#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2f4p n ASP 3 N 0.00 0.48 0.31 4.52 8.00 -1.26 -2.65 116.55 125.95 2f4p n ASP 3 Ca 0.00 0.61 0.18 0.00 0.71 0.00 0.00 54.79 56.29 2f4p n ASP 3 Cb 0.00 -0.71 1.01 0.00 -0.02 0.00 0.00 41.12 41.40 2f4p n ASP 3 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2f4p h ASP 4 N 0.00 0.00 0.38 -2.24 3.32 -2.01 -2.37 116.42 113.51 2f4p h ASP 4 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 2f4p h ASP 4 Cb 0.37 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.91 2f4p h ASP 4 CO 0.00 0.02 -0.09 -0.29 -1.72 0.00 0.00 179.24 177.15 2f4p h ILE 5 N 0.00 0.46 -3.26 0.35 6.09 -1.96 -3.44 117.51 115.75 2f4p h ILE 5 Ca -0.00 -0.47 -0.57 0.00 -1.37 0.00 0.00 64.86 62.46 2f4p h ILE 5 Cb 0.08 1.32 -0.03 0.00 0.47 0.00 0.00 36.82 38.66 2f4p h ILE 5 CO 0.00 0.09 -0.24 -0.36 -3.07 0.00 0.00 178.15 174.57 2f4p s PHE 6 N -4.15 3.46 0.04 2.19 0.08 -0.89 -5.03 117.98 113.67 2f4p s PHE 6 Ca -0.03 0.68 -0.27 0.00 0.12 0.00 0.00 56.93 57.43 2f4p s PHE 6 Cb 0.13 -2.10 -0.17 0.00 -0.57 0.00 0.00 43.02 40.31 2f4p s PHE 6 CO 0.56 0.38 1.45 1.49 -0.10 0.00 0.00 175.22 179.00 2f4p h GLU 7 N 2.77 -0.43 -0.01 0.44 4.57 -1.87 -3.34 114.58 116.71 2f4p h GLU 7 Ca -0.46 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.75 2f4p h GLU 7 Cb 1.17 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 2f4p h GLU 7 CO 0.71 -0.18 -0.22 0.54 -1.18 0.00 0.00 179.01 178.68 2f4p n ARG 8 N -5.21 2.48 0.00 1.92 1.74 -1.26 -5.11 116.66 111.21 2f4p n ARG 8 Ca -0.10 -0.48 0.00 0.00 -0.77 0.00 0.00 57.85 56.50 2f4p n ARG 8 Cb 0.25 -1.03 0.00 0.00 -1.02 0.00 0.00 32.46 30.66 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 0.90 -0.08 3.80 -0.13 0.00 -1.26 -4.36 105.19 104.07 2f4p n GLY 9 Ca 0.03 -2.28 -0.38 0.00 0.00 0.00 0.00 46.02 43.39 2f4p n GLY 9 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2f4p s SER 10 N -1.20 7.14 0.17 1.61 1.04 -0.41 -4.73 113.70 117.32 2f4p s SER 10 Ca 0.00 1.40 -0.31 0.00 0.48 0.00 0.00 55.95 57.53 2f4p s SER 10 Cb 0.00 -2.41 -0.09 0.00 0.10 0.00 0.00 66.02 63.62 2f4p s SER 10 CO 0.00 0.17 1.35 -0.75 0.98 0.00 0.00 173.24 174.99 2f4p s LYS 11 N -1.44 4.35 0.21 4.02 2.20 -1.26 -1.39 119.74 126.43 2f4p s LYS 11 Ca 0.36 2.08 -0.32 0.00 -0.36 0.00 0.00 55.97 57.73 2f4p s LYS 11 Cb -0.19 -3.21 -0.12 0.00 -1.51 0.00 0.00 37.83 32.79 2f4p s LYS 11 CO 0.22 -0.34 1.69 0.41 -0.36 0.00 0.00 175.35 176.96 2f4p n GLY 12 N 2.80 1.45 3.77 5.54 0.00 0.87 -4.91 105.19 114.71 2f4p n GLY 12 Ca 0.08 0.61 -0.39 0.00 0.00 0.00 0.00 46.02 46.32 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 1.06 6.69 0.27 1.61 0.15 -1.26 -4.77 113.70 117.45 2f4p s SER 13 Ca 0.75 2.47 0.20 0.00 0.70 0.00 0.00 55.95 60.06 2f4p s SER 13 Cb -0.53 -2.63 1.00 0.00 -1.71 0.00 0.00 66.02 62.15 2f4p s SER 13 CO 0.35 -0.57 1.60 -1.54 1.20 0.00 0.00 173.24 174.28 2f4p n SER 14 N 0.47 0.52 0.13 5.45 3.41 -1.26 -1.51 113.62 120.82 2f4p n SER 14 Ca 0.02 0.71 0.06 0.00 -0.26 0.00 0.00 58.87 59.40 2f4p n SER 14 Cb 0.44 -0.79 0.54 0.00 -0.26 0.00 0.00 64.21 64.14 2f4p n SER 14 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2f4p h ASP 15 N 0.00 0.23 0.00 4.04 5.19 -2.02 -3.35 116.42 120.51 2f4p h ASP 15 Ca 0.00 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 2f4p h ASP 15 Cb 0.09 -0.06 0.00 0.00 0.18 0.00 0.00 39.33 39.54 2f4p h ASP 15 CO 0.00 0.16 -0.61 0.49 -3.12 0.00 0.00 179.24 176.17 2f4p n PHE 16 N -4.51 0.00 -4.23 4.55 3.72 -0.57 -4.97 117.46 111.45 2f4p n PHE 16 Ca 0.00 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.21 2f4p n PHE 16 Cb 0.08 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.50 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 -1.48 1.27 -0.18 1.38 0.08 -0.59 -0.90 117.98 117.56 2f4p s PHE 17 Ca 0.00 -0.43 -0.07 0.00 0.12 0.00 0.00 56.93 56.55 2f4p s PHE 17 Cb 0.00 -0.72 -0.04 0.00 -0.57 0.00 0.00 43.02 41.69 2f4p s PHE 17 CO 0.00 0.06 0.05 0.99 -0.10 0.00 0.00 175.22 176.22 2f4p s THR 18 N -1.15 4.62 0.00 0.64 2.01 0.58 -4.29 115.64 118.05 2f4p s THR 18 Ca -0.00 -0.09 0.00 0.00 0.31 0.00 0.00 61.69 61.91 2f4p s THR 18 Cb -0.09 -3.08 0.00 0.00 0.01 0.00 0.00 72.50 69.33 2f4p s THR 18 CO 0.02 0.45 0.00 0.61 -0.69 0.00 0.00 174.62 175.01 2f4p n GLY 19 N 3.66 -1.77 3.58 4.40 0.00 -1.26 -1.22 105.19 112.58 2f4p n GLY 19 Ca -0.17 -1.38 -0.40 0.00 0.00 0.00 0.00 46.02 44.07 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 6.23 0.01 1.61 0.01 -1.26 -4.91 114.94 112.62 2f4p s ASN 20 Ca 0.00 0.09 0.01 0.00 -0.71 0.00 0.00 52.86 52.24 2f4p s ASN 20 Cb 0.00 -2.21 -0.01 0.00 0.41 0.00 0.00 41.25 39.45 2f4p s ASN 20 CO 0.00 -0.25 -0.03 -0.69 -1.51 0.00 0.00 177.10 174.61 2f4p s VAL 21 N 2.07 0.22 -0.04 1.60 1.01 -1.26 -1.74 120.40 122.26 2f4p s VAL 21 Ca 0.14 -0.32 0.03 0.00 0.00 0.00 0.00 61.98 61.84 2f4p s VAL 21 Cb -0.16 -0.23 0.00 0.00 0.00 0.00 0.00 36.38 35.99 2f4p s VAL 21 CO 0.11 -0.07 -0.14 0.26 0.00 0.00 0.00 175.10 175.26 2f4p s TRP 22 N -0.39 1.49 -0.13 5.22 0.51 -0.27 -0.09 118.94 125.29 2f4p s TRP 22 Ca -0.02 -0.44 0.02 0.00 -2.12 0.00 0.00 56.10 53.54 2f4p s TRP 22 Cb -0.03 -1.03 0.00 0.00 -0.81 0.00 0.00 33.47 31.60 2f4p s TRP 22 CO -0.00 -0.17 -0.21 0.08 -0.51 0.00 0.00 176.95 176.14 2f4p s VAL 23 N 0.19 2.23 0.00 4.03 1.01 -0.48 -1.10 120.40 126.27 2f4p s VAL 23 Ca -0.06 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 60.98 2f4p s VAL 23 Cb -0.12 -1.89 0.00 0.00 0.00 0.00 0.00 36.38 34.38 2f4p s VAL 23 CO 0.02 0.55 0.00 0.29 0.00 0.00 0.00 175.10 175.96 2f4p n LYS 24 N 3.84 3.88 0.00 2.72 4.01 0.14 -1.29 118.16 131.47 2f4p n LYS 24 Ca -0.19 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.61 2f4p n LYS 24 Cb 0.52 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.04 2f4p n LYS 24 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2f4p n LEU 26 N 0.00 0.00 -3.82 -0.35 4.77 0.83 -0.32 117.00 118.10 2f4p n LEU 26 Ca 0.00 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.70 2f4p n LEU 26 Cb 0.00 0.14 -0.16 0.00 -2.33 0.00 0.00 43.42 41.07 2f4p n LEU 26 CO 0.00 -0.16 -0.40 -0.69 -1.33 0.00 0.00 177.39 174.81 2f4p s VAL 27 N -1.32 0.85 -0.15 4.08 1.01 -0.36 -4.96 120.40 119.56 2f4p s VAL 27 Ca 0.00 -0.58 0.18 0.00 0.00 0.00 0.00 61.98 61.58 2f4p s VAL 27 Cb 0.00 -1.16 -0.10 0.00 0.00 0.00 0.00 36.38 35.12 2f4p s VAL 27 CO 0.00 -0.01 0.89 0.71 0.00 0.00 0.00 175.10 176.69 2f4p h THR 28 N 6.46 0.40 -5.94 3.92 1.35 -1.87 -0.59 112.91 116.64 2f4p h THR 28 Ca -0.20 -1.79 -0.40 0.00 -0.55 0.00 0.00 66.41 63.46 2f4p h THR 28 Cb 1.11 1.94 0.09 0.00 -1.73 0.00 0.00 68.15 69.56 2f4p h THR 28 CO 0.36 0.23 -0.74 -0.67 -0.25 0.00 0.00 175.52 174.45 2f4p n ASP 29 N -2.86 -4.35 -0.34 5.36 2.03 -1.26 -4.85 116.55 110.28 2f4p n ASP 29 Ca -0.07 -0.65 0.20 0.00 0.52 0.00 0.00 54.79 54.78 2f4p n ASP 29 Cb 0.78 -4.66 0.43 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 -2.28 0.49 -0.70 -0.67 4.11 -1.95 0.79 114.58 114.37 2f4p h GLU 30 Ca -0.58 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 58.82 2f4p h GLU 30 Cb 1.36 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2f4p h GLU 30 CO 0.57 0.32 0.00 0.09 0.07 0.00 0.00 179.01 180.07 2f4p n ASN 31 N -4.81 3.92 -1.49 3.06 3.02 -1.26 -4.96 115.26 112.73 2f4p n ASN 31 Ca 0.27 -2.07 -0.18 0.00 -0.03 0.00 0.00 54.58 52.57 2f4p n ASN 31 Cb 0.81 -0.49 -0.08 0.00 -0.61 0.00 0.00 39.78 39.42 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 1.55 1.72 0.29 7.41 0.00 0.27 -4.84 105.19 111.60 2f4p n GLY 32 Ca 0.24 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.39 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 0.63 0.00 1.61 2.07 -1.93 -3.29 116.25 115.33 2f4p h VAL 33 Ca -0.37 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.13 2f4p h VAL 33 Cb 1.21 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.99 2f4p h VAL 33 CO 0.54 0.00 -1.00 0.49 0.02 0.00 0.00 177.57 177.62 2f4p n PHE 34 N -3.98 0.00 -2.60 1.57 3.72 -1.26 -5.00 117.46 109.90 2f4p n PHE 34 Ca -0.03 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.20 2f4p n PHE 34 Cb 0.09 -0.06 -0.00 0.00 -0.94 0.00 0.00 39.48 38.56 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 -1.53 -4.58 -3.73 4.37 5.15 -1.24 -4.94 115.26 108.76 2f4p n ASN 35 Ca -0.00 0.03 -0.12 0.00 -0.60 0.00 0.00 54.58 53.88 2f4p n ASN 35 Cb 0.08 -3.83 -0.10 0.00 -0.53 0.00 0.00 39.78 35.39 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 -2.81 -0.01 0.13 -0.44 2.01 -1.26 -1.72 115.64 111.54 2f4p s THR 36 Ca 0.08 0.02 0.09 0.00 0.31 0.00 0.00 61.69 62.20 2f4p s THR 36 Cb -0.04 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.86 2f4p s THR 36 CO 0.10 0.01 -0.18 -1.10 -0.69 0.00 0.00 174.62 172.75 2f4p s GLN 37 N 0.51 1.76 -0.02 4.92 -0.21 -0.55 -4.49 119.66 121.58 2f4p s GLN 37 Ca -0.02 -1.23 0.02 0.00 0.02 0.00 0.00 55.36 54.14 2f4p s GLN 37 Cb -0.04 -2.08 0.00 0.00 1.00 0.00 0.00 33.01 31.89 2f4p s GLN 37 CO -0.03 0.47 -0.07 0.08 -2.12 0.00 0.00 175.29 173.62 2f4p s VAL 38 N -1.25 0.58 0.06 1.09 1.01 -0.23 -0.58 120.40 121.07 2f4p s VAL 38 Ca 0.19 -0.26 -0.03 0.00 0.00 0.00 0.00 61.98 61.87 2f4p s VAL 38 Cb -0.10 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.74 2f4p s VAL 38 CO 0.10 0.18 0.04 -0.72 0.00 0.00 0.00 175.10 174.71 2f4p s TYR 39 N 0.14 0.38 -0.10 5.22 -0.85 -0.17 -0.12 117.35 121.85 2f4p s TYR 39 Ca -0.02 -0.86 0.03 0.00 -0.52 0.00 0.00 57.07 55.71 2f4p s TYR 39 Cb -0.06 -0.27 0.01 0.00 0.38 0.00 0.00 41.96 42.01 2f4p s TYR 39 CO -0.00 -0.41 -0.20 0.34 -1.52 0.00 0.00 175.55 173.76 2f4p s ASP 40 N -2.75 2.71 -0.01 -0.18 2.15 0.57 -0.15 116.67 119.01 2f4p s ASP 40 Ca 0.04 -0.49 0.03 0.00 0.43 0.00 0.00 52.55 52.56 2f4p s ASP 40 Cb 0.05 -1.24 -0.01 0.00 -0.30 0.00 0.00 42.92 41.43 2f4p s ASP 40 CO -0.09 0.09 -0.12 0.68 -0.17 0.00 0.00 175.17 175.56 2f4p s VAL 41 N 0.63 0.94 -0.15 1.11 -7.23 0.17 -0.68 120.40 115.19 2f4p s VAL 41 Ca -0.13 -0.49 0.00 0.00 -1.81 0.00 0.00 61.98 59.54 2f4p s VAL 41 Cb -0.16 -0.80 -0.00 0.00 0.56 0.00 0.00 36.38 35.97 2f4p s VAL 41 CO 0.04 0.27 -0.14 0.68 -0.31 0.00 0.00 175.10 175.63 2f4p s VAL 42 N -0.17 2.76 -0.24 1.32 -7.23 -0.26 -1.60 120.40 114.99 2f4p s VAL 42 Ca 0.03 -0.74 -0.08 0.00 -1.81 0.00 0.00 61.98 59.38 2f4p s VAL 42 Cb -0.06 -2.17 -0.03 0.00 0.56 0.00 0.00 36.38 34.68 2f4p s VAL 42 CO -0.00 0.51 0.08 -0.36 -0.31 0.00 0.00 175.10 175.02 2f4p s PHE 43 N 0.74 3.13 0.79 2.82 0.40 0.37 -1.11 117.98 125.12 2f4p s PHE 43 Ca -0.06 -0.26 -0.11 0.00 -0.60 0.00 0.00 56.93 55.89 2f4p s PHE 43 Cb -0.15 -2.21 0.07 0.00 0.51 0.00 0.00 43.02 41.23 2f4p s PHE 43 CO 0.01 -0.23 1.09 -1.21 0.70 0.00 0.00 175.22 175.58 2f4p s GLU 44 N 1.36 2.11 0.17 0.44 0.41 -0.71 -1.41 118.70 121.06 2f4p s GLU 44 Ca 0.05 0.98 -0.33 0.00 -0.41 0.00 0.00 54.97 55.26 2f4p s GLU 44 Cb -0.15 -1.89 -0.15 0.00 -1.78 0.00 0.00 34.13 30.16 2f4p s GLU 44 CO 0.04 -1.69 1.30 -2.30 -0.49 0.00 0.00 175.26 172.11 2f4p n PRO 45 N -3.53 1.45 0.00 0.39 -0.02 -1.26 -1.06 135.00 130.97 2f4p n PRO 45 Ca 0.08 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2f4p n PRO 45 Cb 0.54 -2.11 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 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 2.30 2.34 3.85 -1.23 0.00 -0.17 -4.92 105.19 107.36 2f4p n GLY 46 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.27 3.33 0.05 4.61 0.00 -0.23 -4.80 121.76 122.46 2f4p s ALA 47 Ca 0.00 0.02 -0.27 0.00 0.00 0.00 0.00 51.96 51.71 2f4p s ALA 47 Cb 0.00 -2.75 0.09 0.00 0.00 0.00 0.00 23.12 20.46 2f4p s ALA 47 CO 0.00 0.34 0.86 -0.98 0.00 0.00 0.00 175.76 175.98 2f4p s ARG 48 N -2.97 0.97 0.74 0.00 3.03 -0.36 -0.47 118.95 119.89 2f4p s ARG 48 Ca 0.54 -0.40 -0.11 0.00 2.03 0.00 0.00 55.73 57.78 2f4p s ARG 48 Cb -0.10 0.42 0.04 0.00 -1.03 0.00 0.00 34.95 34.27 2f4p s ARG 48 CO 0.18 -0.43 1.09 0.95 -1.13 0.00 0.00 175.30 175.96 2f4p s THR 49 N -3.25 3.40 1.06 4.99 -4.23 -0.40 -0.31 115.64 116.89 2f4p s THR 49 Ca 0.06 0.49 -0.12 0.00 -1.18 0.00 0.00 61.69 60.94 2f4p s THR 49 Cb -0.01 -3.01 0.22 0.00 1.34 0.00 0.00 72.50 71.04 2f4p s THR 49 CO -0.07 -0.56 1.07 -1.00 -0.54 0.00 0.00 174.62 173.52 2f4p s HIS 50 N -2.81 1.74 0.34 3.99 0.09 -0.08 -4.47 115.29 114.09 2f4p s HIS 50 Ca 0.62 1.18 -0.29 0.00 -0.00 0.00 0.00 55.06 56.57 2f4p s HIS 50 Cb -0.17 -3.18 -0.11 0.00 -0.00 0.00 0.00 32.58 29.12 2f4p s HIS 50 CO 0.53 -3.29 1.50 -1.58 -0.00 0.00 0.00 174.74 171.89 2f4p s TRP 51 N -2.70 2.72 0.21 1.40 0.52 0.27 -4.57 118.94 116.78 2f4p s TRP 51 Ca 0.67 1.07 -0.23 0.00 0.02 0.00 0.00 56.10 57.62 2f4p s TRP 51 Cb -0.22 -3.98 0.06 0.00 -1.15 0.00 0.00 33.47 28.18 2f4p s TRP 51 CO 0.61 -3.02 0.91 -3.38 0.02 0.00 0.00 176.95 172.09 2f4p s HIS 52 N -0.69 -0.08 0.06 -1.98 -3.43 -0.54 -0.53 115.29 108.09 2f4p s HIS 52 Ca 0.56 -0.31 -0.04 0.00 -0.80 0.00 0.00 55.06 54.47 2f4p s HIS 52 Cb -0.46 0.69 -0.02 0.00 -1.43 0.00 0.00 32.58 31.36 2f4p s HIS 52 CO 0.56 -1.00 0.06 -1.54 -2.00 0.00 0.00 174.74 170.82 2f4p s SER 53 N -3.03 0.30 -0.14 7.38 1.04 -0.54 -1.01 113.70 117.71 2f4p s SER 53 Ca 0.14 -0.77 0.02 0.00 0.48 0.00 0.00 55.95 55.81 2f4p s SER 53 Cb -0.03 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.34 2f4p s SER 53 CO 0.05 -0.61 -0.20 -1.00 0.98 0.00 0.00 173.24 172.46 2f4p s HIS 54 N -3.54 2.69 0.45 5.02 3.76 -1.26 0.08 115.29 122.49 2f4p s HIS 54 Ca 0.03 -1.18 0.17 0.00 -0.15 0.00 0.00 55.06 53.93 2f4p s HIS 54 Cb 0.04 -1.82 1.12 0.00 1.11 0.00 0.00 32.58 33.03 2f4p s HIS 54 CO -0.09 -0.53 1.97 -1.35 -0.85 0.00 0.00 174.74 173.90 2f4p h PRO 55 N 7.19 0.31 -0.01 8.40 0.11 -1.79 0.03 132.00 146.24 2f4p h PRO 55 Ca -0.30 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2f4p h PRO 55 Cb 1.20 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2f4p h PRO 55 CO 0.54 0.20 -0.43 0.41 -0.21 0.00 0.00 178.00 178.52 2f4p n GLY 56 N -1.55 -0.36 0.00 -0.55 0.00 -1.26 -4.26 105.19 97.21 2f4p n GLY 56 Ca 0.11 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.60 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 1.40 0.05 3.41 -0.02 0.00 -0.85 -4.33 105.19 104.85 2f4p n GLY 57 Ca 0.10 -1.87 -0.16 0.00 0.00 0.00 0.00 46.02 44.09 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 -1.56 0.85 -0.09 1.61 0.74 -0.41 -2.59 119.66 118.21 2f4p s GLN 58 Ca 0.00 0.20 0.03 0.00 0.05 0.00 0.00 55.36 55.64 2f4p s GLN 58 Cb 0.00 0.40 0.01 0.00 1.10 0.00 0.00 33.01 34.51 2f4p s GLN 58 CO 0.00 -0.23 -0.19 0.42 -0.55 0.00 0.00 175.29 174.74 2f4p s ILE 59 N -0.96 1.71 -0.07 -2.34 1.01 -0.00 -0.23 121.20 120.32 2f4p s ILE 59 Ca -0.10 -0.81 0.00 0.00 0.00 0.00 0.00 60.65 59.75 2f4p s ILE 59 Cb -0.03 -1.51 -0.03 0.00 0.01 0.00 0.00 42.46 40.91 2f4p s ILE 59 CO 0.06 0.48 -0.06 -0.76 0.00 0.00 0.00 174.94 174.67 2f4p s LEU 60 N 0.55 3.24 -0.22 2.97 1.43 -0.17 -0.37 118.68 126.10 2f4p s LEU 60 Ca -0.15 0.00 -0.00 0.00 -1.03 0.00 0.00 54.13 52.95 2f4p s LEU 60 Cb -0.17 -1.71 0.06 0.00 0.03 0.00 0.00 46.19 44.40 2f4p s LEU 60 CO 0.05 0.36 -0.02 -0.63 0.23 0.00 0.00 176.35 176.34 2f4p s ILE 61 N -0.79 1.19 -0.13 -0.59 1.01 -0.10 -0.90 121.20 120.90 2f4p s ILE 61 Ca 0.12 -1.02 -0.27 0.00 0.00 0.00 0.00 60.65 59.48 2f4p s ILE 61 Cb -0.11 -1.55 -0.02 0.00 0.01 0.00 0.00 42.46 40.79 2f4p s ILE 61 CO 0.02 -0.16 0.91 -0.69 0.00 0.00 0.00 174.94 175.02 2f4p s VAL 62 N 1.55 4.85 -0.07 2.92 1.01 -0.47 -0.57 120.40 129.62 2f4p s VAL 62 Ca -0.04 1.83 0.14 0.00 0.00 0.00 0.00 61.98 63.91 2f4p s VAL 62 Cb -0.18 -4.22 -0.21 0.00 0.00 0.00 0.00 36.38 31.77 2f4p s VAL 62 CO -0.07 0.04 0.32 0.35 0.00 0.00 0.00 175.10 175.74 2f4p n THR 63 N 4.54 0.00 -3.58 3.92 -2.24 -0.19 -0.51 114.28 116.22 2f4p n THR 63 Ca 0.06 -0.31 -0.14 0.00 -2.27 0.00 0.00 64.05 61.40 2f4p n THR 63 Cb 0.49 0.25 -0.06 0.00 -2.10 0.00 0.00 70.33 68.90 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 -2.91 0.80 1.58 -0.78 3.52 -1.07 -4.80 118.95 115.30 2f4p s ARG 64 Ca -0.04 0.50 0.00 0.00 -0.13 0.00 0.00 55.73 56.06 2f4p s ARG 64 Cb 0.09 0.38 0.00 0.00 -1.56 0.00 0.00 34.95 33.86 2f4p s ARG 64 CO 0.57 -0.19 0.00 0.41 -0.81 0.00 0.00 175.30 175.29 2f4p n GLY 65 N 1.59 -0.39 2.95 8.12 0.00 -1.26 -1.45 105.19 114.75 2f4p n GLY 65 Ca -0.15 -1.46 -0.13 0.00 0.00 0.00 0.00 46.02 44.28 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 0.11 0.00 1.61 2.20 -0.34 -3.78 119.74 119.54 2f4p s LYS 66 Ca 0.00 0.33 0.00 0.00 -0.36 0.00 0.00 55.97 55.94 2f4p s LYS 66 Cb 0.00 -0.11 0.00 0.00 -1.51 0.00 0.00 37.83 36.21 2f4p s LYS 66 CO 0.00 -0.13 0.00 0.41 -0.36 0.00 0.00 175.35 175.27 2f4p n GLY 67 N 3.89 3.58 2.94 5.54 0.00 -0.33 -1.59 105.19 119.22 2f4p n GLY 67 Ca -0.23 -1.30 -0.12 0.00 0.00 0.00 0.00 46.02 44.38 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 -3.79 0.23 -0.05 1.61 0.40 0.05 0.09 117.98 116.52 2f4p s PHE 68 Ca 0.00 -0.26 0.04 0.00 -0.60 0.00 0.00 56.93 56.11 2f4p s PHE 68 Cb 0.00 -0.15 0.00 0.00 0.51 0.00 0.00 43.02 43.38 2f4p s PHE 68 CO 0.00 -0.08 -0.16 -0.47 0.70 0.00 0.00 175.22 175.21 2f4p s TYR 69 N -0.70 1.66 -0.05 0.36 5.04 0.02 -1.31 117.35 122.38 2f4p s TYR 69 Ca -0.07 -0.54 -0.02 0.00 -2.44 0.00 0.00 57.07 54.01 2f4p s TYR 69 Cb -0.05 -1.15 0.04 0.00 0.35 0.00 0.00 41.96 41.15 2f4p s TYR 69 CO -0.00 -0.22 0.11 -1.14 -1.34 0.00 0.00 175.55 172.97 2f4p s GLN 70 N 0.26 0.05 0.20 4.97 0.74 -0.63 0.26 119.66 125.51 2f4p s GLN 70 Ca -0.08 0.33 -0.15 0.00 0.05 0.00 0.00 55.36 55.51 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 0.61 -1.21 -0.55 0.00 0.00 175.29 174.00 2f4p s GLU 71 N 1.20 4.02 -0.10 1.67 2.02 -1.26 -1.18 118.70 125.07 2f4p s GLU 71 Ca -0.09 0.56 -0.38 0.00 0.02 0.00 0.00 54.97 55.09 2f4p s GLU 71 Cb -0.12 -2.82 -0.16 0.00 0.10 0.00 0.00 34.13 31.13 2f4p s GLU 71 CO -0.05 0.40 1.60 -2.13 0.02 0.00 0.00 175.26 175.09 2f4p n ARG 72 N 0.52 1.30 -0.99 1.61 0.63 -0.33 -1.34 116.66 118.07 2f4p n ARG 72 Ca -0.03 0.47 0.00 0.00 -0.92 0.00 0.00 57.85 57.38 2f4p n ARG 72 Cb 0.52 -2.16 0.00 0.00 0.45 0.00 0.00 32.46 31.27 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 3.54 0.64 3.43 5.14 0.00 -1.26 -5.02 105.19 111.65 2f4p n GLY 73 Ca 0.23 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.11 1.55 0.40 1.61 -0.14 -0.45 -5.12 119.74 117.49 2f4p s LYS 74 Ca 0.00 -1.61 -0.27 0.00 -1.36 0.00 0.00 55.97 52.73 2f4p s LYS 74 Cb 0.00 -1.73 -0.09 0.00 -1.68 0.00 0.00 37.83 34.32 2f4p s LYS 74 CO 0.00 0.35 1.38 -2.14 -0.76 0.00 0.00 175.35 174.18 2f4p s PRO 75 N -3.05 3.99 0.56 -1.68 0.02 -1.26 -4.55 135.00 129.03 2f4p s PRO 75 Ca 0.24 2.33 -0.20 0.00 0.02 0.00 0.00 61.00 63.39 2f4p s PRO 75 Cb -0.06 -2.83 -0.05 0.00 0.02 0.00 0.00 34.50 31.58 2f4p s PRO 75 CO 0.11 -0.53 1.21 0.00 -0.33 0.00 0.00 177.00 177.46 2f4p s ALA 76 N -1.19 2.67 -0.16 -1.55 0.00 -1.26 -4.70 121.76 115.57 2f4p s ALA 76 Ca 0.56 1.03 -0.05 0.00 0.00 0.00 0.00 51.96 53.49 2f4p s ALA 76 Cb -0.42 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.22 2f4p s ALA 76 CO 0.55 -1.07 0.01 0.50 0.00 0.00 0.00 175.76 175.75 2f4p s ARG 77 N -3.16 3.69 0.07 0.00 3.52 0.14 -4.96 118.95 118.26 2f4p s ARG 77 Ca 0.74 -0.43 -0.26 0.00 -0.13 0.00 0.00 55.73 55.64 2f4p s ARG 77 Cb -0.31 -3.02 -0.06 0.00 -1.56 0.00 0.00 34.95 30.01 2f4p s ARG 77 CO 0.35 0.33 0.82 0.42 -0.81 0.00 0.00 175.30 176.41 2f4p s ILE 78 N 0.17 4.63 -0.08 4.11 1.01 -1.26 -0.80 121.20 128.98 2f4p s ILE 78 Ca 0.01 1.77 0.01 0.00 0.00 0.00 0.00 60.65 62.44 2f4p s ILE 78 Cb -0.13 -4.18 -0.03 0.00 0.01 0.00 0.00 42.46 38.13 2f4p s ILE 78 CO 0.02 0.36 -0.10 -0.76 0.00 0.00 0.00 174.94 174.47 2f4p s LEU 79 N -0.13 2.99 0.27 2.97 1.43 0.11 -4.94 118.68 121.39 2f4p s LEU 79 Ca 0.41 -0.12 0.02 0.00 -1.03 0.00 0.00 54.13 53.41 2f4p s LEU 79 Cb -0.22 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 2f4p s LEU 79 CO 0.25 0.32 0.13 -0.54 0.23 0.00 0.00 176.35 176.74 2f4p s LYS 80 N -0.57 1.45 0.08 1.70 3.01 -1.26 -1.19 119.74 122.97 2f4p s LYS 80 Ca 0.08 -1.80 -0.37 0.00 -1.01 0.00 0.00 55.97 52.87 2f4p s LYS 80 Cb -0.12 -0.13 -0.17 0.00 -1.01 0.00 0.00 37.83 36.41 2f4p s LYS 80 CO 0.02 -0.37 1.35 1.17 0.51 0.00 0.00 175.35 178.02 2f4p n LYS 81 N -0.48 1.15 0.00 1.68 4.81 -1.25 -1.81 118.16 122.26 2f4p n LYS 81 Ca 0.01 0.42 0.00 0.00 -0.87 0.00 0.00 58.31 57.86 2f4p n LYS 81 Cb 0.66 -2.06 0.00 0.00 0.02 0.00 0.00 35.03 33.65 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 2.54 2.01 3.77 3.14 0.00 0.34 -4.99 105.19 111.99 2f4p n GLY 82 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.52 6.57 -0.12 1.61 1.01 -0.75 -4.80 116.67 118.68 2f4p s ASP 83 Ca 0.00 2.22 0.02 0.00 0.71 0.00 0.00 52.55 55.50 2f4p s ASP 83 Cb 0.00 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.34 2f4p s ASP 83 CO 0.00 -0.63 -0.18 -0.69 0.21 0.00 0.00 175.17 173.89 2f4p s VAL 84 N -1.52 1.68 -0.24 -1.27 1.01 -1.26 -1.37 120.40 117.43 2f4p s VAL 84 Ca 0.58 -0.76 -0.05 0.00 0.00 0.00 0.00 61.98 61.76 2f4p s VAL 84 Cb -0.27 -1.52 -0.00 0.00 0.00 0.00 0.00 36.38 34.59 2f4p s VAL 84 CO 0.34 0.48 -0.01 -0.69 0.00 0.00 0.00 175.10 175.21 2f4p s VAL 85 N 0.91 3.54 -0.38 2.92 1.01 -0.07 -4.97 120.40 123.36 2f4p s VAL 85 Ca -0.07 -0.53 -0.18 0.00 0.00 0.00 0.00 61.98 61.19 2f4p s VAL 85 Cb -0.15 -2.67 0.01 0.00 0.00 0.00 0.00 36.38 33.57 2f4p s VAL 85 CO -0.01 0.34 0.52 -1.61 0.00 0.00 0.00 175.10 174.33 2f4p s GLU 86 N 1.49 3.43 -0.41 2.72 2.02 -1.26 -1.00 118.70 125.68 2f4p s GLU 86 Ca 0.05 -0.35 -0.10 0.00 0.02 0.00 0.00 54.97 54.58 2f4p s GLU 86 Cb -0.15 -3.87 0.07 0.00 0.10 0.00 0.00 34.13 30.27 2f4p s GLU 86 CO -0.02 -0.76 0.25 0.42 0.02 0.00 0.00 175.26 175.17 2f4p s ILE 87 N 2.41 4.35 0.80 -1.63 1.01 0.68 -5.02 121.20 123.80 2f4p s ILE 87 Ca 0.18 -1.25 -0.11 0.00 0.00 0.00 0.00 60.65 59.47 2f4p s ILE 87 Cb -0.16 -3.60 0.07 0.00 0.01 0.00 0.00 42.46 38.78 2f4p s ILE 87 CO 0.14 -0.44 1.11 -2.84 0.00 0.00 0.00 174.94 172.91 2f4p s PRO 88 N 1.47 2.02 0.05 2.79 0.02 -1.26 -1.29 135.00 138.79 2f4p s PRO 88 Ca 0.03 1.27 -0.37 0.00 0.02 0.00 0.00 61.00 61.94 2f4p s PRO 88 Cb -0.22 -1.86 -0.17 0.00 0.02 0.00 0.00 34.50 32.26 2f4p s PRO 88 CO 0.03 -1.84 1.31 -2.30 -0.33 0.00 0.00 177.00 173.88 2f4p n PRO 89 N -3.61 0.94 -0.82 5.54 -0.02 -1.26 -2.15 135.00 133.62 2f4p n PRO 89 Ca 0.10 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2f4p n PRO 89 Cb 0.53 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 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 2.47 -1.17 -4.69 2.55 3.02 -0.06 -4.91 115.26 112.46 2f4p n ASN 90 Ca 0.19 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.32 2f4p n ASN 90 Cb 0.17 -1.41 -0.03 0.00 -0.61 0.00 0.00 39.78 37.90 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 -2.27 3.84 -0.07 2.41 1.01 -0.91 -4.84 120.40 119.56 2f4p s VAL 91 Ca 0.00 1.24 -0.28 0.00 0.00 0.00 0.00 61.98 62.95 2f4p s VAL 91 Cb 0.00 -3.80 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 2f4p s VAL 91 CO 0.00 0.02 0.91 -0.69 0.00 0.00 0.00 175.10 175.34 2f4p s VAL 92 N 2.01 4.88 0.25 2.92 1.01 -1.26 -4.36 120.40 125.85 2f4p s VAL 92 Ca 0.61 1.87 -0.19 0.00 0.00 0.00 0.00 61.98 64.27 2f4p s VAL 92 Cb -0.30 -4.23 0.02 0.00 0.00 0.00 0.00 36.38 31.86 2f4p s VAL 92 CO 0.26 0.12 0.63 -1.38 0.00 0.00 0.00 175.10 174.72 2f4p s HIS 93 N 1.42 -0.07 0.11 5.22 -3.43 -0.18 -1.18 115.29 117.17 2f4p s HIS 93 Ca 0.46 -0.33 0.02 0.00 -0.80 0.00 0.00 55.06 54.41 2f4p s HIS 93 Cb -0.19 0.53 -0.04 0.00 -1.43 0.00 0.00 32.58 31.45 2f4p s HIS 93 CO 0.21 -1.11 -0.06 1.67 -2.00 0.00 0.00 174.74 173.45 2f4p s TRP 94 N -3.92 0.97 0.10 0.38 1.48 -0.32 -1.47 118.94 116.15 2f4p s TRP 94 Ca 0.13 -0.90 -0.02 0.00 -1.06 0.00 0.00 56.10 54.25 2f4p s TRP 94 Cb -0.04 -0.55 -0.04 0.00 -1.16 0.00 0.00 33.47 31.69 2f4p s TRP 94 CO 0.05 -0.12 0.04 -3.38 -4.06 0.00 0.00 176.95 169.47 2f4p s HIS 95 N -3.59 0.68 -2.01 1.66 -3.43 -1.26 -1.60 115.29 105.74 2f4p s HIS 95 Ca 0.14 -1.13 0.00 0.00 -0.80 0.00 0.00 55.06 53.27 2f4p s HIS 95 Cb 0.05 -0.41 0.00 0.00 -1.43 0.00 0.00 32.58 30.79 2f4p s HIS 95 CO -0.03 -0.47 0.00 0.41 -2.00 0.00 0.00 174.74 172.64 2f4p n GLY 96 N -0.02 -1.35 3.89 -1.38 0.00 -0.42 -1.28 105.19 104.63 2f4p n GLY 96 Ca -0.09 -0.99 -0.29 0.00 0.00 0.00 0.00 46.02 44.65 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 -1.09 3.07 0.84 4.61 0.00 0.38 -0.77 121.76 128.81 2f4p s ALA 97 Ca 0.00 -0.36 -0.11 0.00 0.00 0.00 0.00 51.96 51.49 2f4p s ALA 97 Cb 0.00 -2.92 0.10 0.00 0.00 0.00 0.00 23.12 20.30 2f4p s ALA 97 CO 0.00 -0.88 1.10 0.00 0.00 0.00 0.00 175.76 175.98 2f4p s ALA 98 N -3.18 1.85 0.58 0.00 0.00 -0.62 -4.27 121.76 116.12 2f4p s ALA 98 Ca 0.55 0.29 0.32 0.00 0.00 0.00 0.00 51.96 53.13 2f4p s ALA 98 Cb -0.11 -3.31 1.89 0.00 0.00 0.00 0.00 23.12 21.59 2f4p s ALA 98 CO 0.50 -2.19 2.26 -1.35 0.00 0.00 0.00 175.76 174.98 2f4p h PRO 99 N -1.44 0.00 0.00 0.00 0.11 -1.92 -0.43 132.00 128.32 2f4p h PRO 99 Ca -0.45 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 2f4p h PRO 99 Cb 1.25 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.34 2f4p h PRO 99 CO 0.49 0.01 -0.38 -0.40 -0.21 0.00 0.00 178.00 177.51 2f4p n ASP 100 N -3.70 0.86 -3.61 -2.05 5.68 -1.26 -4.08 116.55 108.39 2f4p n ASP 100 Ca -0.03 -2.41 -0.15 0.00 -0.50 0.00 0.00 54.79 51.70 2f4p n ASP 100 Cb 0.10 -0.29 -0.07 0.00 -1.14 0.00 0.00 41.12 39.72 2f4p n ASP 100 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 2f4p s GLU 101 N -1.01 0.88 0.72 0.11 2.12 -1.23 -5.00 118.70 115.28 2f4p s GLU 101 Ca 0.13 0.59 -0.11 0.00 0.36 0.00 0.00 54.97 55.95 2f4p s GLU 101 Cb 0.13 0.42 0.02 0.00 0.26 0.00 0.00 34.13 34.96 2f4p s GLU 101 CO -0.00 -0.19 1.07 -1.83 -0.54 0.00 0.00 175.26 173.76 2f4p s GLU 102 N -0.36 2.75 -0.06 4.30 -1.05 -1.26 -2.88 118.70 120.14 2f4p s GLU 102 Ca -0.05 1.02 0.04 0.00 -0.15 0.00 0.00 54.97 55.83 2f4p s GLU 102 Cb -0.03 -1.96 0.00 0.00 -0.44 0.00 0.00 34.13 31.70 2f4p s GLU 102 CO 0.05 -1.25 -0.17 -1.17 0.95 0.00 0.00 175.26 173.66 2f4p s LEU 103 N -5.63 1.87 -0.07 1.83 2.96 -0.50 -1.20 118.68 117.93 2f4p s LEU 103 Ca 0.59 -0.38 0.04 0.00 -0.22 0.00 0.00 54.13 54.16 2f4p s LEU 103 Cb -0.15 -1.02 0.00 0.00 0.50 0.00 0.00 46.19 45.52 2f4p s LEU 103 CO 0.55 0.12 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.82 2f4p s VAL 104 N 0.30 1.62 0.05 1.68 1.01 -0.53 -0.48 120.40 124.04 2f4p s VAL 104 Ca -0.10 -0.78 -0.15 0.00 0.00 0.00 0.00 61.98 60.95 2f4p s VAL 104 Cb -0.14 -1.42 0.02 0.00 0.00 0.00 0.00 36.38 34.85 2f4p s VAL 104 CO 0.04 0.46 0.33 -1.38 0.00 0.00 0.00 175.10 174.55 2f4p s HIS 105 N 0.33 -0.14 0.10 5.22 -3.43 -0.62 -1.03 115.29 115.72 2f4p s HIS 105 Ca -0.13 0.01 -0.24 0.00 -0.80 0.00 0.00 55.06 53.91 2f4p s HIS 105 Cb -0.15 0.13 -0.07 0.00 -1.43 0.00 0.00 32.58 31.06 2f4p s HIS 105 CO 0.05 -0.53 0.72 0.42 -2.00 0.00 0.00 174.74 173.40 2f4p s ILE 106 N -2.62 4.59 -0.03 -5.38 1.01 0.27 -0.66 121.20 118.39 2f4p s ILE 106 Ca -0.04 1.55 0.07 0.00 0.00 0.00 0.00 60.65 62.23 2f4p s ILE 106 Cb -0.01 -4.07 -0.02 0.00 0.01 0.00 0.00 42.46 38.37 2f4p s ILE 106 CO -0.04 0.47 -0.24 -0.83 0.00 0.00 0.00 174.94 174.31 2f4p s GLY 107 N -0.72 1.32 -0.21 6.18 0.00 0.79 -0.92 107.32 113.76 2f4p s GLY 107 Ca 0.35 -1.09 0.02 0.00 0.00 0.00 0.00 44.72 44.00 2f4p s GLY 107 CO 0.23 -0.89 -0.13 -0.42 0.00 0.00 0.00 173.10 171.89 2f4p s ILE 108 N -0.63 1.93 -0.39 0.90 1.01 0.50 -0.99 121.20 123.53 2f4p s ILE 108 Ca 0.10 -1.20 -0.22 0.00 0.00 0.00 0.00 60.65 59.32 2f4p s ILE 108 Cb -0.10 -1.95 0.01 0.00 0.01 0.00 0.00 42.46 40.44 2f4p s ILE 108 CO -0.01 0.20 0.74 -0.44 0.00 0.00 0.00 174.94 175.44 2f4p s SER 109 N 1.27 6.47 0.28 3.58 0.01 0.25 -0.82 113.70 124.74 2f4p s SER 109 Ca -0.02 0.13 -0.05 0.00 1.31 0.00 0.00 55.95 57.33 2f4p s SER 109 Cb -0.17 -2.37 -0.05 0.00 0.21 0.00 0.00 66.02 63.64 2f4p s SER 109 CO -0.08 -0.76 0.54 0.42 0.41 0.00 0.00 173.24 173.77 2f4p s THR 110 N 3.05 5.03 -1.33 1.44 -4.23 -1.07 -1.49 115.64 117.05 2f4p s THR 110 Ca 0.29 0.04 -0.06 0.00 -1.18 0.00 0.00 61.69 60.78 2f4p s THR 110 Cb -0.13 -3.73 -0.00 0.00 1.34 0.00 0.00 72.50 69.98 2f4p s THR 110 CO 0.18 -0.31 0.54 0.00 -0.54 0.00 0.00 174.62 174.49 2f4p n GLN 111 N -0.91 -2.89 -0.01 3.99 6.02 -0.86 -4.06 117.38 118.67 2f4p n GLN 111 Ca -0.02 0.43 0.12 0.00 -0.01 0.00 0.00 57.00 57.52 2f4p n GLN 111 Cb 0.54 -4.45 0.55 0.00 1.02 0.00 0.00 30.24 27.90 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 -1.87 0.90 0.00 5.09 2.07 -1.56 -1.34 116.25 119.54 2f4p h VAL 112 Ca -0.64 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 66.79 2f4p h VAL 112 Cb 1.37 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 31.73 2f4p h VAL 112 CO 0.58 0.05 0.00 -0.74 0.02 0.00 0.00 177.57 177.48 2f4p h HIS 113 N 0.28 0.00 0.00 1.57 -0.00 -1.88 -0.58 115.15 114.54 2f4p h HIS 113 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.59 2f4p h HIS 113 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.92 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 -2.95 0.41 0.00 0.26 4.77 -0.50 -4.96 117.00 114.03 2f4p n LEU 114 Ca -0.02 0.58 0.00 0.00 -0.03 0.00 0.00 56.01 56.53 2f4p n LEU 114 Cb 0.09 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.69 2f4p n LEU 114 CO 0.19 -0.31 0.00 0.61 -1.33 0.00 0.00 177.39 176.55 2f4p n GLY 115 N 0.51 3.30 3.88 -0.72 0.00 -0.23 -4.80 105.19 107.13 2f4p n GLY 115 Ca 0.04 -1.79 -0.30 0.00 0.00 0.00 0.00 46.02 43.97 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 -2.24 2.43 0.51 1.61 0.04 -1.26 -4.49 135.00 131.60 2f4p s PRO 116 Ca 0.00 0.37 -0.23 0.00 0.04 0.00 0.00 61.00 61.18 2f4p s PRO 116 Cb 0.00 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.50 2f4p s PRO 116 CO 0.00 -1.32 1.30 0.00 0.04 0.00 0.00 177.00 177.02 2f4p n ALA 117 N -3.18 1.39 -3.02 8.56 0.00 -1.26 -4.47 120.51 118.53 2f4p n ALA 117 Ca 0.07 0.16 -0.37 0.00 0.00 0.00 0.00 53.44 53.30 2f4p n ALA 117 Cb 0.58 -2.31 -0.12 0.00 0.00 0.00 0.00 19.45 17.60 2f4p n ALA 117 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2f4p s GLU 118 N -2.66 3.44 -0.19 0.00 2.12 0.11 -4.98 118.70 116.54 2f4p s GLU 118 Ca 0.68 -0.63 -0.12 0.00 0.36 0.00 0.00 54.97 55.27 2f4p s GLU 118 Cb -0.44 -3.42 -0.05 0.00 0.26 0.00 0.00 34.13 30.48 2f4p s GLU 118 CO 0.52 -0.31 0.21 -1.58 -0.54 0.00 0.00 175.26 173.55 2f4p s TRP 119 N 1.59 3.42 0.00 5.30 0.52 -1.26 -1.46 118.94 127.05 2f4p s TRP 119 Ca 0.05 0.44 0.00 0.00 0.02 0.00 0.00 56.10 56.61 2f4p s TRP 119 Cb -0.16 -2.26 0.00 0.00 -1.15 0.00 0.00 33.47 29.90 2f4p s TRP 119 CO 0.04 0.24 0.00 1.28 0.02 0.00 0.00 176.95 178.53 2f4p n LEU 120 N 3.64 0.00 -4.84 2.99 4.77 0.31 -5.00 117.00 118.87 2f4p n LEU 120 Ca -0.14 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.54 2f4p n LEU 120 Cb 0.52 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.67 2f4p n LEU 120 CO 0.38 0.00 0.73 -0.83 -1.33 0.00 0.00 177.39 176.34 2f4p s GLY 121 N 0.00 1.63 0.77 -0.72 0.00 -1.26 -4.63 107.32 103.12 2f4p s GLY 121 Ca 0.00 -0.24 -0.14 0.00 0.00 0.00 0.00 44.72 44.34 2f4p s GLY 121 CO 0.00 0.15 1.22 -0.56 0.00 0.00 0.00 173.10 173.91 2f4p s SER 122 N -4.12 3.81 -0.29 1.64 0.01 -1.26 -0.57 113.70 112.93 2f4p s SER 122 Ca 0.59 2.41 -0.25 0.00 1.31 0.00 0.00 55.95 60.01 2f4p s SER 122 Cb -0.13 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.51 2f4p s SER 122 CO 0.53 -2.52 0.85 -0.69 0.41 0.00 0.00 173.24 171.82 2f4p s VAL 123 N -2.01 4.75 0.83 3.43 1.01 -1.26 -4.68 120.40 122.47 2f4p s VAL 123 Ca 0.75 1.39 -0.11 0.00 0.00 0.00 0.00 61.98 64.01 2f4p s VAL 123 Cb -0.30 -4.19 0.09 0.00 0.00 0.00 0.00 36.38 31.98 2f4p s VAL 123 CO 0.48 -0.24 1.09 0.42 0.00 0.00 0.00 175.10 176.85 2f4p s THR 124 N 3.05 3.01 0.35 3.92 -4.23 -1.26 -4.76 115.64 115.72 2f4p s THR 124 Ca 0.35 0.33 0.03 0.00 -1.18 0.00 0.00 61.69 61.23 2f4p s THR 124 Cb -0.14 -2.89 0.22 0.00 1.34 0.00 0.00 72.50 71.02 2f4p s THR 124 CO 0.11 -0.43 1.96 -0.33 -0.54 0.00 0.00 174.62 175.39 2f4p h GLU 125 N -1.28 0.68 -0.23 3.99 4.39 -1.98 0.11 114.58 120.25 2f4p h GLU 125 Ca -0.47 -0.08 -0.04 0.00 0.34 0.00 0.00 59.36 59.11 2f4p h GLU 125 Cb 1.26 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.77 2f4p h GLU 125 CO 0.55 0.54 0.00 0.93 -1.16 0.00 0.00 179.01 179.87 2f4p h GLU 126 N 0.68 0.40 -0.51 2.33 3.07 -1.98 0.23 114.58 118.79 2f4p h GLU 126 Ca 0.17 -0.13 0.03 0.00 -0.50 0.00 0.00 59.36 58.93 2f4p h GLU 126 Cb 0.09 -0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 27.93 2f4p h GLU 126 CO -0.02 0.58 0.29 0.93 -1.40 0.00 0.00 179.01 179.39 2f4p h GLU 127 N 0.17 0.56 -0.11 2.33 5.08 -1.79 -0.06 114.58 120.75 2f4p h GLU 127 Ca 0.06 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2f4p h GLU 127 Cb 0.40 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 2f4p h GLU 127 CO 0.01 0.37 -0.04 -0.92 -1.00 0.00 0.00 179.01 177.42 2f4p h TYR 128 N 0.57 0.26 -0.25 4.33 3.20 -0.60 -0.54 116.97 123.94 2f4p h TYR 128 Ca 0.21 -0.06 0.04 0.00 3.14 0.00 0.00 58.73 62.05 2f4p h TYR 128 Cb 0.05 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 2f4p h TYR 128 CO -0.08 0.56 0.03 -0.09 -1.64 0.00 0.00 178.16 176.95 2f4p h ARG 129 N -0.11 0.11 -0.58 1.82 2.43 -0.47 0.38 114.38 117.96 2f4p h ARG 129 Ca 0.03 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.14 2f4p h ARG 129 Cb 0.49 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.99 2f4p h ARG 129 CO 0.01 0.07 0.14 0.87 -1.51 0.00 0.00 179.97 179.56 2f4p h LYS 130 N 0.12 0.89 -0.30 0.20 1.57 -0.86 0.54 116.57 118.73 2f4p h LYS 130 Ca 0.11 -0.19 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 2f4p h LYS 130 Cb 0.13 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 2f4p h LYS 130 CO -0.17 0.79 -0.14 0.00 -0.57 0.00 0.00 179.45 179.37 2f4p h ALA 131 N 1.30 1.21 0.00 3.86 0.00 -0.61 -3.39 119.26 121.62 2f4p h ALA 131 Ca 0.19 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2f4p h ALA 131 Cb 0.30 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2f4p h ALA 131 CO -0.00 0.51 -1.20 0.25 0.00 0.00 0.00 179.25 178.81 2f4p n THR 132 N -4.19 0.18 -1.68 0.00 -2.24 0.08 -4.80 114.28 101.63 2f4p n THR 132 Ca 0.01 -0.12 -0.45 0.00 -2.27 0.00 0.00 64.05 61.22 2f4p n THR 132 Cb 0.34 -0.80 -0.04 0.00 -2.10 0.00 0.00 70.33 67.73 2f4p n THR 132 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2f4p n GLU 133 N -2.06 2.35 -0.99 -0.78 1.02 0.18 -1.61 120.64 118.74 2f4p n GLU 133 Ca -0.04 0.85 0.00 0.00 -0.02 0.00 0.00 57.16 57.94 2f4p n GLU 133 Cb 0.55 -2.64 0.00 0.00 -0.02 0.00 0.00 31.44 29.33 2f4p n GLU 133 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2f4p n GLY 134 N 3.61 0.36 0.86 0.62 0.00 -1.26 -4.99 105.19 104.39 2f4p n GLY 134 Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.30 2f4p n GLY 134 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60