#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f4p h ASP 4 N 0.00 0.00 0.17 -2.24 3.32 -2.00 -2.44 116.42 113.23 2f4p h ASP 4 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2f4p h ASP 4 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 2f4p h ASP 4 CO 0.00 0.00 -0.06 -0.29 -1.72 0.00 0.00 179.24 177.17 2f4p h ILE 5 N 0.00 0.57 -3.24 0.35 6.09 -2.04 -3.44 117.51 115.80 2f4p h ILE 5 Ca -0.00 -0.26 -0.56 0.00 -1.37 0.00 0.00 64.86 62.67 2f4p h ILE 5 Cb 0.28 1.17 -0.03 0.00 0.47 0.00 0.00 36.82 38.70 2f4p h ILE 5 CO 0.00 0.06 -0.24 -0.36 -3.07 0.00 0.00 178.15 174.54 2f4p s PHE 6 N -4.44 3.46 0.04 2.19 0.08 -0.92 -5.04 117.98 113.35 2f4p s PHE 6 Ca -0.04 0.65 -0.28 0.00 0.12 0.00 0.00 56.93 57.38 2f4p s PHE 6 Cb 0.14 -2.08 -0.17 0.00 -0.57 0.00 0.00 43.02 40.34 2f4p s PHE 6 CO 0.57 0.36 1.39 1.49 -0.10 0.00 0.00 175.22 178.94 2f4p h GLU 7 N 2.63 -0.64 -0.01 0.44 4.57 -1.87 -3.35 114.58 116.36 2f4p h GLU 7 Ca -0.46 0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.76 2f4p h GLU 7 Cb 1.17 0.14 0.00 0.00 -0.16 0.00 0.00 28.75 29.90 2f4p h GLU 7 CO 0.71 -0.35 -0.20 0.54 -1.18 0.00 0.00 179.01 178.53 2f4p n ARG 8 N -5.30 1.99 0.00 1.92 1.74 -1.26 -5.11 116.66 110.64 2f4p n ARG 8 Ca -0.11 -0.63 0.00 0.00 -0.77 0.00 0.00 57.85 56.33 2f4p n ARG 8 Cb 0.31 -1.09 0.00 0.00 -1.02 0.00 0.00 32.46 30.65 2f4p n ARG 8 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2f4p n GLY 9 N 0.89 -0.45 3.73 -0.13 0.00 -1.26 -4.33 105.19 103.63 2f4p n GLY 9 Ca 0.04 -2.26 -0.41 0.00 0.00 0.00 0.00 46.02 43.39 2f4p n GLY 9 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2f4p s SER 10 N -1.85 7.39 0.13 1.61 0.15 0.63 -4.69 113.70 117.06 2f4p s SER 10 Ca 0.00 1.88 -0.31 0.00 0.70 0.00 0.00 55.95 58.22 2f4p s SER 10 Cb 0.00 -2.59 -0.09 0.00 -1.71 0.00 0.00 66.02 61.63 2f4p s SER 10 CO 0.00 -0.16 1.53 -0.75 1.20 0.00 0.00 173.24 175.05 2f4p s LYS 11 N 0.10 4.24 0.19 5.44 2.20 -1.26 -0.69 119.74 129.95 2f4p s LYS 11 Ca 0.49 2.26 -0.32 0.00 -0.36 0.00 0.00 55.97 58.04 2f4p s LYS 11 Cb -0.25 -3.27 -0.12 0.00 -1.51 0.00 0.00 37.83 32.68 2f4p s LYS 11 CO 0.31 -0.58 1.72 0.41 -0.36 0.00 0.00 175.35 176.85 2f4p n GLY 12 N 3.72 1.48 3.77 5.54 0.00 0.47 -4.90 105.19 115.27 2f4p n GLY 12 Ca 0.13 0.64 -0.40 0.00 0.00 0.00 0.00 46.02 46.39 2f4p n GLY 12 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2f4p s SER 13 N 1.36 6.43 0.38 1.61 0.15 -1.26 -4.79 113.70 117.58 2f4p s SER 13 Ca 0.77 2.79 0.23 0.00 0.70 0.00 0.00 55.95 60.44 2f4p s SER 13 Cb -0.53 -2.65 1.24 0.00 -1.71 0.00 0.00 66.02 62.36 2f4p s SER 13 CO 0.34 -0.78 1.67 0.77 1.20 0.00 0.00 173.24 176.44 2f4p h SER 14 N 2.96 0.00 0.27 5.45 4.64 -1.93 -1.22 113.55 123.72 2f4p h SER 14 Ca -0.50 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.79 2f4p h SER 14 Cb 1.24 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.32 2f4p h SER 14 CO 0.64 0.00 -0.17 0.44 -0.87 0.00 0.00 176.83 176.86 2f4p h ASP 15 N 0.00 0.00 0.00 4.97 3.32 -2.02 -3.35 116.42 119.34 2f4p h ASP 15 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2f4p h ASP 15 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 2f4p h ASP 15 CO 0.00 0.17 -0.66 0.49 -1.72 0.00 0.00 179.24 177.52 2f4p n PHE 16 N -4.03 0.00 -4.27 4.55 3.72 -0.54 -4.97 117.46 111.92 2f4p n PHE 16 Ca -0.02 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.18 2f4p n PHE 16 Cb 0.26 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.67 2f4p n PHE 16 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2f4p s PHE 17 N -1.52 1.24 -0.18 1.38 0.08 -0.72 -0.70 117.98 117.56 2f4p s PHE 17 Ca 0.00 -0.40 -0.09 0.00 0.12 0.00 0.00 56.93 56.56 2f4p s PHE 17 Cb 0.00 -0.72 -0.05 0.00 -0.57 0.00 0.00 43.02 41.69 2f4p s PHE 17 CO 0.00 0.05 0.11 0.99 -0.10 0.00 0.00 175.22 176.27 2f4p s THR 18 N -1.05 5.24 0.00 0.64 2.01 0.74 -4.29 115.64 118.92 2f4p s THR 18 Ca 0.00 0.13 0.00 0.00 0.31 0.00 0.00 61.69 62.13 2f4p s THR 18 Cb -0.09 -3.37 0.00 0.00 0.01 0.00 0.00 72.50 69.05 2f4p s THR 18 CO 0.02 0.47 0.00 0.61 -0.69 0.00 0.00 174.62 175.03 2f4p n GLY 19 N 3.32 -1.74 3.59 4.40 0.00 -1.26 -1.36 105.19 112.15 2f4p n GLY 19 Ca -0.17 -1.36 -0.39 0.00 0.00 0.00 0.00 46.02 44.11 2f4p n GLY 19 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2f4p s ASN 20 N -4.00 6.13 -0.00 1.61 0.01 -1.26 -4.91 114.94 112.51 2f4p s ASN 20 Ca 0.00 0.07 -0.00 0.00 -0.71 0.00 0.00 52.86 52.22 2f4p s ASN 20 Cb 0.00 -2.16 -0.00 0.00 0.41 0.00 0.00 41.25 39.50 2f4p s ASN 20 CO 0.00 -0.14 0.01 -0.69 -1.51 0.00 0.00 177.10 174.77 2f4p s VAL 21 N 1.90 0.01 -0.09 1.60 1.01 -1.26 -1.55 120.40 122.02 2f4p s VAL 21 Ca 0.11 -0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.06 2f4p s VAL 21 Cb -0.16 -0.04 0.00 0.00 0.00 0.00 0.00 36.38 36.18 2f4p s VAL 21 CO 0.11 -0.03 -0.20 0.26 0.00 0.00 0.00 175.10 175.23 2f4p s TRP 22 N -0.10 2.22 -0.11 5.22 0.52 -0.50 -0.40 118.94 125.79 2f4p s TRP 22 Ca -0.01 -0.89 0.03 0.00 0.02 0.00 0.00 56.10 55.26 2f4p s TRP 22 Cb -0.01 -1.51 0.00 0.00 -1.15 0.00 0.00 33.47 30.80 2f4p s TRP 22 CO -0.00 -0.37 -0.23 0.08 0.02 0.00 0.00 176.95 176.45 2f4p s VAL 23 N 0.43 2.11 0.00 4.03 1.01 0.13 -1.64 120.40 126.47 2f4p s VAL 23 Ca -0.17 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 60.81 2f4p s VAL 23 Cb -0.17 -1.82 0.00 0.00 0.00 0.00 0.00 36.38 34.39 2f4p s VAL 23 CO 0.07 0.56 0.00 1.17 0.00 0.00 0.00 175.10 176.90 2f4p n LYS 24 N 3.67 3.96 0.00 2.72 4.81 -0.19 -0.27 118.16 132.85 2f4p n LYS 24 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.25 2f4p n LYS 24 Cb 0.53 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.58 2f4p n LYS 24 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2f4p n LEU 26 N 0.00 0.00 -3.78 3.14 4.77 0.93 -0.48 117.00 121.58 2f4p n LEU 26 Ca 0.00 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.72 2f4p n LEU 26 Cb 0.00 0.09 -0.17 0.00 -2.33 0.00 0.00 43.42 41.01 2f4p n LEU 26 CO 0.00 -0.10 -0.38 -0.69 -1.33 0.00 0.00 177.39 174.89 2f4p s VAL 27 N -1.20 0.60 -0.17 4.08 1.01 -0.40 -4.95 120.40 119.37 2f4p s VAL 27 Ca 0.00 -0.37 0.22 0.00 0.00 0.00 0.00 61.98 61.83 2f4p s VAL 27 Cb 0.00 -0.94 -0.10 0.00 0.00 0.00 0.00 36.38 35.34 2f4p s VAL 27 CO 0.00 -0.00 0.87 0.35 0.00 0.00 0.00 175.10 176.32 2f4p n THR 28 N 5.04 0.51 -3.65 3.92 -2.24 -1.26 -1.02 114.28 115.58 2f4p n THR 28 Ca -0.09 -0.55 -0.23 0.00 -2.27 0.00 0.00 64.05 60.91 2f4p n THR 28 Cb 0.48 -0.28 0.06 0.00 -2.10 0.00 0.00 70.33 68.49 2f4p n THR 28 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2f4p n ASP 29 N -2.59 -3.68 -0.26 3.42 2.03 -1.26 -4.85 116.55 109.37 2f4p n ASP 29 Ca -0.02 -0.68 0.21 0.00 0.52 0.00 0.00 54.79 54.81 2f4p n ASP 29 Cb 0.58 -4.56 0.53 0.00 -0.72 0.00 0.00 41.12 36.95 2f4p n ASP 29 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 2f4p h GLU 30 N -2.17 0.35 -0.61 -0.67 4.11 -1.95 0.03 114.58 113.67 2f4p h GLU 30 Ca -0.59 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 58.82 2f4p h GLU 30 Cb 1.36 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2f4p h GLU 30 CO 0.57 0.23 0.00 0.09 0.07 0.00 0.00 179.01 179.98 2f4p n ASN 31 N -4.50 4.24 -1.45 3.06 3.02 -1.26 -4.97 115.26 113.40 2f4p n ASN 31 Ca 0.20 -2.30 -0.17 0.00 -0.03 0.00 0.00 54.58 52.29 2f4p n ASN 31 Cb 0.77 -0.50 -0.07 0.00 -0.61 0.00 0.00 39.78 39.36 2f4p n ASN 31 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2f4p n GLY 32 N 1.09 1.60 0.26 7.41 0.00 -0.01 -4.82 105.19 110.72 2f4p n GLY 32 Ca 0.23 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.35 2f4p n GLY 32 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2f4p h VAL 33 N 0.00 0.88 0.00 1.61 2.07 -1.93 -3.28 116.25 115.60 2f4p h VAL 33 Ca -0.34 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 66.98 2f4p h VAL 33 Cb 1.13 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 32.01 2f4p h VAL 33 CO 0.51 0.05 -1.01 0.49 0.02 0.00 0.00 177.57 177.62 2f4p n PHE 34 N -4.25 0.00 -2.67 1.57 3.72 -1.26 -5.00 117.46 109.58 2f4p n PHE 34 Ca -0.03 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.22 2f4p n PHE 34 Cb 0.14 -0.11 -0.00 0.00 -0.94 0.00 0.00 39.48 38.57 2f4p n PHE 34 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2f4p n ASN 35 N -1.56 -4.12 -3.71 4.37 5.15 -1.24 -4.94 115.26 109.21 2f4p n ASN 35 Ca -0.01 0.03 -0.12 0.00 -0.60 0.00 0.00 54.58 53.89 2f4p n ASN 35 Cb 0.15 -3.46 -0.10 0.00 -0.53 0.00 0.00 39.78 35.84 2f4p n ASN 35 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2f4p s THR 36 N -2.74 -0.01 0.15 -0.44 2.01 -1.26 -1.58 115.64 111.78 2f4p s THR 36 Ca 0.10 0.03 0.09 0.00 0.31 0.00 0.00 61.69 62.22 2f4p s THR 36 Cb -0.05 -0.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 2f4p s THR 36 CO 0.13 0.01 -0.14 -1.10 -0.69 0.00 0.00 174.62 172.83 2f4p s GLN 37 N 0.67 1.91 -0.01 4.92 -0.21 -0.73 -4.48 119.66 121.72 2f4p s GLN 37 Ca -0.03 -1.24 0.01 0.00 0.02 0.00 0.00 55.36 54.12 2f4p s GLN 37 Cb -0.05 -2.12 0.01 0.00 1.00 0.00 0.00 33.01 31.84 2f4p s GLN 37 CO -0.05 0.45 -0.04 0.08 -2.12 0.00 0.00 175.29 173.62 2f4p s VAL 38 N -1.45 0.35 0.05 1.09 1.01 -0.19 -0.82 120.40 120.43 2f4p s VAL 38 Ca 0.22 -0.13 -0.03 0.00 0.00 0.00 0.00 61.98 62.04 2f4p s VAL 38 Cb -0.10 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.92 2f4p s VAL 38 CO 0.13 0.13 0.02 -0.72 0.00 0.00 0.00 175.10 174.65 2f4p s TYR 39 N 0.26 0.38 -0.10 5.22 -0.85 -0.15 -0.05 117.35 122.05 2f4p s TYR 39 Ca -0.03 -0.83 0.03 0.00 -0.52 0.00 0.00 57.07 55.72 2f4p s TYR 39 Cb -0.06 -0.28 0.00 0.00 0.38 0.00 0.00 41.96 42.01 2f4p s TYR 39 CO -0.00 -0.37 -0.21 0.34 -1.52 0.00 0.00 175.55 173.79 2f4p s ASP 40 N -2.56 2.82 -0.01 -0.18 2.15 0.37 -0.18 116.67 119.09 2f4p s ASP 40 Ca 0.01 -0.51 0.02 0.00 0.43 0.00 0.00 52.55 52.50 2f4p s ASP 40 Cb 0.03 -1.29 -0.01 0.00 -0.30 0.00 0.00 42.92 41.36 2f4p s ASP 40 CO -0.08 0.11 -0.08 0.68 -0.17 0.00 0.00 175.17 175.64 2f4p s VAL 41 N 0.52 0.59 -0.18 1.11 -7.23 0.38 -1.02 120.40 114.57 2f4p s VAL 41 Ca -0.15 -0.33 -0.01 0.00 -1.81 0.00 0.00 61.98 59.68 2f4p s VAL 41 Cb -0.17 -0.50 0.00 0.00 0.56 0.00 0.00 36.38 36.27 2f4p s VAL 41 CO 0.06 0.16 -0.13 -0.69 -0.31 0.00 0.00 175.10 174.19 2f4p s VAL 42 N -0.18 2.74 -0.24 1.32 1.01 -0.65 -1.35 120.40 123.05 2f4p s VAL 42 Ca 0.03 -0.73 -0.08 0.00 0.00 0.00 0.00 61.98 61.20 2f4p s VAL 42 Cb -0.03 -2.19 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 2f4p s VAL 42 CO -0.00 0.50 0.10 -0.36 0.00 0.00 0.00 175.10 175.33 2f4p s PHE 43 N 1.09 3.17 0.80 5.22 0.40 0.22 -1.41 117.98 127.47 2f4p s PHE 43 Ca 0.00 -0.14 -0.11 0.00 -0.60 0.00 0.00 56.93 56.08 2f4p s PHE 43 Cb -0.14 -2.23 0.07 0.00 0.51 0.00 0.00 43.02 41.23 2f4p s PHE 43 CO -0.04 -0.16 1.09 -1.21 0.70 0.00 0.00 175.22 175.60 2f4p s GLU 44 N 1.29 2.07 0.23 0.44 0.41 -0.60 -1.48 118.70 121.06 2f4p s GLU 44 Ca 0.05 0.92 -0.31 0.00 -0.41 0.00 0.00 54.97 55.23 2f4p s GLU 44 Cb -0.15 -1.89 -0.14 0.00 -1.78 0.00 0.00 34.13 30.17 2f4p s GLU 44 CO 0.05 -1.70 1.23 -2.30 -0.49 0.00 0.00 175.26 172.04 2f4p n PRO 45 N -3.53 1.59 0.00 0.39 -0.02 -1.26 -0.85 135.00 131.32 2f4p n PRO 45 Ca 0.08 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 2f4p n PRO 45 Cb 0.54 -2.10 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 2f4p n PRO 45 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2f4p n GLY 46 N 1.83 2.81 3.82 -1.23 0.00 -0.08 -4.91 105.19 107.43 2f4p n GLY 46 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 2f4p n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f4p s ALA 47 N -2.72 3.31 0.11 4.61 0.00 -0.03 -4.79 121.76 122.26 2f4p s ALA 47 Ca 0.00 0.22 -0.25 0.00 0.00 0.00 0.00 51.96 51.93 2f4p s ALA 47 Cb 0.00 -2.91 0.08 0.00 0.00 0.00 0.00 23.12 20.29 2f4p s ALA 47 CO 0.00 0.28 0.77 -0.98 0.00 0.00 0.00 175.76 175.83 2f4p s ARG 48 N -2.37 1.14 0.76 0.00 3.03 -0.46 -0.45 118.95 120.60 2f4p s ARG 48 Ca 0.49 -0.48 -0.11 0.00 2.03 0.00 0.00 55.73 57.66 2f4p s ARG 48 Cb -0.15 0.49 0.05 0.00 -1.03 0.00 0.00 34.95 34.31 2f4p s ARG 48 CO 0.20 -0.51 1.09 0.95 -1.13 0.00 0.00 175.30 175.90 2f4p s THR 49 N -3.47 3.32 1.04 4.99 -4.23 -0.38 -0.19 115.64 116.73 2f4p s THR 49 Ca 0.05 0.44 -0.12 0.00 -1.18 0.00 0.00 61.69 60.88 2f4p s THR 49 Cb -0.02 -2.93 0.21 0.00 1.34 0.00 0.00 72.50 71.11 2f4p s THR 49 CO -0.08 -0.55 1.07 -1.00 -0.54 0.00 0.00 174.62 173.53 2f4p s HIS 50 N -2.86 1.85 0.33 3.99 0.09 0.13 -4.46 115.29 114.35 2f4p s HIS 50 Ca 0.62 1.11 -0.29 0.00 -0.00 0.00 0.00 55.06 56.50 2f4p s HIS 50 Cb -0.17 -3.20 -0.11 0.00 -0.00 0.00 0.00 32.58 29.10 2f4p s HIS 50 CO 0.55 -3.17 1.52 -1.58 -0.00 0.00 0.00 174.74 172.06 2f4p s TRP 51 N -2.78 2.71 0.17 1.40 0.52 0.25 -4.56 118.94 116.65 2f4p s TRP 51 Ca 0.66 0.99 -0.24 0.00 0.02 0.00 0.00 56.10 57.53 2f4p s TRP 51 Cb -0.21 -4.02 0.06 0.00 -1.15 0.00 0.00 33.47 28.16 2f4p s TRP 51 CO 0.60 -3.20 0.95 -3.38 0.02 0.00 0.00 176.95 171.94 2f4p s HIS 52 N -0.54 -0.10 0.06 -1.98 -3.43 -0.44 -0.61 115.29 108.24 2f4p s HIS 52 Ca 0.58 -0.24 -0.04 0.00 -0.80 0.00 0.00 55.06 54.56 2f4p s HIS 52 Cb -0.46 0.66 -0.02 0.00 -1.43 0.00 0.00 32.58 31.32 2f4p s HIS 52 CO 0.54 -0.89 0.05 -1.54 -2.00 0.00 0.00 174.74 170.91 2f4p s SER 53 N -3.00 0.33 -0.12 7.38 1.04 -0.56 -0.80 113.70 117.98 2f4p s SER 53 Ca 0.13 -0.83 0.03 0.00 0.48 0.00 0.00 55.95 55.76 2f4p s SER 53 Cb -0.02 0.24 -0.00 0.00 0.10 0.00 0.00 66.02 66.34 2f4p s SER 53 CO 0.03 -0.62 -0.21 -1.00 0.98 0.00 0.00 173.24 172.42 2f4p s HIS 54 N -3.70 2.64 0.50 5.02 3.76 -1.26 -0.15 115.29 122.10 2f4p s HIS 54 Ca 0.04 -1.04 0.18 0.00 -0.15 0.00 0.00 55.06 54.09 2f4p s HIS 54 Cb 0.06 -1.77 1.23 0.00 1.11 0.00 0.00 32.58 33.21 2f4p s HIS 54 CO -0.10 -0.43 2.06 -1.35 -0.85 0.00 0.00 174.74 174.08 2f4p h PRO 55 N 6.87 0.12 -0.01 8.40 0.11 -1.78 0.76 132.00 146.47 2f4p h PRO 55 Ca -0.24 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2f4p h PRO 55 Cb 1.22 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2f4p h PRO 55 CO 0.51 0.08 -0.47 0.41 -0.21 0.00 0.00 178.00 178.32 2f4p n GLY 56 N -1.56 -0.14 0.00 -0.55 0.00 -1.26 -4.31 105.19 97.36 2f4p n GLY 56 Ca 0.04 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.46 2f4p n GLY 56 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2f4p n GLY 57 N 1.41 0.10 3.33 -0.02 0.00 -0.97 -4.29 105.19 104.75 2f4p n GLY 57 Ca 0.09 -1.90 -0.15 0.00 0.00 0.00 0.00 46.02 44.07 2f4p n GLY 57 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2f4p s GLN 58 N -1.45 0.75 -0.10 1.61 0.74 -0.47 -2.48 119.66 118.26 2f4p s GLN 58 Ca 0.00 0.07 0.02 0.00 0.05 0.00 0.00 55.36 55.51 2f4p s GLN 58 Cb 0.00 0.34 0.01 0.00 1.10 0.00 0.00 33.01 34.46 2f4p s GLN 58 CO 0.00 -0.20 -0.17 0.42 -0.55 0.00 0.00 175.29 174.79 2f4p s ILE 59 N -1.01 1.60 -0.09 -2.34 1.01 -0.09 -0.23 121.20 120.05 2f4p s ILE 59 Ca -0.11 -0.72 -0.01 0.00 0.00 0.00 0.00 60.65 59.81 2f4p s ILE 59 Cb -0.04 -1.44 -0.03 0.00 0.01 0.00 0.00 42.46 40.96 2f4p s ILE 59 CO 0.05 0.46 -0.01 -0.76 0.00 0.00 0.00 174.94 174.68 2f4p s LEU 60 N 0.81 3.48 -0.23 2.97 1.43 -0.29 -0.17 118.68 126.67 2f4p s LEU 60 Ca -0.10 0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.10 2f4p s LEU 60 Cb -0.16 -1.79 0.06 0.00 0.03 0.00 0.00 46.19 44.33 2f4p s LEU 60 CO 0.01 0.36 -0.04 -0.63 0.23 0.00 0.00 176.35 176.29 2f4p s ILE 61 N -0.79 1.36 -0.09 -0.59 1.01 -0.11 -0.62 121.20 121.36 2f4p s ILE 61 Ca 0.12 -1.12 -0.27 0.00 0.00 0.00 0.00 60.65 59.38 2f4p s ILE 61 Cb -0.11 -1.67 -0.02 0.00 0.01 0.00 0.00 42.46 40.66 2f4p s ILE 61 CO 0.02 -0.13 0.89 -0.69 0.00 0.00 0.00 174.94 175.03 2f4p s VAL 62 N 1.47 4.88 -0.03 2.92 1.01 -0.18 -0.73 120.40 129.75 2f4p s VAL 62 Ca -0.05 1.81 0.10 0.00 0.00 0.00 0.00 61.98 63.85 2f4p s VAL 62 Cb -0.19 -4.21 -0.16 0.00 0.00 0.00 0.00 36.38 31.83 2f4p s VAL 62 CO -0.07 0.10 0.19 0.35 0.00 0.00 0.00 175.10 175.67 2f4p n THR 63 N 4.29 0.14 -3.59 3.92 -2.24 -0.10 -0.76 114.28 115.94 2f4p n THR 63 Ca 0.05 -0.28 -0.16 0.00 -2.27 0.00 0.00 64.05 61.39 2f4p n THR 63 Cb 0.50 0.05 -0.07 0.00 -2.10 0.00 0.00 70.33 68.71 2f4p n THR 63 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2f4p s ARG 64 N -2.64 0.92 1.41 -0.78 3.52 -1.04 -4.81 118.95 115.53 2f4p s ARG 64 Ca -0.04 0.51 0.00 0.00 -0.13 0.00 0.00 55.73 56.07 2f4p s ARG 64 Cb 0.06 0.44 0.00 0.00 -1.56 0.00 0.00 34.95 33.89 2f4p s ARG 64 CO 0.44 -0.22 0.00 0.41 -0.81 0.00 0.00 175.30 175.12 2f4p n GLY 65 N 1.68 -0.71 2.81 8.12 0.00 -1.26 -0.88 105.19 114.96 2f4p n GLY 65 Ca -0.17 -1.51 -0.14 0.00 0.00 0.00 0.00 46.02 44.20 2f4p n GLY 65 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2f4p s LYS 66 N 0.00 -0.02 0.00 1.61 2.20 -0.35 -3.82 119.74 119.37 2f4p s LYS 66 Ca 0.00 0.13 0.00 0.00 -0.36 0.00 0.00 55.97 55.74 2f4p s LYS 66 Cb 0.00 -0.16 0.00 0.00 -1.51 0.00 0.00 37.83 36.16 2f4p s LYS 66 CO 0.00 -0.11 0.00 0.41 -0.36 0.00 0.00 175.35 175.29 2f4p n GLY 67 N 3.79 3.00 2.97 5.54 0.00 -0.17 -1.68 105.19 118.64 2f4p n GLY 67 Ca -0.22 -1.33 -0.13 0.00 0.00 0.00 0.00 46.02 44.34 2f4p n GLY 67 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2f4p s PHE 68 N -5.53 0.37 -0.05 1.61 0.40 -0.09 0.59 117.98 115.27 2f4p s PHE 68 Ca 0.00 -0.25 0.03 0.00 -0.60 0.00 0.00 56.93 56.11 2f4p s PHE 68 Cb 0.00 -0.24 0.00 0.00 0.51 0.00 0.00 43.02 43.30 2f4p s PHE 68 CO 0.00 -0.06 -0.15 -0.47 0.70 0.00 0.00 175.22 175.24 2f4p s TYR 69 N -0.66 1.57 -0.05 0.36 5.04 -0.19 -1.68 117.35 121.75 2f4p s TYR 69 Ca -0.05 -0.51 -0.02 0.00 -2.44 0.00 0.00 57.07 54.06 2f4p s TYR 69 Cb -0.05 -1.09 0.04 0.00 0.35 0.00 0.00 41.96 41.20 2f4p s TYR 69 CO -0.00 -0.21 0.10 -1.14 -1.34 0.00 0.00 175.55 172.96 2f4p s GLN 70 N 0.30 0.04 0.21 4.97 0.74 -0.44 -0.01 119.66 125.46 2f4p s GLN 70 Ca -0.08 0.31 -0.10 0.00 0.05 0.00 0.00 55.36 55.53 2f4p s GLN 70 Cb -0.13 -0.21 -0.07 0.00 1.10 0.00 0.00 33.01 33.70 2f4p s GLN 70 CO 0.03 -0.17 0.54 -1.21 -0.55 0.00 0.00 175.29 173.93 2f4p s GLU 71 N 1.17 3.83 0.22 1.67 2.02 -1.26 -1.11 118.70 125.23 2f4p s GLU 71 Ca -0.09 0.30 -0.32 0.00 0.02 0.00 0.00 54.97 54.88 2f4p s GLU 71 Cb -0.12 -2.71 -0.13 0.00 0.10 0.00 0.00 34.13 31.27 2f4p s GLU 71 CO -0.05 0.36 1.58 -2.13 0.02 0.00 0.00 175.26 175.04 2f4p n ARG 72 N 0.06 2.39 -0.90 1.61 0.63 -0.34 -1.32 116.66 118.80 2f4p n ARG 72 Ca -0.01 0.86 0.00 0.00 -0.92 0.00 0.00 57.85 57.78 2f4p n ARG 72 Cb 0.52 -2.62 0.00 0.00 0.45 0.00 0.00 32.46 30.81 2f4p n ARG 72 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2f4p n GLY 73 N 3.02 0.52 3.50 5.14 0.00 -1.26 -5.02 105.19 111.10 2f4p n GLY 73 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 2f4p n GLY 73 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2f4p s LYS 74 N -0.48 1.80 0.41 1.61 1.02 -0.43 -5.11 119.74 118.55 2f4p s LYS 74 Ca 0.00 -1.57 -0.26 0.00 0.02 0.00 0.00 55.97 54.16 2f4p s LYS 74 Cb 0.00 -1.92 -0.09 0.00 -0.52 0.00 0.00 37.83 35.30 2f4p s LYS 74 CO 0.00 0.37 1.39 -2.14 -0.92 0.00 0.00 175.35 174.05 2f4p s PRO 75 N -3.20 3.92 0.56 -1.68 0.02 -1.26 -4.52 135.00 128.83 2f4p s PRO 75 Ca 0.27 2.34 -0.20 0.00 0.02 0.00 0.00 61.00 63.43 2f4p s PRO 75 Cb -0.07 -2.78 -0.05 0.00 0.02 0.00 0.00 34.50 31.62 2f4p s PRO 75 CO 0.14 -0.60 1.22 0.00 -0.33 0.00 0.00 177.00 177.43 2f4p s ALA 76 N -1.20 2.67 -0.17 -1.55 0.00 -1.26 -4.68 121.76 115.56 2f4p s ALA 76 Ca 0.57 1.04 -0.06 0.00 0.00 0.00 0.00 51.96 53.51 2f4p s ALA 76 Cb -0.42 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.21 2f4p s ALA 76 CO 0.55 -1.09 0.01 0.50 0.00 0.00 0.00 175.76 175.74 2f4p s ARG 77 N -3.16 3.83 0.13 0.00 3.52 0.98 -4.96 118.95 119.30 2f4p s ARG 77 Ca 0.74 -0.43 -0.28 0.00 -0.13 0.00 0.00 55.73 55.64 2f4p s ARG 77 Cb -0.31 -3.07 -0.07 0.00 -1.56 0.00 0.00 34.95 29.94 2f4p s ARG 77 CO 0.35 0.26 0.87 0.42 -0.81 0.00 0.00 175.30 176.39 2f4p s ILE 78 N 0.35 4.46 -0.07 4.11 1.01 -1.26 -1.02 121.20 128.78 2f4p s ILE 78 Ca -0.00 1.88 0.03 0.00 0.00 0.00 0.00 60.65 62.55 2f4p s ILE 78 Cb -0.13 -4.23 -0.02 0.00 0.01 0.00 0.00 42.46 38.08 2f4p s ILE 78 CO 0.01 0.40 -0.14 -0.76 0.00 0.00 0.00 174.94 174.46 2f4p s LEU 79 N -0.46 2.71 0.26 2.97 1.43 0.20 -4.94 118.68 120.85 2f4p s LEU 79 Ca 0.41 -0.24 0.02 0.00 -1.03 0.00 0.00 54.13 53.30 2f4p s LEU 79 Cb -0.23 -1.56 -0.04 0.00 0.03 0.00 0.00 46.19 44.39 2f4p s LEU 79 CO 0.28 0.30 0.17 -1.59 0.23 0.00 0.00 176.35 175.73 2f4p s LYS 80 N -0.43 1.46 0.12 1.70 -2.85 -1.26 -1.00 119.74 117.47 2f4p s LYS 80 Ca 0.05 -1.81 -0.35 0.00 -1.00 0.00 0.00 55.97 52.86 2f4p s LYS 80 Cb -0.12 0.13 -0.16 0.00 -2.06 0.00 0.00 37.83 35.62 2f4p s LYS 80 CO 0.02 -0.46 1.27 1.17 0.10 0.00 0.00 175.35 177.45 2f4p n LYS 81 N -0.46 1.16 0.00 1.78 4.81 -1.25 -1.77 118.16 122.44 2f4p n LYS 81 Ca 0.03 0.42 0.00 0.00 -0.87 0.00 0.00 58.31 57.88 2f4p n LYS 81 Cb 0.65 -2.00 0.00 0.00 0.02 0.00 0.00 35.03 33.70 2f4p n LYS 81 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2f4p n GLY 82 N 2.32 1.93 3.77 3.14 0.00 0.06 -4.99 105.19 111.42 2f4p n GLY 82 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 2f4p n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2f4p s ASP 83 N -1.78 6.85 -0.16 1.61 1.01 -0.73 -4.79 116.67 118.69 2f4p s ASP 83 Ca 0.00 2.34 0.01 0.00 0.71 0.00 0.00 52.55 55.61 2f4p s ASP 83 Cb 0.00 -2.62 0.01 0.00 1.01 0.00 0.00 42.92 41.32 2f4p s ASP 83 CO 0.00 -0.45 -0.19 -0.69 0.21 0.00 0.00 175.17 174.05 2f4p s VAL 84 N -1.31 2.29 -0.24 -1.27 1.01 -1.26 -1.00 120.40 118.61 2f4p s VAL 84 Ca 0.51 -0.89 -0.05 0.00 0.00 0.00 0.00 61.98 61.55 2f4p s VAL 84 Cb -0.32 -1.94 -0.01 0.00 0.00 0.00 0.00 36.38 34.11 2f4p s VAL 84 CO 0.40 0.53 -0.00 -0.69 0.00 0.00 0.00 175.10 175.34 2f4p s VAL 85 N 0.94 3.63 -0.37 2.92 1.01 0.21 -4.97 120.40 123.76 2f4p s VAL 85 Ca -0.04 -0.47 -0.18 0.00 0.00 0.00 0.00 61.98 61.30 2f4p s VAL 85 Cb -0.15 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.54 2f4p s VAL 85 CO -0.04 0.35 0.48 -1.61 0.00 0.00 0.00 175.10 174.29 2f4p s GLU 86 N 1.50 3.46 -0.39 2.72 2.02 -1.26 -1.14 118.70 125.61 2f4p s GLU 86 Ca 0.05 -0.37 -0.09 0.00 0.02 0.00 0.00 54.97 54.58 2f4p s GLU 86 Cb -0.15 -3.86 0.06 0.00 0.10 0.00 0.00 34.13 30.28 2f4p s GLU 86 CO -0.01 -0.71 0.22 0.42 0.02 0.00 0.00 175.26 175.20 2f4p s ILE 87 N 2.31 4.27 0.77 -1.63 1.01 0.68 -5.02 121.20 123.60 2f4p s ILE 87 Ca 0.16 -1.20 -0.12 0.00 0.00 0.00 0.00 60.65 59.49 2f4p s ILE 87 Cb -0.16 -3.52 0.06 0.00 0.01 0.00 0.00 42.46 38.85 2f4p s ILE 87 CO 0.14 -0.38 1.12 -2.84 0.00 0.00 0.00 174.94 172.98 2f4p s PRO 88 N 1.46 2.15 -0.04 2.79 0.02 -1.26 -1.36 135.00 138.76 2f4p s PRO 88 Ca 0.02 1.36 -0.39 0.00 0.02 0.00 0.00 61.00 62.01 2f4p s PRO 88 Cb -0.21 -1.87 -0.18 0.00 0.02 0.00 0.00 34.50 32.26 2f4p s PRO 88 CO 0.04 -1.75 1.32 -2.30 -0.33 0.00 0.00 177.00 173.98 2f4p n PRO 89 N -3.30 0.66 -0.81 5.54 -0.02 -1.26 -1.95 135.00 133.87 2f4p n PRO 89 Ca 0.10 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 2f4p n PRO 89 Cb 0.52 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.18 2f4p n PRO 89 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2f4p n ASN 90 N 2.65 -0.83 -4.69 2.55 3.02 0.22 -4.91 115.26 113.26 2f4p n ASN 90 Ca 0.21 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.34 2f4p n ASN 90 Cb 0.12 -1.33 -0.03 0.00 -0.61 0.00 0.00 39.78 37.93 2f4p n ASN 90 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2f4p s VAL 91 N -2.37 3.75 -0.06 2.41 1.01 -0.82 -4.84 120.40 119.48 2f4p s VAL 91 Ca 0.00 1.16 -0.27 0.00 0.00 0.00 0.00 61.98 62.87 2f4p s VAL 91 Cb 0.00 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 2f4p s VAL 91 CO 0.00 0.02 0.87 -0.69 0.00 0.00 0.00 175.10 175.30 2f4p s VAL 92 N 2.09 4.92 0.27 2.92 1.01 -1.26 -4.37 120.40 125.97 2f4p s VAL 92 Ca 0.63 1.79 -0.16 0.00 0.00 0.00 0.00 61.98 64.23 2f4p s VAL 92 Cb -0.31 -4.20 0.01 0.00 0.00 0.00 0.00 36.38 31.88 2f4p s VAL 92 CO 0.27 0.15 0.59 -1.38 0.00 0.00 0.00 175.10 174.72 2f4p s HIS 93 N 1.26 0.15 0.12 5.22 -3.43 0.02 -1.19 115.29 117.43 2f4p s HIS 93 Ca 0.45 -0.56 0.01 0.00 -0.80 0.00 0.00 55.06 54.16 2f4p s HIS 93 Cb -0.19 0.41 -0.04 0.00 -1.43 0.00 0.00 32.58 31.33 2f4p s HIS 93 CO 0.21 -1.11 -0.02 1.67 -2.00 0.00 0.00 174.74 173.49 2f4p s TRP 94 N -3.90 0.94 0.12 0.38 1.48 -0.27 -1.33 118.94 116.36 2f4p s TRP 94 Ca 0.18 -1.03 -0.07 0.00 -1.06 0.00 0.00 56.10 54.12 2f4p s TRP 94 Cb -0.03 -0.55 -0.01 0.00 -1.16 0.00 0.00 33.47 31.72 2f4p s TRP 94 CO 0.09 -0.27 0.18 -3.38 -4.06 0.00 0.00 176.95 169.51 2f4p s HIS 95 N -3.75 0.39 -2.13 1.66 -3.43 -1.26 -1.33 115.29 105.44 2f4p s HIS 95 Ca 0.17 -0.80 0.00 0.00 -0.80 0.00 0.00 55.06 53.63 2f4p s HIS 95 Cb 0.06 -0.16 0.00 0.00 -1.43 0.00 0.00 32.58 31.06 2f4p s HIS 95 CO -0.01 -0.59 0.00 0.41 -2.00 0.00 0.00 174.74 172.55 2f4p n GLY 96 N -0.11 -1.62 3.88 -1.38 0.00 -0.67 -1.25 105.19 104.04 2f4p n GLY 96 Ca -0.11 -1.07 -0.30 0.00 0.00 0.00 0.00 46.02 44.54 2f4p n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2f4p s ALA 97 N -1.55 2.85 0.86 4.61 0.00 0.40 -0.92 121.76 128.02 2f4p s ALA 97 Ca 0.00 -0.35 -0.11 0.00 0.00 0.00 0.00 51.96 51.49 2f4p s ALA 97 Cb 0.00 -3.03 0.11 0.00 0.00 0.00 0.00 23.12 20.20 2f4p s ALA 97 CO 0.00 -1.20 1.09 0.00 0.00 0.00 0.00 175.76 175.65 2f4p s ALA 98 N -3.36 1.73 0.08 0.00 0.00 -0.67 -4.32 121.76 115.22 2f4p s ALA 98 Ca 0.59 0.05 0.33 0.00 0.00 0.00 0.00 51.96 52.92 2f4p s ALA 98 Cb -0.11 -3.22 1.55 0.00 0.00 0.00 0.00 23.12 21.33 2f4p s ALA 98 CO 0.52 -2.21 1.98 -1.35 0.00 0.00 0.00 175.76 174.70 2f4p h PRO 99 N -1.45 0.00 0.00 0.00 0.11 -1.92 -0.17 132.00 128.57 2f4p h PRO 99 Ca -0.48 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 2f4p h PRO 99 Cb 1.27 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.33 2f4p h PRO 99 CO 0.53 0.00 -0.47 -0.40 -0.21 0.00 0.00 178.00 177.46 2f4p n ASP 100 N -2.77 0.64 -3.62 -2.05 5.75 -1.26 -4.13 116.55 109.11 2f4p n ASP 100 Ca -0.00 -2.28 -0.13 0.00 -0.01 0.00 0.00 54.79 52.37 2f4p n ASP 100 Cb 0.18 -0.27 -0.07 0.00 -1.03 0.00 0.00 41.12 39.93 2f4p n ASP 100 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 2f4p s GLU 101 N -0.68 0.76 0.67 0.11 2.12 -1.23 -5.01 118.70 115.44 2f4p s GLU 101 Ca 0.12 0.75 -0.13 0.00 0.36 0.00 0.00 54.97 56.07 2f4p s GLU 101 Cb 0.11 0.37 0.00 0.00 0.26 0.00 0.00 34.13 34.87 2f4p s GLU 101 CO -0.02 -0.12 1.07 -1.83 -0.54 0.00 0.00 175.26 173.83 2f4p s GLU 102 N 0.07 2.90 -0.08 4.30 -1.05 -1.26 -2.90 118.70 120.68 2f4p s GLU 102 Ca -0.00 1.14 0.04 0.00 -0.15 0.00 0.00 54.97 56.00 2f4p s GLU 102 Cb -0.04 -1.98 -0.00 0.00 -0.44 0.00 0.00 34.13 31.67 2f4p s GLU 102 CO 0.00 -1.14 -0.22 -1.17 0.95 0.00 0.00 175.26 173.68 2f4p s LEU 103 N -5.19 2.02 -0.07 1.83 2.96 -0.55 -1.21 118.68 118.48 2f4p s LEU 103 Ca 0.62 -0.51 0.04 0.00 -0.22 0.00 0.00 54.13 54.06 2f4p s LEU 103 Cb -0.16 -1.31 -0.00 0.00 0.50 0.00 0.00 46.19 45.22 2f4p s LEU 103 CO 0.47 0.16 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.77 2f4p s VAL 104 N 0.27 1.78 0.06 1.68 1.01 -0.06 -0.61 120.40 124.52 2f4p s VAL 104 Ca -0.15 -0.88 -0.16 0.00 0.00 0.00 0.00 61.98 60.80 2f4p s VAL 104 Cb -0.17 -1.54 0.03 0.00 0.00 0.00 0.00 36.38 34.71 2f4p s VAL 104 CO 0.07 0.50 0.37 -1.38 0.00 0.00 0.00 175.10 174.66 2f4p s HIS 105 N 0.24 -0.19 0.12 5.22 -3.43 -0.46 -0.92 115.29 115.88 2f4p s HIS 105 Ca -0.12 0.07 -0.23 0.00 -0.80 0.00 0.00 55.06 53.98 2f4p s HIS 105 Cb -0.16 0.17 -0.07 0.00 -1.43 0.00 0.00 32.58 31.10 2f4p s HIS 105 CO 0.06 -0.57 0.68 0.42 -2.00 0.00 0.00 174.74 173.33 2f4p s ILE 106 N -2.72 4.54 -0.04 -5.38 1.01 0.09 -0.47 121.20 118.23 2f4p s ILE 106 Ca -0.04 1.48 0.06 0.00 0.00 0.00 0.00 60.65 62.15 2f4p s ILE 106 Cb -0.00 -4.03 -0.01 0.00 0.01 0.00 0.00 42.46 38.43 2f4p s ILE 106 CO -0.04 0.54 -0.23 -0.83 0.00 0.00 0.00 174.94 174.38 2f4p s GLY 107 N -1.12 1.15 -0.21 6.18 0.00 0.74 -0.93 107.32 113.13 2f4p s GLY 107 Ca 0.33 -0.95 0.02 0.00 0.00 0.00 0.00 44.72 44.12 2f4p s GLY 107 CO 0.23 -0.63 -0.14 -0.42 0.00 0.00 0.00 173.10 172.14 2f4p s ILE 108 N -0.23 1.99 -0.27 0.90 1.01 0.76 -0.98 121.20 124.36 2f4p s ILE 108 Ca 0.00 -1.22 -0.23 0.00 0.00 0.00 0.00 60.65 59.20 2f4p s ILE 108 Cb -0.12 -1.98 -0.01 0.00 0.01 0.00 0.00 42.46 40.37 2f4p s ILE 108 CO 0.02 0.22 0.76 -0.44 0.00 0.00 0.00 174.94 175.50 2f4p s SER 109 N 1.25 6.70 0.16 3.58 0.01 0.00 -0.92 113.70 124.47 2f4p s SER 109 Ca -0.02 0.80 0.02 0.00 1.31 0.00 0.00 55.95 58.06 2f4p s SER 109 Cb -0.16 -2.40 -0.04 0.00 0.21 0.00 0.00 66.02 63.63 2f4p s SER 109 CO -0.09 -0.51 0.30 0.42 0.41 0.00 0.00 173.24 173.78 2f4p s THR 110 N 2.78 5.30 -1.29 1.44 -4.23 -1.03 -1.77 115.64 116.84 2f4p s THR 110 Ca 0.31 -0.60 -0.11 0.00 -1.18 0.00 0.00 61.69 60.11 2f4p s THR 110 Cb -0.15 -3.74 0.00 0.00 1.34 0.00 0.00 72.50 69.96 2f4p s THR 110 CO 0.09 -0.10 0.58 0.00 -0.54 0.00 0.00 174.62 174.66 2f4p n GLN 111 N -0.53 -2.20 0.09 3.99 6.02 -0.93 -4.00 117.38 119.82 2f4p n GLN 111 Ca -0.06 0.39 0.09 0.00 -0.01 0.00 0.00 57.00 57.41 2f4p n GLN 111 Cb 0.54 -4.19 0.56 0.00 1.02 0.00 0.00 30.24 28.18 2f4p n GLN 111 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 2f4p h VAL 112 N -1.93 0.97 0.00 5.09 2.07 -1.53 -1.58 116.25 119.34 2f4p h VAL 112 Ca -0.65 -0.08 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 2f4p h VAL 112 Cb 1.37 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 31.87 2f4p h VAL 112 CO 0.56 0.04 -0.00 -0.74 0.02 0.00 0.00 177.57 177.45 2f4p h HIS 113 N 0.22 0.00 0.00 1.57 -0.00 -1.88 0.05 115.15 115.11 2f4p h HIS 113 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.50 2f4p h HIS 113 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.64 2f4p h HIS 113 CO -0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.93 179.21 2f4p n LEU 114 N -3.23 0.48 0.00 0.26 4.77 -0.60 -4.96 117.00 113.73 2f4p n LEU 114 Ca -0.03 0.60 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 2f4p n LEU 114 Cb 0.08 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 40.65 2f4p n LEU 114 CO 0.22 -0.40 0.00 0.61 -1.33 0.00 0.00 177.39 176.49 2f4p n GLY 115 N 0.27 3.69 3.82 -0.72 0.00 0.00 -4.81 105.19 107.44 2f4p n GLY 115 Ca 0.03 -1.73 -0.29 0.00 0.00 0.00 0.00 46.02 44.03 2f4p n GLY 115 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2f4p s PRO 116 N -2.66 1.52 0.52 1.61 0.04 -1.26 -4.42 135.00 130.34 2f4p s PRO 116 Ca 0.00 0.29 -0.22 0.00 0.04 0.00 0.00 61.00 61.11 2f4p s PRO 116 Cb 0.00 -1.88 -0.06 0.00 0.04 0.00 0.00 34.50 32.60 2f4p s PRO 116 CO 0.00 -1.94 1.32 0.00 0.04 0.00 0.00 177.00 176.42 2f4p s ALA 117 N -3.34 2.90 -0.29 8.56 0.00 -1.26 -4.45 121.76 123.88 2f4p s ALA 117 Ca 0.63 1.26 -0.09 0.00 0.00 0.00 0.00 51.96 53.76 2f4p s ALA 117 Cb -0.14 -3.53 -0.01 0.00 0.00 0.00 0.00 23.12 19.44 2f4p s ALA 117 CO 0.52 -1.20 0.12 -2.00 0.00 0.00 0.00 175.76 173.20 2f4p s GLU 118 N -2.81 3.43 -0.18 0.00 2.12 0.79 -4.97 118.70 117.08 2f4p s GLU 118 Ca 0.69 -0.64 -0.12 0.00 0.36 0.00 0.00 54.97 55.26 2f4p s GLU 118 Cb -0.38 -3.47 -0.05 0.00 0.26 0.00 0.00 34.13 30.49 2f4p s GLU 118 CO 0.46 -0.34 0.21 -1.58 -0.54 0.00 0.00 175.26 173.47 2f4p s TRP 119 N 1.61 3.44 0.00 5.30 0.52 -1.26 -1.49 118.94 127.05 2f4p s TRP 119 Ca 0.05 0.47 0.00 0.00 0.02 0.00 0.00 56.10 56.64 2f4p s TRP 119 Cb -0.16 -2.25 0.00 0.00 -1.15 0.00 0.00 33.47 29.91 2f4p s TRP 119 CO 0.05 0.27 0.00 1.28 0.02 0.00 0.00 176.95 178.57 2f4p n LEU 120 N 3.54 0.00 -4.79 2.99 4.77 0.21 -5.00 117.00 118.73 2f4p n LEU 120 Ca -0.14 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.55 2f4p n LEU 120 Cb 0.52 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.72 2f4p n LEU 120 CO 0.38 0.00 0.71 -0.83 -1.33 0.00 0.00 177.39 176.32 2f4p s GLY 121 N 0.00 1.60 0.71 -0.72 0.00 -1.26 -4.61 107.32 103.05 2f4p s GLY 121 Ca 0.00 -0.33 -0.14 0.00 0.00 0.00 0.00 44.72 44.25 2f4p s GLY 121 CO 0.00 0.16 1.14 -0.56 0.00 0.00 0.00 173.10 173.84 2f4p s SER 122 N -3.91 4.59 -0.21 1.64 0.01 -1.26 -0.59 113.70 113.97 2f4p s SER 122 Ca 0.62 2.11 -0.25 0.00 1.31 0.00 0.00 55.95 59.73 2f4p s SER 122 Cb -0.15 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.51 2f4p s SER 122 CO 0.54 -1.99 0.86 -0.69 0.41 0.00 0.00 173.24 172.37 2f4p s VAL 123 N -2.31 4.83 0.69 3.43 1.01 -1.26 -4.70 120.40 122.08 2f4p s VAL 123 Ca 0.69 1.66 -0.12 0.00 0.00 0.00 0.00 61.98 64.21 2f4p s VAL 123 Cb -0.23 -4.15 0.01 0.00 0.00 0.00 0.00 36.38 32.01 2f4p s VAL 123 CO 0.45 -0.05 1.07 0.42 0.00 0.00 0.00 175.10 176.99 2f4p s THR 124 N 2.65 3.83 0.41 3.92 -4.23 -1.26 -4.75 115.64 116.21 2f4p s THR 124 Ca 0.37 0.66 0.17 0.00 -1.18 0.00 0.00 61.69 61.71 2f4p s THR 124 Cb -0.16 -3.30 0.38 0.00 1.34 0.00 0.00 72.50 70.77 2f4p s THR 124 CO 0.09 -0.72 1.83 1.05 -0.54 0.00 0.00 174.62 176.33 2f4p h GLU 125 N -0.53 0.41 -0.07 3.99 9.09 -1.99 0.18 114.58 125.67 2f4p h GLU 125 Ca -0.44 -0.02 -0.11 0.00 0.05 0.00 0.00 59.36 58.83 2f4p h GLU 125 Cb 1.22 -0.09 0.01 0.00 -1.65 0.00 0.00 28.75 28.23 2f4p h GLU 125 CO 0.56 0.27 -0.40 0.93 0.05 0.00 0.00 179.01 180.42 2f4p h GLU 126 N 0.43 0.40 -0.60 1.06 3.07 -1.99 -1.06 114.58 115.89 2f4p h GLU 126 Ca 0.51 -0.33 -0.03 0.00 -0.50 0.00 0.00 59.36 59.00 2f4p h GLU 126 Cb 1.25 0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 29.21 2f4p h GLU 126 CO -0.22 0.98 0.25 0.93 -1.40 0.00 0.00 179.01 179.55 2f4p h GLU 127 N -0.07 0.88 -0.26 2.33 5.08 -1.64 -1.69 114.58 119.21 2f4p h GLU 127 Ca -0.03 -0.15 -0.07 0.00 -1.00 0.00 0.00 59.36 58.11 2f4p h GLU 127 Cb 1.06 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 2f4p h GLU 127 CO 0.08 0.74 -0.09 -0.92 -1.00 0.00 0.00 179.01 177.82 2f4p h TYR 128 N 0.82 0.59 -0.06 4.33 3.20 -0.65 -1.31 116.97 123.90 2f4p h TYR 128 Ca 0.20 -0.14 0.00 0.00 3.14 0.00 0.00 58.73 61.93 2f4p h TYR 128 Cb 0.18 -0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.30 2f4p h TYR 128 CO 0.01 0.75 0.04 -0.09 -1.64 0.00 0.00 178.16 177.23 2f4p h ARG 129 N 0.26 0.08 -0.65 1.82 2.43 -1.13 -0.33 114.38 116.85 2f4p h ARG 129 Ca 0.06 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 2f4p h ARG 129 Cb 0.58 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 2f4p h ARG 129 CO 0.03 0.06 0.31 0.87 -1.51 0.00 0.00 179.97 179.73 2f4p h LYS 130 N 0.08 0.93 -0.19 0.20 1.57 -1.24 0.43 116.57 118.35 2f4p h LYS 130 Ca 0.02 -0.12 -0.10 0.00 -1.87 0.00 0.00 60.65 58.59 2f4p h LYS 130 Cb -0.01 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 2f4p h LYS 130 CO -0.00 0.72 -0.30 0.00 -0.57 0.00 0.00 179.45 179.29 2f4p h ALA 131 N 1.42 1.14 0.00 3.86 0.00 -0.86 -3.39 119.26 121.43 2f4p h ALA 131 Ca 0.23 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 2f4p h ALA 131 Cb 0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2f4p h ALA 131 CO -0.03 0.55 -1.29 0.25 0.00 0.00 0.00 179.25 178.73 2f4p n THR 132 N -4.10 0.29 -1.79 0.00 -2.24 -0.17 -4.81 114.28 101.46 2f4p n THR 132 Ca -0.01 -0.16 -0.42 0.00 -2.27 0.00 0.00 64.05 61.19 2f4p n THR 132 Cb 0.42 -0.85 -0.02 0.00 -2.10 0.00 0.00 70.33 67.78 2f4p n THR 132 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2f4p s GLU 133 N -2.10 4.14 0.00 -0.78 2.12 0.14 -1.40 118.70 120.82 2f4p s GLU 133 Ca -0.03 2.55 0.00 0.00 0.36 0.00 0.00 54.97 57.85 2f4p s GLU 133 Cb 0.01 -3.06 0.00 0.00 0.26 0.00 0.00 34.13 31.35 2f4p s GLU 133 CO 0.16 -0.65 0.00 0.41 -0.54 0.00 0.00 175.26 174.64 2f4p n GLY 134 N 2.89 0.34 0.77 -1.50 0.00 -1.26 -4.97 105.19 101.46 2f4p n GLY 134 Ca 0.11 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.23 2f4p n GLY 134 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90