#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4fis h LEU 27 N 0.00 0.22 -2.20 1.53 5.85 -2.06 -2.45 115.31 116.20 4fis h LEU 27 Ca 0.00 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 4fis h LEU 27 Cb 0.00 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 40.97 4fis h LEU 27 CO 0.00 0.62 -0.06 0.08 -0.34 0.00 0.00 178.44 178.74 4fis h ARG 28 N 0.18 0.00 0.00 1.25 0.11 -2.05 0.05 114.38 113.92 4fis h ARG 28 Ca 0.02 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.06 4fis h ARG 28 Cb 0.82 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.90 4fis h ARG 28 CO 0.06 0.06 -0.19 -0.44 0.10 0.00 0.00 179.97 179.56 4fis h ASP 29 N 0.00 0.00 0.36 0.08 5.19 -1.87 -0.85 116.42 119.33 4fis h ASP 29 Ca -0.00 0.00 -0.30 0.00 -0.62 0.00 0.00 57.03 56.11 4fis h ASP 29 Cb 0.18 0.00 0.02 0.00 0.18 0.00 0.00 39.33 39.71 4fis h ASP 29 CO 0.01 0.19 -1.29 0.28 -3.12 0.00 0.00 179.24 175.31 4fis h SER 30 N 0.00 0.68 0.02 6.45 0.02 -1.06 0.53 113.55 120.19 4fis h SER 30 Ca -0.00 -0.69 -0.00 0.00 -0.84 0.00 0.00 61.79 60.26 4fis h SER 30 Cb 0.65 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.97 4fis h SER 30 CO 0.02 1.52 -0.01 0.58 -1.14 0.00 0.00 176.83 177.80 4fis h VAL 31 N 0.16 1.37 -0.67 2.27 2.07 -1.32 0.33 116.25 120.47 4fis h VAL 31 Ca -0.18 -1.25 0.13 0.00 0.82 0.00 0.00 66.70 66.22 4fis h VAL 31 Cb 1.98 2.20 -0.09 0.00 -1.52 0.00 0.00 31.29 33.86 4fis h VAL 31 CO 0.23 0.32 0.20 0.11 0.02 0.00 0.00 177.57 178.45 4fis h LYS 32 N -0.58 0.32 -0.14 1.57 1.57 -1.16 -0.37 116.57 117.79 4fis h LYS 32 Ca -0.00 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 4fis h LYS 32 Cb 0.54 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 4fis h LYS 32 CO 0.01 0.21 0.01 0.37 -0.57 0.00 0.00 179.45 179.48 4fis h GLN 33 N 0.33 0.23 -0.95 3.15 5.75 -0.86 -1.25 115.11 121.52 4fis h GLN 33 Ca 0.36 -0.07 0.11 0.00 -0.15 0.00 0.00 58.65 58.90 4fis h GLN 33 Cb 0.54 -0.02 -0.08 0.00 1.07 0.00 0.00 27.48 28.98 4fis h GLN 33 CO -0.41 0.44 0.58 0.00 -2.65 0.00 0.00 178.83 176.79 4fis h ALA 34 N 0.78 1.39 -0.03 3.38 0.00 -0.17 -1.67 119.26 122.95 4fis h ALA 34 Ca 0.04 0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.74 4fis h ALA 34 Cb 0.32 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 17.93 4fis h ALA 34 CO 0.00 0.20 -0.91 -0.07 0.00 0.00 0.00 179.25 178.47 4fis h LEU 35 N 0.94 0.68 -1.51 0.00 -0.00 -0.88 0.46 115.31 115.00 4fis h LEU 35 Ca 0.46 -0.51 -0.05 0.00 -0.00 0.00 0.00 57.88 57.78 4fis h LEU 35 Cb 0.42 -0.20 -0.01 0.00 -0.00 0.00 0.00 40.66 40.87 4fis h LEU 35 CO -0.25 1.30 -0.25 0.07 -0.00 0.00 0.00 178.44 179.31 4fis h LYS 36 N 0.32 0.00 0.00 1.13 2.10 -0.65 0.16 116.57 119.63 4fis h LYS 36 Ca -0.08 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.49 4fis h LYS 36 Cb 1.54 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.86 4fis h LYS 36 CO 0.17 0.25 -0.40 -0.91 -2.00 0.00 0.00 179.45 176.56 4fis h ASN 37 N 0.00 0.00 0.16 7.07 4.21 -1.08 -2.63 115.58 123.31 4fis h ASN 37 Ca -0.00 0.00 -0.24 0.00 1.21 0.00 0.00 56.30 57.27 4fis h ASN 37 Cb 0.53 0.00 0.03 0.00 -1.12 0.00 0.00 38.32 37.75 4fis h ASN 37 CO 0.03 0.40 -1.03 0.22 -1.29 0.00 0.00 177.43 175.76 4fis h TYR 38 N 0.00 0.73 0.06 1.19 3.20 0.56 -3.29 116.97 119.42 4fis h TYR 38 Ca -0.00 -0.51 0.00 0.00 3.14 0.00 0.00 58.73 61.36 4fis h TYR 38 Cb 1.12 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 39.34 4fis h TYR 38 CO 0.00 1.39 -0.06 0.74 -1.64 0.00 0.00 178.16 178.59 4fis h PHE 39 N -0.12 -0.15 -0.77 -3.82 0.04 -0.76 -3.04 116.94 108.32 4fis h PHE 39 Ca -0.17 0.00 0.15 0.00 2.80 0.00 0.00 57.97 60.75 4fis h PHE 39 Cb 1.79 0.06 -0.15 0.00 2.20 0.00 0.00 35.95 39.85 4fis h PHE 39 CO 0.16 -0.09 -0.19 0.00 -0.60 0.00 0.00 178.31 177.59 4fis h ALA 40 N 0.81 0.51 0.00 2.45 0.00 -1.57 0.51 119.26 121.96 4fis h ALA 40 Ca 0.01 0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.21 4fis h ALA 40 Cb 0.13 0.58 0.00 0.00 0.00 0.00 0.00 17.79 18.50 4fis h ALA 40 CO -0.02 -0.41 0.00 0.00 0.00 0.00 0.00 179.25 178.82 4fis n GLN 41 N -5.50 0.18 -0.26 0.00 -0.00 -1.16 -3.43 117.38 107.22 4fis n GLN 41 Ca 0.11 0.50 0.14 0.00 -0.00 0.00 0.00 57.00 57.74 4fis n GLN 41 Cb 0.39 -1.91 0.42 0.00 -0.00 0.00 0.00 30.24 29.14 4fis n GLN 41 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 4fis h LEU 42 N 0.00 0.57 -1.31 2.61 3.38 0.10 -3.46 115.31 117.20 4fis h LEU 42 Ca 0.00 0.04 -0.59 0.00 0.09 0.00 0.00 57.88 57.42 4fis h LEU 42 Cb 0.25 -0.07 -0.29 0.00 0.09 0.00 0.00 40.66 40.65 4fis h LEU 42 CO 0.00 0.27 -0.89 -0.46 0.09 0.00 0.00 178.44 177.45 4fis n ASN 43 N -4.55 -1.96 -0.96 -0.43 2.04 -1.22 -1.21 115.26 106.96 4fis n ASN 43 Ca 0.18 -1.16 -0.13 0.00 -0.44 0.00 0.00 54.58 53.04 4fis n ASN 43 Cb 0.54 -2.09 -0.05 0.00 -2.53 0.00 0.00 39.78 35.65 4fis n ASN 43 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 4fis n GLY 44 N -1.40 1.31 3.82 4.83 0.00 -1.26 -5.03 105.19 107.45 4fis n GLY 44 Ca 0.03 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 4fis n GLY 44 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 4fis s GLN 45 N -2.97 4.25 0.07 1.61 -2.07 -0.35 -5.05 119.66 115.15 4fis s GLN 45 Ca 0.00 0.96 -0.03 0.00 -1.82 0.00 0.00 55.36 54.47 4fis s GLN 45 Cb 0.00 -2.63 -0.05 0.00 -1.09 0.00 0.00 33.01 29.24 4fis s GLN 45 CO 0.00 0.24 0.27 0.16 -1.32 0.00 0.00 175.29 174.64 4fis s ASP 46 N -1.89 6.43 -0.13 12.60 1.47 -1.26 -5.00 116.67 128.88 4fis s ASP 46 Ca 0.51 0.43 -0.07 0.00 1.18 0.00 0.00 52.55 54.60 4fis s ASP 46 Cb -0.14 -2.03 -0.04 0.00 -0.34 0.00 0.00 42.92 40.37 4fis s ASP 46 CO 0.19 0.16 0.10 -0.69 0.68 0.00 0.00 175.17 175.61 4fis s VAL 47 N -1.50 5.18 -0.07 2.11 1.01 -1.26 -5.04 120.40 120.83 4fis s VAL 47 Ca 0.35 0.09 0.25 0.00 0.00 0.00 0.00 61.98 62.67 4fis s VAL 47 Cb -0.13 -3.27 0.45 0.00 0.00 0.00 0.00 36.38 33.43 4fis s VAL 47 CO 0.24 0.57 1.15 -0.46 0.00 0.00 0.00 175.10 176.60 4fis n ASN 48 N 2.42 1.16 -0.20 3.32 6.94 -1.26 -4.89 115.26 122.76 4fis n ASN 48 Ca -0.19 -2.02 0.00 0.00 -0.02 0.00 0.00 54.58 52.35 4fis n ASN 48 Cb 0.54 -0.35 0.00 0.00 -2.36 0.00 0.00 39.78 37.61 4fis n ASN 48 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 4fis n ASP 49 N 0.20 0.00 -0.11 0.53 5.75 -1.26 -4.96 116.55 116.69 4fis n ASP 49 Ca 0.06 -1.08 0.19 0.00 -0.01 0.00 0.00 54.79 53.95 4fis n ASP 49 Cb 1.06 -0.02 0.59 0.00 -1.03 0.00 0.00 41.12 41.72 4fis n ASP 49 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 4fis h LEU 50 N 0.00 0.22 -0.07 -2.12 3.38 -1.99 -2.29 115.31 112.43 4fis h LEU 50 Ca 0.00 0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.82 4fis h LEU 50 Cb 1.03 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.76 4fis h LEU 50 CO 0.00 0.11 -0.60 0.22 0.09 0.00 0.00 178.44 178.25 4fis h TYR 51 N 0.23 0.74 -0.13 1.13 3.20 -1.99 -2.14 116.97 118.01 4fis h TYR 51 Ca 0.34 -0.35 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 4fis h TYR 51 Cb 1.02 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 39.18 4fis h TYR 51 CO -0.00 1.15 -0.05 1.49 -1.64 0.00 0.00 178.16 179.11 4fis h GLU 52 N 0.12 0.27 -0.62 1.82 4.22 -1.87 -0.12 114.58 118.40 4fis h GLU 52 Ca -0.06 -0.11 0.13 0.00 0.08 0.00 0.00 59.36 59.40 4fis h GLU 52 Cb 1.26 -0.01 -0.10 0.00 0.50 0.00 0.00 28.75 30.40 4fis h GLU 52 CO 0.12 0.58 0.01 1.25 -2.18 0.00 0.00 179.01 178.79 4fis h LEU 53 N -0.06 -0.26 -0.35 1.64 6.46 -1.48 -0.16 115.31 121.10 4fis h LEU 53 Ca 0.03 0.15 -0.11 0.00 -0.12 0.00 0.00 57.88 57.83 4fis h LEU 53 Cb 0.49 0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 40.68 4fis h LEU 53 CO 0.02 -0.11 -0.55 0.58 -0.62 0.00 0.00 178.44 177.76 4fis h VAL 54 N 0.12 1.03 0.41 1.05 2.07 -1.24 -3.10 116.25 116.60 4fis h VAL 54 Ca 0.32 -2.18 -0.02 0.00 0.82 0.00 0.00 66.70 65.65 4fis h VAL 54 Cb 0.53 2.31 0.00 0.00 -1.52 0.00 0.00 31.29 32.61 4fis h VAL 54 CO -0.53 0.53 -0.19 -0.07 0.02 0.00 0.00 177.57 177.33 4fis h LEU 55 N 0.00 -0.46 -1.00 2.57 3.38 0.62 -2.91 115.31 117.51 4fis h LEU 55 Ca -0.01 -0.09 0.38 0.00 0.09 0.00 0.00 57.88 58.26 4fis h LEU 55 Cb 1.27 0.12 -0.17 0.00 0.09 0.00 0.00 40.66 41.97 4fis h LEU 55 CO 0.07 -0.03 0.53 0.00 0.09 0.00 0.00 178.44 179.10 4fis h ALA 56 N -0.84 2.06 0.00 1.53 0.00 -1.17 0.23 119.26 121.07 4fis h ALA 56 Ca -0.06 0.25 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 4fis h ALA 56 Cb 0.52 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 4fis h ALA 56 CO 0.09 -0.82 -0.26 1.49 0.00 0.00 0.00 179.25 179.75 4fis h GLU 57 N 0.10 0.00 0.00 0.00 4.57 -1.49 -2.96 114.58 114.80 4fis h GLU 57 Ca 0.80 0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 58.80 4fis h GLU 57 Cb 2.02 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 30.58 4fis h GLU 57 CO -0.72 0.26 -1.96 1.55 -1.18 0.00 0.00 179.01 176.95 4fis n VAL 58 N -3.25 0.68 -0.02 0.32 3.14 -0.22 -4.51 118.33 114.47 4fis n VAL 58 Ca 0.02 -0.56 -0.17 0.00 -2.96 0.00 0.00 64.34 60.67 4fis n VAL 58 Cb 0.55 -0.33 -0.09 0.00 -1.06 0.00 0.00 33.84 32.91 4fis n VAL 58 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 4fis h GLU 59 N 0.00 0.56 -0.17 1.45 5.08 -0.61 -2.58 114.58 118.31 4fis h GLU 59 Ca -0.27 -0.49 -0.17 0.00 -1.00 0.00 0.00 59.36 57.43 4fis h GLU 59 Cb 1.53 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.88 4fis h GLU 59 CO 0.01 1.12 -0.59 0.37 -1.00 0.00 0.00 179.01 178.92 4fis h GLN 60 N 0.17 0.57 -0.17 2.33 4.15 -1.75 0.23 115.11 120.63 4fis h GLN 60 Ca -0.05 -0.38 0.00 0.00 0.77 0.00 0.00 58.65 58.99 4fis h GLN 60 Cb 1.26 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.99 4fis h GLN 60 CO 0.12 0.99 0.11 -1.35 -1.93 0.00 0.00 178.83 176.78 4fis h PRO 61 N 0.43 0.22 -0.59 -2.39 0.11 -1.79 -2.45 132.00 125.53 4fis h PRO 61 Ca -0.00 -0.01 0.11 0.00 0.11 0.00 0.00 66.00 66.21 4fis h PRO 61 Cb 1.14 -0.05 -0.12 0.00 0.11 0.00 0.00 31.00 32.09 4fis h PRO 61 CO 0.11 0.15 -0.29 1.25 -0.21 0.00 0.00 178.00 179.01 4fis h LEU 62 N 0.23 -1.00 -0.51 2.35 5.85 -1.30 -0.11 115.31 120.82 4fis h LEU 62 Ca 0.06 0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.96 4fis h LEU 62 Cb -0.03 0.52 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 4fis h LEU 62 CO -0.01 -0.28 0.17 0.25 -0.34 0.00 0.00 178.44 178.23 4fis h LEU 63 N -0.13 0.73 -0.34 2.25 5.85 -0.91 -1.02 115.31 121.75 4fis h LEU 63 Ca 0.25 -0.20 -0.19 0.00 0.84 0.00 0.00 57.88 58.58 4fis h LEU 63 Cb 0.53 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.37 4fis h LEU 63 CO -0.67 0.73 -0.68 -2.24 -0.34 0.00 0.00 178.44 175.24 4fis h ASP 64 N 0.69 0.72 -0.30 1.25 2.03 -1.27 -2.22 116.42 117.32 4fis h ASP 64 Ca 0.17 -0.44 -0.12 0.00 -0.73 0.00 0.00 57.03 55.90 4fis h ASP 64 Cb 0.25 -0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 38.53 4fis h ASP 64 CO -0.01 1.21 -0.25 0.24 -1.03 0.00 0.00 179.24 179.40 4fis h MET 65 N 0.44 0.79 -0.35 4.15 2.86 -0.90 -1.81 114.93 120.12 4fis h MET 65 Ca -0.02 -0.33 -0.13 0.00 -2.06 0.00 0.00 59.70 57.16 4fis h MET 65 Cb 1.27 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.90 4fis h MET 65 CO 0.13 0.96 -0.27 0.28 1.06 0.00 0.00 176.91 179.07 4fis h VAL 66 N 0.69 1.29 -0.25 -2.22 2.07 -1.24 -2.74 116.25 113.84 4fis h VAL 66 Ca 0.09 -1.43 0.02 0.00 0.82 0.00 0.00 66.70 66.20 4fis h VAL 66 Cb 0.77 1.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.95 4fis h VAL 66 CO 0.06 0.47 0.12 0.24 0.02 0.00 0.00 177.57 178.48 4fis h MET 67 N 0.59 0.25 -0.15 1.57 2.86 -1.35 0.62 114.93 119.32 4fis h MET 67 Ca 0.07 -0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.71 4fis h MET 67 Cb 0.84 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.43 4fis h MET 67 CO 0.07 0.17 0.03 1.96 1.06 0.00 0.00 176.91 180.19 4fis h GLN 68 N 0.26 0.09 -0.03 1.72 4.20 -1.40 0.25 115.11 120.19 4fis h GLN 68 Ca 0.10 -0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.83 4fis h GLN 68 Cb 0.03 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 4fis h GLN 68 CO -0.07 0.06 -0.07 -0.92 -0.67 0.00 0.00 178.83 177.16 4fis h TYR 69 N 0.09 -0.16 -0.09 2.96 3.20 -1.41 -1.55 116.97 120.00 4fis h TYR 69 Ca 0.07 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.95 4fis h TYR 69 Cb 0.06 0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.41 4fis h TYR 69 CO -0.13 -0.10 0.00 0.25 -1.64 0.00 0.00 178.16 176.54 4fis n THR 70 N -5.19 0.39 -3.96 1.81 -2.24 0.20 -4.84 114.28 100.45 4fis n THR 70 Ca -0.05 -0.21 -0.25 0.00 -2.27 0.00 0.00 64.05 61.27 4fis n THR 70 Cb 0.12 -0.40 -0.02 0.00 -2.10 0.00 0.00 70.33 67.93 4fis n THR 70 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 4fis n ARG 71 N 0.06 -3.29 -0.96 -0.78 1.74 -0.58 -1.02 116.66 111.82 4fis n ARG 71 Ca 0.04 0.40 0.00 0.00 -0.77 0.00 0.00 57.85 57.53 4fis n ARG 71 Cb 0.36 -4.54 0.00 0.00 -1.02 0.00 0.00 32.46 27.26 4fis n ARG 71 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 4fis n GLY 72 N -1.98 0.46 3.51 -0.13 0.00 0.78 -4.95 105.19 102.88 4fis n GLY 72 Ca -0.31 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 4fis n GLY 72 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 4fis s ASN 73 N -2.19 6.28 0.22 1.61 3.84 -0.19 -4.90 114.94 119.60 4fis s ASN 73 Ca 0.00 -0.98 -0.12 0.00 0.21 0.00 0.00 52.86 51.97 4fis s ASN 73 Cb 0.00 -2.50 0.28 0.00 -0.55 0.00 0.00 41.25 38.48 4fis s ASN 73 CO 0.00 -1.57 1.63 1.56 -2.79 0.00 0.00 177.10 175.93 4fis h GLN 74 N 9.72 0.03 -0.06 0.43 4.20 -1.92 -0.77 115.11 126.73 4fis h GLN 74 Ca -0.14 -0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.38 4fis h GLN 74 Cb 1.05 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.81 4fis h GLN 74 CO 1.26 0.02 -0.76 1.15 -0.67 0.00 0.00 178.83 179.83 4fis h THR 75 N 0.03 1.40 -0.54 -0.54 2.02 -1.98 0.31 112.91 113.61 4fis h THR 75 Ca 0.33 -2.21 -0.02 0.00 0.77 0.00 0.00 66.41 65.27 4fis h THR 75 Cb 0.51 2.17 -0.03 0.00 -1.74 0.00 0.00 68.15 69.07 4fis h THR 75 CO -0.64 0.66 0.24 0.03 0.37 0.00 0.00 175.52 176.18 4fis h ARG 76 N 0.24 0.76 -0.11 6.66 2.47 -1.80 -2.12 114.38 120.48 4fis h ARG 76 Ca -0.03 -0.10 -0.16 0.00 -1.26 0.00 0.00 59.98 58.43 4fis h ARG 76 Cb 1.34 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 29.50 4fis h ARG 76 CO 0.13 0.60 -0.61 0.00 0.56 0.00 0.00 179.97 180.65 4fis h ALA 77 N 1.51 0.75 -0.35 0.04 0.00 -0.14 -2.53 119.26 118.54 4fis h ALA 77 Ca 0.19 -0.54 -0.11 0.00 0.00 0.00 0.00 54.91 54.45 4fis h ALA 77 Cb 0.10 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 4fis h ALA 77 CO -0.02 0.72 -0.20 0.00 0.00 0.00 0.00 179.25 179.74 4fis h ALA 78 N 1.07 0.49 -0.40 0.00 0.00 -0.06 -1.29 119.26 119.07 4fis h ALA 78 Ca -0.01 -0.36 -0.11 0.00 0.00 0.00 0.00 54.91 54.43 4fis h ALA 78 Cb 1.14 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 4fis h ALA 78 CO 0.10 0.44 -0.20 -0.07 0.00 0.00 0.00 179.25 179.53 4fis h LEU 79 N 0.53 0.79 -0.75 0.00 3.38 -1.41 0.13 115.31 117.98 4fis h LEU 79 Ca 0.07 -0.27 -0.13 0.00 0.09 0.00 0.00 57.88 57.64 4fis h LEU 79 Cb 0.75 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 4fis h LEU 79 CO 0.06 0.97 -0.49 -0.03 0.09 0.00 0.00 178.44 179.04 4fis h MET 80 N 0.69 0.34 -0.00 1.13 4.05 -1.37 -2.70 114.93 117.06 4fis h MET 80 Ca 0.10 -0.19 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 4fis h MET 80 Cb 0.70 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.52 4fis h MET 80 CO 0.05 0.76 -0.15 -1.33 0.23 0.00 0.00 176.91 176.47 4fis n MET 81 N -3.97 0.12 -1.04 0.39 2.81 -0.50 -4.89 117.12 110.04 4fis n MET 81 Ca -0.02 -0.03 -0.01 0.00 -1.81 0.00 0.00 57.70 55.83 4fis n MET 81 Cb 0.55 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.55 4fis n MET 81 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 4fis n GLY 82 N 1.46 0.49 3.80 3.03 0.00 -0.16 -5.04 105.19 108.77 4fis n GLY 82 Ca 0.08 -0.25 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 4fis n GLY 82 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 4fis s ILE 83 N -1.89 2.34 0.65 -0.61 -4.36 0.27 -4.98 121.20 112.62 4fis s ILE 83 Ca 0.00 -1.56 -0.02 0.00 -0.26 0.00 0.00 60.65 58.80 4fis s ILE 83 Cb 0.00 -2.90 0.07 0.00 1.25 0.00 0.00 42.46 40.88 4fis s ILE 83 CO 0.00 0.00 0.92 0.54 0.24 0.00 0.00 174.94 176.64 4fis s ASN 84 N -4.02 4.84 0.19 4.36 2.20 -1.26 -4.15 114.94 117.10 4fis s ASN 84 Ca 0.42 0.08 -0.12 0.00 -0.94 0.00 0.00 52.86 52.30 4fis s ASN 84 Cb 0.01 -0.74 0.15 0.00 -2.00 0.00 0.00 41.25 38.67 4fis s ASN 84 CO 0.24 -1.51 1.81 0.03 -2.94 0.00 0.00 177.10 174.73 4fis h ARG 85 N -0.34 0.63 -0.81 3.55 3.08 -1.93 -2.30 114.38 116.25 4fis h ARG 85 Ca -0.42 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 59.61 4fis h ARG 85 Cb 1.29 -0.14 -0.04 0.00 0.08 0.00 0.00 29.97 31.16 4fis h ARG 85 CO 0.52 0.41 0.54 0.78 -1.07 0.00 0.00 179.97 181.15 4fis h GLY 86 N 0.64 1.15 0.92 0.04 0.00 -1.98 0.99 103.07 104.83 4fis h GLY 86 Ca 0.24 -0.42 -0.03 0.00 0.00 0.00 0.00 47.33 47.12 4fis h GLY 86 CO -0.13 0.41 0.10 -0.84 0.00 0.00 0.00 176.54 176.09 4fis h THR 87 N 1.09 1.21 -0.68 4.70 2.02 -1.88 0.88 112.91 120.25 4fis h THR 87 Ca 0.30 -0.71 0.09 0.00 0.77 0.00 0.00 66.41 66.86 4fis h THR 87 Cb -0.11 1.00 -0.07 0.00 -1.74 0.00 0.00 68.15 67.22 4fis h THR 87 CO -0.07 0.24 0.31 0.25 0.37 0.00 0.00 175.52 176.63 4fis h LEU 88 N 0.43 0.39 -0.67 2.58 5.85 -0.80 0.11 115.31 123.21 4fis h LEU 88 Ca 0.11 0.07 -0.13 0.00 0.84 0.00 0.00 57.88 58.77 4fis h LEU 88 Cb 0.27 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 4fis h LEU 88 CO -0.00 0.22 -0.37 0.00 -0.34 0.00 0.00 178.44 177.95 4fis h LYS 90 N 0.52 -0.55 -0.76 0.00 6.56 0.10 -1.34 116.57 121.10 4fis h LYS 90 Ca 0.05 0.04 -0.05 0.00 -1.06 0.00 0.00 60.65 59.62 4fis h LYS 90 Cb 0.87 0.13 -0.03 0.00 -0.57 0.00 0.00 32.23 32.63 4fis h LYS 90 CO 0.08 -0.37 0.26 0.87 -2.06 0.00 0.00 179.45 178.23 4fis h LYS 91 N -0.57 1.16 -0.53 3.15 1.57 -0.81 -1.68 116.57 118.86 4fis h LYS 91 Ca 0.01 -0.23 -0.01 0.00 -1.87 0.00 0.00 60.65 58.55 4fis h LYS 91 Cb 0.56 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.67 4fis h LYS 91 CO -0.12 0.97 0.31 -0.07 -0.57 0.00 0.00 179.45 179.96 4fis h LEU 92 N 1.11 0.63 0.31 2.94 3.38 -0.59 -2.34 115.31 120.75 4fis h LEU 92 Ca 0.25 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 4fis h LEU 92 Cb 0.27 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.87 4fis h LEU 92 CO -0.01 0.49 -0.15 0.11 0.09 0.00 0.00 178.44 178.97 4fis h LYS 93 N 0.73 -0.40 -0.92 1.13 1.79 -0.33 0.40 116.57 118.96 4fis h LYS 93 Ca 0.19 0.03 0.30 0.00 -2.18 0.00 0.00 60.65 58.99 4fis h LYS 93 Cb -0.01 0.09 -0.17 0.00 -1.58 0.00 0.00 32.23 30.56 4fis h LYS 93 CO -0.03 -0.10 0.19 1.63 -1.08 0.00 0.00 179.45 180.06 4fis n LYS 94 N -5.15 -0.07 -0.11 3.15 5.02 -0.89 -0.41 118.16 119.71 4fis n LYS 94 Ca -0.10 1.35 0.12 0.00 -2.02 0.00 0.00 58.31 57.66 4fis n LYS 94 Cb 0.26 -2.23 0.16 0.00 -0.02 0.00 0.00 35.03 33.20 4fis n LYS 94 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 4fis n TYR 95 N -5.27 0.28 -3.00 2.13 4.01 -1.15 -4.95 117.16 109.21 4fis n TYR 95 Ca 0.26 -0.14 -0.12 0.00 -0.16 0.00 0.00 57.90 57.74 4fis n TYR 95 Cb 0.88 -0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.97 4fis n TYR 95 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 4fis n GLY 96 N 1.43 -0.02 0.09 2.72 0.00 0.45 -4.92 105.19 104.93 4fis n GLY 96 Ca 0.17 -0.11 -0.06 0.00 0.00 0.00 0.00 46.02 46.02 4fis n GLY 96 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 4fis n MET 97 N -3.08 0.63 0.00 1.61 2.81 0.14 -5.02 117.12 114.20 4fis n MET 97 Ca -0.10 0.27 0.00 0.00 -1.81 0.00 0.00 57.70 56.06 4fis n MET 97 Cb 0.58 -1.80 0.00 0.00 -0.71 0.00 0.00 33.22 31.29 4fis n MET 97 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77