.00 0.00 59.36 59.12 1rjv h GLU 61 Cb 1.27 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 30.38 1rjv h GLU 61 CO 0.58 0.21 -0.18 -0.44 0.07 0.00 0.00 179.01 179.25 1rjv h ASP 62 N 0.33 -0.58 0.49 3.06 5.19 -2.03 -2.63 116.42 120.25 1rjv h ASP 62 Ca 0.55 0.13 -0.30 0.00 -0.62 0.00 0.00 57.03 56.79 1rjv h ASP 62 Cb 1.53 0.31 0.01 0.00 0.18 0.00 0.00 39.33 41.35 1rjv h ASP 62 CO -0.22 -0.21 -1.39 -0.33 -3.12 0.00 0.00 179.24 173.96 1rjv h GLU 63 N -0.14 0.32 -1.03 3.56 3.07 -1.74 -3.39 114.58 115.23 1rjv h GLU 63 Ca 0.16 -0.56 0.26 0.00 -0.50 0.00 0.00 59.36 58.72 1rjv h GLU 63 Cb 0.38 0.21 -0.11 0.00 -0.84 0.00 0.00 28.75 28.38 1rjv h GLU 63 CO -0.39 1.24 0.63 1.25 -1.40 0.00 0.00 179.01 180.34 1rjv h LEU 64 N 0.09 0.57 -1.03 1.33 5.85 -0.65 0.28 115.31 121.75 1rjv h LEU 64 Ca -0.20 0.12 0.18 0.00 0.84 0.00 0.00 57.88 58.82 1rjv h LEU 64 Cb 2.03 0.03 -0.10 0.00 0.37 0.00 0.00 40.66 42.99 1rjv h LEU 64 CO 0.21 0.08 0.62 1.23 -0.34 0.00 0.00 178.44 180.24 1rjv h GLY 65 N 0.49 1.72 -3.59 3.75 0.00 -1.69 -3.36 103.07 100.39 1rjv h GLY 65 Ca 0.63 -0.36 -0.18 0.00 0.00 0.00 0.00 47.33 47.42 1rjv h GLY 65 CO -0.41 -0.03 -0.70 1.97 0.00 0.00 0.00 176.54 177.38 1rjv n PHE 66 N -4.73 -0.13 -0.33 5.60 -1.74 0.62 -0.28 117.46 116.48 1rjv n PHE 66 Ca 0.23 -1.07 0.26 0.00 -0.56 0.00 0.00 57.45 56.31 1rjv n PHE 66 Cb 0.55 0.34 0.50 0.00 1.52 0.00 0.00 39.48 42.38 1rjv n PHE 66 CO 0.00 0.00 0.00 0.97 -0.56 0.00 0.00 176.76 177.17 1rjv h ILE 67 N 5.57 0.09 0.00 1.97 -0.00 -0.77 0.63 117.51 125.00 1rjv h ILE 67 Ca -0.35 -0.03 0.00 0.00 -0.00 0.00 0.00 64.86 64.48 1rjv h ILE 67 Cb 1.52 -0.00 0.00 0.00 -0.00 0.00 0.00 36.82 38.33 1rjv h ILE 67 CO -0.05 0.02 0.03 -0.07 -0.00 0.00 0.00 178.15 178.07 1rjv h LEU 68 N 0.09 0.00 -1.64 2.19 4.07 -1.87 -1.05 115.31 117.10 1rjv h LEU 68 Ca 0.76 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.72 1rjv h LEU 68 Cb 1.88 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.62 1rjv h LEU 68 CO -0.75 0.00 0.00 0.11 -1.08 0.00 0.00 178.44 176.72 1rjv h LYS 69 N 0.00 0.00 0.21 1.13 1.57 -0.96 0.20 116.57 118.72 1rjv h LYS 69 Ca 0.00 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.44 1rjv h LYS 69 Cb 0.06 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.39 1rjv h LYS 69 CO 0.00 0.00 -1.60 0.78 -0.57 0.00 0.00 179.45 178.06 1rjv h GLY 70 N 0.11 0.52 1.44 3.86 0.00 -1.33 -3.37 103.07 104.31 1rjv h GLY 70 Ca 0.00 -1.33 -0.09 0.00 0.00 0.00 0.00 47.33 45.91 1rjv h GLY 70 CO 0.00 1.16 -0.13 0.74 0.00 0.00 0.00 176.54 178.32 1rjv h PHE 71 N 0.12 0.73 0.00 5.60 0.04 -1.11 -3.44 116.94 118.88 1rjv h PHE 71 Ca -0.29 -0.13 0.00 0.00 2.80 0.00 0.00 57.97 60.35 1rjv h PHE 71 Cb 2.13 -0.19 0.00 0.00 2.20 0.00 0.00 35.95 40.09 1rjv h PHE 71 CO 0.11 0.76 0.00 0.43 -0.60 0.00 0.00 178.31 179.01 1rjv n SER 72 N -4.17 0.00 -4.63 2.17 7.64 0.49 -4.80 113.62 110.32 1rjv n SER 72 Ca 0.01 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.61 1rjv n SER 72 Cb 0.36 0.00 0.20 0.00 -1.01 0.00 0.00 64.21 63.76 1rjv n SER 72 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1rjv s PRO 73 N -2.00 0.00 -1.98 1.43 0.04 -1.26 -3.80 135.00 127.44 1rjv s PRO 73 Ca 0.00 0.56 0.00 0.00 0.04 0.00 0.00 61.00 61.60 1rjv s PRO 73 Cb 0.00 -1.68 0.00 0.00 0.04 0.00 0.00 34.50 32.86 1rjv s PRO 73 CO 0.00 -3.03 0.00 -3.47 0.04 0.00 0.00 177.00 170.54 1rjv n ASP 74 N -4.39 -5.46 -0.17 6.66 2.03 -1.26 -4.93 116.55 109.02 1rjv n ASP 74 Ca 0.04 0.34 -0.04 0.00 0.52 0.00 0.00 54.79 55.65 1rjv n ASP 74 Cb 0.57 -4.64 0.06 0.00 -0.72 0.00 0.00 41.12 36.38 1rjv n ASP 74 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rjv h ALA 75 N 0.28 0.67 -2.96 -1.67 0.00 -1.84 -3.49 119.26 110.24 1rjv h ALA 75 Ca -0.42 0.02 0.35 0.00 0.00 0.00 0.00 54.91 54.86 1rjv h ALA 75 Cb 1.31 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.92 1rjv h ALA 75 CO 0.58 -0.08 -0.58 0.54 0.00 0.00 0.00 179.25 179.71 1rjv n ARG 76 N -4.87 -2.70 -3.06 0.00 1.74 -1.26 -4.81 116.66 101.70 1rjv n ARG 76 Ca 0.05 1.86 -0.43 0.00 -0.77 0.00 0.00 57.85 58.55 1rjv n ARG 76 Cb 0.14 -3.27 -0.06 0.00 -1.02 0.00 0.00 32.46 28.25 1rjv n ARG 76 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 1rjv s ASP 77 N -6.78 6.30 0.51 0.55 -4.77 -1.26 -4.32 116.67 106.90 1rjv s ASP 77 Ca 0.00 -0.51 -0.23 0.00 -3.30 0.00 0.00 52.55 48.50 1rjv s ASP 77 Cb 0.00 -2.34 -0.06 0.00 -1.09 0.00 0.00 42.92 39.43 1rjv s ASP 77 CO 0.00 -0.92 1.40 -0.76 0.70 0.00 0.00 175.17 175.59 1rjv s LEU 78 N 3.03 3.96 0.95 2.11 1.43 0.61 -4.94 118.68 125.82 1rjv s LEU 78 Ca 0.22 2.87 -0.12 0.00 -1.03 0.00 0.00 54.13 56.07 1rjv s LEU 78 Cb -0.15 -4.13 0.16 0.00 0.03 0.00 0.00 46.19 42.10 1rjv s LEU 78 CO 0.17 -1.44 1.09 -0.94 0.23 0.00 0.00 176.35 175.46 1rjv s SER 79 N -0.73 2.94 0.57 2.29 1.04 -0.27 -4.73 113.70 114.81 1rjv s SER 79 Ca 0.67 1.56 0.26 0.00 0.48 0.00 0.00 55.95 58.92 1rjv s SER 79 Cb -0.43 -2.22 1.60 0.00 0.10 0.00 0.00 66.02 65.08 1rjv s SER 79 CO 0.52 -2.98 2.16 0.00 0.98 0.00 0.00 173.24 173.92 1rjv h ALA 80 N -1.79 1.82 0.20 5.32 0.00 -1.95 0.88 119.26 123.74 1rjv h ALA 80 Ca -0.51 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.13 1rjv h ALA 80 Cb 1.29 0.01 0.03 0.00 0.00 0.00 0.00 17.79 19.12 1rjv h ALA 80 CO 0.53 -0.15 -1.18 0.87 0.00 0.00 0.00 179.25 179.31 1rjv h LYS 81 N 0.00 0.42 0.38 0.00 1.79 -1.91 -2.73 116.57 114.51 1rjv h LYS 81 Ca 0.05 -0.71 -0.01 0.00 -2.18 0.00 0.00 60.65 57.80 1rjv h LYS 81 Cb 0.25 0.26 -0.02 0.00 -1.58 0.00 0.00 32.23 31.15 1rjv h LYS 81 CO -0.00 1.34 -0.40 1.49 -1.08 0.00 0.00 179.45 180.80 1rjv h GLU 82 N -0.12 -0.76 -0.81 3.15 4.22 -1.68 -1.34 114.58 117.25 1rjv h GLU 82 Ca -0.21 0.05 0.09 0.00 0.08 0.00 0.00 59.36 59.38 1rjv h GLU 82 Cb 1.91 0.17 -0.07 0.00 0.50 0.00 0.00 28.75 31.26 1rjv h GLU 82 CO 0.21 -0.50 0.46 1.79 -2.18 0.00 0.00 179.01 178.78 1rjv h THR 83 N -0.78 0.90 0.21 0.32 1.35 -0.98 0.31 112.91 114.24 1rjv h THR 83 Ca -0.05 -0.26 0.01 0.00 -0.55 0.00 0.00 66.41 65.56 1rjv h THR 83 Cb 0.68 0.07 -0.02 0.00 -1.73 0.00 0.00 68.15 67.15 1rjv h THR 83 CO -0.06 0.14 -0.26 0.50 -0.25 0.00 0.00 175.52 175.59 1rjv h LYS 84 N 0.77 -0.51 -0.39 4.72 3.64 -1.41 0.53 116.57 123.92 1rjv h LYS 84 Ca 0.39 0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.76 1rjv h LYS 84 Cb 0.36 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 1rjv h LYS 84 CO -0.25 -0.34 0.06 0.52 -2.27 0.00 0.00 179.45 177.18 1rjv h MET 85 N -0.52 0.65 -0.23 1.90 2.86 -0.49 -2.44 114.93 116.65 1rjv h MET 85 Ca 0.01 -0.18 0.06 0.00 -2.06 0.00 0.00 59.70 57.53 1rjv h MET 85 Cb 0.51 -0.08 -0.06 0.00 0.06 0.00 0.00 31.60 32.03 1rjv h MET 85 CO -0.09 0.71 -0.17 1.25 1.06 0.00 0.00 176.91 179.67 1rjv h LEU 86 N 0.50 -0.55 0.29 1.22 6.46 -0.36 0.17 115.31 123.04 1rjv h LEU 86 Ca 0.12 0.11 0.00 0.00 -0.12 0.00 0.00 57.88 57.99 1rjv h LEU 86 Cb 0.37 0.28 -0.04 0.00 -0.73 0.00 0.00 40.66 40.54 1rjv h LEU 86 CO 0.01 -0.21 -0.50 -0.03 -0.62 0.00 0.00 178.44 177.09 1rjv h MET 87 N -0.17 -0.82 -0.30 1.25 4.05 -0.82 0.24 114.93 118.36 1rjv h MET 87 Ca 0.13 0.06 -0.05 0.00 -0.28 0.00 0.00 59.70 59.56 1rjv h MET 87 Cb 0.36 0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 31.33 1rjv h MET 87 CO -0.33 -0.55 -0.02 0.00 0.23 0.00 0.00 176.91 176.25 1rjv h ALA 88 N -0.61 1.42 0.05 0.39 0.00 -1.19 -2.36 119.26 116.96 1rjv h ALA 88 Ca -0.03 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 1rjv h ALA 88 Cb 0.80 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.46 1rjv h ALA 88 CO -0.18 0.41 -0.30 0.00 0.00 0.00 0.00 179.25 179.17 1rjv h ALA 89 N 1.55 -0.02 -0.10 0.00 0.00 -0.58 -3.40 119.26 116.71 1rjv h ALA 89 Ca 0.10 -0.58 -0.18 0.00 0.00 0.00 0.00 54.91 54.25 1rjv h ALA 89 Cb 0.32 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1rjv h ALA 89 CO 0.01 0.14 -0.69 0.78 0.00 0.00 0.00 179.25 179.50 1rjv h GLY 90 N -0.78 0.46 -6.27 0.00 0.00 -0.48 -3.29 103.07 92.70 1rjv h GLY 90 Ca -0.06 -0.62 -0.68 0.00 0.00 0.00 0.00 47.33 45.97 1rjv h GLY 90 CO 0.05 0.55 2.81 1.34 0.00 0.00 0.00 176.54 181.28 1rjv n ASP 91 N -3.86 3.53 0.28 0.19 2.03 -0.90 -4.64 116.55 113.19 1rjv n ASP 91 Ca -0.04 -2.80 0.12 0.00 0.52 0.00 0.00 54.79 52.60 1rjv n ASP 91 Cb 0.68 -1.51 0.82 0.00 -0.72 0.00 0.00 41.12 40.38 1rjv n ASP 91 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1rjv h LYS 92 N 6.70 0.00 0.00 -0.67 1.79 -1.84 -2.92 116.57 119.63 1rjv h LYS 92 Ca 0.51 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.90 1rjv h LYS 92 Cb 0.67 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.31 1rjv h LYS 92 CO 1.87 0.00 -0.52 -0.44 -1.08 0.00 0.00 179.45 179.29 1rjv h ASP 93 N 0.00 0.00 0.00 0.86 3.32 -1.91 -3.48 116.42 115.20 1rjv h ASP 93 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1rjv h ASP 93 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1rjv h ASP 93 CO 0.00 0.37 0.00 0.61 -1.72 0.00 0.00 179.24 178.50 1rjv n GLY 94 N 1.21 0.69 0.06 2.75 0.00 -1.10 -4.99 105.19 103.80 1rjv n GLY 94 Ca 0.01 -0.64 0.14 0.00 0.00 0.00 0.00 46.02 45.53 1rjv n GLY 94 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1rjv n ASP 95 N 1.20 0.34 -0.49 1.61 8.00 -1.26 -4.95 116.55 121.01 1rjv n ASP 95 Ca 0.00 -0.22 -0.06 0.00 0.71 0.00 0.00 54.79 55.22 1rjv n ASP 95 Cb 0.04 -0.12 -0.03 0.00 -0.02 0.00 0.00 41.12 40.99 1rjv n ASP 95 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rjv n GLY 96 N 1.38 0.80 3.02 0.44 0.00 -1.26 -5.03 105.19 104.54 1rjv n GLY 96 Ca 0.11 -0.26 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 1rjv n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rjv s LYS 97 N -2.14 0.44 -0.02 1.61 3.01 -1.26 -4.84 119.74 116.54 1rjv s LYS 97 Ca 0.00 -0.60 -0.30 0.00 -1.01 0.00 0.00 55.97 54.06 1rjv s LYS 97 Cb 0.00 -0.22 -0.04 0.00 -1.01 0.00 0.00 37.83 36.56 1rjv s LYS 97 CO 0.00 0.04 1.23 0.42 0.51 0.00 0.00 175.35 177.55 1rjv s ILE 98 N -1.12 4.12 0.06 2.17 1.01 -1.09 -4.48 121.20 121.88 1rjv s ILE 98 Ca -0.09 1.48 0.01 0.00 0.00 0.00 0.00 60.65 62.05 1rjv s ILE 98 Cb -0.08 -3.95 -0.04 0.00 0.01 0.00 0.00 42.46 38.40 1rjv s ILE 98 CO 0.00 0.02 0.14 -0.83 0.00 0.00 0.00 174.94 174.27 1rjv s GLY 99 N 1.47 2.11 0.20 6.18 0.00 -1.26 -2.41 107.32 113.61 1rjv s GLY 99 Ca 0.58 -0.91 -0.16 0.00 0.00 0.00 0.00 44.72 44.22 1rjv s GLY 99 CO 0.24 -0.88 1.61 -0.24 0.00 0.00 0.00 173.10 173.83 1rjv h VAL 100 N 2.39 0.31 -0.64 1.40 3.04 -1.93 0.01 116.25 120.84 1rjv h VAL 100 Ca -0.46 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.23 1rjv h VAL 100 Cb 1.16 0.31 -0.03 0.00 -2.01 0.00 0.00 31.29 30.72 1rjv h VAL 100 CO 0.70 0.00 0.38 0.44 -1.01 0.00 0.00 177.57 178.09 1rjv h ASP 101 N -0.07 0.75 0.49 3.17 5.19 -1.97 0.55 116.42 124.53 1rjv h ASP 101 Ca 0.27 -0.04 -0.02 0.00 -0.62 0.00 0.00 57.03 56.62 1rjv h ASP 101 Cb 0.49 -0.19 0.00 0.00 0.18 0.00 0.00 39.33 39.82 1rjv h ASP 101 CO -0.64 0.58 -0.24 -0.33 -3.12 0.00 0.00 179.24 175.49 1rjv h GLU 102 N 0.87 -0.63 -0.81 3.56 5.08 -1.73 -3.21 114.58 117.70 1rjv h GLU 102 Ca 0.23 0.04 0.13 0.00 -1.00 0.00 0.00 59.36 58.76 1rjv h GLU 102 Cb -0.04 0.14 -0.06 0.00 0.50 0.00 0.00 28.75 29.30 1rjv h GLU 102 CO -0.04 -0.33 0.53 0.35 -1.00 0.00 0.00 179.01 178.52 1rjv h PHE 103 N -0.91 0.70 -0.07 4.33 3.57 -0.14 0.40 116.94 124.81 1rjv h PHE 103 Ca -0.07 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.44 1rjv h PHE 103 Cb 0.59 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 1rjv h PHE 103 CO 0.00 0.28 -0.01 1.03 -2.23 0.00 0.00 178.31 177.38 1rjv h SER 104 N 0.62 0.09 0.00 0.41 0.87 -1.00 -3.37 113.55 111.16 1rjv h SER 104 Ca 0.39 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.94 1rjv h SER 104 Cb 0.67 -0.02 -0.00 0.00 -0.44 0.00 0.00 62.40 62.60 1rjv h SER 104 CO -0.16 0.12 -1.06 0.35 -0.53 0.00 0.00 176.83 175.56 1rjv n THR 105 N -4.46 0.04 -0.33 2.23 -2.24 0.34 -4.38 114.28 105.48 1rjv n THR 105 Ca -0.02 -0.04 0.21 0.00 -2.27 0.00 0.00 64.05 61.94 1rjv n THR 105 Cb 0.14 -0.37 0.41 0.00 -2.10 0.00 0.00 70.33 68.41 1rjv n THR 105 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1rjv h LEU 106 N 0.00 -0.17 0.00 3.22 7.12 -0.50 0.81 115.31 125.78 1rjv h LEU 106 Ca -0.02 0.27 0.00 0.00 0.13 0.00 0.00 57.88 58.27 1rjv h LEU 106 Cb 0.64 0.40 0.00 0.00 -0.53 0.00 0.00 40.66 41.17 1rjv h LEU 106 CO 0.00 -0.39 -0.34 1.33 -0.13 0.00 0.00 178.44 178.91 1rjv n VAL 107 N -5.40 0.03 0.00 1.05 0.24 -1.26 -3.61 118.33 109.38 1rjv n VAL 107 Ca 0.29 -0.02 -0.11 0.00 -2.04 0.00 0.00 64.34 62.46 1rjv n VAL 107 Cb 0.96 -0.01 -0.14 0.00 -1.47 0.00 0.00 33.84 33.18 1rjv n VAL 107 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1rjv h ALA 108 N 2.97 0.62 0.00 2.33 0.00 -1.09 -3.03 119.26 121.06 1rjv h ALA 108 Ca 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 54.91 53.56 1rjv h ALA 108 Cb 0.52 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1rjv h ALA 108 CO 0.00 1.46 0.19 0.93 0.00 0.00 0.00 179.25 181.83 1rjv h GLU 109 N 0.02 0.00 0.00 0.00 5.08 -1.31 -3.52 114.58 114.85 1rjv h GLU 109 Ca -0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 1rjv h GLU 109 Cb 1.99 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.24 1rjv h GLU 109 CO 0.10 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 176.98