#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2prf n TRP 2 N 0.00 -0.11 0.00 1.43 7.02 -1.26 -1.32 117.44 123.20 2prf n TRP 2 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2prf n TRP 2 Cb 0.00 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 2prf n TRP 2 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 2prf n GLN 3 N -0.03 0.00 -0.26 -0.99 1.13 -1.26 -3.15 117.38 112.82 2prf n GLN 3 Ca 0.00 0.00 0.07 0.00 -1.94 0.00 0.00 57.00 55.13 2prf n GLN 3 Cb 0.00 0.00 0.20 0.00 0.11 0.00 0.00 30.24 30.55 2prf n GLN 3 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2prf h THR 4 N 0.00 0.49 -0.95 5.09 1.03 -1.98 0.18 112.91 116.77 2prf h THR 4 Ca 0.00 -0.09 0.26 0.00 -0.01 0.00 0.00 66.41 66.56 2prf h THR 4 Cb 0.00 0.19 -0.17 0.00 -1.07 0.00 0.00 68.15 67.10 2prf h THR 4 CO 0.00 0.05 0.06 1.88 -0.01 0.00 0.00 175.52 177.50 2prf h TYR 5 N 0.27 0.02 -0.12 0.00 0.05 -1.99 0.29 116.97 115.50 2prf h TYR 5 Ca 0.44 0.07 0.05 0.00 0.05 0.00 0.00 58.73 59.33 2prf h TYR 5 Cb 0.76 0.15 -0.06 0.00 1.01 0.00 0.00 36.73 38.59 2prf h TYR 5 CO -0.26 -0.38 -0.25 0.28 -1.05 0.00 0.00 178.16 176.50 2prf h VAL 6 N 0.04 0.41 -1.19 -2.88 2.07 -0.58 -2.66 116.25 111.46 2prf h VAL 6 Ca 0.58 0.00 -0.55 0.00 0.82 0.00 0.00 66.70 67.55 2prf h VAL 6 Cb 1.18 0.41 -0.18 0.00 -1.52 0.00 0.00 31.29 31.17 2prf h VAL 6 CO -0.86 0.00 0.60 0.47 0.02 0.00 0.00 177.57 177.80 2prf n ASP 7 N -5.37 6.70 0.00 0.57 8.00 0.10 -4.34 116.55 122.21 2prf n ASP 7 Ca -0.03 -3.28 0.00 0.00 0.71 0.00 0.00 54.79 52.19 2prf n ASP 7 Cb 0.29 -1.22 0.00 0.00 -0.02 0.00 0.00 41.12 40.16 2prf n ASP 7 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 2prf n THR 8 N 0.77 0.00 -0.00 -3.53 5.66 -1.01 -5.01 114.28 111.15 2prf n THR 8 Ca 0.50 0.00 -0.00 0.00 -3.05 0.00 0.00 64.05 61.50 2prf n THR 8 Cb 0.49 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 69.27 2prf n THR 8 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2prf n ASN 9 N 0.00 0.05 -0.05 1.09 2.85 -1.24 -4.37 115.26 113.60 2prf n ASN 9 Ca 0.00 0.01 0.04 0.00 -0.11 0.00 0.00 54.58 54.52 2prf n ASN 9 Cb 0.00 -0.45 0.08 0.00 1.24 0.00 0.00 39.78 40.65 2prf n ASN 9 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2prf n LEU 10 N -2.55 0.04 0.00 1.20 4.77 -1.24 0.34 117.00 119.56 2prf n LEU 10 Ca -0.00 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 2prf n LEU 10 Cb 0.01 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 2prf n LEU 10 CO 0.01 -0.27 0.00 0.52 -1.33 0.00 0.00 177.39 176.31 2prf n VAL 11 N -3.41 0.00 -0.58 4.08 0.31 -1.21 -2.11 118.33 115.40 2prf n VAL 11 Ca 0.05 0.49 0.45 0.00 -0.01 0.00 0.00 64.34 65.33 2prf n VAL 11 Cb 0.18 -1.48 0.71 0.00 -0.91 0.00 0.00 33.84 32.34 2prf n VAL 11 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2prf n GLY 12 N 1.98 -0.86 0.00 2.92 0.00 -0.32 -3.55 105.19 105.36 2prf n GLY 12 Ca 0.00 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.68 2prf n GLY 12 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2prf n THR 13 N -4.01 0.00 0.52 2.61 5.66 -0.43 -4.54 114.28 114.10 2prf n THR 13 Ca 0.40 0.00 -0.00 0.00 -3.05 0.00 0.00 64.05 61.39 2prf n THR 13 Cb 1.72 0.00 0.08 0.00 -1.55 0.00 0.00 70.33 70.59 2prf n THR 13 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2prf n GLY 14 N 0.00 2.05 0.00 1.09 0.00 0.15 -4.37 105.19 104.12 2prf n GLY 14 Ca 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2prf n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2prf n ALA 15 N 0.14 0.00 -3.33 4.61 0.00 -1.25 -4.26 120.51 116.42 2prf n ALA 15 Ca 0.09 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.38 2prf n ALA 15 Cb 0.56 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.92 2prf n ALA 15 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2prf s VAL 16 N 0.00 0.03 -2.00 0.00 -7.23 -1.19 -4.61 120.40 105.39 2prf s VAL 16 Ca 0.00 -0.24 0.13 0.00 -1.81 0.00 0.00 61.98 60.06 2prf s VAL 16 Cb 0.00 -0.70 0.36 0.00 0.56 0.00 0.00 36.38 36.60 2prf s VAL 16 CO 0.00 -0.13 1.44 0.35 -0.31 0.00 0.00 175.10 176.45 2prf n THR 17 N 1.65 0.00 -3.48 5.32 -2.24 -1.23 -3.00 114.28 111.30 2prf n THR 17 Ca -0.19 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.49 2prf n THR 17 Cb 0.56 -0.24 -0.02 0.00 -2.10 0.00 0.00 70.33 68.53 2prf n THR 17 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2prf s GLN 18 N -2.00 1.10 0.07 -0.78 -0.21 0.12 -4.69 119.66 113.26 2prf s GLN 18 Ca 0.19 -0.42 -0.25 0.00 0.02 0.00 0.00 55.36 54.90 2prf s GLN 18 Cb 0.09 0.49 0.09 0.00 1.00 0.00 0.00 33.01 34.68 2prf s GLN 18 CO 0.15 -0.48 1.17 0.00 -2.12 0.00 0.00 175.29 174.00 2prf n ALA 19 N -0.33 -3.20 0.00 6.09 0.00 -1.20 -0.90 120.51 120.97 2prf n ALA 19 Ca -0.13 -0.89 0.00 0.00 0.00 0.00 0.00 53.44 52.42 2prf n ALA 19 Cb 0.63 0.33 0.00 0.00 0.00 0.00 0.00 19.45 20.41 2prf n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2prf n ALA 20 N -0.88 0.00 -2.58 0.00 0.00 -0.73 -1.97 120.51 114.36 2prf n ALA 20 Ca -0.12 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.91 2prf n ALA 20 Cb 0.58 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.00 2prf n ALA 20 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2prf s ILE 21 N 0.00 3.79 -0.42 0.00 1.09 0.15 -2.38 121.20 123.42 2prf s ILE 21 Ca 0.00 0.37 -0.24 0.00 -1.10 0.00 0.00 60.65 59.68 2prf s ILE 21 Cb 0.00 -4.89 0.02 0.00 -1.06 0.00 0.00 42.46 36.53 2prf s ILE 21 CO 0.00 -1.80 0.83 -0.76 -0.10 0.00 0.00 174.94 173.11 2prf s LEU 22 N 5.56 4.13 0.00 2.97 1.43 -0.66 -2.59 118.68 129.52 2prf s LEU 22 Ca 0.34 0.15 0.00 0.00 -1.03 0.00 0.00 54.13 53.59 2prf s LEU 22 Cb -0.09 -3.06 0.00 0.00 0.03 0.00 0.00 46.19 43.07 2prf s LEU 22 CO 0.15 -0.89 0.00 0.61 0.23 0.00 0.00 176.35 176.45 2prf n GLY 23 N 4.78 -3.49 0.36 -3.19 0.00 -1.22 -1.98 105.19 100.45 2prf n GLY 23 Ca 0.04 -1.24 0.07 0.00 0.00 0.00 0.00 46.02 44.89 2prf n GLY 23 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2prf n LEU 24 N 0.00 2.76 -0.06 0.99 4.32 -1.26 -4.48 117.00 119.27 2prf n LEU 24 Ca 0.00 -2.66 -0.08 0.00 -0.02 0.00 0.00 56.01 53.25 2prf n LEU 24 Cb 0.00 -0.33 -0.15 0.00 -1.62 0.00 0.00 43.42 41.32 2prf n LEU 24 CO 0.00 0.66 -0.89 0.47 -1.22 0.00 0.00 177.39 176.41 2prf n ASP 25 N -0.68 0.32 0.00 -1.43 9.92 -1.26 -4.98 116.55 118.44 2prf n ASP 25 Ca 0.13 0.15 0.00 0.00 -0.53 0.00 0.00 54.79 54.54 2prf n ASP 25 Cb 0.59 0.67 0.00 0.00 -0.64 0.00 0.00 41.12 41.74 2prf n ASP 25 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2prf n GLY 26 N 1.64 1.27 0.00 0.44 0.00 -1.26 -5.10 105.19 102.17 2prf n GLY 26 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2prf n GLY 26 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2prf n ASN 27 N 0.00 0.01 -4.08 1.61 0.23 -1.26 -4.17 115.26 107.61 2prf n ASN 27 Ca 0.00 -0.30 -0.23 0.00 -0.53 0.00 0.00 54.58 53.52 2prf n ASN 27 Cb 0.00 0.00 -0.16 0.00 -2.08 0.00 0.00 39.78 37.54 2prf n ASN 27 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2prf s THR 28 N 1.69 1.10 -0.07 5.53 2.01 -1.26 -3.41 115.64 121.23 2prf s THR 28 Ca 0.00 -0.55 -0.24 0.00 0.31 0.00 0.00 61.69 61.21 2prf s THR 28 Cb 0.00 -0.95 -0.30 0.00 0.01 0.00 0.00 72.50 71.26 2prf s THR 28 CO 0.00 0.32 0.87 -0.50 -0.69 0.00 0.00 174.62 174.62 2prf h TRP 29 N 6.20 0.40 -3.74 4.92 6.55 -1.87 -3.46 115.95 124.96 2prf h TRP 29 Ca -0.33 -0.29 -0.31 0.00 0.95 0.00 0.00 58.89 58.90 2prf h TRP 29 Cb 1.17 -0.02 -0.30 0.00 -0.86 0.00 0.00 29.16 29.15 2prf h TRP 29 CO 0.43 1.23 -0.75 0.00 -1.05 0.00 0.00 178.44 178.30 2prf s ALA 30 N -2.39 0.31 0.18 1.49 0.00 -1.23 -5.02 121.76 115.10 2prf s ALA 30 Ca -0.15 -0.06 -0.04 0.00 0.00 0.00 0.00 51.96 51.71 2prf s ALA 30 Cb -0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 2prf s ALA 30 CO 0.79 0.03 0.19 -0.08 0.00 0.00 0.00 175.76 176.69 2prf s THR 31 N 0.26 0.04 0.00 0.00 -1.32 -1.26 -0.68 115.64 112.68 2prf s THR 31 Ca -0.02 -1.78 0.00 0.00 -1.21 0.00 0.00 61.69 58.68 2prf s THR 31 Cb -0.05 -2.20 0.00 0.00 -1.51 0.00 0.00 72.50 68.74 2prf s THR 31 CO -0.01 -0.19 0.00 -1.20 -2.21 0.00 0.00 174.62 171.01 2prf n SER 32 N -0.22 0.00 0.00 8.08 7.64 -1.02 -3.63 113.62 124.46 2prf n SER 32 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.86 2prf n SER 32 Cb 0.64 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.84 2prf n SER 32 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2prf n ALA 33 N 0.00 0.00 -0.55 -0.43 0.00 -1.25 -3.26 120.51 115.03 2prf n ALA 33 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2prf n ALA 33 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2prf n ALA 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2prf n GLY 34 N 4.82 -0.25 3.40 0.00 0.00 -1.26 -4.99 105.19 106.91 2prf n GLY 34 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2prf n GLY 34 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2prf s PHE 35 N -0.37 1.73 -0.14 1.61 -0.12 -1.26 -5.15 117.98 114.28 2prf s PHE 35 Ca 0.00 -1.41 0.01 0.00 -0.05 0.00 0.00 56.93 55.47 2prf s PHE 35 Cb 0.00 -0.96 0.02 0.00 -0.63 0.00 0.00 43.02 41.45 2prf s PHE 35 CO 0.00 -0.51 -0.14 0.00 -0.05 0.00 0.00 175.22 174.51 2prf s ALA 36 N -3.38 1.84 0.32 1.99 0.00 -1.26 -5.05 121.76 116.23 2prf s ALA 36 Ca 0.32 -0.89 -0.11 0.00 0.00 0.00 0.00 51.96 51.28 2prf s ALA 36 Cb 0.03 -1.02 -0.07 0.00 0.00 0.00 0.00 23.12 22.05 2prf s ALA 36 CO 0.19 -0.34 0.69 0.08 0.00 0.00 0.00 175.76 176.38 2prf s VAL 37 N 1.41 4.80 0.22 0.00 1.01 -1.26 -4.60 120.40 121.98 2prf s VAL 37 Ca 0.03 0.65 0.06 0.00 0.00 0.00 0.00 61.98 62.73 2prf s VAL 37 Cb -0.13 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 2prf s VAL 37 CO -0.09 -0.28 0.20 0.42 0.00 0.00 0.00 175.10 175.35 2prf s THR 38 N -2.08 4.55 0.44 3.92 -4.23 -1.26 -5.00 115.64 111.98 2prf s THR 38 Ca 0.51 -1.26 0.13 0.00 -1.18 0.00 0.00 61.69 59.88 2prf s THR 38 Cb -0.10 -3.42 0.19 0.00 1.34 0.00 0.00 72.50 70.51 2prf s THR 38 CO 0.24 -0.28 1.99 1.55 -0.54 0.00 0.00 174.62 177.58 2prf h PRO 39 N 1.73 0.11 -0.71 3.99 0.13 -1.99 -2.51 132.00 132.75 2prf h PRO 39 Ca -0.49 -0.02 0.01 0.00 -0.87 0.00 0.00 66.00 64.63 2prf h PRO 39 Cb 1.23 -0.02 -0.04 0.00 0.13 0.00 0.00 31.00 32.30 2prf h PRO 39 CO 0.62 0.23 0.47 0.00 -0.23 0.00 0.00 178.00 179.08 2prf h ALA 40 N 1.78 1.50 -0.00 -0.56 0.00 -1.94 -0.68 119.26 119.37 2prf h ALA 40 Ca 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2prf h ALA 40 Cb 0.27 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2prf h ALA 40 CO 0.02 0.46 -0.06 1.04 0.00 0.00 0.00 179.25 180.71 2prf n GLN 41 N -4.43 0.01 0.07 0.00 1.13 -0.95 -3.48 117.38 109.72 2prf n GLN 41 Ca 0.08 -0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 55.02 2prf n GLN 41 Cb 0.04 -1.50 -0.01 0.00 0.11 0.00 0.00 30.24 28.88 2prf n GLN 41 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2prf h GLY 42 N 5.00 0.39 1.06 1.08 0.00 -1.07 -3.06 103.07 106.47 2prf h GLY 42 Ca 0.00 -0.64 -0.28 0.00 0.00 0.00 0.00 47.33 46.41 2prf h GLY 42 CO 0.00 0.57 -1.20 -1.61 0.00 0.00 0.00 176.54 174.30 2prf h GLN 43 N 0.21 0.48 -0.83 4.80 4.15 -1.58 -3.16 115.11 119.18 2prf h GLN 43 Ca -0.06 -0.77 0.12 0.00 0.77 0.00 0.00 58.65 58.71 2prf h GLN 43 Cb 1.48 0.28 -0.08 0.00 0.21 0.00 0.00 27.48 29.37 2prf h GLN 43 CO 0.14 1.36 0.45 1.15 -1.93 0.00 0.00 178.83 180.01 2prf h THR 44 N -0.00 0.83 -0.78 2.39 2.02 -1.63 -0.10 112.91 115.64 2prf h THR 44 Ca -0.20 -0.25 -0.04 0.00 0.77 0.00 0.00 66.41 66.69 2prf h THR 44 Cb 1.93 0.05 -0.03 0.00 -1.74 0.00 0.00 68.15 68.36 2prf h THR 44 CO 0.23 0.13 0.32 0.25 0.37 0.00 0.00 175.52 176.82 2prf h LEU 45 N 0.72 1.08 -0.83 2.58 5.85 -1.60 -0.61 115.31 122.49 2prf h LEU 45 Ca 0.42 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.98 2prf h LEU 45 Cb 0.48 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2prf h LEU 45 CO -0.29 0.95 0.55 0.00 -0.34 0.00 0.00 178.44 179.31 2prf h ALA 46 N 1.17 1.06 0.00 1.25 0.00 -1.01 -0.44 119.26 121.29 2prf h ALA 46 Ca 0.26 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2prf h ALA 46 Cb 0.21 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 2prf h ALA 46 CO -0.02 0.46 -0.05 0.66 0.00 0.00 0.00 179.25 180.30 2prf h SER 47 N 1.12 0.00 0.69 0.00 4.64 -0.87 -2.80 113.55 116.33 2prf h SER 47 Ca 0.31 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.61 2prf h SER 47 Cb -0.12 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 61.97 2prf h SER 47 CO -0.07 0.05 -0.10 0.00 -0.87 0.00 0.00 176.83 175.84 2prf h ALA 48 N 1.95 1.09 0.00 5.18 0.00 0.51 -1.94 119.26 126.06 2prf h ALA 48 Ca -0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 2prf h ALA 48 Cb 0.73 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2prf h ALA 48 CO 0.01 0.12 -0.17 0.74 0.00 0.00 0.00 179.25 179.95 2prf h PHE 49 N 0.00 0.00 0.03 0.00 0.04 -1.34 -3.06 116.94 112.62 2prf h PHE 49 Ca -0.00 0.00 -0.32 0.00 2.80 0.00 0.00 57.97 60.45 2prf h PHE 49 Cb 0.47 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.57 2prf h PHE 49 CO 0.00 0.17 -1.89 -1.71 -0.60 0.00 0.00 178.31 174.28 2prf n ASN 50 N -3.34 1.12 -4.37 2.17 5.15 -0.76 -4.89 115.26 110.34 2prf n ASN 50 Ca 0.00 0.30 -0.29 0.00 -0.60 0.00 0.00 54.58 53.99 2prf n ASN 50 Cb 0.39 -0.15 -0.14 0.00 -0.53 0.00 0.00 39.78 39.35 2prf n ASN 50 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 2prf s ASN 51 N -6.27 3.22 0.00 1.20 -0.87 -1.00 -5.02 114.94 106.21 2prf s ASN 51 Ca -0.11 -0.69 0.01 0.00 -1.57 0.00 0.00 52.86 50.50 2prf s ASN 51 Cb 0.07 -0.24 0.02 0.00 -0.02 0.00 0.00 41.25 41.08 2prf s ASN 51 CO 0.80 0.20 0.96 0.00 -2.57 0.00 0.00 177.10 176.50 2prf n ALA 52 N 1.24 2.06 -0.05 0.60 0.00 -1.26 -4.54 120.51 118.56 2prf n ALA 52 Ca -0.18 -0.96 -0.14 0.00 0.00 0.00 0.00 53.44 52.16 2prf n ALA 52 Cb 0.53 -0.03 -0.13 0.00 0.00 0.00 0.00 19.45 19.82 2prf n ALA 52 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2prf h ASP 53 N 0.12 0.05 0.30 0.00 1.82 -1.95 -2.66 116.42 114.10 2prf h ASP 53 Ca 0.00 -0.92 0.00 0.00 -0.39 0.00 0.00 57.03 55.72 2prf h ASP 53 Cb 0.46 -0.01 0.00 0.00 0.68 0.00 0.00 39.33 40.46 2prf h ASP 53 CO 0.00 0.96 0.00 -0.81 -1.61 0.00 0.00 179.24 177.78 2prf n PRO 54 N -4.60 0.00 -0.00 0.28 -0.05 -1.26 -2.06 135.00 127.31 2prf n PRO 54 Ca -0.10 0.35 0.06 0.00 -0.05 0.00 0.00 63.50 63.75 2prf n PRO 54 Cb 0.47 -1.50 -0.07 0.00 -0.05 0.00 0.00 33.50 32.35 2prf n PRO 54 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 175.50 175.89 2prf n ILE 55 N -1.50 0.00 0.67 0.52 -5.35 -1.23 -4.35 119.36 108.12 2prf n ILE 55 Ca 0.02 -0.24 0.11 0.00 -0.27 0.00 0.00 62.75 62.37 2prf n ILE 55 Cb 0.10 0.74 -0.08 0.00 -1.74 0.00 0.00 39.64 38.67 2prf n ILE 55 CO 0.00 0.00 0.00 -2.11 -1.76 0.00 0.00 176.55 172.68 2prf n ARG 56 N -1.49 0.22 -4.00 6.28 1.85 -0.87 -4.11 116.66 114.54 2prf n ARG 56 Ca 0.01 -0.05 -0.30 0.00 -1.00 0.00 0.00 57.85 56.51 2prf n ARG 56 Cb 0.22 -1.53 -0.16 0.00 -1.05 0.00 0.00 32.46 29.94 2prf n ARG 56 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2prf s ALA 57 N -3.16 1.85 -0.03 2.89 0.00 -0.93 -4.65 121.76 117.72 2prf s ALA 57 Ca 0.04 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.02 2prf s ALA 57 Cb 0.15 -1.12 0.00 0.00 0.00 0.00 0.00 23.12 22.15 2prf s ALA 57 CO 0.85 -0.55 0.00 -1.13 0.00 0.00 0.00 175.76 174.93 2prf n SER 58 N 4.76 -4.63 0.00 0.00 3.41 -1.26 -4.79 113.62 111.11 2prf n SER 58 Ca -0.16 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.46 2prf n SER 58 Cb 0.49 -2.16 0.00 0.00 -0.26 0.00 0.00 64.21 62.28 2prf n SER 58 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2prf n GLY 59 N -0.84 2.64 1.77 5.00 0.00 -1.26 -4.79 105.19 107.71 2prf n GLY 59 Ca -0.00 0.20 -0.05 0.00 0.00 0.00 0.00 46.02 46.17 2prf n GLY 59 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2prf n PHE 60 N 14.00 -1.52 -4.67 1.61 1.16 -1.06 -4.36 117.46 122.62 2prf n PHE 60 Ca 0.00 -0.94 -0.33 0.00 -1.87 0.00 0.00 57.45 54.32 2prf n PHE 60 Cb 0.00 0.41 -0.16 0.00 -1.61 0.00 0.00 39.48 38.12 2prf n PHE 60 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 2prf s ASP 61 N -2.00 3.24 -0.30 5.98 -4.77 -1.26 -3.02 116.67 114.54 2prf s ASP 61 Ca 0.09 -0.57 0.03 0.00 -3.30 0.00 0.00 52.55 48.80 2prf s ASP 61 Cb -0.02 -1.47 0.08 0.00 -1.09 0.00 0.00 42.92 40.42 2prf s ASP 61 CO 0.07 0.09 -0.01 -0.76 0.70 0.00 0.00 175.17 175.25 2prf s LEU 62 N 0.79 4.08 0.00 2.11 1.02 -1.09 -4.92 118.68 120.67 2prf s LEU 62 Ca -0.07 -1.81 0.00 0.00 0.02 0.00 0.00 54.13 52.27 2prf s LEU 62 Cb -0.16 -1.55 0.00 0.00 0.02 0.00 0.00 46.19 44.50 2prf s LEU 62 CO -0.01 -0.30 0.00 0.00 0.02 0.00 0.00 176.35 176.06 2prf n ALA 63 N 4.36 0.00 -1.93 4.21 0.00 -1.26 -3.08 120.51 122.80 2prf n ALA 63 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2prf n ALA 63 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 2prf n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2prf n GLY 64 N 0.00 0.65 3.47 0.00 0.00 -1.26 -5.00 105.19 103.05 2prf n GLY 64 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2prf n GLY 64 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2prf s VAL 65 N 0.00 1.88 -0.20 1.61 1.01 -1.18 -5.13 120.40 118.40 2prf s VAL 65 Ca 0.00 -2.16 -0.04 0.00 0.00 0.00 0.00 61.98 59.78 2prf s VAL 65 Cb 0.00 -2.53 -0.01 0.00 0.00 0.00 0.00 36.38 33.84 2prf s VAL 65 CO 0.00 -0.26 -0.04 -1.00 0.00 0.00 0.00 175.10 173.80 2prf s HIS 66 N -2.85 2.97 0.36 5.22 0.09 -1.26 -2.68 115.29 117.13 2prf s HIS 66 Ca 0.31 -0.72 0.09 0.00 -0.00 0.00 0.00 55.06 54.74 2prf s HIS 66 Cb 0.03 -2.06 -0.07 0.00 -0.00 0.00 0.00 32.58 30.48 2prf s HIS 66 CO 0.14 -0.39 -0.08 0.71 -0.00 0.00 0.00 174.74 175.12 2prf s TYR 67 N 1.14 2.42 0.00 1.40 2.02 -1.17 -4.94 117.35 118.23 2prf s TYR 67 Ca 0.02 -0.53 0.00 0.00 -0.37 0.00 0.00 57.07 56.19 2prf s TYR 67 Cb -0.15 -1.45 0.00 0.00 -0.40 0.00 0.00 41.96 39.96 2prf s TYR 67 CO -0.00 0.56 0.00 0.28 -1.57 0.00 0.00 175.55 174.81 2prf n VAL 68 N -0.82 0.00 -3.67 0.71 0.31 -1.21 -2.57 118.33 111.08 2prf n VAL 68 Ca -0.05 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.19 2prf n VAL 68 Cb 0.64 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 33.48 2prf n VAL 68 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2prf s THR 69 N 0.12 -0.01 -0.13 2.52 2.01 -1.26 -3.28 115.64 115.61 2prf s THR 69 Ca 0.00 0.04 0.19 0.00 0.31 0.00 0.00 61.69 62.23 2prf s THR 69 Cb 0.00 -0.81 0.29 0.00 0.01 0.00 0.00 72.50 72.00 2prf s THR 69 CO 0.00 0.02 1.15 0.18 -0.69 0.00 0.00 174.62 175.28 2prf n LEU 70 N 4.09 2.38 0.00 4.42 7.99 -1.26 -4.83 117.00 129.79 2prf n LEU 70 Ca -0.21 -3.08 0.00 0.00 -0.01 0.00 0.00 56.01 52.72 2prf n LEU 70 Cb 0.57 -0.43 0.00 0.00 -0.11 0.00 0.00 43.42 43.45 2prf n LEU 70 CO 0.04 0.71 0.00 -1.14 -1.51 0.00 0.00 177.39 175.48 2prf n ARG 71 N -1.41 0.00 -3.43 3.23 0.63 -1.26 -5.08 116.66 109.33 2prf n ARG 71 Ca 0.16 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.70 2prf n ARG 71 Cb 0.64 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.51 2prf n ARG 71 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2prf n ALA 72 N 0.00 4.18 -1.56 5.13 0.00 -1.26 -3.92 120.51 123.08 2prf n ALA 72 Ca 0.00 -4.67 -0.30 0.00 0.00 0.00 0.00 53.44 48.47 2prf n ALA 72 Cb 0.00 -1.93 0.20 0.00 0.00 0.00 0.00 19.45 17.72 2prf n ALA 72 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2prf s ASP 73 N -0.29 2.36 0.00 0.00 1.11 -1.13 -4.92 116.67 113.79 2prf s ASP 73 Ca 0.30 0.51 0.30 0.00 0.18 0.00 0.00 52.55 53.84 2prf s ASP 73 Cb -0.04 -0.70 1.49 0.00 1.07 0.00 0.00 42.92 44.74 2prf s ASP 73 CO -0.06 -3.22 2.00 -0.67 1.18 0.00 0.00 175.17 174.39 2prf n ASP 74 N -4.14 0.40 -0.03 0.27 -0.08 -1.26 -4.19 116.55 107.52 2prf n ASP 74 Ca 0.13 -0.81 -0.03 0.00 -1.51 0.00 0.00 54.79 52.57 2prf n ASP 74 Cb 0.59 -0.06 -0.01 0.00 2.34 0.00 0.00 41.12 43.98 2prf n ASP 74 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2prf n ARG 75 N -0.84 0.20 -4.56 -0.67 1.74 -1.26 -4.89 116.66 106.38 2prf n ARG 75 Ca 0.19 0.13 -0.27 0.00 -0.77 0.00 0.00 57.85 57.13 2prf n ARG 75 Cb 0.22 -0.91 -0.09 0.00 -1.02 0.00 0.00 32.46 30.67 2prf n ARG 75 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2prf s SER 76 N -4.68 3.04 -0.27 0.55 0.01 -1.26 -3.34 113.70 107.75 2prf s SER 76 Ca -0.10 -1.61 -0.19 0.00 1.31 0.00 0.00 55.95 55.35 2prf s SER 76 Cb 0.01 0.38 0.07 0.00 0.21 0.00 0.00 66.02 66.70 2prf s SER 76 CO 0.15 -0.85 0.69 -0.63 0.41 0.00 0.00 173.24 173.01 2prf s ILE 77 N -3.14 -0.00 -0.41 1.44 1.01 0.21 -2.82 121.20 117.49 2prf s ILE 77 Ca 0.23 0.00 0.04 0.00 0.00 0.00 0.00 60.65 60.92 2prf s ILE 77 Cb 0.04 -0.98 0.17 0.00 0.01 0.00 0.00 42.46 41.70 2prf s ILE 77 CO 0.12 0.00 0.37 -0.31 0.00 0.00 0.00 174.94 175.12 2prf s TYR 78 N 1.09 0.68 1.03 3.97 2.02 -1.25 0.14 117.35 125.03 2prf s TYR 78 Ca -0.06 -1.98 -0.13 0.00 -0.37 0.00 0.00 57.07 54.54 2prf s TYR 78 Cb -0.05 -0.75 0.20 0.00 -0.40 0.00 0.00 41.96 40.96 2prf s TYR 78 CO -0.11 -0.88 1.09 0.20 -1.57 0.00 0.00 175.55 174.28 2prf s GLY 79 N 0.34 1.56 0.09 0.71 0.00 -0.94 -4.68 107.32 104.41 2prf s GLY 79 Ca 0.30 -0.42 -0.13 0.00 0.00 0.00 0.00 44.72 44.47 2prf s GLY 79 CO -0.15 0.23 0.32 -1.59 0.00 0.00 0.00 173.10 171.91 2prf s LYS 80 N -4.97 0.94 0.00 2.90 -2.85 -1.20 -1.64 119.74 112.91 2prf s LYS 80 Ca 0.66 -0.73 0.00 0.00 -1.00 0.00 0.00 55.97 54.90 2prf s LYS 80 Cb -0.18 0.40 0.00 0.00 -2.06 0.00 0.00 37.83 35.99 2prf s LYS 80 CO 0.58 -0.33 0.00 1.17 0.10 0.00 0.00 175.35 176.86 2prf n LYS 81 N 0.02 0.00 -1.54 1.78 0.00 -0.37 -3.35 118.16 114.70 2prf n LYS 81 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.15 2prf n LYS 81 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.65 2prf n LYS 81 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2prf n GLY 82 N 0.00 0.89 2.96 3.14 0.00 -1.26 -3.47 105.19 107.45 2prf n GLY 82 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.44 2prf n GLY 82 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2prf n SER 83 N 1.29 -2.01 -4.06 1.61 3.41 -1.26 -4.78 113.62 107.83 2prf n SER 83 Ca 0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.30 2prf n SER 83 Cb 0.35 -1.42 -0.16 0.00 -0.26 0.00 0.00 64.21 62.73 2prf n SER 83 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2prf s ALA 84 N -2.17 2.11 0.09 7.33 0.00 -1.23 -2.10 121.76 125.80 2prf s ALA 84 Ca 0.00 -1.14 0.07 0.00 0.00 0.00 0.00 51.96 50.89 2prf s ALA 84 Cb 0.00 -1.18 -0.03 0.00 0.00 0.00 0.00 23.12 21.91 2prf s ALA 84 CO 0.00 -0.51 -0.19 0.20 0.00 0.00 0.00 175.76 175.26 2prf s GLY 85 N 1.37 1.14 -0.22 0.00 0.00 -1.18 -1.24 107.32 107.19 2prf s GLY 85 Ca 0.03 -1.18 -0.07 0.00 0.00 0.00 0.00 44.72 43.50 2prf s GLY 85 CO -0.11 -1.18 0.07 0.54 0.00 0.00 0.00 173.10 172.42 2prf s VAL 86 N -1.17 4.50 -1.23 1.40 0.11 -0.65 -2.98 120.40 120.37 2prf s VAL 86 Ca 0.04 -0.12 -0.14 0.00 -2.93 0.00 0.00 61.98 58.83 2prf s VAL 86 Cb -0.10 -3.07 0.15 0.00 -1.53 0.00 0.00 36.38 31.83 2prf s VAL 86 CO 0.04 0.38 1.52 -0.38 -3.33 0.00 0.00 175.10 173.32 2prf n ILE 87 N 4.40 4.19 -3.30 7.04 5.41 -0.33 -2.21 119.36 134.58 2prf n ILE 87 Ca -0.16 -4.59 -0.38 0.00 1.00 0.00 0.00 62.75 58.62 2prf n ILE 87 Cb 0.52 -2.44 -0.07 0.00 -0.71 0.00 0.00 39.64 36.94 2prf n ILE 87 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 2prf s THR 88 N 2.06 5.15 -0.09 1.39 -4.23 0.38 -2.42 115.64 117.88 2prf s THR 88 Ca 0.45 0.91 -0.05 0.00 -1.18 0.00 0.00 61.69 61.82 2prf s THR 88 Cb -0.01 -3.81 0.04 0.00 1.34 0.00 0.00 72.50 70.06 2prf s THR 88 CO 0.02 0.25 0.22 0.54 -0.54 0.00 0.00 174.62 175.10 2prf s VAL 89 N 1.20 -0.04 0.00 2.29 0.11 -1.12 0.68 120.40 123.52 2prf s VAL 89 Ca 0.24 0.15 -0.27 0.00 -2.93 0.00 0.00 61.98 59.16 2prf s VAL 89 Cb -0.15 -0.34 -0.04 0.00 -1.53 0.00 0.00 36.38 34.32 2prf s VAL 89 CO 0.09 0.06 0.87 -0.54 -3.33 0.00 0.00 175.10 172.26 2prf s LYS 90 N 1.18 4.54 0.00 1.54 1.02 -1.21 -2.78 119.74 124.03 2prf s LYS 90 Ca -0.09 1.23 0.00 0.00 0.02 0.00 0.00 55.97 57.13 2prf s LYS 90 Cb -0.10 -3.43 0.00 0.00 -0.52 0.00 0.00 37.83 33.78 2prf s LYS 90 CO -0.07 0.07 0.00 0.25 -0.92 0.00 0.00 175.35 174.67 2prf n THR 91 N 3.55 0.00 0.00 2.17 -2.24 -1.15 -4.85 114.28 111.76 2prf n THR 91 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 2prf n THR 91 Cb 0.51 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 2prf n THR 91 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2prf n SER 92 N 0.00 1.99 -2.69 3.42 2.88 -1.26 -4.92 113.62 113.04 2prf n SER 92 Ca 0.00 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.45 2prf n SER 92 Cb 0.00 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 63.52 2prf n SER 92 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2prf n LYS 93 N -2.40 1.15 0.00 -1.46 4.76 -1.26 -5.09 118.16 113.86 2prf n LYS 93 Ca 0.00 -2.79 0.00 0.00 -2.87 0.00 0.00 58.31 52.65 2prf n LYS 93 Cb 0.35 -0.88 0.00 0.00 -1.84 0.00 0.00 35.03 32.67 2prf n LYS 93 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 2prf n SER 94 N -0.21 0.00 -4.36 4.39 3.41 -1.26 -4.69 113.62 110.89 2prf n SER 94 Ca 0.06 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.36 2prf n SER 94 Cb 0.82 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.63 2prf n SER 94 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2prf s ILE 95 N -2.00 2.29 0.05 -1.33 1.01 -0.84 -2.93 121.20 117.46 2prf s ILE 95 Ca 0.00 -1.22 0.03 0.00 0.00 0.00 0.00 60.65 59.46 2prf s ILE 95 Cb 0.00 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.55 2prf s ILE 95 CO 0.00 0.44 0.00 -0.76 0.00 0.00 0.00 174.94 174.62 2prf s LEU 96 N -1.05 3.48 -0.04 2.97 1.43 -1.12 -1.65 118.68 122.70 2prf s LEU 96 Ca 0.12 -0.11 0.02 0.00 -1.03 0.00 0.00 54.13 53.13 2prf s LEU 96 Cb -0.10 -2.13 0.02 0.00 0.03 0.00 0.00 46.19 44.01 2prf s LEU 96 CO 0.02 0.22 -0.07 -0.69 0.23 0.00 0.00 176.35 176.06 2prf s VAL 97 N -1.22 0.68 -0.50 -1.59 1.01 -1.00 -2.80 120.40 114.98 2prf s VAL 97 Ca 0.23 -0.23 0.03 0.00 0.00 0.00 0.00 61.98 62.01 2prf s VAL 97 Cb -0.12 -0.66 0.13 0.00 0.00 0.00 0.00 36.38 35.73 2prf s VAL 97 CO 0.15 0.25 0.24 -0.83 0.00 0.00 0.00 175.10 174.91 2prf s GLY 98 N 0.72 2.36 -0.43 4.51 0.00 -1.02 -1.77 107.32 111.69 2prf s GLY 98 Ca -0.11 -3.14 -0.19 0.00 0.00 0.00 0.00 44.72 41.29 2prf s GLY 98 CO 0.01 1.01 0.51 -1.34 0.00 0.00 0.00 173.10 173.29 2prf s VAL 99 N -0.04 4.99 0.25 1.40 -7.23 -0.08 -1.18 120.40 118.51 2prf s VAL 99 Ca 0.16 -0.19 0.12 0.00 -1.81 0.00 0.00 61.98 60.26 2prf s VAL 99 Cb -0.24 -4.10 -0.05 0.00 0.56 0.00 0.00 36.38 32.55 2prf s VAL 99 CO -0.02 -0.49 -0.21 -0.72 -0.31 0.00 0.00 175.10 173.36 2prf s TYR 100 N 2.38 2.30 0.35 2.82 -0.85 -1.16 0.16 117.35 123.35 2prf s TYR 100 Ca 0.16 -0.34 0.03 0.00 -0.52 0.00 0.00 57.07 56.41 2prf s TYR 100 Cb -0.16 -1.04 -0.04 0.00 0.38 0.00 0.00 41.96 41.10 2prf s TYR 100 CO 0.16 0.65 0.12 -0.80 -1.52 0.00 0.00 175.55 174.15 2prf s ASN 101 N -3.26 2.25 -0.91 -0.18 0.01 -1.26 -3.10 114.94 108.49 2prf s ASN 101 Ca 0.27 -1.55 0.00 0.00 -0.71 0.00 0.00 52.86 50.87 2prf s ASN 101 Cb -0.06 0.30 0.00 0.00 0.41 0.00 0.00 41.25 41.90 2prf s ASN 101 CO 0.14 -0.82 0.00 -0.62 -1.51 0.00 0.00 177.10 174.28 2prf n GLU 102 N -0.74 -0.75 -3.10 -0.60 -0.58 -1.17 -3.94 120.64 109.76 2prf n GLU 102 Ca -0.03 0.61 -0.17 0.00 -0.42 0.00 0.00 57.16 57.15 2prf n GLU 102 Cb 0.65 -4.61 0.02 0.00 -0.57 0.00 0.00 31.44 26.93 2prf n GLU 102 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2prf n LYS 103 N -2.23 -2.12 -2.13 3.49 4.01 -0.89 -4.86 118.16 113.43 2prf n LYS 103 Ca -0.11 1.81 -0.39 0.00 -0.51 0.00 0.00 58.31 59.11 2prf n LYS 103 Cb 0.49 -4.50 0.02 0.00 -0.51 0.00 0.00 35.03 30.53 2prf n LYS 103 CO 0.00 0.00 0.00 -0.89 -1.11 0.00 0.00 177.40 175.40 2prf n ILE 104 N -0.51 4.61 -3.07 -0.18 5.41 -1.25 -4.92 119.36 119.44 2prf n ILE 104 Ca 0.03 -4.75 -0.00 0.00 1.00 0.00 0.00 62.75 59.03 2prf n ILE 104 Cb 0.54 -1.46 -0.00 0.00 -0.71 0.00 0.00 39.64 38.00 2prf n ILE 104 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 2prf n GLN 105 N -0.01 -1.32 0.13 0.38 7.27 -1.26 -4.13 117.38 118.45 2prf n GLN 105 Ca 0.52 1.32 0.08 0.00 0.07 0.00 0.00 57.00 58.99 2prf n GLN 105 Cb 0.28 -1.29 0.45 0.00 2.41 0.00 0.00 30.24 32.09 2prf n GLN 105 CO 0.00 0.00 0.00 -2.30 0.07 0.00 0.00 177.06 174.83 2prf n PRO 106 N 2.10 0.11 -0.10 3.69 -0.02 -1.26 -1.32 135.00 138.20 2prf n PRO 106 Ca -0.03 0.60 -0.10 0.00 -2.02 0.00 0.00 63.50 61.95 2prf n PRO 106 Cb 0.18 -1.91 -0.15 0.00 -0.02 0.00 0.00 33.50 31.60 2prf n PRO 106 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2prf n GLY 107 N -1.32 -0.96 0.15 -1.23 0.00 -1.26 -3.51 105.19 97.05 2prf n GLY 107 Ca -0.01 -0.33 -0.05 0.00 0.00 0.00 0.00 46.02 45.63 2prf n GLY 107 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2prf h THR 108 N 0.00 1.44 0.00 2.61 2.02 -1.45 -2.60 112.91 114.93 2prf h THR 108 Ca -0.53 -2.20 0.00 0.00 0.77 0.00 0.00 66.41 64.45 2prf h THR 108 Cb 2.20 2.17 0.00 0.00 -1.74 0.00 0.00 68.15 70.78 2prf h THR 108 CO 0.03 0.64 -0.62 0.00 0.37 0.00 0.00 175.52 175.94 2prf h ALA 109 N 1.18 0.59 0.03 6.16 0.00 -1.55 -3.28 119.26 122.38 2prf h ALA 109 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.64 2prf h ALA 109 Cb 1.21 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 2prf h ALA 109 CO 0.10 0.00 -1.33 0.00 0.00 0.00 0.00 179.25 178.02 2prf h ALA 110 N 2.50 0.46 -0.14 0.00 0.00 -1.56 -3.21 119.26 117.31 2prf h ALA 110 Ca 0.00 -1.12 -0.22 0.00 0.00 0.00 0.00 54.91 53.57 2prf h ALA 110 Cb 0.75 0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.68 2prf h ALA 110 CO 0.00 1.33 -0.78 -0.91 0.00 0.00 0.00 179.25 178.88 2prf h ASN 111 N 0.02 0.87 -0.67 0.00 -0.26 -1.57 -2.97 115.58 111.00 2prf h ASN 111 Ca -0.14 -0.57 -0.02 0.00 -0.56 0.00 0.00 56.30 55.00 2prf h ASN 111 Cb 1.90 -0.26 -0.03 0.00 -1.06 0.00 0.00 38.32 38.87 2prf h ASN 111 CO 0.12 1.37 0.34 1.62 -1.06 0.00 0.00 177.43 179.82 2prf h VAL 112 N 0.49 1.22 0.00 2.81 3.04 -1.67 -0.50 116.25 121.64 2prf h VAL 112 Ca -0.05 -0.61 -0.01 0.00 -1.01 0.00 0.00 66.70 65.03 2prf h VAL 112 Cb 1.40 0.33 -0.00 0.00 -2.01 0.00 0.00 31.29 31.01 2prf h VAL 112 CO 0.16 0.26 -0.03 0.58 -1.01 0.00 0.00 177.57 177.53 2prf h VAL 113 N 0.97 0.09 0.67 1.51 2.07 -1.54 -2.23 116.25 117.80 2prf h VAL 113 Ca 0.24 -0.50 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 2prf h VAL 113 Cb 0.09 1.46 0.01 0.00 -1.52 0.00 0.00 31.29 31.32 2prf h VAL 113 CO -0.03 0.03 -0.32 -0.08 0.02 0.00 0.00 177.57 177.18 2prf h GLU 114 N 0.00 -0.87 -0.85 1.57 4.81 -0.92 -1.25 114.58 117.07 2prf h GLU 114 Ca -0.00 0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2prf h GLU 114 Cb 0.45 0.20 -0.04 0.00 0.63 0.00 0.00 28.75 29.99 2prf h GLU 114 CO 0.00 -0.58 0.48 0.87 -0.73 0.00 0.00 179.01 179.05 2prf h LYS 115 N -1.06 1.16 -0.19 1.92 1.79 -1.54 -0.75 116.57 117.90 2prf h LYS 115 Ca -0.09 -0.12 0.06 0.00 -2.18 0.00 0.00 60.65 58.31 2prf h LYS 115 Cb 0.69 -0.24 -0.01 0.00 -1.58 0.00 0.00 32.23 31.10 2prf h LYS 115 CO 0.15 0.84 0.18 1.25 -1.08 0.00 0.00 179.45 180.79 2prf h LEU 116 N 1.18 0.00 -0.01 2.94 5.85 -1.32 -1.44 115.31 122.50 2prf h LEU 116 Ca 0.30 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.87 2prf h LEU 116 Cb 0.00 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.04 2prf h LEU 116 CO -0.05 0.00 -0.59 0.00 -0.34 0.00 0.00 178.44 177.46 2prf h ALA 117 N 1.82 0.09 0.00 1.25 0.00 0.11 -3.02 119.26 119.51 2prf h ALA 117 Ca 0.09 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2prf h ALA 117 Cb 0.45 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2prf h ALA 117 CO -0.00 0.35 0.32 -0.44 0.00 0.00 0.00 179.25 179.48 2prf h ASP 118 N -0.08 0.00 0.00 0.00 3.32 -1.06 -0.63 116.42 117.96 2prf h ASP 118 Ca -0.07 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 2prf h ASP 118 Cb 1.29 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.84 2prf h ASP 118 CO 0.12 0.00 -0.16 0.22 -1.72 0.00 0.00 179.24 177.70 2prf h TYR 119 N 0.00 0.00 0.63 4.55 3.20 -1.45 -3.31 116.97 120.59 2prf h TYR 119 Ca 0.00 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.84 2prf h TYR 119 Cb 0.64 0.00 0.01 0.00 1.54 0.00 0.00 36.73 38.92 2prf h TYR 119 CO 0.00 0.16 -0.30 -0.07 -1.64 0.00 0.00 178.16 176.31 2prf h LEU 120 N -1.00 -0.71 -1.97 2.82 3.38 -1.37 -2.25 115.31 114.21 2prf h LEU 120 Ca -0.01 0.00 0.54 0.00 0.09 0.00 0.00 57.88 58.50 2prf h LEU 120 Cb 0.26 0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.12 2prf h LEU 120 CO -0.01 -0.47 1.35 0.40 0.09 0.00 0.00 178.44 179.80 2prf h ILE 121 N -0.90 0.06 -1.80 1.22 2.04 -1.34 0.82 117.51 117.59 2prf h ILE 121 Ca -0.09 0.00 -0.71 0.00 1.00 0.00 0.00 64.86 65.06 2prf h ILE 121 Cb 0.67 0.06 -0.31 0.00 -0.74 0.00 0.00 36.82 36.49 2prf h ILE 121 CO 0.14 0.00 0.55 0.61 0.00 0.00 0.00 178.15 179.46 2prf n GLY 122 N -1.90 5.68 0.63 5.37 0.00 -0.85 -4.42 105.19 109.71 2prf n GLY 122 Ca 0.41 -2.55 0.00 0.00 0.00 0.00 0.00 46.02 43.88 2prf n GLY 122 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2prf n GLN 123 N -0.55 0.00 -2.92 1.61 6.02 0.27 -4.98 117.38 116.85 2prf n GLN 123 Ca 0.50 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 57.31 2prf n GLN 123 Cb 0.38 0.00 -0.01 0.00 1.02 0.00 0.00 30.24 31.62 2prf n GLN 123 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2prf n GLY 124 N -1.49 3.71 2.20 1.08 0.00 -0.60 -5.10 105.19 105.00 2prf n GLY 124 Ca 0.00 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.10 2prf n GLY 124 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01