#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qpv s ALA 7 N 0.00 -1.82 -0.07 1.55 0.00 -0.96 -4.94 121.76 115.52 1qpv s ALA 7 Ca 0.00 -0.18 0.04 0.00 0.00 0.00 0.00 51.96 51.82 1qpv s ALA 7 Cb 0.00 0.76 0.00 0.00 0.00 0.00 0.00 23.12 23.88 1qpv s ALA 7 CO 0.00 -1.08 -0.20 0.54 0.00 0.00 0.00 175.76 175.02 1qpv s VAL 8 N -2.21 1.71 0.21 0.00 0.11 -1.26 -0.60 120.40 118.36 1qpv s VAL 8 Ca 0.23 -0.84 -0.32 0.00 -2.93 0.00 0.00 61.98 58.11 1qpv s VAL 8 Cb -0.02 -1.48 -0.12 0.00 -1.53 0.00 0.00 36.38 33.22 1qpv s VAL 8 CO 0.03 0.48 1.66 0.00 -3.33 0.00 0.00 175.10 173.95 1qpv n ALA 9 N 3.39 2.40 0.30 1.54 0.00 -0.33 -4.75 120.51 123.06 1qpv n ALA 9 Ca -0.19 0.41 0.17 0.00 0.00 0.00 0.00 53.44 53.82 1qpv n ALA 9 Cb 0.53 -2.47 0.90 0.00 0.00 0.00 0.00 19.45 18.41 1qpv n ALA 9 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1qpv h ASP 10 N 6.26 0.00 1.07 0.00 3.58 -1.99 0.63 116.42 125.97 1qpv h ASP 10 Ca -0.44 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 56.98 1qpv h ASP 10 Cb 1.22 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.26 1qpv h ASP 10 CO 0.92 0.00 -0.95 1.05 -2.88 0.00 0.00 179.24 177.37 1qpv h GLU 11 N 0.00 0.00 -0.11 0.28 4.11 -1.92 -3.28 114.58 113.65 1qpv h GLU 11 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 1qpv h GLU 11 Cb 0.31 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.56 1qpv h GLU 11 CO 0.00 0.06 0.05 1.03 0.07 0.00 0.00 179.01 180.22 1qpv h SER 12 N 0.00 0.15 0.51 3.06 0.87 0.04 -2.60 113.55 115.58 1qpv h SER 12 Ca -0.03 -0.15 -0.18 0.00 -1.23 0.00 0.00 61.79 60.21 1qpv h SER 12 Cb 1.11 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 63.02 1qpv h SER 12 CO 0.01 0.25 -0.78 0.17 -0.53 0.00 0.00 176.83 175.95 1qpv h LEU 13 N 0.03 0.26 -1.94 2.23 8.10 -1.71 -3.04 115.31 119.24 1qpv h LEU 13 Ca 0.04 -0.19 0.03 0.00 0.11 0.00 0.00 57.88 57.87 1qpv h LEU 13 Cb 0.15 -0.08 -0.01 0.00 -0.44 0.00 0.00 40.66 40.28 1qpv h LEU 13 CO -0.00 0.94 0.11 0.74 -4.11 0.00 0.00 178.44 176.12 1qpv h THR 14 N 0.13 0.96 -0.00 0.15 2.02 -1.59 0.22 112.91 114.79 1qpv h THR 14 Ca -0.03 -0.03 -0.17 0.00 0.77 0.00 0.00 66.41 66.95 1qpv h THR 14 Cb 1.36 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 68.63 1qpv h THR 14 CO 0.12 0.01 -0.79 0.00 0.37 0.00 0.00 175.52 175.23 1qpv h ALA 15 N 1.91 0.67 -0.14 6.16 0.00 -1.35 -2.83 119.26 123.68 1qpv h ALA 15 Ca 0.07 -0.70 -0.18 0.00 0.00 0.00 0.00 54.91 54.11 1qpv h ALA 15 Cb 0.19 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.88 1qpv h ALA 15 CO -0.01 0.93 -0.61 0.35 0.00 0.00 0.00 179.25 179.91 1qpv h PHE 16 N 0.05 0.89 0.00 0.00 3.57 -0.77 -2.02 116.94 118.66 1qpv h PHE 16 Ca -0.02 -0.38 0.00 0.00 3.53 0.00 0.00 57.97 61.10 1qpv h PHE 16 Cb 1.39 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.99 1qpv h PHE 16 CO 0.01 1.19 0.00 -0.91 -2.23 0.00 0.00 178.31 176.37 1qpv h ASN 17 N 0.34 0.00 0.04 0.41 4.21 -0.71 -1.52 115.58 118.35 1qpv h ASN 17 Ca -0.04 0.00 -0.20 0.00 1.21 0.00 0.00 56.30 57.28 1qpv h ASN 17 Cb 1.25 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 38.43 1qpv h ASN 17 CO 0.13 0.00 -1.05 0.44 -1.29 0.00 0.00 177.43 175.66 1qpv h ASP 18 N 0.00 0.12 0.54 5.81 3.32 -1.30 -3.14 116.42 121.77 1qpv h ASP 18 Ca 0.00 -0.73 -0.04 0.00 0.02 0.00 0.00 57.03 56.27 1qpv h ASP 18 Cb 0.27 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 1qpv h ASP 18 CO 0.00 1.43 -0.21 0.25 -1.72 0.00 0.00 179.24 179.00 1qpv h LEU 19 N -0.76 0.00 0.00 1.55 6.46 -1.16 0.19 115.31 121.59 1qpv h LEU 19 Ca -0.26 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.50 1qpv h LEU 19 Cb 1.39 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.32 1qpv h LEU 19 CO -0.08 0.21 -0.01 0.50 -0.62 0.00 0.00 178.44 178.44 1qpv h LYS 20 N 0.00 0.00 0.00 1.25 3.64 -1.43 -2.49 116.57 117.54 1qpv h LYS 20 Ca -0.00 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 1qpv h LYS 20 Cb 0.53 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 1qpv h LYS 20 CO 0.03 0.00 -0.43 -0.07 -2.27 0.00 0.00 179.45 176.70 1qpv h LEU 21 N -0.08 0.00 -0.30 5.20 3.38 -1.67 -3.31 115.31 118.52 1qpv h LEU 21 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1qpv h LEU 21 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1qpv h LEU 21 CO 0.00 0.43 -0.41 0.61 0.09 0.00 0.00 178.44 179.16 1qpv n GLY 22 N 0.88 -0.07 3.33 0.83 0.00 0.31 -4.98 105.19 105.48 1qpv n GLY 22 Ca 0.01 -0.32 -0.23 0.00 0.00 0.00 0.00 46.02 45.48 1qpv n GLY 22 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qpv n LYS 23 N -0.86 -3.53 0.45 1.61 4.76 0.39 -4.86 118.16 116.10 1qpv n LYS 23 Ca 0.03 0.52 -0.18 0.00 -2.87 0.00 0.00 58.31 55.80 1qpv n LYS 23 Cb 0.20 -5.24 -0.09 0.00 -1.84 0.00 0.00 35.03 28.06 1qpv n LYS 23 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1qpv h LYS 24 N -1.01 -1.13 -6.20 1.97 3.64 -1.58 -3.44 116.57 108.82 1qpv h LYS 24 Ca -0.44 0.08 -0.57 0.00 -1.27 0.00 0.00 60.65 58.45 1qpv h LYS 24 Cb 1.30 0.26 -0.07 0.00 -0.41 0.00 0.00 32.23 33.30 1qpv h LYS 24 CO 0.54 -0.75 -0.56 0.71 -2.27 0.00 0.00 179.45 177.11 1qpv s TYR 25 N -5.66 3.14 -0.21 1.91 1.51 -1.26 -4.78 117.35 112.01 1qpv s TYR 25 Ca -0.18 -0.03 0.19 0.00 -1.01 0.00 0.00 57.07 56.04 1qpv s TYR 25 Cb 0.02 -1.50 0.26 0.00 -0.11 0.00 0.00 41.96 40.63 1qpv s TYR 25 CO 0.54 0.52 1.54 -0.22 -1.11 0.00 0.00 175.55 176.82 1qpv h LYS 26 N 2.33 0.00 -2.02 -0.62 3.11 -0.07 -3.44 116.57 115.86 1qpv h LYS 26 Ca -0.48 0.00 0.24 0.00 -2.81 0.00 0.00 60.65 57.60 1qpv h LYS 26 Cb 1.20 0.00 -0.09 0.00 -1.00 0.00 0.00 32.23 32.34 1qpv h LYS 26 CO 0.63 0.32 0.64 -0.59 -2.81 0.00 0.00 179.45 177.64 1qpv s PHE 27 N -3.12 -0.07 0.03 1.91 -0.12 -1.14 -1.56 117.98 113.92 1qpv s PHE 27 Ca 0.04 -0.17 0.01 0.00 -0.05 0.00 0.00 56.93 56.76 1qpv s PHE 27 Cb 0.07 0.61 -0.02 0.00 -0.63 0.00 0.00 43.02 43.04 1qpv s PHE 27 CO 0.71 -0.61 -0.04 0.42 -0.05 0.00 0.00 175.22 175.64 1qpv s ILE 28 N -2.78 0.26 -0.32 -4.49 1.01 -1.00 -3.00 121.20 110.87 1qpv s ILE 28 Ca 0.15 -1.13 0.01 0.00 0.00 0.00 0.00 60.65 59.68 1qpv s ILE 28 Cb 0.01 -0.60 0.10 0.00 0.01 0.00 0.00 42.46 41.98 1qpv s ILE 28 CO 0.00 -0.56 0.08 -0.76 0.00 0.00 0.00 174.94 173.70 1qpv s LEU 29 N -1.78 3.30 0.00 2.97 1.43 0.26 -1.87 118.68 122.99 1qpv s LEU 29 Ca -0.10 -1.86 -0.03 0.00 -1.03 0.00 0.00 54.13 51.11 1qpv s LEU 29 Cb -0.07 -1.18 0.13 0.00 0.03 0.00 0.00 46.19 45.10 1qpv s LEU 29 CO -0.02 -0.40 0.88 0.49 0.23 0.00 0.00 176.35 177.53 1qpv n PHE 30 N 4.59 -3.26 0.00 0.29 3.01 0.23 0.14 117.46 122.45 1qpv n PHE 30 Ca 0.01 -1.31 0.00 0.00 1.01 0.00 0.00 57.45 57.15 1qpv n PHE 30 Cb 0.42 -0.65 0.00 0.00 -0.01 0.00 0.00 39.48 39.24 1qpv n PHE 30 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1qpv n GLY 31 N -1.43 3.29 3.62 1.37 0.00 -1.08 -2.61 105.19 108.35 1qpv n GLY 31 Ca 0.13 -0.39 -0.45 0.00 0.00 0.00 0.00 46.02 45.31 1qpv n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1qpv n LEU 32 N 0.00 2.21 -4.65 0.99 7.99 -1.26 -3.10 117.00 119.19 1qpv n LEU 32 Ca 0.00 1.17 -0.29 0.00 -0.01 0.00 0.00 56.01 56.88 1qpv n LEU 32 Cb 0.00 -1.32 0.20 0.00 -0.11 0.00 0.00 43.42 42.19 1qpv n LEU 32 CO 0.00 -1.09 0.63 0.54 -1.51 0.00 0.00 177.39 175.97 1qpv s ASN 33 N -0.24 1.93 0.66 -1.43 2.20 -0.89 -4.78 114.94 112.39 1qpv s ASN 33 Ca 0.63 0.95 0.37 0.00 -0.94 0.00 0.00 52.86 53.87 1qpv s ASN 33 Cb -0.71 -1.45 2.03 0.00 -2.00 0.00 0.00 41.25 39.11 1qpv s ASN 33 CO 0.57 -3.53 2.15 -2.24 -2.94 0.00 0.00 177.10 171.10 1qpv h ASP 34 N -2.17 0.00 0.20 3.54 2.03 -1.93 0.24 116.42 118.33 1qpv h ASP 34 Ca -0.51 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.79 1qpv h ASP 34 Cb 1.32 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.82 1qpv h ASP 34 CO 0.49 0.00 -0.97 0.00 -1.03 0.00 0.00 179.24 177.73 1qpv n ALA 35 N -2.00 4.07 -3.17 4.15 0.00 -1.26 -5.02 120.51 117.28 1qpv n ALA 35 Ca -0.02 -0.50 -0.05 0.00 0.00 0.00 0.00 53.44 52.87 1qpv n ALA 35 Cb 0.23 -0.89 0.01 0.00 0.00 0.00 0.00 19.45 18.80 1qpv n ALA 35 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1qpv n LYS 36 N -1.66 -1.44 0.00 0.00 3.00 0.85 -4.93 118.16 113.99 1qpv n LYS 36 Ca 0.03 1.33 0.00 0.00 -0.00 0.00 0.00 58.31 59.67 1qpv n LYS 36 Cb 0.37 -5.40 0.00 0.00 0.00 0.00 0.00 35.03 30.00 1qpv n LYS 36 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 1qpv n THR 37 N -2.08 0.00 -3.73 3.15 5.66 -1.26 -4.97 114.28 111.05 1qpv n THR 37 Ca -0.04 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.86 1qpv n THR 37 Cb 0.53 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.26 1qpv n THR 37 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1qpv s GLU 38 N 0.00 1.07 -0.52 1.09 2.02 -1.26 -2.27 118.70 118.84 1qpv s GLU 38 Ca 0.00 -0.84 -0.03 0.00 0.02 0.00 0.00 54.97 54.12 1qpv s GLU 38 Cb 0.00 0.44 0.14 0.00 0.10 0.00 0.00 34.13 34.81 1qpv s GLU 38 CO 0.00 -0.41 0.33 0.42 0.02 0.00 0.00 175.26 175.62 1qpv s ILE 39 N -3.84 3.53 -0.06 -1.63 1.01 0.24 -2.11 121.20 118.33 1qpv s ILE 39 Ca 0.06 -2.51 -0.03 0.00 0.00 0.00 0.00 60.65 58.17 1qpv s ILE 39 Cb 0.02 -3.36 -0.04 0.00 0.01 0.00 0.00 42.46 39.10 1qpv s ILE 39 CO -0.09 -0.79 0.08 -0.69 0.00 0.00 0.00 174.94 173.45 1qpv s VAL 40 N 0.54 4.85 -0.31 2.92 1.01 -1.18 -1.18 120.40 127.04 1qpv s VAL 40 Ca 0.13 -0.17 -0.27 0.00 0.00 0.00 0.00 61.98 61.66 1qpv s VAL 40 Cb -0.22 -3.13 -0.05 0.00 0.00 0.00 0.00 36.38 32.98 1qpv s VAL 40 CO -0.04 0.51 2.27 0.54 0.00 0.00 0.00 175.10 178.39 1qpv s VAL 41 N -1.05 3.02 0.09 2.92 0.11 -1.26 -2.63 120.40 121.59 1qpv s VAL 41 Ca 0.18 0.02 0.21 0.00 -2.93 0.00 0.00 61.98 59.46 1qpv s VAL 41 Cb -0.12 -3.03 0.18 0.00 -1.53 0.00 0.00 36.38 31.88 1qpv s VAL 41 CO 0.07 -0.02 1.74 0.11 -3.33 0.00 0.00 175.10 173.67 1qpv h LYS 42 N 16.53 0.00 -1.73 1.54 1.79 0.91 -3.47 116.57 132.14 1qpv h LYS 42 Ca -0.35 0.00 0.15 0.00 -2.18 0.00 0.00 60.65 58.26 1qpv h LYS 42 Cb 1.25 0.00 -0.20 0.00 -1.58 0.00 0.00 32.23 31.70 1qpv h LYS 42 CO 1.03 0.30 0.63 -1.21 -1.08 0.00 0.00 179.45 179.12 1qpv s GLU 43 N -3.53 0.55 0.05 3.15 0.41 0.47 -4.97 118.70 114.83 1qpv s GLU 43 Ca 0.01 -0.07 -0.08 0.00 -0.41 0.00 0.00 54.97 54.42 1qpv s GLU 43 Cb 0.10 0.26 -0.00 0.00 -1.78 0.00 0.00 34.13 32.70 1qpv s GLU 43 CO 0.67 -0.21 0.16 0.95 -0.49 0.00 0.00 175.26 176.34 1qpv s THR 44 N -2.07 0.13 -0.03 3.63 -4.23 -1.26 0.92 115.64 112.71 1qpv s THR 44 Ca 0.04 -1.04 -0.28 0.00 -1.18 0.00 0.00 61.69 59.23 1qpv s THR 44 Cb -0.01 -1.04 0.06 0.00 1.34 0.00 0.00 72.50 72.86 1qpv s THR 44 CO -0.04 -0.58 0.61 -0.55 -0.54 0.00 0.00 174.62 173.52 1qpv s SER 45 N -2.32 -0.57 -0.30 3.99 0.15 -1.16 -5.02 113.70 108.47 1qpv s SER 45 Ca -0.02 0.57 0.08 0.00 0.70 0.00 0.00 55.95 57.28 1qpv s SER 45 Cb 0.01 0.50 0.50 0.00 -1.71 0.00 0.00 66.02 65.32 1qpv s SER 45 CO -0.06 -0.60 1.46 0.35 1.20 0.00 0.00 173.24 175.59 1qpv n THR 46 N 0.90 2.57 -3.12 6.45 -2.24 -1.26 0.65 114.28 118.23 1qpv n THR 46 Ca -0.19 -2.86 -0.40 0.00 -2.27 0.00 0.00 64.05 58.33 1qpv n THR 46 Cb 0.57 -0.36 -0.06 0.00 -2.10 0.00 0.00 70.33 68.38 1qpv n THR 46 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1qpv s ASP 47 N -2.61 6.72 0.03 3.42 3.68 -1.26 -4.73 116.67 121.92 1qpv s ASP 47 Ca 0.45 0.87 -0.29 0.00 2.13 0.00 0.00 52.55 55.71 1qpv s ASP 47 Cb 0.41 -2.35 -0.16 0.00 -1.45 0.00 0.00 42.92 39.37 1qpv s ASP 47 CO -0.01 -0.24 1.30 -0.65 0.13 0.00 0.00 175.17 175.69 1qpv h PRO 48 N 7.36 -1.01 -4.85 4.34 0.11 -1.98 -3.45 132.00 132.52 1qpv h PRO 48 Ca -0.33 0.07 -0.55 0.00 0.11 0.00 0.00 66.00 65.30 1qpv h PRO 48 Cb 1.15 0.23 0.08 0.00 0.11 0.00 0.00 31.00 32.57 1qpv h PRO 48 CO 0.77 -0.67 -0.39 0.45 -0.21 0.00 0.00 178.00 177.95 1qpv n SER 49 N -5.15 -0.93 -0.02 -2.05 2.88 -1.26 -4.88 113.62 102.21 1qpv n SER 49 Ca -0.13 0.92 -0.09 0.00 -1.33 0.00 0.00 58.87 58.23 1qpv n SER 49 Cb 0.41 -0.77 -0.14 0.00 -0.75 0.00 0.00 64.21 62.97 1qpv n SER 49 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1qpv h TYR 50 N 0.94 0.02 0.00 0.66 5.03 -2.02 -3.32 116.97 118.28 1qpv h TYR 50 Ca -0.24 -0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.05 1qpv h TYR 50 Cb 1.16 -0.00 0.00 0.00 1.55 0.00 0.00 36.73 39.44 1qpv h TYR 50 CO 0.35 1.04 0.00 -0.25 -1.32 0.00 0.00 178.16 177.98 1qpv n ASP 51 N -3.08 0.09 -0.00 -2.11 8.00 -1.26 -0.61 116.55 117.58 1qpv n ASP 51 Ca -0.17 -0.87 0.03 0.00 0.71 0.00 0.00 54.79 54.49 1qpv n ASP 51 Cb 1.05 -0.05 -0.04 0.00 -0.02 0.00 0.00 41.12 42.06 1qpv n ASP 51 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qpv n ALA 52 N -0.33 2.42 0.00 2.24 0.00 -1.25 -4.50 120.51 119.09 1qpv n ALA 52 Ca 0.00 -0.15 -0.18 0.00 0.00 0.00 0.00 53.44 53.11 1qpv n ALA 52 Cb 0.02 -0.21 -0.14 0.00 0.00 0.00 0.00 19.45 19.13 1qpv n ALA 52 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1qpv h PHE 53 N 0.00 0.35 0.00 0.00 -0.00 -1.04 -3.20 116.94 113.05 1qpv h PHE 53 Ca 0.00 -0.25 0.00 0.00 -0.00 0.00 0.00 57.97 57.72 1qpv h PHE 53 Cb 0.22 -0.02 0.00 0.00 -0.00 0.00 0.00 35.95 36.15 1qpv h PHE 53 CO 0.00 1.18 0.00 1.28 -0.00 0.00 0.00 178.31 180.77 1qpv n LEU 54 N -4.31 0.00 0.00 0.59 4.32 -1.22 -1.74 117.00 114.65 1qpv n LEU 54 Ca -0.12 0.00 0.11 0.00 -0.02 0.00 0.00 56.01 55.97 1qpv n LEU 54 Cb 0.69 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.45 1qpv n LEU 54 CO 0.43 0.00 0.02 -0.62 -1.22 0.00 0.00 177.39 176.00 1qpv n GLU 55 N -0.93 0.06 -0.17 3.23 4.71 -1.21 -3.90 120.64 122.43 1qpv n GLU 55 Ca 0.13 -0.01 0.08 0.00 -0.01 0.00 0.00 57.16 57.35 1qpv n GLU 55 Cb 0.06 -1.51 0.17 0.00 -1.01 0.00 0.00 31.44 29.15 1qpv n GLU 55 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 1qpv n LYS 56 N -1.58 2.32 -2.79 3.49 4.76 -0.71 -4.95 118.16 118.70 1qpv n LYS 56 Ca 0.04 -2.02 -0.43 0.00 -2.87 0.00 0.00 58.31 53.03 1qpv n LYS 56 Cb 0.35 -1.36 -0.04 0.00 -1.84 0.00 0.00 35.03 32.15 1qpv n LYS 56 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1qpv s LEU 57 N -1.09 3.98 -0.45 -0.35 1.02 -1.22 -4.98 118.68 115.59 1qpv s LEU 57 Ca 0.28 0.64 -0.26 0.00 0.02 0.00 0.00 54.13 54.81 1qpv s LEU 57 Cb 0.16 -3.29 -0.07 0.00 0.02 0.00 0.00 46.19 43.01 1qpv s LEU 57 CO 0.21 -0.85 2.38 -2.84 0.02 0.00 0.00 176.35 175.27 1qpv s PRO 58 N 3.49 2.24 0.29 1.29 0.02 -1.26 -4.83 135.00 136.24 1qpv s PRO 58 Ca 0.39 1.50 0.03 0.00 0.02 0.00 0.00 61.00 62.94 1qpv s PRO 58 Cb -0.12 -4.56 0.68 0.00 0.02 0.00 0.00 34.50 30.52 1qpv s PRO 58 CO 0.18 -3.12 1.75 1.49 -0.33 0.00 0.00 177.00 176.98 1qpv h GLU 59 N 18.96 0.61 -1.00 5.54 4.81 -1.97 -1.83 114.58 139.71 1qpv h GLU 59 Ca -0.27 -0.04 -0.62 0.00 -0.13 0.00 0.00 59.36 58.31 1qpv h GLU 59 Cb 1.26 -0.14 -0.37 0.00 0.63 0.00 0.00 28.75 30.14 1qpv h GLU 59 CO 1.13 0.41 -0.04 0.09 -0.73 0.00 0.00 179.01 179.86 1qpv n ASN 60 N -4.86 6.14 -3.63 1.04 4.13 -1.26 -4.46 115.26 112.35 1qpv n ASN 60 Ca 0.21 -3.77 -0.09 0.00 1.68 0.00 0.00 54.58 52.61 1qpv n ASN 60 Cb 0.55 -0.64 -0.02 0.00 -1.54 0.00 0.00 39.78 38.13 1qpv n ASN 60 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1qpv s ASP 61 N -2.76 -0.39 0.42 6.41 3.68 -0.69 -4.41 116.67 118.94 1qpv s ASP 61 Ca 0.56 -0.28 0.08 0.00 2.13 0.00 0.00 52.55 55.04 1qpv s ASP 61 Cb 0.45 0.62 -0.01 0.00 -1.45 0.00 0.00 42.92 42.52 1qpv s ASP 61 CO -0.03 -1.07 0.42 0.00 0.13 0.00 0.00 175.17 174.62 1qpv n LEU 63 N -1.63 0.00 -4.71 0.00 -0.00 -1.20 -4.96 117.00 104.50 1qpv n LEU 63 Ca 0.05 0.00 -0.35 0.00 -0.00 0.00 0.00 56.01 55.70 1qpv n LEU 63 Cb 0.61 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 43.94 1qpv n LEU 63 CO 0.42 0.00 -0.29 -0.31 -0.00 0.00 0.00 177.39 177.21 1qpv s TYR 64 N -2.00 3.23 -0.01 1.47 2.02 -1.07 -2.07 117.35 118.92 1qpv s TYR 64 Ca 0.00 0.23 -0.00 0.00 -0.37 0.00 0.00 57.07 56.93 1qpv s TYR 64 Cb 0.00 -1.82 0.01 0.00 -0.40 0.00 0.00 41.96 39.75 1qpv s TYR 64 CO 0.00 0.50 0.01 0.00 -1.57 0.00 0.00 175.55 174.49 1qpv s ALA 65 N -0.85 0.02 -0.37 3.71 0.00 -1.12 0.74 121.76 123.89 1qpv s ALA 65 Ca 0.13 0.10 0.04 0.00 0.00 0.00 0.00 51.96 52.23 1qpv s ALA 65 Cb -0.11 -0.08 0.11 0.00 0.00 0.00 0.00 23.12 23.03 1qpv s ALA 65 CO 0.02 -0.04 0.09 0.42 0.00 0.00 0.00 175.76 176.26 1qpv s ILE 66 N 0.34 2.25 0.25 0.00 1.01 -0.78 0.39 121.20 124.65 1qpv s ILE 66 Ca -0.03 -2.46 -0.10 0.00 0.00 0.00 0.00 60.65 58.06 1qpv s ILE 66 Cb -0.04 -2.65 -0.07 0.00 0.01 0.00 0.00 42.46 39.71 1qpv s ILE 66 CO -0.01 -0.64 0.57 -0.47 0.00 0.00 0.00 174.94 174.40 1qpv s TYR 67 N 0.74 3.43 -0.95 3.97 5.04 -0.49 -2.38 117.35 126.70 1qpv s TYR 67 Ca 0.12 0.89 -0.01 0.00 -2.44 0.00 0.00 57.07 55.63 1qpv s TYR 67 Cb -0.20 -2.28 0.31 0.00 0.35 0.00 0.00 41.96 40.14 1qpv s TYR 67 CO -0.07 0.23 1.48 -3.47 -1.34 0.00 0.00 175.55 172.37 1qpv n ASP 68 N -0.27 6.29 -4.53 4.32 2.03 -0.60 -0.19 116.55 123.60 1qpv n ASP 68 Ca 0.01 -3.56 -0.54 0.00 0.52 0.00 0.00 54.79 51.22 1qpv n ASP 68 Cb 0.53 -1.08 -0.06 0.00 -0.72 0.00 0.00 41.12 39.78 1qpv n ASP 68 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 1qpv n PHE 69 N 0.53 0.87 -3.77 -0.67 7.35 -0.78 -4.68 117.46 116.31 1qpv n PHE 69 Ca 0.35 0.86 -0.27 0.00 -0.76 0.00 0.00 57.45 57.64 1qpv n PHE 69 Cb 0.32 -2.18 -0.17 0.00 0.35 0.00 0.00 39.48 37.81 1qpv n PHE 69 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1qpv s GLU 70 N -0.07 0.81 0.44 -4.13 2.02 -1.26 -0.30 118.70 116.21 1qpv s GLU 70 Ca 0.83 -0.41 0.04 0.00 0.02 0.00 0.00 54.97 55.45 1qpv s GLU 70 Cb -1.07 -1.99 -0.02 0.00 0.10 0.00 0.00 34.13 31.16 1qpv s GLU 70 CO 0.53 -0.57 0.13 1.52 0.02 0.00 0.00 175.26 176.90 1qpv s TYR 71 N 1.81 1.78 0.14 1.61 -0.00 -0.21 -4.97 117.35 117.51 1qpv s TYR 71 Ca -0.00 -1.31 0.05 0.00 -0.00 0.00 0.00 57.07 55.81 1qpv s TYR 71 Cb -0.16 -1.19 -0.04 0.00 -0.00 0.00 0.00 41.96 40.57 1qpv s TYR 71 CO -0.07 -0.30 0.09 -1.21 -0.00 0.00 0.00 175.55 174.06 1qpv s GLU 72 N -3.68 2.78 0.25 -3.49 2.02 -1.26 -0.71 118.70 114.62 1qpv s GLU 72 Ca 0.20 -0.86 0.02 0.00 0.02 0.00 0.00 54.97 54.35 1qpv s GLU 72 Cb 0.01 -2.61 -0.05 0.00 0.10 0.00 0.00 34.13 31.58 1qpv s GLU 72 CO 0.14 0.50 0.07 0.96 0.02 0.00 0.00 175.26 176.95 1qpv s ILE 73 N -1.62 0.68 0.00 -1.63 -4.36 -0.93 -4.89 121.20 108.46 1qpv s ILE 73 Ca 0.29 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.68 1qpv s ILE 73 Cb -0.11 -2.58 0.00 0.00 1.25 0.00 0.00 42.46 41.03 1qpv s ILE 73 CO 0.22 -0.08 0.00 0.59 0.24 0.00 0.00 174.94 175.91 1qpv n ASN 74 N -0.46 4.49 -0.27 4.36 5.03 -1.26 -3.84 115.26 123.30 1qpv n ASN 74 Ca -0.01 0.00 0.07 0.00 0.87 0.00 0.00 54.58 55.50 1qpv n ASN 74 Cb 0.66 0.35 0.21 0.00 -1.02 0.00 0.00 39.78 39.98 1qpv n ASN 74 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 1qpv h GLY 75 N 0.00 1.25 -5.39 7.41 0.00 -1.98 -2.91 103.07 101.46 1qpv h GLY 75 Ca 0.00 -0.17 -0.54 0.00 0.00 0.00 0.00 47.33 46.62 1qpv h GLY 75 CO 0.00 -0.11 -0.87 0.70 0.00 0.00 0.00 176.54 176.26 1qpv n ASN 76 N -4.98 3.17 0.00 0.19 4.13 -1.26 -5.07 115.26 111.44 1qpv n ASN 76 Ca 0.16 -3.41 0.00 0.00 1.68 0.00 0.00 54.58 53.01 1qpv n ASN 76 Cb 0.45 -0.56 0.00 0.00 -1.54 0.00 0.00 39.78 38.13 1qpv n ASN 76 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1qpv n GLU 77 N -0.10 0.00 -3.74 3.52 4.71 -1.10 -4.79 120.64 119.14 1qpv n GLU 77 Ca 0.28 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.43 1qpv n GLU 77 Cb 0.54 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.97 1qpv n GLU 77 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1qpv n GLY 78 N 0.00 -2.40 3.82 0.62 0.00 -1.25 -5.05 105.19 100.93 1qpv n GLY 78 Ca 0.00 -1.35 -0.35 0.00 0.00 0.00 0.00 46.02 44.32 1qpv n GLY 78 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1qpv s LYS 79 N -1.95 3.24 0.12 1.61 2.47 -1.26 -2.18 119.74 121.79 1qpv s LYS 79 Ca 0.00 -0.32 0.10 0.00 -1.56 0.00 0.00 55.97 54.19 1qpv s LYS 79 Cb 0.00 -3.00 -0.04 0.00 -1.46 0.00 0.00 37.83 33.33 1qpv s LYS 79 CO 0.00 0.71 -0.26 1.03 0.16 0.00 0.00 175.35 176.99 1qpv s ARG 80 N -1.35 1.38 0.04 4.03 1.81 0.12 -4.97 118.95 120.00 1qpv s ARG 80 Ca 0.19 -1.30 0.07 0.00 -1.72 0.00 0.00 55.73 52.97 1qpv s ARG 80 Cb -0.12 -1.81 -0.02 0.00 -0.45 0.00 0.00 34.95 32.55 1qpv s ARG 80 CO 0.09 0.43 -0.19 -1.54 -0.68 0.00 0.00 175.30 173.41 1qpv s SER 81 N -1.97 2.25 -0.10 0.23 1.04 -1.26 -1.04 113.70 112.84 1qpv s SER 81 Ca 0.12 -0.49 -0.04 0.00 0.48 0.00 0.00 55.95 56.02 1qpv s SER 81 Cb -0.10 -0.18 0.05 0.00 0.10 0.00 0.00 66.02 65.89 1qpv s SER 81 CO 0.05 0.13 0.21 -0.54 0.98 0.00 0.00 173.24 174.07 1qpv s LYS 82 N -1.11 0.09 -0.07 4.02 1.02 0.59 -4.99 119.74 119.29 1qpv s LYS 82 Ca 0.06 0.62 -0.30 0.00 0.02 0.00 0.00 55.97 56.37 1qpv s LYS 82 Cb -0.08 -0.16 -0.04 0.00 -0.52 0.00 0.00 37.83 37.03 1qpv s LYS 82 CO 0.01 -0.28 1.37 0.42 -0.92 0.00 0.00 175.35 175.96 1qpv s ILE 83 N 2.18 3.96 0.03 2.17 1.01 -1.26 -1.87 121.20 127.42 1qpv s ILE 83 Ca 0.00 1.25 0.03 0.00 0.00 0.00 0.00 60.65 61.93 1qpv s ILE 83 Cb -0.12 -3.80 -0.04 0.00 0.01 0.00 0.00 42.46 38.51 1qpv s ILE 83 CO -0.07 -0.06 -0.01 -0.69 0.00 0.00 0.00 174.94 174.11 1qpv s VAL 84 N 3.05 4.05 -0.58 2.92 1.01 0.74 -1.89 120.40 129.70 1qpv s VAL 84 Ca 0.61 -0.75 -0.02 0.00 0.00 0.00 0.00 61.98 61.82 1qpv s VAL 84 Cb -0.27 -2.84 0.15 0.00 0.00 0.00 0.00 36.38 33.41 1qpv s VAL 84 CO 0.22 0.29 0.39 0.12 0.00 0.00 0.00 175.10 176.12 1qpv s PHE 85 N -1.15 3.41 0.61 5.22 5.36 0.03 -1.40 117.98 130.06 1qpv s PHE 85 Ca 0.21 -2.74 -0.14 0.00 -0.96 0.00 0.00 56.93 53.30 1qpv s PHE 85 Cb -0.12 -3.16 -0.03 0.00 -0.34 0.00 0.00 43.02 39.38 1qpv s PHE 85 CO 0.13 -0.85 1.04 -0.06 -1.46 0.00 0.00 175.22 174.02 1qpv s PHE 86 N 0.07 3.13 -0.39 10.12 0.40 0.16 -1.34 117.98 130.14 1qpv s PHE 86 Ca 0.16 1.47 0.03 0.00 -0.60 0.00 0.00 56.93 57.98 1qpv s PHE 86 Cb -0.21 -2.92 0.16 0.00 0.51 0.00 0.00 43.02 40.55 1qpv s PHE 86 CO -0.03 -0.99 0.29 0.99 0.70 0.00 0.00 175.22 176.18 1qpv s THR 87 N -2.67 0.28 0.27 0.64 2.01 0.22 -2.80 115.64 113.59 1qpv s THR 87 Ca 0.61 -2.32 -0.30 0.00 0.31 0.00 0.00 61.69 60.00 1qpv s THR 87 Cb -0.14 -1.21 -0.10 0.00 0.01 0.00 0.00 72.50 71.06 1qpv s THR 87 CO 0.41 -1.15 1.33 0.86 -0.69 0.00 0.00 174.62 175.38 1qpv s TRP 88 N 0.42 3.13 -0.35 4.92 -0.00 -0.88 0.20 118.94 126.38 1qpv s TRP 88 Ca 0.28 1.28 0.03 0.00 -0.00 0.00 0.00 56.10 57.68 1qpv s TRP 88 Cb -0.06 -3.67 0.31 0.00 -0.00 0.00 0.00 33.47 30.05 1qpv s TRP 88 CO -0.12 -1.99 1.30 0.43 -0.00 0.00 0.00 176.95 176.56 1qpv n SER 89 N 1.76 -1.48 -3.34 5.86 7.64 0.28 -3.22 113.62 121.12 1qpv n SER 89 Ca 0.03 -2.15 -0.24 0.00 1.01 0.00 0.00 58.87 57.52 1qpv n SER 89 Cb 0.42 1.18 0.23 0.00 -1.01 0.00 0.00 64.21 65.03 1qpv n SER 89 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1qpv n PRO 90 N 0.78 -3.85 -0.04 1.43 -0.02 -1.25 -4.42 135.00 127.63 1qpv n PRO 90 Ca -0.02 -1.14 0.11 0.00 -2.02 0.00 0.00 63.50 60.43 1qpv n PRO 90 Cb 0.73 -1.72 0.47 0.00 -0.02 0.00 0.00 33.50 32.96 1qpv n PRO 90 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1qpv n ASP 91 N -3.90 1.09 -0.06 2.55 10.43 -1.26 -3.60 116.55 121.81 1qpv n ASP 91 Ca 0.11 -1.56 -0.05 0.00 2.57 0.00 0.00 54.79 55.86 1qpv n ASP 91 Cb 0.47 -0.06 -0.11 0.00 1.84 0.00 0.00 41.12 43.27 1qpv n ASP 91 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 1qpv n THR 92 N -0.08 0.80 -1.64 -3.53 -2.24 -1.26 -5.00 114.28 101.33 1qpv n THR 92 Ca 0.16 -0.54 -0.44 0.00 -2.27 0.00 0.00 64.05 60.96 1qpv n THR 92 Cb 0.25 -0.53 -0.01 0.00 -2.10 0.00 0.00 70.33 67.94 1qpv n THR 92 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qpv n ALA 93 N -2.43 0.42 -1.65 6.98 0.00 -1.24 -4.83 120.51 117.76 1qpv n ALA 93 Ca -0.19 0.38 -0.49 0.00 0.00 0.00 0.00 53.44 53.14 1qpv n ALA 93 Cb 0.86 -2.13 -0.05 0.00 0.00 0.00 0.00 19.45 18.14 1qpv n ALA 93 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1qpv n PRO 94 N 0.80 1.79 -0.01 0.00 -0.02 -1.26 -4.82 135.00 131.48 1qpv n PRO 94 Ca 0.08 0.65 0.18 0.00 -2.02 0.00 0.00 63.50 62.39 1qpv n PRO 94 Cb 0.33 -2.38 0.66 0.00 -0.02 0.00 0.00 33.50 32.08 1qpv n PRO 94 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 1qpv h VAL 95 N 3.86 0.77 0.00 -1.45 3.04 -1.98 0.37 116.25 120.87 1qpv h VAL 95 Ca -0.46 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 65.20 1qpv h VAL 95 Cb 1.28 0.69 0.00 0.00 -2.01 0.00 0.00 31.29 31.26 1qpv h VAL 95 CO 0.87 0.01 0.00 0.03 -1.01 0.00 0.00 177.57 177.47 1qpv h ARG 96 N 0.07 0.00 -0.02 4.17 -0.00 -2.02 -3.10 114.38 113.49 1qpv h ARG 96 Ca 0.25 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.73 1qpv h ARG 96 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.87 1qpv h ARG 96 CO -0.02 0.00 -0.41 -1.13 0.00 0.00 0.00 179.97 178.41 1qpv n SER 97 N -2.83 2.06 -0.05 7.04 3.41 0.11 -4.23 113.62 119.13 1qpv n SER 97 Ca 0.04 -1.53 -0.09 0.00 -0.26 0.00 0.00 58.87 57.03 1qpv n SER 97 Cb 0.47 0.43 -0.15 0.00 -0.26 0.00 0.00 64.21 64.70 1qpv n SER 97 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1qpv n LYS 98 N 0.09 0.66 0.19 4.33 5.02 -0.19 -3.69 118.16 124.58 1qpv n LYS 98 Ca 0.09 0.18 0.13 0.00 -2.02 0.00 0.00 58.31 56.69 1qpv n LYS 98 Cb 0.46 -1.68 0.30 0.00 -0.02 0.00 0.00 35.03 34.09 1qpv n LYS 98 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1qpv h MET 99 N 0.00 0.00 0.00 1.97 -0.00 -1.73 -2.34 114.93 112.83 1qpv h MET 99 Ca -0.39 0.00 -0.26 0.00 -0.00 0.00 0.00 59.70 59.05 1qpv h MET 99 Cb 2.11 0.00 -0.04 0.00 -0.00 0.00 0.00 31.60 33.66 1qpv h MET 99 CO 0.06 0.00 -1.40 0.28 -0.00 0.00 0.00 176.91 175.85 1qpv h VAL 100 N 0.00 1.23 0.00 -0.10 2.07 -1.74 -3.17 116.25 114.54 1qpv h VAL 100 Ca 0.00 -3.02 0.00 0.00 0.82 0.00 0.00 66.70 64.50 1qpv h VAL 100 Cb 0.85 2.61 0.00 0.00 -1.52 0.00 0.00 31.29 33.23 1qpv h VAL 100 CO 0.00 0.70 -0.35 -1.22 0.02 0.00 0.00 177.57 176.72 1qpv n TYR 101 N -3.18 0.11 -0.06 1.57 4.02 -1.20 -3.03 117.16 115.40 1qpv n TYR 101 Ca -0.10 0.03 -0.19 0.00 -0.01 0.00 0.00 57.90 57.63 1qpv n TYR 101 Cb 1.00 -0.41 -0.13 0.00 -0.02 0.00 0.00 39.34 39.79 1qpv n TYR 101 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1qpv h ALA 102 N 2.91 0.15 0.21 -0.72 0.00 -1.48 -3.33 119.26 117.01 1qpv h ALA 102 Ca 0.00 -0.96 -0.01 0.00 0.00 0.00 0.00 54.91 53.94 1qpv h ALA 102 Cb 0.54 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1qpv h ALA 102 CO 0.00 0.53 -0.10 0.77 0.00 0.00 0.00 179.25 180.45 1qpv h SER 103 N -0.77 -0.24 0.00 0.00 0.02 -1.69 -3.16 113.55 107.71 1qpv h SER 103 Ca -0.23 -0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 1qpv h SER 103 Cb 1.36 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.97 1qpv h SER 103 CO -0.06 0.27 0.00 -1.20 -1.14 0.00 0.00 176.83 174.70 1qpv n SER 104 N -4.98 0.64 -0.05 3.07 7.64 -1.17 -3.43 113.62 115.35 1qpv n SER 104 Ca -0.08 -0.90 -0.10 0.00 1.01 0.00 0.00 58.87 58.80 1qpv n SER 104 Cb 0.25 -0.23 -0.09 0.00 -1.01 0.00 0.00 64.21 63.14 1qpv n SER 104 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 1qpv h LYS 105 N 0.66 -0.02 0.00 1.43 3.11 -1.66 -3.29 116.57 116.81 1qpv h LYS 105 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1qpv h LYS 105 Cb 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.51 1qpv h LYS 105 CO 0.00 0.64 0.00 0.38 -2.81 0.00 0.00 179.45 177.66 1qpv h ASP 106 N -0.97 0.00 -0.94 4.20 3.04 -1.80 -1.44 116.42 118.51 1qpv h ASP 106 Ca -0.00 0.00 0.03 0.00 -3.24 0.00 0.00 57.03 53.82 1qpv h ASP 106 Cb 0.67 0.00 -0.05 0.00 -1.04 0.00 0.00 39.33 38.91 1qpv h ASP 106 CO 0.00 0.00 0.62 0.00 -2.04 0.00 0.00 179.24 177.82 1qpv h ALA 107 N 2.00 1.40 0.00 4.15 0.00 -1.78 -1.72 119.26 123.30 1qpv h ALA 107 Ca 0.00 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1qpv h ALA 107 Cb 0.02 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1qpv h ALA 107 CO 0.00 0.51 -0.48 1.25 0.00 0.00 0.00 179.25 180.53 1qpv h LEU 108 N 1.18 0.00 -0.70 0.00 6.46 -1.44 -3.29 115.31 117.53 1qpv h LEU 108 Ca 0.37 -0.52 0.06 0.00 -0.12 0.00 0.00 57.88 57.67 1qpv h LEU 108 Cb 0.00 0.00 -0.08 0.00 -0.73 0.00 0.00 40.66 39.85 1qpv h LEU 108 CO -0.11 1.04 -0.41 -1.14 -0.62 0.00 0.00 178.44 177.19 1qpv n ARG 109 N -4.58 -0.31 -0.33 1.25 3.00 -0.96 -0.69 116.66 114.04 1qpv n ARG 109 Ca -0.15 1.28 -0.04 0.00 -0.00 0.00 0.00 57.85 58.94 1qpv n ARG 109 Cb 0.43 -1.89 0.09 0.00 0.00 0.00 0.00 32.46 31.09 1qpv n ARG 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1qpv h ARG 110 N 0.00 1.23 -0.06 -0.14 2.47 -1.52 -2.48 114.38 113.88 1qpv h ARG 110 Ca 0.11 -0.14 0.02 0.00 -1.26 0.00 0.00 59.98 58.71 1qpv h ARG 110 Cb 0.29 -0.25 -0.00 0.00 -1.65 0.00 0.00 29.97 28.36 1qpv h ARG 110 CO -0.66 0.89 0.06 0.00 0.56 0.00 0.00 179.97 180.82 1qpv h ALA 111 N 1.27 1.75 -2.96 0.04 0.00 -0.97 -3.39 119.26 114.99 1qpv h ALA 111 Ca 0.32 -0.00 -0.64 0.00 0.00 0.00 0.00 54.91 54.59 1qpv h ALA 111 Cb 0.01 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 17.63 1qpv h ALA 111 CO -0.05 -0.09 -0.53 -0.51 0.00 0.00 0.00 179.25 178.07 1qpv s LEU 112 N -8.09 3.95 -0.23 0.00 1.43 -0.61 -5.07 118.68 110.06 1qpv s LEU 112 Ca -0.05 -0.01 -0.05 0.00 -1.03 0.00 0.00 54.13 52.99 1qpv s LEU 112 Cb 0.16 -2.08 -0.02 0.00 0.03 0.00 0.00 46.19 44.28 1qpv s LEU 112 CO 0.59 -0.01 -0.00 0.20 0.23 0.00 0.00 176.35 177.35 1qpv s ASN 113 N 1.53 4.63 0.00 2.29 0.01 -1.26 -4.42 114.94 117.72 1qpv s ASN 113 Ca 0.07 -0.31 0.00 0.00 -0.71 0.00 0.00 52.86 51.91 1qpv s ASN 113 Cb -0.15 -1.81 0.00 0.00 0.41 0.00 0.00 41.25 39.70 1qpv s ASN 113 CO 0.08 -0.01 0.00 0.61 -1.51 0.00 0.00 177.10 176.27 1qpv n GLY 114 N 4.77 0.73 3.67 0.66 0.00 -1.26 -5.10 105.19 108.66 1qpv n GLY 114 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 1qpv n GLY 114 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qpv s VAL 115 N -0.77 3.21 -0.14 1.61 1.01 -1.26 -4.70 120.40 119.36 1qpv s VAL 115 Ca 0.00 0.46 -0.11 0.00 0.00 0.00 0.00 61.98 62.33 1qpv s VAL 115 Cb 0.00 -3.29 -0.08 0.00 0.00 0.00 0.00 36.38 33.01 1qpv s VAL 115 CO 0.00 -0.02 0.09 0.28 0.00 0.00 0.00 175.10 175.45 1qpv h SER 116 N 9.22 0.00 -3.98 3.32 0.02 -1.75 -3.49 113.55 116.89 1qpv h SER 116 Ca -0.43 -0.23 -0.49 0.00 -0.84 0.00 0.00 61.79 59.79 1qpv h SER 116 Cb 1.20 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 63.54 1qpv h SER 116 CO 0.94 0.81 -0.79 0.28 -1.14 0.00 0.00 176.83 176.93 1qpv s THR 117 N -2.00 1.58 -0.02 -2.27 -1.32 -1.16 -5.07 115.64 105.38 1qpv s THR 117 Ca -0.12 -1.68 0.07 0.00 -1.21 0.00 0.00 61.69 58.75 1qpv s THR 117 Cb 0.01 -1.59 -0.02 0.00 -1.51 0.00 0.00 72.50 69.39 1qpv s THR 117 CO 0.27 -0.25 -0.24 -1.81 -2.21 0.00 0.00 174.62 170.38 1qpv s ASP 118 N -2.26 3.27 -0.10 8.08 -0.00 -1.26 -0.79 116.67 123.60 1qpv s ASP 118 Ca 0.09 -0.42 -0.02 0.00 -0.00 0.00 0.00 52.55 52.21 1qpv s ASP 118 Cb -0.07 -0.45 0.04 0.00 -0.00 0.00 0.00 42.92 42.44 1qpv s ASP 118 CO 0.04 0.32 0.01 -0.69 -0.00 0.00 0.00 175.17 174.85 1qpv s VAL 119 N -0.65 0.43 0.02 -1.27 1.01 -0.45 -4.90 120.40 114.58 1qpv s VAL 119 Ca 0.10 -0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.74 1qpv s VAL 119 Cb -0.10 -0.66 -0.03 0.00 0.00 0.00 0.00 36.38 35.58 1qpv s VAL 119 CO -0.00 0.15 0.98 -1.58 0.00 0.00 0.00 175.10 174.65 1qpv s GLN 120 N 1.94 4.57 -0.45 2.72 2.00 -1.26 -0.61 119.66 128.58 1qpv s GLN 120 Ca 0.04 1.43 -0.13 0.00 -2.00 0.00 0.00 55.36 54.70 1qpv s GLN 120 Cb -0.13 -3.45 0.07 0.00 0.80 0.00 0.00 33.01 30.30 1qpv s GLN 120 CO -0.06 -0.02 0.34 0.20 -0.50 0.00 0.00 175.29 175.25 1qpv s GLY 121 N 0.88 2.01 -0.03 2.59 0.00 0.53 -4.81 107.32 108.49 1qpv s GLY 121 Ca 0.52 -2.08 0.21 0.00 0.00 0.00 0.00 44.72 43.36 1qpv s GLY 121 CO 0.28 1.01 1.16 2.41 0.00 0.00 0.00 173.10 177.96 1qpv n THR 122 N 5.10 0.37 0.00 0.90 -1.04 -1.26 0.98 114.28 119.33 1qpv n THR 122 Ca -0.12 -1.25 0.00 0.00 -2.04 0.00 0.00 64.05 60.64 1qpv n THR 122 Cb 0.44 0.74 0.00 0.00 -1.82 0.00 0.00 70.33 69.68 1qpv n THR 122 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1qpv n ASP 123 N 0.17 0.00 0.29 8.00 2.03 -1.26 -4.67 116.55 121.10 1qpv n ASP 123 Ca 0.07 0.00 0.18 0.00 0.52 0.00 0.00 54.79 55.56 1qpv n ASP 123 Cb 1.02 0.00 0.96 0.00 -0.72 0.00 0.00 41.12 42.39 1qpv n ASP 123 CO 0.00 0.00 0.00 -0.26 -1.92 0.00 0.00 177.20 175.02 1qpv h PHE 124 N 0.00 0.00 0.00 -0.67 0.04 -1.99 -0.53 116.94 113.80 1qpv h PHE 124 Ca 0.00 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.70 1qpv h PHE 124 Cb 0.00 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.14 1qpv h PHE 124 CO 0.00 0.00 -0.91 0.77 -0.60 0.00 0.00 178.31 177.57 1qpv h SER 125 N 0.00 0.00 -0.41 2.17 0.02 -1.99 -3.27 113.55 110.07 1qpv h SER 125 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1qpv h SER 125 Cb 0.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.72 1qpv h SER 125 CO 0.00 0.25 0.00 -1.84 -1.14 0.00 0.00 176.83 174.10 1qpv n GLU 126 N -2.89 3.42 0.00 3.45 0.28 -0.21 -3.63 120.64 121.07 1qpv n GLU 126 Ca -0.02 -2.08 0.00 0.00 -0.16 0.00 0.00 57.16 54.90 1qpv n GLU 126 Cb 0.66 -1.93 0.00 0.00 1.43 0.00 0.00 31.44 31.61 1qpv n GLU 126 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 177.13 178.30 1qpv n VAL 127 N 0.51 0.06 -1.03 3.84 0.24 -1.22 -4.83 118.33 115.90 1qpv n VAL 127 Ca 0.18 -0.10 -0.29 0.00 -2.04 0.00 0.00 64.34 62.10 1qpv n VAL 127 Cb 0.82 1.44 0.19 0.00 -1.47 0.00 0.00 33.84 34.82 1qpv n VAL 127 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1qpv s SER 128 N -0.06 2.28 0.00 -1.34 1.04 -1.23 -4.70 113.70 109.69 1qpv s SER 128 Ca 0.00 1.29 0.00 0.00 0.48 0.00 0.00 55.95 57.72 1qpv s SER 128 Cb 0.00 -1.98 0.00 0.00 0.10 0.00 0.00 66.02 64.14 1qpv s SER 128 CO 0.00 -3.36 0.91 0.00 0.98 0.00 0.00 173.24 171.77 1qpv n TYR 129 N -4.34 0.00 -0.04 5.02 9.36 -1.26 -0.87 117.16 125.04 1qpv n TYR 129 Ca 0.05 0.00 0.24 0.00 3.32 0.00 0.00 57.90 61.51 1qpv n TYR 129 Cb 0.56 -0.41 0.60 0.00 -0.63 0.00 0.00 39.34 39.46 1qpv n TYR 129 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 1qpv h ASP 130 N 0.00 0.00 0.16 2.98 3.45 -1.97 0.54 116.42 121.57 1qpv h ASP 130 Ca 0.00 0.00 -0.21 0.00 0.43 0.00 0.00 57.03 57.25 1qpv h ASP 130 Cb 0.00 0.00 0.02 0.00 -0.56 0.00 0.00 39.33 38.79 1qpv h ASP 130 CO 0.00 0.00 -0.92 0.28 -1.57 0.00 0.00 179.24 177.03 1qpv h SER 131 N 0.00 0.53 0.77 6.45 0.02 -1.72 -2.54 113.55 117.06 1qpv h SER 131 Ca 0.32 -0.95 -0.20 0.00 -0.84 0.00 0.00 61.79 60.13 1qpv h SER 131 Cb 1.93 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 64.28 1qpv h SER 131 CO -0.00 1.44 -0.92 0.58 -1.14 0.00 0.00 176.83 176.79 1qpv h VAL 132 N -0.28 1.58 -0.17 2.27 2.07 0.15 -3.13 116.25 118.74 1qpv h VAL 132 Ca -0.16 -2.92 -0.13 0.00 0.82 0.00 0.00 66.70 64.30 1qpv h VAL 132 Cb 1.72 2.62 0.00 0.00 -1.52 0.00 0.00 31.29 34.12 1qpv h VAL 132 CO 0.17 0.84 -0.42 0.25 0.02 0.00 0.00 177.57 178.43 1qpv h LEU 133 N 0.04 0.67 -0.88 2.57 5.85 -0.24 -2.29 115.31 121.03 1qpv h LEU 133 Ca -0.03 -0.57 0.02 0.00 0.84 0.00 0.00 57.88 58.13 1qpv h LEU 133 Cb 1.59 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 42.38 1qpv h LEU 133 CO 0.13 1.12 0.58 -0.08 -0.34 0.00 0.00 178.44 179.85 1qpv h GLU 134 N 0.24 1.13 -0.03 1.25 4.81 -1.53 -0.80 114.58 119.66 1qpv h GLU 134 Ca -0.00 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1qpv h GLU 134 Cb 1.03 -0.26 0.00 0.00 0.63 0.00 0.00 28.75 30.15 1qpv h GLU 134 CO 0.09 0.75 0.00 0.54 -0.73 0.00 0.00 179.01 179.66 1qpv n ARG 135 N -4.49 1.27 0.01 1.92 1.74 -1.18 -2.95 116.66 112.98 1qpv n ARG 135 Ca 0.10 -0.40 0.11 0.00 -0.77 0.00 0.00 57.85 56.89 1qpv n ARG 135 Cb 0.04 -1.43 -0.06 0.00 -1.02 0.00 0.00 32.46 29.98 1qpv n ARG 135 CO 0.00 0.00 0.00 1.55 -1.52 0.00 0.00 177.63 177.66 1qpv n VAL 136 N -0.47 0.11 0.00 1.55 3.14 -0.33 -4.74 118.33 117.59 1qpv n VAL 136 Ca 0.19 -0.27 0.00 0.00 -2.96 0.00 0.00 64.34 61.30 1qpv n VAL 136 Cb 0.19 0.30 0.00 0.00 -1.06 0.00 0.00 33.84 33.27 1qpv n VAL 136 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 1qpv n SER 137 N -1.98 0.00 -4.55 6.55 7.64 -1.09 -4.92 113.62 115.27 1qpv n SER 137 Ca 0.01 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.52 1qpv n SER 137 Cb 0.46 -0.03 -0.04 0.00 -1.01 0.00 0.00 64.21 63.59 1qpv n SER 137 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1qpv s ARG 138 N -0.16 2.91 0.00 1.43 1.70 -1.15 -5.13 118.95 118.55 1qpv s ARG 138 Ca 0.00 -0.13 0.00 0.00 -0.47 0.00 0.00 55.73 55.13 1qpv s ARG 138 Cb 0.00 -4.69 0.00 0.00 -0.57 0.00 0.00 34.95 29.69 1qpv s ARG 138 CO 0.00 -2.67 0.00 0.41 -1.08 0.00 0.00 175.30 171.96