#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2prf s TRP 2 N 0.00 -0.50 0.00 1.43 0.52 -1.26 -4.62 118.94 114.51 2prf s TRP 2 Ca 0.00 1.20 0.00 0.00 0.02 0.00 0.00 56.10 57.32 2prf s TRP 2 Cb 0.00 0.17 0.00 0.00 -1.15 0.00 0.00 33.47 32.49 2prf s TRP 2 CO 0.00 -0.25 0.24 1.04 0.02 0.00 0.00 176.95 178.01 2prf n GLN 3 N 2.79 0.00 -0.01 4.98 6.02 -1.26 0.23 117.38 130.13 2prf n GLN 3 Ca -0.13 0.24 -0.00 0.00 -0.01 0.00 0.00 57.00 57.10 2prf n GLN 3 Cb 0.57 -0.56 0.29 0.00 1.02 0.00 0.00 30.24 31.56 2prf n GLN 3 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 2prf h THR 4 N 0.00 1.20 0.00 5.09 2.02 -1.98 -1.41 112.91 117.83 2prf h THR 4 Ca 0.00 -0.79 0.00 0.00 0.77 0.00 0.00 66.41 66.39 2prf h THR 4 Cb 0.00 0.94 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 2prf h THR 4 CO 0.00 0.27 0.00 -1.22 0.37 0.00 0.00 175.52 174.94 2prf n TYR 5 N -4.28 0.00 -0.08 3.16 4.01 -0.35 -3.23 117.16 116.39 2prf n TYR 5 Ca 0.02 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.53 2prf n TYR 5 Cb 0.25 0.00 -0.12 0.00 -0.31 0.00 0.00 39.34 39.16 2prf n TYR 5 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2prf n VAL 6 N -0.84 1.60 -1.72 -0.72 0.31 0.61 -2.02 118.33 115.55 2prf n VAL 6 Ca 0.13 -0.31 -0.32 0.00 -0.01 0.00 0.00 64.34 63.83 2prf n VAL 6 Cb 0.06 -1.87 -0.03 0.00 -0.91 0.00 0.00 33.84 31.08 2prf n VAL 6 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2prf n ASP 7 N -4.04 7.06 0.00 4.52 -0.08 -1.20 -4.12 116.55 118.69 2prf n ASP 7 Ca -0.38 -3.24 0.00 0.00 -1.51 0.00 0.00 54.79 49.67 2prf n ASP 7 Cb 0.85 -1.26 0.00 0.00 2.34 0.00 0.00 41.12 43.04 2prf n ASP 7 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 2prf n THR 8 N 1.04 0.00 0.00 5.18 -2.24 -1.26 -5.03 114.28 111.97 2prf n THR 8 Ca 0.53 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.31 2prf n THR 8 Cb 0.43 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 2prf n THR 8 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2prf n ASN 9 N 0.00 0.00 -0.02 3.42 4.13 -1.26 -3.64 115.26 117.89 2prf n ASN 9 Ca 0.00 0.00 0.01 0.00 1.68 0.00 0.00 54.58 56.27 2prf n ASN 9 Cb 0.00 0.00 0.02 0.00 -1.54 0.00 0.00 39.78 38.26 2prf n ASN 9 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2prf n LEU 10 N -0.24 0.00 -0.06 3.41 4.77 -1.22 0.14 117.00 123.79 2prf n LEU 10 Ca 0.00 0.10 -0.21 0.00 -0.03 0.00 0.00 56.01 55.87 2prf n LEU 10 Cb 0.00 -0.04 -0.13 0.00 -2.33 0.00 0.00 43.42 40.92 2prf n LEU 10 CO 0.00 -0.10 -1.02 0.52 -1.33 0.00 0.00 177.39 175.46 2prf n VAL 11 N -3.54 1.64 -0.33 4.08 0.31 -0.85 -3.17 118.33 116.47 2prf n VAL 11 Ca 0.02 -0.54 0.20 0.00 -0.01 0.00 0.00 64.34 64.01 2prf n VAL 11 Cb 0.05 -1.67 0.42 0.00 -0.91 0.00 0.00 33.84 31.73 2prf n VAL 11 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2prf h GLY 12 N 1.02 1.88 0.00 2.92 0.00 0.11 -3.30 103.07 105.71 2prf h GLY 12 Ca -0.49 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 46.63 2prf h GLY 12 CO -0.05 -0.43 0.00 -0.37 0.00 0.00 0.00 176.54 175.70 2prf n THR 13 N -5.06 0.00 0.52 4.70 5.66 -0.57 -4.61 114.28 114.91 2prf n THR 13 Ca 0.29 0.00 0.02 0.00 -3.05 0.00 0.00 64.05 61.30 2prf n THR 13 Cb 0.88 0.00 0.11 0.00 -1.55 0.00 0.00 70.33 69.76 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 1.86 0.00 1.09 0.00 -0.95 -4.40 105.19 102.79 2prf n GLY 14 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 0.16 0.00 -3.42 4.61 0.00 -1.26 -4.78 120.51 115.82 2prf n ALA 15 Ca 0.07 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.38 2prf n ALA 15 Cb 0.49 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.80 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 -1.98 0.00 -7.23 -1.25 -4.70 120.40 105.21 2prf s VAL 16 Ca 0.00 0.12 0.00 0.00 -1.81 0.00 0.00 61.98 60.30 2prf s VAL 16 Cb 0.00 -0.10 0.00 0.00 0.56 0.00 0.00 36.38 36.84 2prf s VAL 16 CO 0.00 0.05 0.99 0.35 -0.31 0.00 0.00 175.10 176.18 2prf n THR 17 N 3.74 0.00 -3.68 5.32 -2.24 -1.26 -2.98 114.28 113.18 2prf n THR 17 Ca -0.21 -0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.49 2prf n THR 17 Cb 0.54 -0.01 -0.02 0.00 -2.10 0.00 0.00 70.33 68.75 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 -1.98 1.41 0.00 -0.78 -0.21 -1.02 -4.87 119.66 112.22 2prf s GLN 18 Ca 0.00 -0.70 0.00 0.00 0.02 0.00 0.00 55.36 54.68 2prf s GLN 18 Cb 0.00 0.53 0.00 0.00 1.00 0.00 0.00 33.01 34.54 2prf s GLN 18 CO 0.00 -0.64 0.00 0.00 -2.12 0.00 0.00 175.29 172.54 2prf n ALA 19 N -0.42 0.00 -3.60 6.09 0.00 -1.23 -2.16 120.51 119.20 2prf n ALA 19 Ca -0.08 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.33 2prf n ALA 19 Cb 0.61 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.00 2prf n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2prf s ALA 20 N -2.00 -2.20 -0.47 0.00 0.00 -1.11 -1.99 121.76 113.99 2prf s ALA 20 Ca 0.00 2.27 -0.21 0.00 0.00 0.00 0.00 51.96 54.01 2prf s ALA 20 Cb 0.00 -1.71 0.03 0.00 0.00 0.00 0.00 23.12 21.45 2prf s ALA 20 CO 0.00 -0.58 0.71 0.42 0.00 0.00 0.00 175.76 176.30 2prf s ILE 21 N 1.94 4.74 -0.57 0.00 1.01 -0.26 -1.60 121.20 126.45 2prf s ILE 21 Ca -0.07 0.04 -0.19 0.00 0.00 0.00 0.00 60.65 60.43 2prf s ILE 21 Cb -0.06 -4.30 0.09 0.00 0.01 0.00 0.00 42.46 38.20 2prf s ILE 21 CO -0.18 -0.75 0.69 -0.76 0.00 0.00 0.00 174.94 173.95 2prf s LEU 22 N 3.03 5.28 1.03 2.97 1.43 0.69 -2.31 118.68 130.79 2prf s LEU 22 Ca 0.23 -1.31 -0.25 0.00 -1.03 0.00 0.00 54.13 51.77 2prf s LEU 22 Cb -0.15 -2.33 -0.13 0.00 0.03 0.00 0.00 46.19 43.61 2prf s LEU 22 CO 0.18 -1.07 -1.16 0.61 0.23 0.00 0.00 176.35 175.14 2prf n GLY 23 N 5.26 -2.96 0.00 -3.19 0.00 -1.25 -2.85 105.19 100.20 2prf n GLY 23 Ca -0.09 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.63 2prf n GLY 23 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2prf n LEU 24 N 2.29 0.00 0.00 0.99 -0.00 -1.26 -4.40 117.00 114.63 2prf n LEU 24 Ca -0.01 -0.12 0.00 0.00 -0.00 0.00 0.00 56.01 55.88 2prf n LEU 24 Cb 0.72 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.14 2prf n LEU 24 CO 0.46 0.00 0.10 0.47 -0.00 0.00 0.00 177.39 178.42 2prf n ASP 25 N -1.39 0.40 0.00 1.45 8.00 -1.26 -4.86 116.55 118.89 2prf n ASP 25 Ca -0.00 -0.71 0.00 0.00 0.71 0.00 0.00 54.79 54.79 2prf n ASP 25 Cb 0.00 0.35 0.00 0.00 -0.02 0.00 0.00 41.12 41.46 2prf n ASP 25 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2prf n GLY 26 N 0.35 0.59 0.47 0.44 0.00 -1.26 -5.10 105.19 100.69 2prf n GLY 26 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2prf n GLY 26 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2prf n ASN 27 N 0.00 0.00 -3.64 1.61 2.85 -1.26 -5.01 115.26 109.81 2prf n ASN 27 Ca 0.00 0.00 -0.04 0.00 -0.11 0.00 0.00 54.58 54.43 2prf n ASN 27 Cb 0.00 0.12 -0.07 0.00 1.24 0.00 0.00 39.78 41.07 2prf n ASN 27 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 2prf s THR 28 N -1.57 -0.01 -0.24 -0.44 2.01 -1.26 -3.76 115.64 110.38 2prf s THR 28 Ca 0.00 0.00 -0.09 0.00 0.31 0.00 0.00 61.69 61.91 2prf s THR 28 Cb 0.00 -1.00 -0.17 0.00 0.01 0.00 0.00 72.50 71.34 2prf s THR 28 CO 0.00 0.00 -0.11 0.79 -0.69 0.00 0.00 174.62 174.61 2prf n TRP 29 N 3.93 0.37 -3.85 4.92 7.02 -0.98 -4.78 117.44 124.08 2prf n TRP 29 Ca -0.19 0.12 -0.07 0.00 -1.02 0.00 0.00 57.50 56.34 2prf n TRP 29 Cb 0.58 -1.04 -0.01 0.00 -2.42 0.00 0.00 31.31 28.41 2prf n TRP 29 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2prf s ALA 30 N -2.49 -1.17 0.32 6.99 0.00 -1.23 -5.03 121.76 119.14 2prf s ALA 30 Ca -0.33 -0.36 -0.19 0.00 0.00 0.00 0.00 51.96 51.08 2prf s ALA 30 Cb 0.10 0.81 0.04 0.00 0.00 0.00 0.00 23.12 24.08 2prf s ALA 30 CO 0.58 -1.03 0.79 -0.08 0.00 0.00 0.00 175.76 176.02 2prf s THR 31 N -3.63 0.00 -0.28 0.00 -1.32 -1.26 -1.11 115.64 108.05 2prf s THR 31 Ca 0.12 -0.96 -0.21 0.00 -1.21 0.00 0.00 61.69 59.44 2prf s THR 31 Cb -0.06 -2.48 0.08 0.00 -1.51 0.00 0.00 72.50 68.54 2prf s THR 31 CO 0.07 0.00 0.76 -0.44 -2.21 0.00 0.00 174.62 172.80 2prf s SER 32 N -3.02 -0.79 0.00 8.08 0.01 -0.84 -4.86 113.70 112.29 2prf s SER 32 Ca 0.14 1.38 0.00 0.00 1.31 0.00 0.00 55.95 58.78 2prf s SER 32 Cb -0.05 1.36 0.00 0.00 0.21 0.00 0.00 66.02 67.54 2prf s SER 32 CO 0.09 -0.23 0.00 0.00 0.41 0.00 0.00 173.24 173.51 2prf n ALA 33 N 3.39 0.00 0.00 1.44 0.00 -1.26 -3.54 120.51 120.54 2prf n ALA 33 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2prf n ALA 33 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 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 -2.00 1.68 1.89 0.00 0.00 -1.26 -5.08 105.19 100.41 2prf n GLY 34 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.42 2prf n GLY 34 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2prf n PHE 35 N 0.00 -4.74 -3.58 1.61 -0.00 -1.26 -4.98 117.46 104.51 2prf n PHE 35 Ca 0.00 2.62 -0.29 0.00 -0.00 0.00 0.00 57.45 59.77 2prf n PHE 35 Cb 0.00 -3.63 -0.14 0.00 -0.00 0.00 0.00 39.48 35.71 2prf n PHE 35 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2prf s ALA 36 N -1.41 1.14 -0.69 3.13 0.00 -1.26 -5.04 121.76 117.64 2prf s ALA 36 Ca 0.00 -1.68 -0.10 0.00 0.00 0.00 0.00 51.96 50.18 2prf s ALA 36 Cb 0.00 -1.58 0.18 0.00 0.00 0.00 0.00 23.12 21.72 2prf s ALA 36 CO 0.00 -1.86 0.58 0.08 0.00 0.00 0.00 175.76 174.56 2prf s VAL 37 N 1.41 4.73 -0.15 0.00 1.01 -1.26 -4.45 120.40 121.69 2prf s VAL 37 Ca 0.13 -2.47 -0.02 0.00 0.00 0.00 0.00 61.98 59.62 2prf s VAL 37 Cb -0.20 -4.00 -0.23 0.00 0.00 0.00 0.00 36.38 31.95 2prf s VAL 37 CO -0.17 -0.93 0.22 0.35 0.00 0.00 0.00 175.10 174.57 2prf n THR 38 N 4.03 1.68 0.00 3.92 -2.24 -1.26 -4.39 114.28 116.02 2prf n THR 38 Ca 0.07 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 2prf n THR 38 Cb 0.42 -1.55 0.00 0.00 -2.10 0.00 0.00 70.33 67.11 2prf n THR 38 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2prf n PRO 39 N -3.36 0.00 -2.99 -0.78 -0.02 -1.26 -4.72 135.00 121.87 2prf n PRO 39 Ca -0.35 0.43 -0.11 0.00 -2.02 0.00 0.00 63.50 61.46 2prf n PRO 39 Cb 1.04 -1.30 -0.03 0.00 -0.02 0.00 0.00 33.50 33.19 2prf n PRO 39 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2prf s ALA 40 N -2.86 -1.10 -0.04 3.55 0.00 -1.26 -4.95 121.76 115.10 2prf s ALA 40 Ca 0.00 -0.96 -0.06 0.00 0.00 0.00 0.00 51.96 50.95 2prf s ALA 40 Cb 0.00 -2.38 -0.03 0.00 0.00 0.00 0.00 23.12 20.71 2prf s ALA 40 CO 0.00 -2.16 0.31 1.96 0.00 0.00 0.00 175.76 175.87 2prf h GLN 41 N 5.40 -0.20 -0.00 0.00 7.50 -1.85 -3.06 115.11 122.90 2prf h GLN 41 Ca 0.11 0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.28 2prf h GLN 41 Cb 1.06 0.04 0.00 0.00 0.05 0.00 0.00 27.48 28.63 2prf h GLN 41 CO 0.12 -0.13 -0.46 0.41 -1.50 0.00 0.00 178.83 177.27 2prf n GLY 42 N 1.11 -0.91 0.12 3.46 0.00 -1.26 -3.40 105.19 104.32 2prf n GLY 42 Ca -0.03 -0.41 -0.21 0.00 0.00 0.00 0.00 46.02 45.37 2prf n GLY 42 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2prf h GLN 43 N 0.60 0.36 0.02 1.61 -0.00 -1.92 -2.68 115.11 113.10 2prf h GLN 43 Ca 0.00 -0.62 -0.00 0.00 -0.00 0.00 0.00 58.65 58.03 2prf h GLN 43 Cb 0.52 0.23 0.00 0.00 0.00 0.00 0.00 27.48 28.23 2prf h GLN 43 CO 0.00 1.30 -0.01 1.15 0.00 0.00 0.00 178.83 181.27 2prf h THR 44 N -0.23 1.45 -0.13 2.39 2.02 -1.68 -3.10 112.91 113.64 2prf h THR 44 Ca -0.18 -1.78 0.04 0.00 0.77 0.00 0.00 66.41 65.25 2prf h THR 44 Cb 1.79 2.59 -0.01 0.00 -1.74 0.00 0.00 68.15 70.79 2prf h THR 44 CO 0.18 0.44 0.11 -0.07 0.37 0.00 0.00 175.52 176.55 2prf h LEU 45 N -0.85 0.00 -0.39 2.58 3.38 -1.72 0.25 115.31 118.56 2prf h LEU 45 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 2prf h LEU 45 Cb 0.74 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 2prf h LEU 45 CO 0.01 0.00 -0.10 0.00 0.09 0.00 0.00 178.44 178.44 2prf h ALA 46 N 1.90 0.53 -0.01 1.53 0.00 -1.47 -2.83 119.26 118.91 2prf h ALA 46 Ca 0.06 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2prf h ALA 46 Cb 0.28 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2prf h ALA 46 CO -0.00 0.40 -0.18 0.45 0.00 0.00 0.00 179.25 179.92 2prf n SER 47 N -4.35 1.36 0.05 0.00 2.88 -0.57 -3.75 113.62 109.24 2prf n SER 47 Ca -0.01 -1.19 0.12 0.00 -1.33 0.00 0.00 58.87 56.45 2prf n SER 47 Cb 0.36 0.11 0.17 0.00 -0.75 0.00 0.00 64.21 64.10 2prf n SER 47 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2prf n ALA 48 N -0.23 3.02 1.48 -1.46 0.00 0.76 -3.61 120.51 120.47 2prf n ALA 48 Ca 0.14 -0.27 0.11 0.00 0.00 0.00 0.00 53.44 53.43 2prf n ALA 48 Cb 0.37 -1.15 0.48 0.00 0.00 0.00 0.00 19.45 19.15 2prf n ALA 48 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2prf n PHE 49 N -2.02 0.11 0.05 0.00 3.72 -1.12 -3.83 117.46 114.37 2prf n PHE 49 Ca 0.03 -0.06 -0.22 0.00 -0.05 0.00 0.00 57.45 57.15 2prf n PHE 49 Cb 0.43 0.00 -0.15 0.00 -0.94 0.00 0.00 39.48 38.82 2prf n PHE 49 CO 0.00 0.00 0.00 -0.97 -0.05 0.00 0.00 176.76 175.74 2prf h ASN 50 N 1.65 0.53 -4.56 4.37 -0.00 -1.79 -3.48 115.58 112.31 2prf h ASN 50 Ca 0.00 -0.91 -0.11 0.00 -0.00 0.00 0.00 56.30 55.28 2prf h ASN 50 Cb 0.36 -0.17 -0.21 0.00 -0.00 0.00 0.00 38.32 38.29 2prf h ASN 50 CO 0.00 1.73 -0.21 0.54 -0.00 0.00 0.00 177.43 179.49 2prf s ASN 51 N -7.20 -0.34 -0.21 1.15 6.03 -1.25 -5.03 114.94 108.10 2prf s ASN 51 Ca -0.17 0.44 0.02 0.00 -1.03 0.00 0.00 52.86 52.12 2prf s ASN 51 Cb 0.05 0.54 0.33 0.00 -3.03 0.00 0.00 41.25 39.14 2prf s ASN 51 CO 0.82 -0.35 1.41 0.00 -2.03 0.00 0.00 177.10 176.95 2prf n ALA 52 N 1.84 3.91 -0.00 3.54 0.00 -1.26 -4.22 120.51 124.32 2prf n ALA 52 Ca -0.18 -1.34 -0.21 0.00 0.00 0.00 0.00 53.44 51.71 2prf n ALA 52 Cb 0.57 -1.20 -0.14 0.00 0.00 0.00 0.00 19.45 18.68 2prf n ALA 52 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2prf h ASP 53 N 0.63 0.33 0.00 0.00 5.19 -1.94 -3.26 116.42 117.38 2prf h ASP 53 Ca 0.28 -0.84 0.00 0.00 -0.62 0.00 0.00 57.03 55.84 2prf h ASP 53 Cb 1.83 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 41.23 2prf h ASP 53 CO 0.50 1.55 0.00 -0.81 -3.12 0.00 0.00 179.24 177.36 2prf n PRO 54 N -4.02 0.00 -0.32 3.56 -0.04 -1.26 -3.13 135.00 129.78 2prf n PRO 54 Ca -0.24 0.30 0.14 0.00 -0.04 0.00 0.00 63.50 63.66 2prf n PRO 54 Cb 0.85 -1.09 0.29 0.00 -0.04 0.00 0.00 33.50 33.51 2prf n PRO 54 CO 0.00 0.00 0.00 -0.84 -0.04 0.00 0.00 175.50 174.62 2prf h ILE 55 N 0.00 0.10 -0.59 0.52 3.07 -1.81 0.20 117.51 119.00 2prf h ILE 55 Ca 0.00 -0.02 0.10 0.00 1.55 0.00 0.00 64.86 66.49 2prf h ILE 55 Cb 0.00 0.05 -0.11 0.00 -0.27 0.00 0.00 36.82 36.49 2prf h ILE 55 CO 0.00 0.01 -0.37 -0.09 -1.05 0.00 0.00 178.15 176.65 2prf h ARG 56 N 0.05 -0.18 0.00 0.16 2.43 -1.64 -2.91 114.38 112.29 2prf h ARG 56 Ca 0.58 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.76 2prf h ARG 56 Cb 1.20 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 2prf h ARG 56 CO -0.84 -0.12 0.00 0.00 -1.51 0.00 0.00 179.97 177.50 2prf n ALA 57 N -3.15 0.00 -0.66 2.80 0.00 0.64 -4.49 120.51 115.66 2prf n ALA 57 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2prf n ALA 57 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.80 2prf n ALA 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2prf n SER 58 N 0.00 0.00 0.00 0.00 2.88 -0.89 -4.84 113.62 110.77 2prf n SER 58 Ca 0.00 0.67 0.00 0.00 -1.33 0.00 0.00 58.87 58.21 2prf n SER 58 Cb 0.00 -0.17 0.00 0.00 -0.75 0.00 0.00 64.21 63.29 2prf n SER 58 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2prf n GLY 59 N -0.94 0.09 3.12 0.46 0.00 -1.10 -4.57 105.19 102.24 2prf n GLY 59 Ca 0.00 -1.61 -0.10 0.00 0.00 0.00 0.00 46.02 44.31 2prf n GLY 59 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2prf s PHE 60 N -0.12 0.15 -0.17 1.61 -0.71 -1.21 -4.29 117.98 113.24 2prf s PHE 60 Ca 0.00 -0.39 -0.15 0.00 -1.04 0.00 0.00 56.93 55.35 2prf s PHE 60 Cb 0.00 -0.11 -0.04 0.00 -1.21 0.00 0.00 43.02 41.66 2prf s PHE 60 CO 0.00 -0.35 0.34 -0.51 -1.34 0.00 0.00 175.22 173.36 2prf s ASP 61 N -1.93 6.46 -0.82 1.98 1.11 -1.26 -2.39 116.67 119.82 2prf s ASP 61 Ca -0.08 0.54 0.01 0.00 0.18 0.00 0.00 52.55 53.21 2prf s ASP 61 Cb -0.03 -2.21 0.34 0.00 1.07 0.00 0.00 42.92 42.09 2prf s ASP 61 CO -0.03 0.04 1.54 0.18 1.18 0.00 0.00 175.17 178.08 2prf n LEU 62 N 3.84 6.33 -2.09 1.23 7.99 -1.22 -4.60 117.00 128.49 2prf n LEU 62 Ca -0.10 -5.37 -0.11 0.00 -0.01 0.00 0.00 56.01 50.42 2prf n LEU 62 Cb 0.52 -0.91 -0.02 0.00 -0.11 0.00 0.00 43.42 42.89 2prf n LEU 62 CO 0.40 2.11 -0.13 0.00 -1.51 0.00 0.00 177.39 178.26 2prf n ALA 63 N -0.23 -0.60 -1.70 -1.18 0.00 -1.26 -4.57 120.51 110.97 2prf n ALA 63 Ca 0.43 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.99 2prf n ALA 63 Cb 0.33 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.43 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 -0.60 -0.25 3.77 0.00 0.00 -1.26 -4.99 105.19 101.86 2prf n GLY 64 Ca -0.13 0.43 -0.24 0.00 0.00 0.00 0.00 46.02 46.08 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 0.70 2.32 0.00 1.61 1.01 -1.26 -5.09 120.40 119.69 2prf s VAL 65 Ca 0.00 -1.64 -0.24 0.00 0.00 0.00 0.00 61.98 60.10 2prf s VAL 65 Cb 0.00 -2.95 -0.05 0.00 0.00 0.00 0.00 36.38 33.38 2prf s VAL 65 CO 0.00 0.00 0.75 -1.00 0.00 0.00 0.00 175.10 174.85 2prf s HIS 66 N -2.59 3.67 0.40 5.22 0.09 -1.26 -3.41 115.29 117.40 2prf s HIS 66 Ca 0.41 1.40 0.08 0.00 -0.00 0.00 0.00 55.06 56.95 2prf s HIS 66 Cb 0.03 -2.82 -0.03 0.00 -0.00 0.00 0.00 32.58 29.76 2prf s HIS 66 CO 0.23 0.19 0.33 0.71 -0.00 0.00 0.00 174.74 176.20 2prf s TYR 67 N 0.30 2.73 0.48 1.40 2.02 -1.00 -4.94 117.35 118.34 2prf s TYR 67 Ca 0.39 -0.47 0.06 0.00 -0.37 0.00 0.00 57.07 56.69 2prf s TYR 67 Cb -0.19 -2.06 0.00 0.00 -0.40 0.00 0.00 41.96 39.32 2prf s TYR 67 CO 0.21 -0.01 0.36 0.08 -1.57 0.00 0.00 175.55 174.62 2prf s VAL 68 N -2.46 2.07 -0.08 0.71 1.01 -1.26 -3.30 120.40 117.10 2prf s VAL 68 Ca 0.46 -1.48 0.03 0.00 0.00 0.00 0.00 61.98 60.99 2prf s VAL 68 Cb -0.03 -2.55 -0.02 0.00 0.00 0.00 0.00 36.38 33.78 2prf s VAL 68 CO 0.27 0.00 -0.17 -0.89 0.00 0.00 0.00 175.10 174.31 2prf s THR 69 N -2.65 2.77 -0.17 3.92 2.01 -1.26 -3.58 115.64 116.69 2prf s THR 69 Ca 0.40 -0.80 -0.14 0.00 0.31 0.00 0.00 61.69 61.45 2prf s THR 69 Cb -0.01 -2.09 -0.10 0.00 0.01 0.00 0.00 72.50 70.31 2prf s THR 69 CO 0.24 0.56 -0.02 0.25 -0.69 0.00 0.00 174.62 174.96 2prf h LEU 70 N 5.98 0.00 -6.28 4.42 5.85 -1.92 -3.45 115.31 119.92 2prf h LEU 70 Ca -0.36 -0.21 -0.58 0.00 0.84 0.00 0.00 57.88 57.58 2prf h LEU 70 Cb 1.18 0.00 -0.39 0.00 0.37 0.00 0.00 40.66 41.82 2prf h LEU 70 CO 0.51 1.06 -0.97 0.54 -0.34 0.00 0.00 178.44 179.23 2prf n ARG 71 N -4.54 0.64 -3.39 1.25 3.00 -1.26 -5.03 116.66 107.33 2prf n ARG 71 Ca -0.17 -3.38 -0.44 0.00 -0.01 0.00 0.00 57.85 53.85 2prf n ARG 71 Cb 0.43 -1.59 -0.01 0.00 0.00 0.00 0.00 32.46 31.29 2prf n ARG 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2prf s ALA 72 N -0.66 4.57 0.00 7.54 0.00 -1.26 -4.25 121.76 127.69 2prf s ALA 72 Ca 0.33 -3.77 0.00 0.00 0.00 0.00 0.00 51.96 48.52 2prf s ALA 72 Cb 0.09 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.77 2prf s ALA 72 CO -0.15 -2.20 0.00 -3.47 0.00 0.00 0.00 175.76 169.93 2prf n ASP 73 N 2.82 0.00 0.00 0.00 2.03 -1.26 -4.69 116.55 115.45 2prf n ASP 73 Ca 0.22 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.53 2prf n ASP 73 Cb 0.40 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.80 2prf n ASP 73 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2prf n ASP 74 N 0.00 0.00 0.00 1.67 9.92 -1.26 -4.92 116.55 121.95 2prf n ASP 74 Ca 0.00 0.43 0.00 0.00 -0.53 0.00 0.00 54.79 54.69 2prf n ASP 74 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 2prf n ASP 74 CO 0.00 0.00 0.00 -2.11 0.13 0.00 0.00 177.20 175.22 2prf n ARG 75 N -0.45 0.00 -0.63 -1.24 1.85 -1.26 -5.12 116.66 109.81 2prf n ARG 75 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 57.85 56.84 2prf n ARG 75 Cb 0.00 -0.05 0.01 0.00 -1.05 0.00 0.00 32.46 31.37 2prf n ARG 75 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2prf n SER 76 N -2.38 0.06 -2.72 2.89 7.64 -1.26 -4.58 113.62 113.27 2prf n SER 76 Ca 0.00 -1.05 -0.08 0.00 1.01 0.00 0.00 58.87 58.75 2prf n SER 76 Cb 0.00 -0.04 0.08 0.00 -1.01 0.00 0.00 64.21 63.24 2prf n SER 76 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2prf n ILE 77 N -1.55 0.00 -3.18 0.44 5.41 -0.87 -4.24 119.36 115.37 2prf n ILE 77 Ca 0.01 -1.34 -0.41 0.00 1.00 0.00 0.00 62.75 62.00 2prf n ILE 77 Cb 0.03 1.42 -0.07 0.00 -0.71 0.00 0.00 39.64 40.31 2prf n ILE 77 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 2prf s TYR 78 N 0.37 3.17 0.00 1.39 2.02 -1.23 -3.02 117.35 120.05 2prf s TYR 78 Ca 0.25 0.31 0.00 0.00 -0.37 0.00 0.00 57.07 57.26 2prf s TYR 78 Cb 0.27 -3.01 0.00 0.00 -0.40 0.00 0.00 41.96 38.82 2prf s TYR 78 CO -0.13 -0.56 0.00 0.41 -1.57 0.00 0.00 175.55 173.70 2prf n GLY 79 N 4.69 1.52 3.34 0.71 0.00 -0.25 -4.12 105.19 111.08 2prf n GLY 79 Ca -0.03 -1.95 -0.19 0.00 0.00 0.00 0.00 46.02 43.85 2prf n GLY 79 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2prf s LYS 80 N 2.64 1.31 0.42 1.61 -2.85 -1.23 -2.26 119.74 119.38 2prf s LYS 80 Ca 0.00 -1.54 0.01 0.00 -1.00 0.00 0.00 55.97 53.44 2prf s LYS 80 Cb 0.00 -1.17 -0.01 0.00 -2.06 0.00 0.00 37.83 34.60 2prf s LYS 80 CO 0.00 0.20 0.05 1.63 0.10 0.00 0.00 175.35 177.33 2prf n LYS 81 N -0.21 0.80 -1.79 1.78 5.02 -0.95 -4.43 118.16 118.38 2prf n LYS 81 Ca -0.09 -3.23 -0.41 0.00 -2.02 0.00 0.00 58.31 52.57 2prf n LYS 81 Cb 0.60 1.18 -0.03 0.00 -0.02 0.00 0.00 35.03 36.76 2prf n LYS 81 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2prf s GLY 82 N -3.40 0.33 -1.73 0.72 0.00 -1.26 -2.08 107.32 99.90 2prf s GLY 82 Ca 0.07 0.21 0.00 0.00 0.00 0.00 0.00 44.72 45.00 2prf s GLY 82 CO 0.05 3.65 0.00 1.44 0.00 0.00 0.00 173.10 178.24 2prf n SER 83 N 12.39 -4.35 -0.49 1.64 7.64 -1.26 -4.87 113.62 124.31 2prf n SER 83 Ca 0.28 0.39 0.00 0.00 1.01 0.00 0.00 58.87 60.55 2prf n SER 83 Cb 0.49 -3.94 0.00 0.00 -1.01 0.00 0.00 64.21 59.75 2prf n SER 83 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2prf n ALA 84 N 0.73 0.00 -3.66 -0.43 0.00 -0.88 -3.36 120.51 112.91 2prf n ALA 84 Ca -0.17 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.15 2prf n ALA 84 Cb 0.55 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.87 2prf n ALA 84 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2prf s GLY 85 N -0.42 -0.18 -0.17 0.00 0.00 -1.22 -2.25 107.32 103.08 2prf s GLY 85 Ca 0.00 1.08 -0.06 0.00 0.00 0.00 0.00 44.72 45.73 2prf s GLY 85 CO 0.00 1.28 0.05 0.54 0.00 0.00 0.00 173.10 174.96 2prf s VAL 86 N 1.17 4.67 -0.37 1.40 0.11 -0.96 -2.70 120.40 123.72 2prf s VAL 86 Ca -0.08 -0.08 -0.01 0.00 -2.93 0.00 0.00 61.98 58.87 2prf s VAL 86 Cb -0.09 -3.08 0.10 0.00 -1.53 0.00 0.00 36.38 31.78 2prf s VAL 86 CO -0.08 0.49 0.13 -0.63 -3.33 0.00 0.00 175.10 171.68 2prf s ILE 87 N 0.16 2.98 0.06 7.04 -1.09 0.19 -1.09 121.20 129.45 2prf s ILE 87 Ca 0.04 -2.02 0.08 0.00 -2.23 0.00 0.00 60.65 56.52 2prf s ILE 87 Cb -0.12 -3.02 -0.03 0.00 -1.58 0.00 0.00 42.46 37.70 2prf s ILE 87 CO 0.01 -0.57 -0.21 0.42 -1.23 0.00 0.00 174.94 173.36 2prf s THR 88 N 1.10 2.59 -0.08 2.92 -4.23 -1.17 0.08 115.64 116.86 2prf s THR 88 Ca 0.07 -1.34 -0.09 0.00 -1.18 0.00 0.00 61.69 59.15 2prf s THR 88 Cb -0.21 -2.10 0.02 0.00 1.34 0.00 0.00 72.50 71.55 2prf s THR 88 CO -0.05 0.28 0.24 -0.69 -0.54 0.00 0.00 174.62 173.87 2prf s VAL 89 N -0.94 0.01 -0.20 2.29 1.01 -1.19 -2.04 120.40 119.33 2prf s VAL 89 Ca 0.14 -0.11 -0.19 0.00 0.00 0.00 0.00 61.98 61.82 2prf s VAL 89 Cb -0.10 -0.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.86 2prf s VAL 89 CO 0.05 -0.06 0.53 -0.54 0.00 0.00 0.00 175.10 175.09 2prf s LYS 90 N -0.15 4.20 -0.13 2.72 -0.14 -1.26 -3.44 119.74 121.53 2prf s LYS 90 Ca -0.03 0.45 -0.15 0.00 -1.36 0.00 0.00 55.97 54.88 2prf s LYS 90 Cb -0.03 -3.56 -0.05 0.00 -1.68 0.00 0.00 37.83 32.51 2prf s LYS 90 CO 0.01 -0.16 -0.29 0.25 -0.76 0.00 0.00 175.35 174.40 2prf n THR 91 N 4.55 1.43 0.05 2.17 -2.24 -1.20 -5.03 114.28 114.01 2prf n THR 91 Ca -0.04 0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 2prf n THR 91 Cb 0.50 -2.21 0.00 0.00 -2.10 0.00 0.00 70.33 66.52 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 -4.27 -0.95 -0.05 3.42 2.88 -1.26 -4.93 113.62 108.46 2prf n SER 92 Ca -0.12 0.28 0.06 0.00 -1.33 0.00 0.00 58.87 57.76 2prf n SER 92 Cb 0.43 1.13 0.08 0.00 -0.75 0.00 0.00 64.21 65.10 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 -2.52 1.93 -3.63 -1.46 5.02 -1.23 -5.00 118.16 111.27 2prf n LYS 93 Ca 0.00 -2.09 -0.13 0.00 -2.02 0.00 0.00 58.31 54.07 2prf n LYS 93 Cb 0.00 -1.27 -0.06 0.00 -0.02 0.00 0.00 35.03 33.68 2prf n LYS 93 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2prf s SER 94 N -2.05 -0.35 -0.02 4.39 0.15 -1.26 -3.99 113.70 110.57 2prf s SER 94 Ca 0.18 0.08 0.05 0.00 0.70 0.00 0.00 55.95 56.97 2prf s SER 94 Cb 0.16 0.45 -0.01 0.00 -1.71 0.00 0.00 66.02 64.91 2prf s SER 94 CO 0.02 -0.68 -0.18 -0.63 1.20 0.00 0.00 173.24 172.97 2prf s ILE 95 N -2.39 1.47 0.36 6.45 1.01 -1.13 -3.25 121.20 123.72 2prf s ILE 95 Ca -0.06 -0.78 0.08 0.00 0.00 0.00 0.00 60.65 59.90 2prf s ILE 95 Cb -0.01 -1.24 -0.04 0.00 0.01 0.00 0.00 42.46 41.18 2prf s ILE 95 CO -0.02 0.42 0.15 -1.48 0.00 0.00 0.00 174.94 174.01 2prf s LEU 96 N -0.28 3.21 -0.44 2.97 -0.00 -1.22 -0.23 118.68 122.69 2prf s LEU 96 Ca 0.03 -0.86 0.06 0.00 -0.00 0.00 0.00 54.13 53.36 2prf s LEU 96 Cb -0.09 -1.65 0.19 0.00 -0.00 0.00 0.00 46.19 44.65 2prf s LEU 96 CO 0.00 -0.37 0.52 0.52 -0.00 0.00 0.00 176.35 177.02 2prf n VAL 97 N -1.17 -0.72 -1.80 1.48 0.31 -0.63 -3.19 118.33 112.61 2prf n VAL 97 Ca -0.02 -2.72 -0.41 0.00 -0.01 0.00 0.00 64.34 61.17 2prf n VAL 97 Cb 0.62 -0.74 -0.03 0.00 -0.91 0.00 0.00 33.84 32.78 2prf n VAL 97 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 2prf s GLY 98 N -0.08 0.42 -0.00 2.92 0.00 0.11 -2.73 107.32 107.96 2prf s GLY 98 Ca 0.32 0.28 0.06 0.00 0.00 0.00 0.00 44.72 45.38 2prf s GLY 98 CO -0.15 3.61 -0.17 0.14 0.00 0.00 0.00 173.10 176.53 2prf s VAL 99 N 8.50 2.87 0.33 1.40 1.01 -0.92 -0.64 120.40 132.96 2prf s VAL 99 Ca 0.88 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.92 2prf s VAL 99 Cb -0.24 -2.16 -0.06 0.00 0.00 0.00 0.00 36.38 33.93 2prf s VAL 99 CO 0.31 0.46 0.07 -0.72 0.00 0.00 0.00 175.10 175.23 2prf s TYR 100 N -0.82 1.88 -0.20 5.22 -0.85 -1.10 -2.42 117.35 119.06 2prf s TYR 100 Ca 0.13 -1.03 -0.05 0.00 -0.52 0.00 0.00 57.07 55.60 2prf s TYR 100 Cb -0.11 -1.22 0.10 0.00 0.38 0.00 0.00 41.96 41.12 2prf s TYR 100 CO 0.03 -0.08 0.36 0.54 -1.52 0.00 0.00 175.55 174.88 2prf s ASN 101 N -3.48 0.20 -0.25 -0.18 2.20 -1.26 -3.43 114.94 108.73 2prf s ASN 101 Ca 0.35 0.51 -0.03 0.00 -0.94 0.00 0.00 52.86 52.75 2prf s ASN 101 Cb 0.08 1.05 0.03 0.00 -2.00 0.00 0.00 41.25 40.41 2prf s ASN 101 CO 0.15 -0.27 0.08 -1.84 -2.94 0.00 0.00 177.10 172.28 2prf n GLU 102 N 5.37 -2.60 0.00 3.55 0.28 -1.21 -4.54 120.64 121.48 2prf n GLU 102 Ca -0.06 0.02 0.00 0.00 -0.16 0.00 0.00 57.16 56.96 2prf n GLU 102 Cb 0.50 -4.32 0.00 0.00 1.43 0.00 0.00 31.44 29.05 2prf n GLU 102 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2prf n LYS 103 N -2.59 2.48 -4.03 3.44 4.76 -1.26 -5.09 118.16 115.87 2prf n LYS 103 Ca 0.02 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.34 2prf n LYS 103 Cb 0.47 -0.67 -0.11 0.00 -1.84 0.00 0.00 35.03 32.88 2prf n LYS 103 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2prf s ILE 104 N -1.06 0.34 -0.02 -0.18 1.09 -1.26 -5.03 121.20 115.08 2prf s ILE 104 Ca 0.00 -0.97 -0.04 0.00 -1.10 0.00 0.00 60.65 58.55 2prf s ILE 104 Cb 0.00 -0.44 -0.04 0.00 -1.06 0.00 0.00 42.46 40.92 2prf s ILE 104 CO 0.00 -0.41 0.19 0.00 -0.10 0.00 0.00 174.94 174.61 2prf s GLN 105 N -1.46 3.46 1.27 2.79 0.00 -1.26 -4.82 119.66 119.63 2prf s GLN 105 Ca -0.12 -0.26 -0.20 0.00 -0.00 0.00 0.00 55.36 54.78 2prf s GLN 105 Cb -0.10 -3.11 0.31 0.00 0.00 0.00 0.00 33.01 30.11 2prf s GLN 105 CO -0.00 0.69 1.04 -1.25 0.00 0.00 0.00 175.29 175.77 2prf s PRO 106 N -1.78 -1.72 0.00 9.60 0.04 -1.26 -3.86 135.00 136.02 2prf s PRO 106 Ca 0.25 0.09 0.00 0.00 0.04 0.00 0.00 61.00 61.38 2prf s PRO 106 Cb -0.13 -1.52 0.00 0.00 0.04 0.00 0.00 34.50 32.89 2prf s PRO 106 CO 0.16 -4.07 0.00 0.41 0.04 0.00 0.00 177.00 173.54 2prf n GLY 107 N -0.04 0.95 0.71 0.56 0.00 -1.26 -4.72 105.19 101.38 2prf n GLY 107 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2prf n GLY 107 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2prf n THR 108 N -2.00 0.00 0.13 2.61 -1.04 -1.25 -4.75 114.28 107.99 2prf n THR 108 Ca 0.00 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.77 2prf n THR 108 Cb 0.00 -0.75 -0.16 0.00 -1.82 0.00 0.00 70.33 67.60 2prf n THR 108 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2prf h ALA 109 N 0.00 -0.15 0.00 2.41 0.00 -1.84 -3.19 119.26 116.49 2prf h ALA 109 Ca 0.00 -0.84 0.00 0.00 0.00 0.00 0.00 54.91 54.07 2prf h ALA 109 Cb 0.65 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2prf h ALA 109 CO 0.00 0.64 0.14 0.00 0.00 0.00 0.00 179.25 180.03 2prf h ALA 110 N 0.14 1.12 0.06 0.00 0.00 -1.91 -1.15 119.26 117.51 2prf h ALA 110 Ca -0.24 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.54 2prf h ALA 110 Cb 2.09 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.89 2prf h ALA 110 CO 0.26 -0.12 -0.55 -0.91 0.00 0.00 0.00 179.25 177.93 2prf h ASN 111 N 0.00 0.38 0.99 0.00 4.21 -1.84 -3.15 115.58 116.17 2prf h ASN 111 Ca 0.00 -0.87 -0.03 0.00 1.21 0.00 0.00 56.30 56.60 2prf h ASN 111 Cb 0.28 -0.12 -0.00 0.00 -1.12 0.00 0.00 38.32 37.35 2prf h ASN 111 CO 0.00 1.22 -0.16 1.62 -1.29 0.00 0.00 177.43 178.82 2prf h VAL 112 N -0.40 0.39 -0.10 2.81 3.04 -1.34 -2.87 116.25 117.77 2prf h VAL 112 Ca -0.09 -0.96 -0.14 0.00 -1.01 0.00 0.00 66.70 64.50 2prf h VAL 112 Cb 1.36 1.71 -0.01 0.00 -2.01 0.00 0.00 31.29 32.34 2prf h VAL 112 CO 0.11 0.16 -0.56 0.58 -1.01 0.00 0.00 177.57 176.84 2prf h VAL 113 N 0.00 1.36 0.00 1.51 2.07 -1.44 -2.22 116.25 117.53 2prf h VAL 113 Ca -0.00 -1.86 0.00 0.00 0.82 0.00 0.00 66.70 65.66 2prf h VAL 113 Cb 0.70 1.89 0.00 0.00 -1.52 0.00 0.00 31.29 32.36 2prf h VAL 113 CO 0.02 0.56 -0.01 -0.08 0.02 0.00 0.00 177.57 178.08 2prf h GLU 114 N 0.24 0.00 0.00 1.57 4.22 -1.47 -3.20 114.58 115.94 2prf h GLU 114 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.43 2prf h GLU 114 Cb 1.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.30 2prf h GLU 114 CO 0.09 0.00 -0.34 0.87 -2.18 0.00 0.00 179.01 177.45 2prf h LYS 115 N 0.00 0.00 -1.07 1.92 1.57 -1.37 -3.10 116.57 114.51 2prf h LYS 115 Ca 0.00 0.00 0.28 0.00 -1.87 0.00 0.00 60.65 59.06 2prf h LYS 115 Cb 0.85 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.07 2prf h LYS 115 CO 0.00 0.08 0.69 -0.07 -0.57 0.00 0.00 179.45 179.58 2prf h LEU 116 N -1.00 0.39 -0.51 2.94 -0.00 -1.55 0.48 115.31 116.06 2prf h LEU 116 Ca -0.02 0.08 -0.14 0.00 -0.00 0.00 0.00 57.88 57.80 2prf h LEU 116 Cb 0.38 0.02 -0.01 0.00 -0.00 0.00 0.00 40.66 41.05 2prf h LEU 116 CO -0.01 0.06 -0.29 0.00 -0.00 0.00 0.00 178.44 178.19 2prf h ALA 117 N 1.60 0.70 -0.84 1.53 0.00 -1.69 -2.74 119.26 117.82 2prf h ALA 117 Ca 0.61 -0.42 0.19 0.00 0.00 0.00 0.00 54.91 55.29 2prf h ALA 117 Cb 1.64 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 19.23 2prf h ALA 117 CO -0.28 0.67 0.57 0.22 0.00 0.00 0.00 179.25 180.42 2prf h ASP 118 N 0.76 0.33 0.23 0.00 1.82 0.05 1.18 116.42 120.79 2prf h ASP 118 Ca 0.08 0.03 -0.01 0.00 -0.39 0.00 0.00 57.03 56.74 2prf h ASP 118 Cb 0.86 -0.03 0.00 0.00 0.68 0.00 0.00 39.33 40.84 2prf h ASP 118 CO 0.08 0.14 -0.11 1.88 -1.61 0.00 0.00 179.24 179.62 2prf h TYR 119 N 0.34 -0.29 0.00 0.28 -1.99 -1.32 -3.19 116.97 110.80 2prf h TYR 119 Ca 0.43 -0.01 0.00 0.00 2.00 0.00 0.00 58.73 61.15 2prf h TYR 119 Cb 1.14 0.09 0.00 0.00 2.00 0.00 0.00 36.73 39.97 2prf h TYR 119 CO -0.00 -0.07 0.00 1.47 -0.00 0.00 0.00 178.16 179.55 2prf n LEU 120 N -4.98 0.00 0.07 3.88 -0.00 -0.90 -2.43 117.00 112.65 2prf n LEU 120 Ca -0.05 0.00 0.04 0.00 -0.00 0.00 0.00 56.01 56.00 2prf n LEU 120 Cb 0.17 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.55 2prf n LEU 120 CO 0.14 0.00 -0.10 0.40 -0.00 0.00 0.00 177.39 177.83 2prf h ILE 121 N 0.00 0.35 -0.50 1.47 2.04 0.14 -3.26 117.51 117.75 2prf h ILE 121 Ca 0.00 -1.67 0.14 0.00 1.00 0.00 0.00 64.86 64.34 2prf h ILE 121 Cb 0.00 1.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 2prf h ILE 121 CO 0.00 0.20 0.36 1.23 0.00 0.00 0.00 178.15 179.94 2prf h GLY 122 N 3.79 0.03 0.00 5.37 0.00 -1.53 -3.28 103.07 107.46 2prf h GLY 122 Ca -0.09 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2prf h GLY 122 CO 0.03 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.52 2prf n GLN 123 N -4.39 0.00 0.00 4.80 1.13 -1.25 -5.06 117.38 112.61 2prf n GLN 123 Ca 0.09 0.08 0.00 0.00 -1.94 0.00 0.00 57.00 55.23 2prf n GLN 123 Cb 0.57 -0.41 0.00 0.00 0.11 0.00 0.00 30.24 30.51 2prf n GLN 123 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2prf n GLY 124 N 2.12 0.51 2.24 1.08 0.00 -1.23 -5.09 105.19 104.82 2prf n GLY 124 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2prf n GLY 124 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01