#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 0.00 0.29 7.33 5.03 -1.26 -4.64 117.44 124.19 2prf n TRP 2 Ca 0.00 0.00 -0.13 0.00 3.03 0.00 0.00 57.50 60.40 2prf n TRP 2 Cb 0.00 0.00 -0.07 0.00 -1.03 0.00 0.00 31.31 30.21 2prf n TRP 2 CO 0.00 0.00 0.00 1.96 -0.03 0.00 0.00 177.69 179.62 2prf h GLN 3 N 0.00 -0.74 -0.03 -0.99 4.20 -1.99 -2.86 115.11 112.70 2prf h GLN 3 Ca 0.00 0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.63 2prf h GLN 3 Cb 0.00 0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.93 2prf h GLN 3 CO 0.00 -0.46 -0.59 0.00 -0.67 0.00 0.00 178.83 177.11 2prf h THR 4 N -1.15 1.41 0.00 -0.54 1.03 -1.94 -2.51 112.91 109.21 2prf h THR 4 Ca -0.08 -2.00 0.00 0.00 -0.01 0.00 0.00 66.41 64.32 2prf h THR 4 Cb 0.63 2.05 0.00 0.00 -1.07 0.00 0.00 68.15 69.76 2prf h THR 4 CO 0.13 0.58 0.16 0.22 -0.01 0.00 0.00 175.52 176.60 2prf h TYR 5 N 0.08 0.00 0.01 0.00 5.03 -1.88 -2.18 116.97 118.03 2prf h TYR 5 Ca -0.01 0.00 -0.34 0.00 2.58 0.00 0.00 58.73 60.96 2prf h TYR 5 Cb 1.07 0.00 -0.05 0.00 1.55 0.00 0.00 36.73 39.30 2prf h TYR 5 CO 0.01 0.00 -1.88 0.28 -1.32 0.00 0.00 178.16 175.25 2prf n VAL 6 N -2.52 1.55 -1.23 1.81 0.31 -0.95 -2.97 118.33 114.32 2prf n VAL 6 Ca -0.02 -0.23 -0.22 0.00 -0.01 0.00 0.00 64.34 63.86 2prf n VAL 6 Cb 0.20 -1.93 -0.02 0.00 -0.91 0.00 0.00 33.84 31.18 2prf n VAL 6 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2prf n ASP 7 N -4.25 6.43 0.00 4.52 8.00 -0.84 -4.10 116.55 126.31 2prf n ASP 7 Ca -0.42 -3.12 0.00 0.00 0.71 0.00 0.00 54.79 51.96 2prf n ASP 7 Cb 0.80 -1.17 0.00 0.00 -0.02 0.00 0.00 41.12 40.73 2prf n ASP 7 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2prf n THR 8 N 0.72 0.00 -0.01 -3.53 -2.24 -1.08 -4.99 114.28 103.16 2prf n THR 8 Ca 0.41 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 62.19 2prf n THR 8 Cb 0.58 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.81 2prf n THR 8 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2prf n ASN 9 N 0.00 0.16 -0.13 3.42 2.85 -1.26 -3.57 115.26 116.72 2prf n ASN 9 Ca 0.00 0.03 0.07 0.00 -0.11 0.00 0.00 54.58 54.57 2prf n ASN 9 Cb 0.00 -0.45 0.13 0.00 1.24 0.00 0.00 39.78 40.70 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 -2.66 -0.01 -0.06 1.20 4.77 -1.25 0.92 117.00 119.90 2prf n LEU 10 Ca -0.01 0.66 -0.00 0.00 -0.03 0.00 0.00 56.01 56.62 2prf n LEU 10 Cb 0.04 -0.25 -0.15 0.00 -2.33 0.00 0.00 43.42 40.72 2prf n LEU 10 CO 0.02 -0.68 -0.95 0.52 -1.33 0.00 0.00 177.39 174.97 2prf n VAL 11 N -4.29 0.71 -0.27 4.08 0.31 -1.16 -1.94 118.33 115.76 2prf n VAL 11 Ca 0.10 -0.65 0.33 0.00 -0.01 0.00 0.00 64.34 64.11 2prf n VAL 11 Cb 0.33 -0.25 0.68 0.00 -0.91 0.00 0.00 33.84 33.69 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 3.75 0.00 0.00 2.92 0.00 0.48 -3.38 103.07 106.85 2prf h GLY 12 Ca -0.28 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2prf h GLY 12 CO 0.02 0.00 0.00 -0.37 0.00 0.00 0.00 176.54 176.19 2prf n THR 13 N -3.78 0.00 -1.09 4.70 5.66 -1.00 -4.90 114.28 113.86 2prf n THR 13 Ca 0.24 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.24 2prf n THR 13 Cb 1.33 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 70.11 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 -0.92 0.00 2.66 1.09 0.00 -0.82 0.34 105.19 107.54 2prf n GLY 14 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.37 0.00 -2.78 4.61 0.00 -1.26 -4.86 120.51 115.84 2prf n ALA 15 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 2prf n ALA 15 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 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 -0.86 5.20 -0.70 0.00 -7.23 1.04 -4.76 120.40 113.09 2prf s VAL 16 Ca 0.00 0.11 0.04 0.00 -1.81 0.00 0.00 61.98 60.32 2prf s VAL 16 Cb 0.00 -3.33 0.25 0.00 0.56 0.00 0.00 36.38 33.86 2prf s VAL 16 CO 0.00 0.49 0.93 0.35 -0.31 0.00 0.00 175.10 176.56 2prf n THR 17 N 3.14 0.96 -3.85 5.32 -2.24 -1.22 -3.68 114.28 112.71 2prf n THR 17 Ca -0.17 -0.46 0.03 0.00 -2.27 0.00 0.00 64.05 61.18 2prf n THR 17 Cb 0.53 -0.47 0.01 0.00 -2.10 0.00 0.00 70.33 68.29 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 -1.50 0.32 0.00 -0.78 1.11 -0.28 -4.89 119.66 113.63 2prf s GLN 18 Ca 0.17 -0.20 0.00 0.00 0.01 0.00 0.00 55.36 55.35 2prf s GLN 18 Cb 0.13 0.09 0.00 0.00 -1.01 0.00 0.00 33.01 32.23 2prf s GLN 18 CO 0.05 -0.15 0.00 0.00 0.01 0.00 0.00 175.29 175.20 2prf n ALA 19 N -0.76 0.00 -3.64 6.09 0.00 -1.19 -1.50 120.51 119.52 2prf n ALA 19 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.34 2prf n ALA 19 Cb 0.60 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.98 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 -1.93 -1.19 0.00 0.00 -1.03 -1.94 121.76 113.66 2prf s ALA 20 Ca 0.00 2.11 -0.06 0.00 0.00 0.00 0.00 51.96 54.01 2prf s ALA 20 Cb 0.00 -1.39 0.22 0.00 0.00 0.00 0.00 23.12 21.95 2prf s ALA 20 CO 0.00 -0.32 1.86 -0.89 0.00 0.00 0.00 175.76 176.41 2prf n ILE 21 N 3.10 5.11 -1.64 0.00 2.08 -0.38 0.15 119.36 127.77 2prf n ILE 21 Ca -0.16 -5.08 -0.43 0.00 0.56 0.00 0.00 62.75 57.64 2prf n ILE 21 Cb 0.57 -2.09 -0.03 0.00 -0.75 0.00 0.00 39.64 37.34 2prf n ILE 21 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 2prf s LEU 22 N -2.00 3.44 0.90 1.39 1.43 -0.10 -2.69 118.68 121.05 2prf s LEU 22 Ca 0.40 1.79 -0.10 0.00 -1.03 0.00 0.00 54.13 55.19 2prf s LEU 22 Cb 0.12 -3.47 0.14 0.00 0.03 0.00 0.00 46.19 43.01 2prf s LEU 22 CO -0.01 -1.99 1.16 -0.83 0.23 0.00 0.00 176.35 174.91 2prf s GLY 23 N 8.32 1.75 0.00 -3.19 0.00 -0.04 -1.00 107.32 113.16 2prf s GLY 23 Ca 0.99 0.63 0.12 0.00 0.00 0.00 0.00 44.72 46.46 2prf s GLY 23 CO 0.34 1.05 0.64 1.47 0.00 0.00 0.00 173.10 176.60 2prf n LEU 24 N -4.12 1.04 -2.09 0.66 -0.00 -1.22 -4.42 117.00 106.85 2prf n LEU 24 Ca 0.12 -0.65 0.01 0.00 -0.00 0.00 0.00 56.01 55.48 2prf n LEU 24 Cb 0.52 0.00 0.03 0.00 -0.00 0.00 0.00 43.42 43.97 2prf n LEU 24 CO 0.49 0.22 0.11 -0.67 -0.00 0.00 0.00 177.39 177.54 2prf n ASP 25 N -0.65 0.81 -0.63 1.45 -0.08 -1.26 -4.87 116.55 111.33 2prf n ASP 25 Ca 0.04 -2.03 -0.02 0.00 -1.51 0.00 0.00 54.79 51.27 2prf n ASP 25 Cb 0.23 -0.23 -0.02 0.00 2.34 0.00 0.00 41.12 43.45 2prf n ASP 25 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2prf n GLY 26 N -0.17 -0.21 7.00 0.27 0.00 -1.26 -5.13 105.19 105.68 2prf n GLY 26 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2prf n GLY 26 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2prf n ASN 27 N 0.00 0.00 -4.80 1.61 3.02 -1.26 -4.68 115.26 109.15 2prf n ASN 27 Ca -0.08 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.12 2prf n ASN 27 Cb 0.37 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.49 2prf n ASN 27 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2prf s THR 28 N 0.00 4.05 -0.08 3.41 2.01 -1.26 -0.86 115.64 122.91 2prf s THR 28 Ca 0.00 1.42 -0.03 0.00 0.31 0.00 0.00 61.69 63.40 2prf s THR 28 Cb 0.00 -3.66 -0.04 0.00 0.01 0.00 0.00 72.50 68.81 2prf s THR 28 CO 0.00 -0.13 -0.10 0.79 -0.69 0.00 0.00 174.62 174.49 2prf n TRP 29 N -0.35 0.00 -3.86 4.92 7.02 -1.09 -4.67 117.44 119.41 2prf n TRP 29 Ca 0.06 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.45 2prf n TRP 29 Cb 0.52 -0.29 -0.04 0.00 -2.42 0.00 0.00 31.31 29.07 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 -2.15 -0.67 0.15 6.99 0.00 -1.22 -5.00 121.76 119.86 2prf s ALA 30 Ca -0.11 -0.51 -0.23 0.00 0.00 0.00 0.00 51.96 51.11 2prf s ALA 30 Cb 0.04 0.92 0.07 0.00 0.00 0.00 0.00 23.12 24.15 2prf s ALA 30 CO 0.15 -0.84 0.61 -0.08 0.00 0.00 0.00 175.76 175.60 2prf s THR 31 N -3.94 0.00 -0.36 0.00 -1.32 -1.26 -1.25 115.64 107.52 2prf s THR 31 Ca 0.14 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.66 2prf s THR 31 Cb -0.01 -1.00 0.16 0.00 -1.51 0.00 0.00 72.50 70.14 2prf s THR 31 CO 0.03 0.00 0.42 -0.44 -2.21 0.00 0.00 174.62 172.42 2prf s SER 32 N -2.71 0.55 0.00 8.08 0.01 -0.82 -4.87 113.70 113.94 2prf s SER 32 Ca 0.01 -1.13 0.00 0.00 1.31 0.00 0.00 55.95 56.14 2prf s SER 32 Cb -0.01 0.92 0.00 0.00 0.21 0.00 0.00 66.02 67.14 2prf s SER 32 CO -0.12 -0.27 0.00 0.00 0.41 0.00 0.00 173.24 173.25 2prf n ALA 33 N 4.58 0.00 0.00 1.44 0.00 -1.26 -3.14 120.51 122.13 2prf n ALA 33 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2prf n ALA 33 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 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 0.00 1.83 3.14 0.00 0.00 -1.26 -5.13 105.19 103.77 2prf n GLY 34 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.86 1.78 -0.15 1.61 -0.71 -1.26 -5.12 117.98 112.26 2prf s PHE 35 Ca 0.00 -0.53 -0.03 0.00 -1.04 0.00 0.00 56.93 55.33 2prf s PHE 35 Cb 0.00 -1.20 -0.03 0.00 -1.21 0.00 0.00 43.02 40.59 2prf s PHE 35 CO 0.00 -0.19 -0.05 0.00 -1.34 0.00 0.00 175.22 173.65 2prf s ALA 36 N 0.08 2.97 0.04 1.99 0.00 -1.26 -4.99 121.76 120.59 2prf s ALA 36 Ca -0.05 -0.83 -0.30 0.00 0.00 0.00 0.00 51.96 50.78 2prf s ALA 36 Cb -0.12 -1.50 -0.04 0.00 0.00 0.00 0.00 23.12 21.45 2prf s ALA 36 CO 0.03 0.25 0.99 0.08 0.00 0.00 0.00 175.76 177.10 2prf s VAL 37 N 0.27 4.68 -0.07 0.00 1.01 -1.26 -4.94 120.40 120.09 2prf s VAL 37 Ca -0.04 2.03 -0.38 0.00 0.00 0.00 0.00 61.98 63.59 2prf s VAL 37 Cb -0.14 -4.30 -0.16 0.00 0.00 0.00 0.00 36.38 31.78 2prf s VAL 37 CO 0.03 0.21 1.53 0.41 0.00 0.00 0.00 175.10 177.28 2prf n THR 38 N 3.49 0.14 -0.34 3.92 -1.04 -1.26 -4.81 114.28 114.38 2prf n THR 38 Ca 0.05 -0.03 0.01 0.00 -2.04 0.00 0.00 64.05 62.04 2prf n THR 38 Cb 0.50 -1.02 0.17 0.00 -1.82 0.00 0.00 70.33 68.16 2prf n THR 38 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 2prf h PRO 39 N 5.79 1.18 -0.35 -2.82 0.11 -2.00 -2.10 132.00 131.82 2prf h PRO 39 Ca -0.47 -0.07 0.02 0.00 0.11 0.00 0.00 66.00 65.59 2prf h PRO 39 Cb 1.33 -0.27 -0.03 0.00 0.11 0.00 0.00 31.00 32.14 2prf h PRO 39 CO 0.86 0.78 0.19 0.00 -0.21 0.00 0.00 178.00 179.62 2prf h ALA 40 N 1.44 0.43 0.00 -0.75 0.00 -2.04 0.21 119.26 118.56 2prf h ALA 40 Ca 0.38 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.29 2prf h ALA 40 Cb -0.00 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2prf h ALA 40 CO -0.11 -0.17 -0.02 1.96 0.00 0.00 0.00 179.25 180.91 2prf h GLN 41 N 0.39 0.00 -0.02 0.00 1.08 -1.75 -1.57 115.11 113.24 2prf h GLN 41 Ca 0.14 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.35 2prf h GLN 41 Cb 0.03 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.46 2prf h GLN 41 CO -0.08 0.02 0.01 0.78 -0.95 0.00 0.00 178.83 178.61 2prf h GLY 42 N 0.53 0.00 0.88 3.46 0.00 -0.51 -1.95 103.07 105.49 2prf h GLY 42 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.26 2prf h GLY 42 CO 0.00 0.00 -0.07 1.46 0.00 0.00 0.00 176.54 177.93 2prf h GLN 43 N 0.00 0.56 -0.19 4.80 4.20 -1.33 -2.44 115.11 120.71 2prf h GLN 43 Ca 0.01 -0.22 0.05 0.00 0.06 0.00 0.00 58.65 58.56 2prf h GLN 43 Cb 0.04 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 2prf h GLN 43 CO -0.00 0.76 0.20 1.15 -0.67 0.00 0.00 178.83 180.28 2prf h THR 44 N 0.32 0.48 -0.11 -0.54 2.02 -1.49 -0.45 112.91 113.14 2prf h THR 44 Ca 0.07 0.00 -0.19 0.00 0.77 0.00 0.00 66.41 67.06 2prf h THR 44 Cb 0.56 0.84 0.01 0.00 -1.74 0.00 0.00 68.15 67.81 2prf h THR 44 CO 0.03 0.00 -0.68 0.25 0.37 0.00 0.00 175.52 175.49 2prf h LEU 45 N 0.00 0.79 0.01 2.58 5.85 -1.34 -1.33 115.31 121.88 2prf h LEU 45 Ca 0.09 -0.65 -0.00 0.00 0.84 0.00 0.00 57.88 58.16 2prf h LEU 45 Cb 0.50 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.29 2prf h LEU 45 CO -0.00 1.32 -0.01 0.00 -0.34 0.00 0.00 178.44 179.41 2prf h ALA 46 N 0.49 -0.02 0.00 1.25 0.00 -0.94 -2.13 119.26 117.91 2prf h ALA 46 Ca -0.05 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2prf h ALA 46 Cb 1.33 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2prf h ALA 46 CO 0.14 -0.38 0.00 0.77 0.00 0.00 0.00 179.25 179.78 2prf h SER 47 N -0.28 0.00 0.64 0.00 0.02 -1.42 -1.96 113.55 110.55 2prf h SER 47 Ca -0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.85 2prf h SER 47 Cb 0.27 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2prf h SER 47 CO 0.00 0.00 -0.45 0.00 -1.14 0.00 0.00 176.83 175.24 2prf h ALA 48 N 2.12 1.08 -0.27 3.77 0.00 -0.54 -2.55 119.26 122.88 2prf h ALA 48 Ca 0.00 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.47 2prf h ALA 48 Cb 0.28 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2prf h ALA 48 CO 0.00 0.56 0.04 1.19 0.00 0.00 0.00 179.25 181.04 2prf n PHE 49 N -3.75 0.93 -0.08 0.00 3.72 -0.74 -3.93 117.46 113.62 2prf n PHE 49 Ca -0.01 -0.42 -0.13 0.00 -0.05 0.00 0.00 57.45 56.84 2prf n PHE 49 Cb 0.51 -0.31 -0.06 0.00 -0.94 0.00 0.00 39.48 38.67 2prf n PHE 49 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2prf n ASN 50 N 0.19 2.08 -4.26 4.37 2.85 -0.96 -5.01 115.26 114.52 2prf n ASN 50 Ca 0.14 0.04 -0.28 0.00 -0.11 0.00 0.00 54.58 54.37 2prf n ASN 50 Cb 0.70 -0.34 -0.15 0.00 1.24 0.00 0.00 39.78 41.23 2prf n ASN 50 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 2prf s ASN 51 N -5.87 2.65 0.00 1.20 -0.87 -1.25 -5.01 114.94 105.79 2prf s ASN 51 Ca -0.21 -0.45 0.16 0.00 -1.57 0.00 0.00 52.86 50.80 2prf s ASN 51 Cb 0.07 -0.27 0.02 0.00 -0.02 0.00 0.00 41.25 41.05 2prf s ASN 51 CO 0.31 0.25 0.89 0.00 -2.57 0.00 0.00 177.10 175.98 2prf n ALA 52 N 2.31 3.03 -0.01 0.60 0.00 -1.26 -4.48 120.51 120.69 2prf n ALA 52 Ca -0.16 -0.56 -0.08 0.00 0.00 0.00 0.00 53.44 52.64 2prf n ALA 52 Cb 0.52 -0.56 -0.06 0.00 0.00 0.00 0.00 19.45 19.35 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 2.10 -0.09 0.12 0.00 3.32 -1.95 -2.49 116.42 117.44 2prf h ASP 53 Ca 0.00 -0.40 0.00 0.00 0.02 0.00 0.00 57.03 56.65 2prf h ASP 53 Cb 0.58 0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.15 2prf h ASP 53 CO 0.00 0.57 0.00 -0.81 -1.72 0.00 0.00 179.24 177.28 2prf n PRO 54 N -4.80 0.01 -0.03 3.56 -0.05 -1.26 -1.79 135.00 130.64 2prf n PRO 54 Ca -0.06 0.45 0.02 0.00 -0.05 0.00 0.00 63.50 63.87 2prf n PRO 54 Cb 0.23 -1.53 -0.13 0.00 -0.05 0.00 0.00 33.50 32.03 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 -1.55 0.39 0.82 0.52 -5.35 -1.23 -2.37 119.36 110.59 2prf n ILE 55 Ca 0.01 -0.48 0.13 0.00 -0.27 0.00 0.00 62.75 62.14 2prf n ILE 55 Cb 0.04 -0.14 0.46 0.00 -1.74 0.00 0.00 39.64 38.26 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 -2.26 0.12 0.00 6.28 1.85 -0.74 -2.98 116.66 118.93 2prf n ARG 56 Ca -0.11 0.08 0.00 0.00 -1.00 0.00 0.00 57.85 56.82 2prf n ARG 56 Cb 0.64 -1.63 0.00 0.00 -1.05 0.00 0.00 32.46 30.43 2prf n ARG 56 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2prf n ALA 57 N -1.63 0.36 0.07 2.89 0.00 -1.08 -4.84 120.51 116.28 2prf n ALA 57 Ca 0.06 -0.09 -0.22 0.00 0.00 0.00 0.00 53.44 53.19 2prf n ALA 57 Cb 0.38 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.68 2prf n ALA 57 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2prf h SER 58 N 0.00 0.57 -0.74 0.00 0.87 -1.78 -3.51 113.55 108.97 2prf h SER 58 Ca 0.00 -0.88 0.00 0.00 -1.23 0.00 0.00 61.79 59.68 2prf h SER 58 Cb 0.00 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 61.77 2prf h SER 58 CO 0.00 1.75 0.00 0.61 -0.53 0.00 0.00 176.83 178.66 2prf n GLY 59 N 1.85 -1.68 0.00 5.77 0.00 -1.00 -4.90 105.19 105.23 2prf n GLY 59 Ca -0.24 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.25 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 0.00 -0.27 -3.45 1.61 -1.74 -1.18 -4.76 117.46 107.68 2prf n PHE 60 Ca 0.00 0.00 -0.13 0.00 -0.56 0.00 0.00 57.45 56.76 2prf n PHE 60 Cb 0.00 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 40.97 2prf n PHE 60 CO 0.00 0.00 0.00 0.16 -0.56 0.00 0.00 176.76 176.36 2prf s ASP 61 N -0.77 -0.59 0.00 5.98 1.47 -1.26 -0.07 116.67 121.43 2prf s ASP 61 Ca 0.00 0.18 0.00 0.00 1.18 0.00 0.00 52.55 53.91 2prf s ASP 61 Cb 0.00 0.58 0.00 0.00 -0.34 0.00 0.00 42.92 43.16 2prf s ASP 61 CO 0.00 -0.88 0.00 0.18 0.68 0.00 0.00 175.17 175.15 2prf n LEU 62 N -0.06 0.00 -4.48 2.11 4.77 -1.21 -4.96 117.00 113.16 2prf n LEU 62 Ca -0.17 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.38 2prf n LEU 62 Cb 0.63 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.69 2prf n LEU 62 CO 0.15 0.00 0.94 0.00 -1.33 0.00 0.00 177.39 177.15 2prf s ALA 63 N -2.00 3.03 0.00 -1.18 0.00 -1.26 -4.38 121.76 115.97 2prf s ALA 63 Ca 0.00 -1.90 0.00 0.00 0.00 0.00 0.00 51.96 50.06 2prf s ALA 63 Cb 0.00 -4.04 0.00 0.00 0.00 0.00 0.00 23.12 19.08 2prf s ALA 63 CO 0.00 -3.00 0.00 0.41 0.00 0.00 0.00 175.76 173.17 2prf n GLY 64 N 5.50 0.52 3.39 0.00 0.00 -1.26 -4.93 105.19 108.41 2prf n GLY 64 Ca 0.05 -0.08 -0.20 0.00 0.00 0.00 0.00 46.02 45.78 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 1.90 0.16 1.61 1.01 -1.26 -5.11 120.40 118.71 2prf s VAL 65 Ca 0.00 -2.24 -0.03 0.00 0.00 0.00 0.00 61.98 59.71 2prf s VAL 65 Cb 0.00 -2.19 0.04 0.00 0.00 0.00 0.00 36.38 34.23 2prf s VAL 65 CO 0.00 -0.49 0.18 1.41 0.00 0.00 0.00 175.10 176.20 2prf n HIS 66 N -0.48 -3.65 -3.73 5.22 -0.00 -1.26 -3.35 115.22 107.98 2prf n HIS 66 Ca -0.07 -0.16 -0.22 0.00 -0.00 0.00 0.00 57.72 57.27 2prf n HIS 66 Cb 0.61 -0.16 -0.18 0.00 -0.00 0.00 0.00 29.99 30.26 2prf n HIS 66 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.34 175.87 2prf s TYR 67 N -1.38 0.42 -0.15 4.41 6.14 0.90 -4.78 117.35 122.92 2prf s TYR 67 Ca 0.11 -0.00 0.18 0.00 0.64 0.00 0.00 57.07 58.00 2prf s TYR 67 Cb -0.01 -0.67 -0.10 0.00 0.42 0.00 0.00 41.96 41.60 2prf s TYR 67 CO 0.08 -0.28 0.89 0.28 0.64 0.00 0.00 175.55 177.16 2prf h VAL 68 N 6.38 0.41 -5.08 3.14 2.07 -1.84 -3.12 116.25 118.20 2prf h VAL 68 Ca -0.16 -1.80 0.01 0.00 0.82 0.00 0.00 66.70 65.57 2prf h VAL 68 Cb 1.12 1.94 -0.11 0.00 -1.52 0.00 0.00 31.29 32.73 2prf h VAL 68 CO 0.22 0.23 -1.36 0.41 0.02 0.00 0.00 177.57 177.09 2prf n THR 69 N -2.86-11.66 -0.03 2.57 -1.04 -1.26 -4.78 114.28 95.22 2prf n THR 69 Ca -0.07 2.54 0.03 0.00 -2.04 0.00 0.00 64.05 64.51 2prf n THR 69 Cb 0.78 -6.03 -0.13 0.00 -1.82 0.00 0.00 70.33 63.13 2prf n THR 69 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2prf n LEU 70 N 1.84 0.00 -3.16 -4.42 0.00 -1.26 -4.73 117.00 105.26 2prf n LEU 70 Ca -0.33 0.00 -0.22 0.00 0.00 0.00 0.00 56.01 55.46 2prf n LEU 70 Cb 0.51 0.14 -0.06 0.00 0.00 0.00 0.00 43.42 44.02 2prf n LEU 70 CO 0.31 0.14 -0.23 0.54 0.00 0.00 0.00 177.39 178.15 2prf n ARG 71 N -2.27 0.62 -1.34 1.96 1.74 -1.26 -4.99 116.66 111.11 2prf n ARG 71 Ca -0.11 -3.01 -0.24 0.00 -0.77 0.00 0.00 57.85 53.72 2prf n ARG 71 Cb 0.65 -1.33 -0.09 0.00 -1.02 0.00 0.00 32.46 30.67 2prf n ARG 71 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2prf n ALA 72 N 1.74 6.59 -1.00 7.54 0.00 -1.26 -4.43 120.51 129.69 2prf n ALA 72 Ca 0.21 -2.76 0.00 0.00 0.00 0.00 0.00 53.44 50.89 2prf n ALA 72 Cb 0.53 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.56 2prf n ALA 72 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2prf n ASP 73 N 1.89 0.00 -1.28 0.00 2.03 -1.26 -4.61 116.55 113.32 2prf n ASP 73 Ca 0.51 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.74 2prf n ASP 73 Cb 0.62 0.00 0.12 0.00 -0.72 0.00 0.00 41.12 41.14 2prf n ASP 73 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2prf n ASP 74 N 0.00 3.25 0.00 1.67 -0.08 -1.26 -4.72 116.55 115.41 2prf n ASP 74 Ca 0.00 -3.83 0.00 0.00 -1.51 0.00 0.00 54.79 49.45 2prf n ASP 74 Cb 0.00 -0.45 0.00 0.00 2.34 0.00 0.00 41.12 43.01 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 -0.93 0.00 -4.00 -0.67 5.12 -1.26 -5.07 116.66 109.84 2prf n ARG 75 Ca 0.31 0.00 -0.09 0.00 -1.93 0.00 0.00 57.85 56.14 2prf n ARG 75 Cb 0.83 -0.36 -0.08 0.00 -1.16 0.00 0.00 32.46 31.69 2prf n ARG 75 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 2prf s SER 76 N -3.97 0.11 -0.32 0.55 0.01 -1.26 -3.95 113.70 104.87 2prf s SER 76 Ca 0.00 -0.94 0.04 0.00 1.31 0.00 0.00 55.95 56.36 2prf s SER 76 Cb 0.00 0.39 0.19 0.00 0.21 0.00 0.00 66.02 66.82 2prf s SER 76 CO 0.00 -0.84 0.67 -0.63 0.41 0.00 0.00 173.24 172.85 2prf s ILE 77 N -3.98 -0.89 -0.13 1.44 -1.09 -0.73 -4.10 121.20 111.72 2prf s ILE 77 Ca 0.18 0.00 0.01 0.00 -2.23 0.00 0.00 60.65 58.61 2prf s ILE 77 Cb 0.04 -0.63 -0.01 0.00 -1.58 0.00 0.00 42.46 40.28 2prf s ILE 77 CO -0.00 0.00 -0.15 -0.31 -1.23 0.00 0.00 174.94 173.24 2prf s TYR 78 N 2.56 2.76 0.17 3.97 1.51 -1.26 -2.40 117.35 124.66 2prf s TYR 78 Ca 0.14 -0.74 0.04 0.00 -1.01 0.00 0.00 57.07 55.50 2prf s TYR 78 Cb -0.07 -1.82 -0.04 0.00 -0.11 0.00 0.00 41.96 39.92 2prf s TYR 78 CO -0.20 -0.26 0.25 0.20 -1.11 0.00 0.00 175.55 174.43 2prf s GLY 79 N 0.37 1.64 -0.13 0.71 0.00 0.19 -4.62 107.32 105.47 2prf s GLY 79 Ca -0.12 -1.11 -0.14 0.00 0.00 0.00 0.00 44.72 43.34 2prf s GLY 79 CO 0.06 -1.12 0.39 -1.59 0.00 0.00 0.00 173.10 170.84 2prf s LYS 80 N -3.31 0.49 0.00 2.90 -2.85 -1.26 -1.20 119.74 114.51 2prf s LYS 80 Ca 0.34 0.47 0.00 0.00 -1.00 0.00 0.00 55.97 55.77 2prf s LYS 80 Cb -0.10 0.24 0.00 0.00 -2.06 0.00 0.00 37.83 35.90 2prf s LYS 80 CO 0.27 -0.07 0.00 1.63 0.10 0.00 0.00 175.35 177.28 2prf n LYS 81 N 2.66 0.00 -3.17 1.78 4.76 0.01 -4.72 118.16 119.48 2prf n LYS 81 Ca -0.14 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.16 2prf n LYS 81 Cb 0.57 0.00 0.07 0.00 -1.84 0.00 0.00 35.03 33.83 2prf n LYS 81 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2prf n GLY 82 N -0.74 -0.21 1.74 0.72 0.00 -1.26 -1.91 105.19 103.53 2prf n GLY 82 Ca 0.00 -0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.65 -2.10 -3.72 1.61 3.41 -1.26 -4.84 113.62 104.07 2prf n SER 83 Ca -0.21 0.21 -0.14 0.00 -0.26 0.00 0.00 58.87 58.47 2prf n SER 83 Cb 0.63 -2.11 -0.09 0.00 -0.26 0.00 0.00 64.21 62.38 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 -1.77 -0.96 0.02 7.33 0.00 -0.80 -3.45 121.76 122.13 2prf s ALA 84 Ca 0.00 0.67 -0.03 0.00 0.00 0.00 0.00 51.96 52.60 2prf s ALA 84 Cb 0.00 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 23.00 2prf s ALA 84 CO 0.00 -0.26 0.15 0.41 0.00 0.00 0.00 175.76 176.07 2prf n GLY 85 N 1.66 1.12 3.09 0.00 0.00 -1.16 -0.81 105.19 109.08 2prf n GLY 85 Ca -0.19 -0.94 -0.08 0.00 0.00 0.00 0.00 46.02 44.81 2prf n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2prf s VAL 86 N -2.45 0.17 -0.44 1.61 0.11 -0.34 -2.44 120.40 116.62 2prf s VAL 86 Ca 0.03 -1.39 0.04 0.00 -2.93 0.00 0.00 61.98 57.73 2prf s VAL 86 Cb -0.00 -1.10 0.12 0.00 -1.53 0.00 0.00 36.38 33.87 2prf s VAL 86 CO 0.01 -0.77 0.18 -0.63 -3.33 0.00 0.00 175.10 170.56 2prf s ILE 87 N -3.09 2.30 -0.13 7.04 1.01 0.22 -0.64 121.20 127.90 2prf s ILE 87 Ca -0.01 -2.83 -0.03 0.00 0.00 0.00 0.00 60.65 57.78 2prf s ILE 87 Cb 0.02 -2.64 -0.03 0.00 0.01 0.00 0.00 42.46 39.82 2prf s ILE 87 CO -0.07 -0.73 -0.02 0.42 0.00 0.00 0.00 174.94 174.54 2prf s THR 88 N 0.27 4.10 0.07 2.92 -4.23 -1.01 -2.10 115.64 115.66 2prf s THR 88 Ca 0.15 -0.30 -0.14 0.00 -1.18 0.00 0.00 61.69 60.22 2prf s THR 88 Cb -0.23 -2.78 0.02 0.00 1.34 0.00 0.00 72.50 70.85 2prf s THR 88 CO -0.04 0.53 0.32 -0.69 -0.54 0.00 0.00 174.62 174.20 2prf s VAL 89 N -0.04 0.09 0.31 2.29 1.01 -1.22 -1.78 120.40 121.06 2prf s VAL 89 Ca 0.02 -0.71 -0.27 0.00 0.00 0.00 0.00 61.98 61.03 2prf s VAL 89 Cb -0.13 -1.06 -0.10 0.00 0.00 0.00 0.00 36.38 35.10 2prf s VAL 89 CO 0.02 -0.39 0.94 -0.54 0.00 0.00 0.00 175.10 175.14 2prf s LYS 90 N -3.04 4.61 0.00 2.72 1.02 -1.25 -2.76 119.74 121.04 2prf s LYS 90 Ca -0.02 1.35 0.00 0.00 0.02 0.00 0.00 55.97 57.32 2prf s LYS 90 Cb 0.01 -2.85 0.00 0.00 -0.52 0.00 0.00 37.83 34.46 2prf s LYS 90 CO -0.06 0.31 0.00 0.25 -0.92 0.00 0.00 175.35 174.92 2prf n THR 91 N 0.66 0.00 -2.37 2.17 -2.24 0.32 -4.95 114.28 107.88 2prf n THR 91 Ca 0.02 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.43 2prf n THR 91 Cb 0.50 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.70 2prf n THR 91 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2prf s SER 92 N 1.34 6.08 -0.72 3.42 0.01 -1.26 -4.03 113.70 118.55 2prf s SER 92 Ca 0.00 -2.09 0.00 0.00 1.31 0.00 0.00 55.95 55.17 2prf s SER 92 Cb 0.00 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.65 2prf s SER 92 CO 0.00 -1.97 0.00 0.29 0.41 0.00 0.00 173.24 171.97 2prf n LYS 93 N 8.37 -1.76 -4.19 12.44 5.02 -1.24 -4.92 118.16 131.88 2prf n LYS 93 Ca 0.47 0.73 -0.11 0.00 -2.02 0.00 0.00 58.31 57.37 2prf n LYS 93 Cb 0.46 -5.15 -0.10 0.00 -0.02 0.00 0.00 35.03 30.23 2prf n LYS 93 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2prf s SER 94 N -2.26 0.64 -0.19 4.39 1.04 -1.26 -3.43 113.70 112.64 2prf s SER 94 Ca 0.00 -1.21 -0.00 0.00 0.48 0.00 0.00 55.95 55.22 2prf s SER 94 Cb 0.00 0.23 0.05 0.00 0.10 0.00 0.00 66.02 66.40 2prf s SER 94 CO 0.00 -0.68 -0.04 -0.63 0.98 0.00 0.00 173.24 172.87 2prf s ILE 95 N -3.91 1.15 1.04 -1.02 1.01 -0.17 -0.52 121.20 118.78 2prf s ILE 95 Ca 0.25 -0.79 -0.11 0.00 0.00 0.00 0.00 60.65 60.00 2prf s ILE 95 Cb 0.07 -1.40 0.21 0.00 0.01 0.00 0.00 42.46 41.36 2prf s ILE 95 CO 0.03 0.02 1.09 -1.48 0.00 0.00 0.00 174.94 174.60 2prf s LEU 96 N 1.59 1.90 -0.40 2.97 2.34 -1.11 -0.93 118.68 125.04 2prf s LEU 96 Ca -0.01 1.91 0.10 0.00 0.06 0.00 0.00 54.13 56.18 2prf s LEU 96 Cb -0.17 -4.06 0.36 0.00 -0.56 0.00 0.00 46.19 41.77 2prf s LEU 96 CO -0.07 -3.68 1.00 0.52 -1.06 0.00 0.00 176.35 173.06 2prf n VAL 97 N -4.60 0.06 -1.56 1.48 0.31 0.39 -3.42 118.33 110.99 2prf n VAL 97 Ca 0.08 -2.74 -0.54 0.00 -0.01 0.00 0.00 64.34 61.13 2prf n VAL 97 Cb 0.53 0.73 -0.07 0.00 -0.91 0.00 0.00 33.84 34.12 2prf n VAL 97 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2prf n GLY 98 N 0.15 0.66 3.69 2.92 0.00 -0.89 -2.46 105.19 109.27 2prf n GLY 98 Ca 0.12 0.95 -0.33 0.00 0.00 0.00 0.00 46.02 46.75 2prf n GLY 98 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2prf s VAL 99 N 5.41 4.25 0.03 1.61 1.01 -0.56 -0.61 120.40 131.54 2prf s VAL 99 Ca 1.05 -0.50 -0.04 0.00 0.00 0.00 0.00 61.98 62.48 2prf s VAL 99 Cb -0.99 -2.87 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 2prf s VAL 99 CO 0.58 0.43 0.07 -0.72 0.00 0.00 0.00 175.10 175.46 2prf s TYR 100 N -1.05 0.20 0.00 5.22 1.13 -1.02 -1.13 117.35 120.71 2prf s TYR 100 Ca 0.18 -0.48 0.00 0.00 -1.41 0.00 0.00 57.07 55.37 2prf s TYR 100 Cb -0.12 -0.15 0.00 0.00 -1.10 0.00 0.00 41.96 40.60 2prf s TYR 100 CO 0.09 -0.32 0.14 0.09 -2.51 0.00 0.00 175.55 173.04 2prf n ASN 101 N 1.01 0.00 0.00 -0.18 3.02 -1.26 -2.97 115.26 114.89 2prf n ASN 101 Ca -0.20 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.35 2prf n ASN 101 Cb 0.57 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.74 2prf n ASN 101 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2prf n GLU 102 N 0.00 0.00 -1.13 3.52 -0.58 -1.22 -4.77 120.64 116.45 2prf n GLU 102 Ca 0.00 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.70 2prf n GLU 102 Cb 0.41 -0.09 -0.05 0.00 -0.57 0.00 0.00 31.44 31.15 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 -1.66 0.00 -1.87 3.49 4.76 -1.25 -4.80 118.16 116.82 2prf n LYS 103 Ca 0.00 -1.25 -0.37 0.00 -2.87 0.00 0.00 58.31 53.83 2prf n LYS 103 Cb 0.00 0.38 0.05 0.00 -1.84 0.00 0.00 35.03 33.61 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 -0.00 2.31 -0.06 -0.18 -1.09 -1.26 -5.00 121.20 115.91 2prf s ILE 104 Ca 0.08 0.20 -0.01 0.00 -2.23 0.00 0.00 60.65 58.69 2prf s ILE 104 Cb 0.10 -3.08 -0.03 0.00 -1.58 0.00 0.00 42.46 37.86 2prf s ILE 104 CO -0.04 -0.03 0.02 -1.10 -1.23 0.00 0.00 174.94 172.55 2prf s GLN 105 N -3.27 2.97 0.53 2.79 1.11 -1.26 -4.79 119.66 117.75 2prf s GLN 105 Ca 0.78 -0.44 0.25 0.00 0.01 0.00 0.00 55.36 55.96 2prf s GLN 105 Cb -0.35 -2.79 1.49 0.00 -1.01 0.00 0.00 33.01 30.35 2prf s GLN 105 CO 0.38 0.69 2.13 -1.00 0.01 0.00 0.00 175.29 177.50 2prf h PRO 106 N 4.87 0.00 -1.16 2.91 0.13 -1.97 -2.22 132.00 134.56 2prf h PRO 106 Ca -0.50 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.14 2prf h PRO 106 Cb 1.19 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.09 2prf h PRO 106 CO 0.56 0.08 0.63 0.41 -0.23 0.00 0.00 178.00 179.44 2prf n GLY 107 N -1.07 4.77 1.25 1.56 0.00 -1.26 -3.49 105.19 106.95 2prf n GLY 107 Ca -0.02 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.48 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 -0.48 0.00 0.07 2.61 -1.04 -0.85 -4.75 114.28 109.83 2prf n THR 108 Ca 0.48 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 62.50 2prf n THR 108 Cb 0.85 -0.27 -0.05 0.00 -1.82 0.00 0.00 70.33 69.05 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 0.65 0.00 2.41 0.00 -1.71 -3.29 119.26 117.32 2prf h ALA 109 Ca 0.00 -0.70 -0.05 0.00 0.00 0.00 0.00 54.91 54.16 2prf h ALA 109 Cb 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2prf h ALA 109 CO 0.00 0.81 -0.31 0.00 0.00 0.00 0.00 179.25 179.75 2prf h ALA 110 N 1.45 0.83 -0.13 0.00 0.00 -1.81 -2.95 119.26 116.65 2prf h ALA 110 Ca -0.11 -0.21 -0.23 0.00 0.00 0.00 0.00 54.91 54.36 2prf h ALA 110 Cb 1.51 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.29 2prf h ALA 110 CO 0.05 0.29 -0.83 -0.97 0.00 0.00 0.00 179.25 177.79 2prf h ASN 111 N 0.00 0.95 1.35 0.00 -1.24 -1.79 -1.62 115.58 113.23 2prf h ASN 111 Ca -0.01 -0.65 -0.06 0.00 0.71 0.00 0.00 56.30 56.30 2prf h ASN 111 Cb 1.18 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.94 2prf h ASN 111 CO 0.03 1.45 -0.28 1.62 -1.29 0.00 0.00 177.43 178.96 2prf h VAL 112 N 0.52 0.55 0.00 2.57 3.04 -1.62 -3.01 116.25 118.29 2prf h VAL 112 Ca -0.07 -1.50 0.00 0.00 -1.01 0.00 0.00 66.70 64.12 2prf h VAL 112 Cb 1.46 2.06 0.00 0.00 -2.01 0.00 0.00 31.29 32.80 2prf h VAL 112 CO 0.17 0.28 -0.53 0.58 -1.01 0.00 0.00 177.57 177.06 2prf h VAL 113 N 0.00 0.00 0.04 1.51 2.07 -1.45 -2.96 116.25 115.45 2prf h VAL 113 Ca -0.00 -0.88 -0.23 0.00 0.82 0.00 0.00 66.70 66.41 2prf h VAL 113 Cb 1.03 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 32.38 2prf h VAL 113 CO 0.04 0.00 -1.07 -0.33 0.02 0.00 0.00 177.57 176.23 2prf h GLU 114 N 0.00 0.08 0.00 1.57 5.08 -1.16 -2.63 114.58 117.52 2prf h GLU 114 Ca 0.00 -0.14 -0.04 0.00 -1.00 0.00 0.00 59.36 58.18 2prf h GLU 114 Cb 0.94 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.23 2prf h GLU 114 CO 0.00 1.06 -0.33 -0.22 -1.00 0.00 0.00 179.01 178.53 2prf h LYS 115 N 0.02 0.00 -0.22 2.33 3.64 -1.62 -3.02 116.57 117.69 2prf h LYS 115 Ca -0.05 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.37 2prf h LYS 115 Cb 1.83 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.64 2prf h LYS 115 CO 0.15 0.49 0.15 1.25 -2.27 0.00 0.00 179.45 179.22 2prf h LEU 116 N -1.00 0.11 -0.75 5.20 6.46 -1.68 0.48 115.31 124.13 2prf h LEU 116 Ca -0.06 -0.00 -0.10 0.00 -0.12 0.00 0.00 57.88 57.60 2prf h LEU 116 Cb 0.64 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.53 2prf h LEU 116 CO -0.04 0.08 -0.46 0.00 -0.62 0.00 0.00 178.44 177.40 2prf h ALA 117 N 1.88 0.92 0.00 1.25 0.00 -1.59 -2.87 119.26 118.85 2prf h ALA 117 Ca 0.10 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 2prf h ALA 117 Cb 0.23 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2prf h ALA 117 CO -0.01 0.58 -0.22 0.22 0.00 0.00 0.00 179.25 179.81 2prf h ASP 118 N 0.00 0.00 0.00 0.00 1.82 -0.76 -0.23 116.42 117.25 2prf h ASP 118 Ca -0.00 0.00 -0.04 0.00 -0.39 0.00 0.00 57.03 56.60 2prf h ASP 118 Cb 1.03 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.03 2prf h ASP 118 CO 0.06 0.22 -0.24 0.22 -1.61 0.00 0.00 179.24 177.88 2prf h TYR 119 N 0.00 0.00 0.00 0.28 5.03 -1.44 -1.79 116.97 119.05 2prf h TYR 119 Ca -0.00 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.29 2prf h TYR 119 Cb 0.50 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.77 2prf h TYR 119 CO 0.00 0.85 -0.10 1.37 -1.32 0.00 0.00 178.16 178.95 2prf h LEU 120 N -1.00 0.00 0.00 2.82 8.10 -1.50 -1.58 115.31 122.15 2prf h LEU 120 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.93 2prf h LEU 120 Cb 0.84 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.06 2prf h LEU 120 CO -0.04 0.10 -0.96 -0.38 -4.11 0.00 0.00 178.44 173.06 2prf n ILE 121 N -3.73 0.47 0.23 0.15 5.41 -0.10 -3.83 119.36 117.96 2prf n ILE 121 Ca -0.02 -0.44 0.14 0.00 1.00 0.00 0.00 62.75 63.43 2prf n ILE 121 Cb 0.21 -0.20 0.75 0.00 -0.71 0.00 0.00 39.64 39.69 2prf n ILE 121 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2prf h GLY 122 N 4.19 0.00 0.00 7.39 0.00 -0.35 -2.93 103.07 111.37 2prf h GLY 122 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2prf h GLY 122 CO 0.00 0.00 -0.52 -1.06 0.00 0.00 0.00 176.54 174.96 2prf n GLN 123 N -2.51 0.42 0.00 4.80 6.02 -1.25 -5.06 117.38 119.81 2prf n GLN 123 Ca -0.02 0.47 0.00 0.00 -0.01 0.00 0.00 57.00 57.44 2prf n GLN 123 Cb 0.11 -1.59 0.00 0.00 1.02 0.00 0.00 30.24 29.78 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 1.61 0.88 0.00 1.08 0.00 -1.11 -5.20 105.19 102.46 2prf n GLY 124 Ca -0.07 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.42 2prf n GLY 124 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29