#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 -0.54 0.00 1.43 7.02 -1.26 -4.68 117.44 119.41 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 0.00 0.00 0.23 -0.99 6.02 -1.26 -2.92 117.38 118.47 2prf n GLN 3 Ca 0.00 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.11 2prf n GLN 3 Cb 0.00 -0.10 0.62 0.00 1.02 0.00 0.00 30.24 31.78 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 0.00 0.06 5.09 2.02 -2.00 0.43 112.91 118.50 2prf h THR 4 Ca 0.00 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 66.87 2prf h THR 4 Cb 0.00 0.51 -0.03 0.00 -1.74 0.00 0.00 68.15 66.88 2prf h THR 4 CO 0.00 0.00 -1.74 1.88 0.37 0.00 0.00 175.52 176.03 2prf h TYR 5 N 0.00 0.22 -0.75 3.16 0.05 -1.98 -3.36 116.97 114.31 2prf h TYR 5 Ca 0.00 -0.16 0.08 0.00 0.05 0.00 0.00 58.73 58.70 2prf h TYR 5 Cb 0.44 -0.01 -0.06 0.00 1.01 0.00 0.00 36.73 38.11 2prf h TYR 5 CO 0.00 1.30 0.42 0.28 -1.05 0.00 0.00 178.16 179.11 2prf h VAL 6 N 0.03 0.94 -0.88 -2.88 2.07 -0.78 -1.95 116.25 112.81 2prf h VAL 6 Ca -0.31 -0.25 -0.45 0.00 0.82 0.00 0.00 66.70 66.51 2prf h VAL 6 Cb 2.01 0.14 -0.17 0.00 -1.52 0.00 0.00 31.29 31.75 2prf h VAL 6 CO 0.10 0.13 0.41 -0.67 0.02 0.00 0.00 177.57 177.57 2prf n ASP 7 N -4.76 6.51 0.00 0.57 -0.08 -1.20 -4.27 116.55 113.32 2prf n ASP 7 Ca 0.11 -3.18 0.00 0.00 -1.51 0.00 0.00 54.79 50.21 2prf n ASP 7 Cb 0.22 -1.17 0.00 0.00 2.34 0.00 0.00 41.12 42.51 2prf n ASP 7 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 2prf n THR 8 N 0.65 0.00 0.00 5.18 -1.04 -0.74 -5.06 114.28 113.27 2prf n THR 8 Ca 0.43 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.44 2prf n THR 8 Cb 0.56 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.07 2prf n THR 8 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2prf n ASN 9 N 0.00 0.00 -0.10 8.00 2.85 -1.22 -4.25 115.26 120.54 2prf n ASN 9 Ca 0.00 0.00 0.10 0.00 -0.11 0.00 0.00 54.58 54.57 2prf n ASN 9 Cb 0.00 -0.35 0.17 0.00 1.24 0.00 0.00 39.78 40.84 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 -2.27 0.09 -0.02 1.20 4.32 -1.25 0.03 117.00 119.10 2prf n LEU 10 Ca 0.00 0.46 -0.00 0.00 -0.02 0.00 0.00 56.01 56.44 2prf n LEU 10 Cb 0.00 -0.22 -0.00 0.00 -1.62 0.00 0.00 43.42 41.58 2prf n LEU 10 CO 0.00 -0.51 -0.02 0.58 -1.22 0.00 0.00 177.39 176.22 2prf h VAL 11 N 0.00 0.00 -1.60 4.08 2.07 -1.74 -2.52 116.25 116.54 2prf h VAL 11 Ca 0.24 -0.31 0.51 0.00 0.82 0.00 0.00 66.70 67.97 2prf h VAL 11 Cb 0.67 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.33 2prf h VAL 11 CO -0.20 0.00 1.09 1.23 0.02 0.00 0.00 177.57 179.70 2prf h GLY 12 N -0.31 0.87 0.00 2.17 0.00 -1.28 -3.09 103.07 101.43 2prf h GLY 12 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.27 2prf h GLY 12 CO 0.00 -0.30 0.00 -0.37 0.00 0.00 0.00 176.54 175.87 2prf n THR 13 N -4.44 0.00 1.21 4.70 5.66 -0.45 -4.74 114.28 116.22 2prf n THR 13 Ca 0.42 0.00 0.02 0.00 -3.05 0.00 0.00 64.05 61.43 2prf n THR 13 Cb 1.73 0.00 0.06 0.00 -1.55 0.00 0.00 70.33 70.57 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 0.51 0.00 1.09 0.00 0.10 -4.49 105.19 102.40 2prf n GLY 14 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.03 0.00 -2.71 4.61 0.00 -1.24 -4.45 120.51 116.69 2prf n ALA 15 Ca 0.04 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.38 2prf n ALA 15 Cb 0.23 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.58 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 0.35 -1.48 0.00 -7.23 -1.18 -4.53 120.40 106.33 2prf s VAL 16 Ca 0.00 -1.23 0.02 0.00 -1.81 0.00 0.00 61.98 58.96 2prf s VAL 16 Cb 0.00 -0.74 0.07 0.00 0.56 0.00 0.00 36.38 36.27 2prf s VAL 16 CO 0.00 -0.58 0.84 0.35 -0.31 0.00 0.00 175.10 175.40 2prf n THR 17 N 1.14 0.17 -0.54 5.32 -2.24 -1.15 -3.02 114.28 113.96 2prf n THR 17 Ca -0.21 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 2prf n THR 17 Cb 0.56 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 2prf n THR 17 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2prf n GLN 18 N -0.12 -3.01 0.00 -0.78 6.02 -0.95 -4.80 117.38 113.74 2prf n GLN 18 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 2prf n GLN 18 Cb 0.19 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.45 2prf n GLN 18 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2prf n ALA 19 N 0.00 0.00 -3.66 -1.58 0.00 -1.22 -3.01 120.51 111.03 2prf n ALA 19 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 2prf n ALA 19 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 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 -1.47 -1.24 0.00 0.00 -1.18 -1.04 121.76 114.83 2prf s ALA 20 Ca 0.00 1.94 -0.14 0.00 0.00 0.00 0.00 51.96 53.76 2prf s ALA 20 Cb 0.00 -1.26 0.15 0.00 0.00 0.00 0.00 23.12 22.01 2prf s ALA 20 CO 0.00 -0.45 1.56 -0.89 0.00 0.00 0.00 175.76 175.98 2prf n ILE 21 N 4.58 4.19 -0.73 0.00 2.08 -0.21 -1.59 119.36 127.69 2prf n ILE 21 Ca -0.19 -4.54 -0.33 0.00 0.56 0.00 0.00 62.75 58.25 2prf n ILE 21 Cb 0.55 -2.44 0.15 0.00 -0.75 0.00 0.00 39.64 37.15 2prf n ILE 21 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 2prf n LEU 22 N 5.93 -1.05 -4.81 1.39 4.32 0.17 -1.39 117.00 121.55 2prf n LEU 22 Ca 0.40 0.13 -0.22 0.00 -0.02 0.00 0.00 56.01 56.29 2prf n LEU 22 Cb 0.42 -1.11 -0.05 0.00 -1.62 0.00 0.00 43.42 41.07 2prf n LEU 22 CO 0.68 -3.38 -0.18 -0.83 -1.22 0.00 0.00 177.39 172.46 2prf s GLY 23 N -1.97 1.45 -0.08 -0.72 0.00 -0.78 -1.29 107.32 103.94 2prf s GLY 23 Ca 0.57 -1.41 0.09 0.00 0.00 0.00 0.00 44.72 43.96 2prf s GLY 23 CO 0.67 -1.45 0.07 1.04 0.00 0.00 0.00 173.10 173.42 2prf n LEU 24 N -1.08 0.00 -0.14 0.66 4.32 -1.26 -4.50 117.00 114.99 2prf n LEU 24 Ca -0.08 0.00 0.01 0.00 -0.02 0.00 0.00 56.01 55.93 2prf n LEU 24 Cb 0.58 0.19 0.03 0.00 -1.62 0.00 0.00 43.42 42.59 2prf n LEU 24 CO 0.43 0.19 0.45 -0.67 -1.22 0.00 0.00 177.39 176.56 2prf n ASP 25 N -2.25 1.87 0.00 -1.43 2.03 -1.26 -4.93 116.55 110.57 2prf n ASP 25 Ca -0.13 -1.68 0.00 0.00 0.52 0.00 0.00 54.79 53.50 2prf n ASP 25 Cb 0.70 -0.04 0.00 0.00 -0.72 0.00 0.00 41.12 41.07 2prf n ASP 25 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2prf n GLY 26 N -0.10 0.28 0.64 0.27 0.00 -1.26 -5.10 105.19 99.92 2prf n GLY 26 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.33 0.00 -3.59 1.61 0.23 -1.26 -4.96 115.26 106.95 2prf n ASN 27 Ca 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 54.58 54.04 2prf n ASN 27 Cb 0.00 0.16 -0.06 0.00 -2.08 0.00 0.00 39.78 37.80 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 -1.66 -0.10 -0.13 5.53 2.01 -1.26 -1.86 115.64 118.18 2prf s THR 28 Ca 0.00 0.00 -0.08 0.00 0.31 0.00 0.00 61.69 61.92 2prf s THR 28 Cb 0.00 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.46 2prf s THR 28 CO 0.00 0.00 0.04 -0.50 -0.69 0.00 0.00 174.62 173.47 2prf h TRP 29 N 6.26 0.00 -3.85 4.92 4.06 -1.42 -3.44 115.95 122.48 2prf h TRP 29 Ca -0.25 0.00 -0.34 0.00 2.06 0.00 0.00 58.89 60.36 2prf h TRP 29 Cb 1.17 0.00 -0.15 0.00 -1.00 0.00 0.00 29.16 29.19 2prf h TRP 29 CO 0.14 0.23 -0.62 0.00 -3.56 0.00 0.00 178.44 174.63 2prf s ALA 30 N -2.56 1.66 0.32 1.49 0.00 -1.22 -5.01 121.76 116.45 2prf s ALA 30 Ca -0.09 -1.84 -0.19 0.00 0.00 0.00 0.00 51.96 49.84 2prf s ALA 30 Cb 0.01 1.06 0.04 0.00 0.00 0.00 0.00 23.12 24.23 2prf s ALA 30 CO 0.19 -0.47 0.77 -0.08 0.00 0.00 0.00 175.76 176.18 2prf s THR 31 N -3.79 0.00 -0.30 0.00 -1.32 -1.26 -1.04 115.64 107.93 2prf s THR 31 Ca 0.37 -0.98 0.03 0.00 -1.21 0.00 0.00 61.69 59.91 2prf s THR 31 Cb 0.08 -2.45 0.17 0.00 -1.51 0.00 0.00 72.50 68.79 2prf s THR 31 CO 0.13 0.00 0.46 -0.44 -2.21 0.00 0.00 174.62 172.56 2prf s SER 32 N -3.01 -0.16 0.13 8.08 0.01 -0.21 -4.93 113.70 113.61 2prf s SER 32 Ca 0.13 -0.28 0.00 0.00 1.31 0.00 0.00 55.95 57.11 2prf s SER 32 Cb -0.05 1.35 0.00 0.00 0.21 0.00 0.00 66.02 67.53 2prf s SER 32 CO 0.09 -0.33 0.00 0.00 0.41 0.00 0.00 173.24 173.41 2prf n ALA 33 N 5.32 0.00 0.00 1.44 0.00 -1.26 -3.45 120.51 122.55 2prf n ALA 33 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2prf n ALA 33 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 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 0.20 3.94 0.00 0.00 -1.26 -4.69 105.19 103.37 2prf n GLY 34 Ca 0.00 -1.41 -0.19 0.00 0.00 0.00 0.00 46.02 44.42 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 0.00 2.80 -0.32 1.61 -0.12 -1.26 -5.08 117.98 115.61 2prf s PHE 35 Ca 0.00 -0.42 -0.15 0.00 -0.05 0.00 0.00 56.93 56.31 2prf s PHE 35 Cb 0.00 -2.22 -0.02 0.00 -0.63 0.00 0.00 43.02 40.15 2prf s PHE 35 CO 0.00 -0.21 0.39 0.00 -0.05 0.00 0.00 175.22 175.34 2prf s ALA 36 N -2.39 3.51 -0.17 1.99 0.00 -1.26 -5.04 121.76 118.41 2prf s ALA 36 Ca 0.50 -1.06 -0.29 0.00 0.00 0.00 0.00 51.96 51.11 2prf s ALA 36 Cb -0.07 -2.81 -0.00 0.00 0.00 0.00 0.00 23.12 20.24 2prf s ALA 36 CO 0.30 -0.96 1.05 0.08 0.00 0.00 0.00 175.76 176.23 2prf s VAL 37 N 2.09 4.66 0.11 0.00 1.01 -1.26 -4.89 120.40 122.12 2prf s VAL 37 Ca 0.14 1.98 -0.30 0.00 0.00 0.00 0.00 61.98 63.79 2prf s VAL 37 Cb -0.16 -4.27 -0.06 0.00 0.00 0.00 0.00 36.38 31.88 2prf s VAL 37 CO 0.11 -0.10 1.12 -0.89 0.00 0.00 0.00 175.10 175.34 2prf s THR 38 N 2.74 4.07 1.24 3.92 2.01 -1.26 -5.01 115.64 123.34 2prf s THR 38 Ca 0.47 1.62 -0.15 0.00 0.31 0.00 0.00 61.69 63.94 2prf s THR 38 Cb -0.17 -4.04 0.30 0.00 0.01 0.00 0.00 72.50 68.60 2prf s THR 38 CO 0.12 0.20 0.89 -2.65 -0.69 0.00 0.00 174.62 172.49 2prf n PRO 39 N 3.15 -2.90 0.00 4.92 -0.01 -1.26 -3.34 135.00 135.56 2prf n PRO 39 Ca 0.05 -0.83 0.00 0.00 -0.01 0.00 0.00 63.50 62.72 2prf n PRO 39 Cb 0.47 -2.07 0.00 0.00 -0.01 0.00 0.00 33.50 31.89 2prf n PRO 39 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 2prf n ALA 40 N -5.12 0.00 0.16 3.55 0.00 -1.26 -4.60 120.51 113.24 2prf n ALA 40 Ca 0.03 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.48 2prf n ALA 40 Cb 0.55 0.00 0.29 0.00 0.00 0.00 0.00 19.45 20.29 2prf n ALA 40 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2prf h GLN 41 N 0.00 0.04 -0.73 0.00 7.50 -1.97 -2.53 115.11 117.42 2prf h GLN 41 Ca 0.00 -0.02 0.17 0.00 0.50 0.00 0.00 58.65 59.30 2prf h GLN 41 Cb 0.00 -0.00 -0.04 0.00 0.05 0.00 0.00 27.48 27.49 2prf h GLN 41 CO 0.00 0.48 0.50 0.78 -1.50 0.00 0.00 178.83 179.09 2prf h GLY 42 N 1.31 0.47 1.31 3.46 0.00 -1.81 0.31 103.07 108.11 2prf h GLY 42 Ca -0.00 -0.11 -0.10 0.00 0.00 0.00 0.00 47.33 47.11 2prf h GLY 42 CO 0.06 0.03 -0.15 -1.61 0.00 0.00 0.00 176.54 174.87 2prf h GLN 43 N 0.26 0.81 0.00 4.80 4.15 -1.84 -2.12 115.11 121.18 2prf h GLN 43 Ca 0.36 -0.29 -0.04 0.00 0.77 0.00 0.00 58.65 59.44 2prf h GLN 43 Cb 1.02 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.65 2prf h GLN 43 CO -0.08 0.91 -0.19 1.15 -1.93 0.00 0.00 178.83 178.69 2prf h THR 44 N 0.72 1.12 -0.29 2.39 2.02 -0.49 -1.97 112.91 116.42 2prf h THR 44 Ca 0.11 -0.64 -0.17 0.00 0.77 0.00 0.00 66.41 66.48 2prf h THR 44 Cb 0.65 1.35 -0.00 0.00 -1.74 0.00 0.00 68.15 68.41 2prf h THR 44 CO 0.05 0.18 -0.51 0.25 0.37 0.00 0.00 175.52 175.86 2prf h LEU 45 N 0.00 0.90 -0.21 2.58 5.85 -0.86 -1.54 115.31 122.02 2prf h LEU 45 Ca -0.00 -0.46 -0.02 0.00 0.84 0.00 0.00 57.88 58.23 2prf h LEU 45 Cb 0.33 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2prf h LEU 45 CO 0.02 1.24 0.04 0.00 -0.34 0.00 0.00 178.44 179.41 2prf h ALA 46 N 0.78 0.28 0.00 1.25 0.00 -0.98 -2.38 119.26 118.21 2prf h ALA 46 Ca 0.02 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 2prf h ALA 46 Cb 1.10 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2prf h ALA 46 CO 0.11 -0.05 -0.14 0.66 0.00 0.00 0.00 179.25 179.83 2prf h SER 47 N 0.15 0.00 -0.90 0.00 4.64 -1.36 -2.52 113.55 113.56 2prf h SER 47 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2prf h SER 47 Cb 0.31 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.36 2prf h SER 47 CO 0.00 0.14 0.58 0.00 -0.87 0.00 0.00 176.83 176.68 2prf h ALA 48 N 1.86 1.15 -0.57 5.18 0.00 -0.73 -3.34 119.26 122.80 2prf h ALA 48 Ca -0.00 -0.08 -0.28 0.00 0.00 0.00 0.00 54.91 54.55 2prf h ALA 48 Cb 0.41 -0.37 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 2prf h ALA 48 CO 0.02 0.57 0.81 -0.06 0.00 0.00 0.00 179.25 180.59 2prf s PHE 49 N -6.06 1.81 0.24 0.00 0.08 -0.95 -4.17 117.98 108.93 2prf s PHE 49 Ca -0.13 0.70 0.00 0.00 0.12 0.00 0.00 56.93 57.62 2prf s PHE 49 Cb 0.17 -3.97 0.00 0.00 -0.57 0.00 0.00 43.02 38.65 2prf s PHE 49 CO 0.81 -1.47 0.00 0.09 -0.10 0.00 0.00 175.22 174.55 2prf n ASN 50 N 14.60 -1.34 -0.39 1.36 4.13 -1.25 -4.97 115.26 127.39 2prf n ASN 50 Ca 0.42 0.43 0.02 0.00 1.68 0.00 0.00 54.58 57.13 2prf n ASN 50 Cb 0.47 1.41 0.02 0.00 -1.54 0.00 0.00 39.78 40.13 2prf n ASN 50 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 2prf n ASN 51 N -3.10 0.39 -2.02 6.41 2.85 -1.26 -4.97 115.26 113.56 2prf n ASN 51 Ca 0.00 -2.10 -0.02 0.00 -0.11 0.00 0.00 54.58 52.35 2prf n ASN 51 Cb 0.00 -0.22 -0.00 0.00 1.24 0.00 0.00 39.78 40.80 2prf n ASN 51 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2prf n ALA 52 N -0.23 -0.66 -0.07 5.20 0.00 -1.26 -4.75 120.51 118.75 2prf n ALA 52 Ca 0.02 0.02 -0.10 0.00 0.00 0.00 0.00 53.44 53.39 2prf n ALA 52 Cb 0.67 -0.59 -0.08 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00 0.00 0.21 0.00 1.82 -1.93 -1.76 116.42 114.75 2prf h ASP 53 Ca -0.05 -0.61 -0.01 0.00 -0.39 0.00 0.00 57.03 55.97 2prf h ASP 53 Cb 0.74 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.75 2prf h ASP 53 CO 0.06 0.86 -0.03 -0.65 -1.61 0.00 0.00 179.24 177.87 2prf h PRO 54 N -1.00 0.00 0.00 0.28 0.11 -1.90 -2.78 132.00 126.71 2prf h PRO 54 Ca -0.02 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.81 2prf h PRO 54 Cb 0.68 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.74 2prf h PRO 54 CO -0.01 0.03 -1.67 -0.89 -0.21 0.00 0.00 178.00 175.25 2prf n ILE 55 N -3.41 1.52 -0.23 4.15 5.41 -1.25 -4.07 119.36 121.48 2prf n ILE 55 Ca -0.02 -0.13 0.31 0.00 1.00 0.00 0.00 62.75 63.91 2prf n ILE 55 Cb 0.14 -2.04 0.64 0.00 -0.71 0.00 0.00 39.64 37.67 2prf n ILE 55 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 2prf h ARG 56 N -1.00 0.00 0.00 0.38 2.43 -1.26 -3.37 114.38 111.56 2prf h ARG 56 Ca -0.43 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 2prf h ARG 56 Cb 1.33 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.88 2prf h ARG 56 CO -0.26 0.00 0.00 0.00 -1.51 0.00 0.00 179.97 178.20 2prf n ALA 57 N -2.48 0.00 -0.22 2.80 0.00 -1.06 -4.91 120.51 114.65 2prf n ALA 57 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2prf n ALA 57 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.76 2prf n ALA 57 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2prf n SER 58 N -0.80 0.00 0.00 0.00 7.64 -1.26 -4.73 113.62 114.47 2prf n SER 58 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2prf n SER 58 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2prf n SER 58 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2prf n GLY 59 N 0.00 0.34 3.85 0.23 0.00 -1.26 -4.99 105.19 103.36 2prf n GLY 59 Ca 0.00 -1.15 -0.32 0.00 0.00 0.00 0.00 46.02 44.55 2prf n GLY 59 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2prf s PHE 60 N -2.00 3.49 -0.28 1.61 5.36 -1.00 -4.81 117.98 120.34 2prf s PHE 60 Ca 0.00 1.41 0.02 0.00 -0.96 0.00 0.00 56.93 57.40 2prf s PHE 60 Cb 0.00 -2.76 0.17 0.00 -0.34 0.00 0.00 43.02 40.09 2prf s PHE 60 CO 0.00 -0.42 0.45 -0.51 -1.46 0.00 0.00 175.22 173.29 2prf s ASP 61 N -3.29 -0.14 0.02 6.13 1.01 -1.26 -2.95 116.67 116.19 2prf s ASP 61 Ca 0.58 -0.12 0.00 0.00 0.71 0.00 0.00 52.55 53.72 2prf s ASP 61 Cb -0.10 1.36 0.00 0.00 1.01 0.00 0.00 42.92 45.18 2prf s ASP 61 CO 0.36 -0.33 0.00 0.18 0.21 0.00 0.00 175.17 175.58 2prf n LEU 62 N 5.37 0.00 -4.56 1.23 7.99 -0.97 -4.92 117.00 121.15 2prf n LEU 62 Ca 0.01 0.00 -0.24 0.00 -0.01 0.00 0.00 56.01 55.77 2prf n LEU 62 Cb 0.50 0.00 -0.05 0.00 -0.11 0.00 0.00 43.42 43.76 2prf n LEU 62 CO -0.01 -0.15 1.53 0.00 -1.51 0.00 0.00 177.39 177.24 2prf s ALA 63 N -2.13 1.17 -1.13 -1.18 0.00 -1.26 -2.86 121.76 114.38 2prf s ALA 63 Ca 0.00 -0.57 -0.01 0.00 0.00 0.00 0.00 51.96 51.38 2prf s ALA 63 Cb 0.00 -4.48 -0.01 0.00 0.00 0.00 0.00 23.12 18.62 2prf s ALA 63 CO 0.00 -5.22 0.95 0.41 0.00 0.00 0.00 175.76 171.89 2prf n GLY 64 N 6.48 -0.48 3.23 0.00 0.00 -1.26 -4.89 105.19 108.27 2prf n GLY 64 Ca 0.41 0.17 -0.12 0.00 0.00 0.00 0.00 46.02 46.48 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 -3.35 -0.01 -0.63 1.61 1.01 -1.13 -5.11 120.40 112.79 2prf s VAL 65 Ca 0.09 0.04 -0.05 0.00 0.00 0.00 0.00 61.98 62.06 2prf s VAL 65 Cb -0.01 -0.52 0.16 0.00 0.00 0.00 0.00 36.38 36.01 2prf s VAL 65 CO 0.70 0.02 0.46 -1.00 0.00 0.00 0.00 175.10 175.28 2prf s HIS 66 N 0.63 3.48 0.00 5.22 3.76 -1.26 -2.28 115.29 124.83 2prf s HIS 66 Ca -0.04 -2.52 0.00 0.00 -0.15 0.00 0.00 55.06 52.35 2prf s HIS 66 Cb -0.05 -3.32 0.00 0.00 1.11 0.00 0.00 32.58 30.32 2prf s HIS 66 CO -0.04 -0.89 0.00 0.66 -0.85 0.00 0.00 174.74 173.62 2prf n TYR 67 N 3.75 -2.43 -4.47 1.40 4.02 -1.15 -4.97 117.16 113.30 2prf n TYR 67 Ca 0.07 0.00 -0.24 0.00 -0.01 0.00 0.00 57.90 57.72 2prf n TYR 67 Cb 0.40 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.63 2prf n TYR 67 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2prf s VAL 68 N 1.10 0.60 -0.43 -0.72 0.11 -1.00 -2.39 120.40 117.68 2prf s VAL 68 Ca 0.00 -2.00 0.08 0.00 -2.93 0.00 0.00 61.98 57.13 2prf s VAL 68 Cb 0.00 -2.43 0.26 0.00 -1.53 0.00 0.00 36.38 32.68 2prf s VAL 68 CO 0.00 0.00 0.57 0.41 -3.33 0.00 0.00 175.10 172.75 2prf n THR 69 N -0.82 -0.16 1.37 5.04 -1.04 -1.26 -3.89 114.28 113.52 2prf n THR 69 Ca -0.04 -4.24 0.12 0.00 -2.04 0.00 0.00 64.05 57.85 2prf n THR 69 Cb 0.65 -1.89 0.46 0.00 -1.82 0.00 0.00 70.33 67.72 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 1.25 1.56 -3.08 -4.42 7.94 -1.26 -4.34 117.00 114.65 2prf n LEU 70 Ca 0.23 -0.59 -0.20 0.00 -1.11 0.00 0.00 56.01 54.34 2prf n LEU 70 Cb 0.52 -0.05 -0.04 0.00 0.53 0.00 0.00 43.42 44.37 2prf n LEU 70 CO 0.22 0.29 -0.17 -1.14 -1.11 0.00 0.00 177.39 175.48 2prf n ARG 71 N 0.23 0.74 -3.92 1.96 0.63 -1.26 -5.06 116.66 109.98 2prf n ARG 71 Ca 0.18 -2.86 -0.31 0.00 -0.92 0.00 0.00 57.85 53.93 2prf n ARG 71 Cb 0.34 -1.28 -0.13 0.00 0.45 0.00 0.00 32.46 31.83 2prf n ARG 71 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2prf s ALA 72 N -0.75 3.29 0.08 5.13 0.00 -1.26 -3.05 121.76 125.20 2prf s ALA 72 Ca 0.34 -3.16 0.00 0.00 0.00 0.00 0.00 51.96 49.15 2prf s ALA 72 Cb 0.19 -2.22 0.00 0.00 0.00 0.00 0.00 23.12 21.09 2prf s ALA 72 CO -0.14 -1.98 0.00 -0.25 0.00 0.00 0.00 175.76 173.39 2prf n ASP 73 N 3.36 0.00 -2.39 0.00 8.00 -1.24 -4.98 116.55 119.30 2prf n ASP 73 Ca 0.05 -0.28 -0.35 0.00 0.71 0.00 0.00 54.79 54.92 2prf n ASP 73 Cb 0.35 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.52 2prf n ASP 73 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2prf n ASP 74 N -0.84 7.49 0.07 -2.24 2.03 -1.26 -4.50 116.55 117.30 2prf n ASP 74 Ca 0.00 -3.79 0.00 0.00 0.52 0.00 0.00 54.79 51.52 2prf n ASP 74 Cb 0.00 -0.95 0.00 0.00 -0.72 0.00 0.00 41.12 39.45 2prf n ASP 74 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 2prf n ARG 75 N -0.85 0.00 -4.43 -0.67 0.63 -1.26 -5.12 116.66 104.96 2prf n ARG 75 Ca 0.60 0.00 -0.20 0.00 -0.92 0.00 0.00 57.85 57.33 2prf n ARG 75 Cb 0.63 0.00 -0.15 0.00 0.45 0.00 0.00 32.46 33.38 2prf n ARG 75 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 2prf s SER 76 N -3.44 1.26 -1.09 6.15 0.01 -1.26 -4.38 113.70 110.95 2prf s SER 76 Ca 0.00 -0.20 -0.06 0.00 1.31 0.00 0.00 55.95 57.01 2prf s SER 76 Cb 0.00 -0.30 0.30 0.00 0.21 0.00 0.00 66.02 66.23 2prf s SER 76 CO 0.00 0.08 1.38 -0.38 0.41 0.00 0.00 173.24 174.74 2prf n ILE 77 N 3.18 5.13 -2.94 1.44 5.41 -0.09 -3.71 119.36 127.78 2prf n ILE 77 Ca -0.17 -5.78 -0.44 0.00 1.00 0.00 0.00 62.75 57.36 2prf n ILE 77 Cb 0.55 -2.22 -0.01 0.00 -0.71 0.00 0.00 39.64 37.25 2prf n ILE 77 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 2prf s TYR 78 N -2.35 3.42 0.74 1.39 6.14 -1.17 -2.31 117.35 123.21 2prf s TYR 78 Ca 0.31 -1.98 -0.04 0.00 0.64 0.00 0.00 57.07 56.00 2prf s TYR 78 Cb 0.01 -4.31 0.12 0.00 0.42 0.00 0.00 41.96 38.20 2prf s TYR 78 CO 0.05 -1.42 1.03 0.20 0.64 0.00 0.00 175.55 176.06 2prf s GLY 79 N 3.00 1.76 0.03 8.97 0.00 -1.04 -4.32 107.32 115.71 2prf s GLY 79 Ca 0.41 -1.49 -0.00 0.00 0.00 0.00 0.00 44.72 43.63 2prf s GLY 79 CO -0.02 -0.94 0.04 0.28 0.00 0.00 0.00 173.10 172.46 2prf n LYS 80 N -2.96 0.06 -0.64 2.90 5.02 -1.25 -3.05 118.16 118.23 2prf n LYS 80 Ca 0.13 -0.21 -0.03 0.00 -2.02 0.00 0.00 58.31 56.19 2prf n LYS 80 Cb 0.60 0.21 -0.03 0.00 -0.02 0.00 0.00 35.03 35.79 2prf n LYS 80 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2prf n LYS 81 N -0.04 0.00 0.00 1.97 0.00 0.19 -2.36 118.16 117.91 2prf n LYS 81 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 58.31 57.92 2prf n LYS 81 Cb 0.04 0.25 0.00 0.00 0.00 0.00 0.00 35.03 35.33 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 2.31 0.14 3.14 0.00 -1.26 -3.86 105.19 105.66 2prf n GLY 82 Ca -0.11 0.04 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 2prf n GLY 82 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2prf h SER 83 N 0.00 0.69 -3.09 1.61 0.02 -1.97 -3.45 113.55 107.36 2prf h SER 83 Ca 0.00 -0.83 -0.47 0.00 -0.84 0.00 0.00 61.79 59.65 2prf h SER 83 Cb 0.00 -0.23 -0.14 0.00 0.14 0.00 0.00 62.40 62.17 2prf h SER 83 CO 0.00 1.66 -0.68 0.00 -1.14 0.00 0.00 176.83 176.68 2prf s ALA 84 N -2.60 2.24 0.19 3.77 0.00 -1.25 0.26 121.76 124.36 2prf s ALA 84 Ca -0.10 -1.86 -0.22 0.00 0.00 0.00 0.00 51.96 49.78 2prf s ALA 84 Cb 0.05 0.21 0.05 0.00 0.00 0.00 0.00 23.12 23.44 2prf s ALA 84 CO 0.91 -0.09 0.60 0.20 0.00 0.00 0.00 175.76 177.38 2prf s GLY 85 N -3.41 -0.43 0.13 0.00 0.00 -1.22 0.54 107.32 102.92 2prf s GLY 85 Ca 0.29 0.22 0.09 0.00 0.00 0.00 0.00 44.72 45.31 2prf s GLY 85 CO 0.11 0.03 -0.22 0.54 0.00 0.00 0.00 173.10 173.57 2prf s VAL 86 N -3.80 1.88 -0.50 1.40 0.11 -1.17 -3.16 120.40 115.16 2prf s VAL 86 Ca 0.04 -1.70 0.03 0.00 -2.93 0.00 0.00 61.98 57.42 2prf s VAL 86 Cb -0.02 -1.74 0.14 0.00 -1.53 0.00 0.00 36.38 33.23 2prf s VAL 86 CO -0.08 -0.09 0.27 -0.63 -3.33 0.00 0.00 175.10 171.24 2prf s ILE 87 N -1.37 2.03 -0.18 7.04 1.01 0.32 -2.50 121.20 127.56 2prf s ILE 87 Ca 0.11 -3.05 -0.06 0.00 0.00 0.00 0.00 60.65 57.65 2prf s ILE 87 Cb -0.09 -2.41 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 2prf s ILE 87 CO 0.05 -0.87 0.03 0.42 0.00 0.00 0.00 174.94 174.57 2prf s THR 88 N -0.10 4.44 0.01 2.92 -4.23 -0.98 -1.25 115.64 116.45 2prf s THR 88 Ca 0.18 -0.16 -0.08 0.00 -1.18 0.00 0.00 61.69 60.46 2prf s THR 88 Cb -0.23 -2.99 0.00 0.00 1.34 0.00 0.00 72.50 70.63 2prf s THR 88 CO -0.02 0.47 0.15 0.68 -0.54 0.00 0.00 174.62 175.36 2prf s VAL 89 N 0.44 0.09 -0.25 2.29 -7.23 -1.21 -0.91 120.40 113.62 2prf s VAL 89 Ca 0.01 -0.73 -0.13 0.00 -1.81 0.00 0.00 61.98 59.31 2prf s VAL 89 Cb -0.13 -0.54 -0.04 0.00 0.56 0.00 0.00 36.38 36.22 2prf s VAL 89 CO 0.01 -0.40 0.28 -0.54 -0.31 0.00 0.00 175.10 174.14 2prf s LYS 90 N -1.62 4.05 -0.15 4.82 1.02 -1.26 -1.75 119.74 124.85 2prf s LYS 90 Ca -0.13 -0.09 -0.11 0.00 0.02 0.00 0.00 55.97 55.66 2prf s LYS 90 Cb -0.06 -3.60 -0.06 0.00 -0.52 0.00 0.00 37.83 33.59 2prf s LYS 90 CO 0.01 -0.10 -0.11 0.25 -0.92 0.00 0.00 175.35 174.47 2prf n THR 91 N 4.68 1.44 0.00 2.17 -2.24 -1.22 -5.00 114.28 114.10 2prf n THR 91 Ca -0.11 0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2prf n THR 91 Cb 0.51 -2.33 0.00 0.00 -2.10 0.00 0.00 70.33 66.42 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 -4.58 0.00 -1.23 3.42 2.88 -1.26 -4.78 113.62 108.06 2prf n SER 92 Ca -0.12 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.43 2prf n SER 92 Cb 0.34 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.80 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 -0.52 0.00 -3.79 -1.46 5.02 -1.26 -5.11 118.16 111.03 2prf n LYS 93 Ca 0.00 -1.57 -0.07 0.00 -2.02 0.00 0.00 58.31 54.65 2prf n LYS 93 Cb 0.00 0.07 -0.02 0.00 -0.02 0.00 0.00 35.03 35.06 2prf n LYS 93 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2prf s SER 94 N -1.57 -0.28 -0.12 4.39 0.01 -1.26 -4.72 113.70 110.16 2prf s SER 94 Ca 0.21 -0.51 0.01 0.00 1.31 0.00 0.00 55.95 56.97 2prf s SER 94 Cb 0.24 0.67 0.02 0.00 0.21 0.00 0.00 66.02 67.15 2prf s SER 94 CO -0.10 -1.22 -0.14 -0.63 0.41 0.00 0.00 173.24 171.55 2prf s ILE 95 N -3.78 1.48 0.51 1.44 1.01 -0.41 -3.46 121.20 117.98 2prf s ILE 95 Ca 0.10 -0.61 -0.14 0.00 0.00 0.00 0.00 60.65 60.00 2prf s ILE 95 Cb -0.05 -1.37 -0.07 0.00 0.01 0.00 0.00 42.46 40.99 2prf s ILE 95 CO 0.04 0.44 0.94 -0.22 0.00 0.00 0.00 174.94 176.14 2prf s LEU 96 N 1.15 3.61 -0.39 2.97 2.96 -0.72 0.44 118.68 128.70 2prf s LEU 96 Ca -0.03 1.44 0.11 0.00 -0.22 0.00 0.00 54.13 55.42 2prf s LEU 96 Cb -0.14 -4.38 0.38 0.00 0.50 0.00 0.00 46.19 42.55 2prf s LEU 96 CO -0.04 -0.59 1.08 0.52 -1.32 0.00 0.00 176.35 176.00 2prf n VAL 97 N -1.71 0.19 -1.58 1.68 0.31 -0.62 -3.31 118.33 113.29 2prf n VAL 97 Ca 0.05 -2.48 -0.47 0.00 -0.01 0.00 0.00 64.34 61.44 2prf n VAL 97 Cb 0.54 0.81 -0.05 0.00 -0.91 0.00 0.00 33.84 34.23 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 -0.04 1.05 3.36 2.92 0.00 -0.38 -3.08 105.19 109.02 2prf n GLY 98 Ca 0.08 0.86 -0.35 0.00 0.00 0.00 0.00 46.02 46.61 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 6.42 3.49 0.39 1.61 1.01 -1.17 -0.52 120.40 131.63 2prf s VAL 99 Ca 1.00 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 62.56 2prf s VAL 99 Cb -0.62 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.17 2prf s VAL 99 CO 0.45 0.44 0.15 -0.72 0.00 0.00 0.00 175.10 175.43 2prf s TYR 100 N 1.16 1.77 0.00 5.22 1.13 -1.19 -2.23 117.35 123.21 2prf s TYR 100 Ca 0.02 -1.35 0.00 0.00 -1.41 0.00 0.00 57.07 54.33 2prf s TYR 100 Cb -0.14 -1.08 0.00 0.00 -1.10 0.00 0.00 41.96 39.64 2prf s TYR 100 CO -0.01 -0.40 0.00 0.09 -2.51 0.00 0.00 175.55 172.73 2prf n ASN 101 N -1.33 1.83 0.23 -0.18 4.13 -1.26 -3.43 115.26 115.24 2prf n ASN 101 Ca -0.04 -0.74 0.16 0.00 1.68 0.00 0.00 54.58 55.64 2prf n ASN 101 Cb 0.65 0.00 0.68 0.00 -1.54 0.00 0.00 39.78 39.56 2prf n ASN 101 CO 0.00 0.00 0.00 1.05 0.28 0.00 0.00 177.26 178.59 2prf h GLU 102 N 0.00 0.00 0.00 3.52 4.11 0.32 -2.31 114.58 120.22 2prf h GLU 102 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2prf h GLU 102 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2prf h GLU 102 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 179.01 180.71 2prf n LYS 103 N -2.73 0.03 -4.35 1.06 5.02 -1.26 -4.64 118.16 111.29 2prf n LYS 103 Ca 0.00 0.43 -0.20 0.00 -2.02 0.00 0.00 58.31 56.53 2prf n LYS 103 Cb 0.23 -1.59 -0.10 0.00 -0.02 0.00 0.00 35.03 33.55 2prf n LYS 103 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2prf s ILE 104 N -3.09 1.82 0.06 -0.18 1.01 -0.87 -5.14 121.20 114.80 2prf s ILE 104 Ca 0.02 -2.14 -0.01 0.00 0.00 0.00 0.00 60.65 58.53 2prf s ILE 104 Cb 0.05 -2.00 -0.04 0.00 0.01 0.00 0.00 42.46 40.48 2prf s ILE 104 CO 0.14 -0.50 -0.03 -1.10 0.00 0.00 0.00 174.94 173.45 2prf s GLN 105 N -3.38 0.64 1.05 2.79 -0.21 -1.26 -4.83 119.66 114.45 2prf s GLN 105 Ca 0.21 -1.23 -0.14 0.00 0.02 0.00 0.00 55.36 54.22 2prf s GLN 105 Cb -0.03 0.17 0.15 0.00 1.00 0.00 0.00 33.01 34.31 2prf s GLN 105 CO 0.07 -0.10 0.66 -2.30 -2.12 0.00 0.00 175.29 171.50 2prf n PRO 106 N 0.09 -1.30 0.00 2.91 -0.02 -1.26 -3.52 135.00 131.90 2prf n PRO 106 Ca -0.14 -0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.00 2prf n PRO 106 Cb 0.61 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 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 1.21 3.08 0.70 -1.23 0.00 -1.26 -4.73 105.19 102.96 2prf n GLY 107 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.40 0.34 0.20 2.61 -1.04 -1.23 -4.25 114.28 110.51 2prf n THR 108 Ca 0.00 -0.09 0.12 0.00 -2.04 0.00 0.00 64.05 62.03 2prf n THR 108 Cb 0.00 -1.46 0.07 0.00 -1.82 0.00 0.00 70.33 67.11 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 -0.19 0.63 0.00 2.41 0.00 -1.80 -3.09 119.26 117.22 2prf h ALA 109 Ca -0.15 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.65 2prf h ALA 109 Cb 1.15 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 2prf h ALA 109 CO -0.09 0.00 -0.62 0.00 0.00 0.00 0.00 179.25 178.54 2prf h ALA 110 N 2.07 0.12 -0.60 0.00 0.00 -1.84 -3.17 119.26 115.84 2prf h ALA 110 Ca 0.00 -0.77 -0.00 0.00 0.00 0.00 0.00 54.91 54.13 2prf h ALA 110 Cb 0.96 0.39 -0.03 0.00 0.00 0.00 0.00 17.79 19.11 2prf h ALA 110 CO 0.00 0.37 0.36 -2.95 0.00 0.00 0.00 179.25 177.03 2prf h ASN 111 N -1.00 0.71 -0.41 0.00 -1.07 -1.74 -1.73 115.58 110.34 2prf h ASN 111 Ca -0.16 -0.04 -0.07 0.00 0.07 0.00 0.00 56.30 56.10 2prf h ASN 111 Cb 0.99 -0.18 -0.02 0.00 -2.07 0.00 0.00 38.32 37.04 2prf h ASN 111 CO -0.09 0.55 -0.00 1.62 0.07 0.00 0.00 177.43 179.57 2prf h VAL 112 N 0.82 1.24 0.00 6.14 3.04 -1.68 -1.71 116.25 124.10 2prf h VAL 112 Ca 0.22 -1.01 0.00 0.00 -1.01 0.00 0.00 66.70 64.89 2prf h VAL 112 Cb -0.03 0.88 0.00 0.00 -2.01 0.00 0.00 31.29 30.13 2prf h VAL 112 CO -0.04 0.36 0.00 0.58 -1.01 0.00 0.00 177.57 177.46 2prf h VAL 113 N 0.75 0.00 -0.00 1.51 2.07 -1.30 -1.53 116.25 117.75 2prf h VAL 113 Ca 0.14 -0.41 -0.14 0.00 0.82 0.00 0.00 66.70 67.12 2prf h VAL 113 Cb 0.46 1.28 0.01 0.00 -1.52 0.00 0.00 31.29 31.52 2prf h VAL 113 CO 0.02 0.00 -0.55 -0.33 0.02 0.00 0.00 177.57 176.73 2prf h GLU 114 N 0.00 0.37 0.06 1.57 3.07 -0.75 -2.97 114.58 115.93 2prf h GLU 114 Ca 0.00 -0.40 -0.18 0.00 -0.50 0.00 0.00 59.36 58.28 2prf h GLU 114 Cb 0.55 0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.56 2prf h GLU 114 CO 0.00 1.08 -0.95 1.57 -1.40 0.00 0.00 179.01 179.31 2prf h LYS 115 N -0.17 0.13 -0.69 2.33 2.10 -1.50 -3.18 116.57 115.59 2prf h LYS 115 Ca -0.07 -0.23 0.16 0.00 -2.00 0.00 0.00 60.65 58.51 2prf h LYS 115 Cb 1.27 0.08 -0.04 0.00 -0.90 0.00 0.00 32.23 32.64 2prf h LYS 115 CO 0.11 1.11 0.47 -0.07 -2.00 0.00 0.00 179.45 179.07 2prf h LEU 116 N -0.65 0.24 -0.13 7.07 4.07 -1.44 -1.04 115.31 123.44 2prf h LEU 116 Ca -0.22 0.01 -0.15 0.00 0.08 0.00 0.00 57.88 57.61 2prf h LEU 116 Cb 1.45 -0.03 0.01 0.00 1.08 0.00 0.00 40.66 43.16 2prf h LEU 116 CO -0.01 0.13 -0.50 0.00 -1.08 0.00 0.00 178.44 176.98 2prf h ALA 117 N 1.67 0.24 -0.02 1.53 0.00 -1.63 -2.41 119.26 118.63 2prf h ALA 117 Ca 0.33 -0.50 0.01 0.00 0.00 0.00 0.00 54.91 54.75 2prf h ALA 117 Cb 0.94 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 2prf h ALA 117 CO -0.08 0.42 0.11 0.22 0.00 0.00 0.00 179.25 179.92 2prf h ASP 118 N 0.20 0.00 0.00 0.00 1.82 -1.17 0.30 116.42 117.57 2prf h ASP 118 Ca -0.03 0.00 -0.09 0.00 -0.39 0.00 0.00 57.03 56.52 2prf h ASP 118 Cb 1.13 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.13 2prf h ASP 118 CO 0.11 0.00 -0.80 0.00 -1.61 0.00 0.00 179.24 176.93 2prf n TYR 119 N -3.16 0.97 1.30 0.28 9.36 -1.05 -4.08 117.16 120.78 2prf n TYR 119 Ca -0.02 0.42 0.11 0.00 3.32 0.00 0.00 57.90 61.72 2prf n TYR 119 Cb 0.19 -0.90 0.62 0.00 -0.63 0.00 0.00 39.34 38.62 2prf n TYR 119 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 2prf n LEU 120 N -4.55 0.00 -0.22 2.98 4.77 -0.92 -3.14 117.00 115.92 2prf n LEU 120 Ca -0.17 0.03 -0.06 0.00 -0.03 0.00 0.00 56.01 55.78 2prf n LEU 120 Cb 0.42 -0.03 0.09 0.00 -2.33 0.00 0.00 43.42 41.58 2prf n LEU 120 CO 0.14 -0.01 0.96 -0.29 -1.33 0.00 0.00 177.39 176.86 2prf h ILE 121 N 0.00 1.25 -1.14 -0.08 6.09 -0.54 0.12 117.51 123.21 2prf h ILE 121 Ca 0.00 -0.92 -0.55 0.00 -1.37 0.00 0.00 64.86 62.02 2prf h ILE 121 Cb 0.02 0.55 -0.42 0.00 0.47 0.00 0.00 36.82 37.44 2prf h ILE 121 CO 0.00 0.35 -0.80 0.61 -3.07 0.00 0.00 178.15 175.24 2prf n GLY 122 N -0.74 5.79 1.29 8.18 0.00 -1.19 -4.31 105.19 114.21 2prf n GLY 122 Ca 0.05 -2.59 0.00 0.00 0.00 0.00 0.00 46.02 43.48 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 -0.56 0.00 0.00 1.61 1.13 -1.19 -5.00 117.38 113.37 2prf n GLN 123 Ca 0.38 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.44 2prf n GLN 123 Cb 0.80 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.15 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 0.91 0.15 3.84 1.08 0.00 -1.23 -5.09 105.19 104.85 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