#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fof s SER 21 N 0.00 0.21 -0.03 1.61 1.04 0.02 -5.01 113.70 111.54 1fof s SER 21 Ca 0.00 -1.13 -0.05 0.00 0.48 0.00 0.00 55.95 55.25 1fof s SER 21 Cb 0.00 0.35 0.01 0.00 0.10 0.00 0.00 66.02 66.48 1fof s SER 21 CO 0.00 -0.79 0.12 -0.51 0.98 0.00 0.00 173.24 173.04 1fof s ILE 22 N -4.04 0.03 0.01 -1.02 2.07 -1.26 -0.46 121.20 116.53 1fof s ILE 22 Ca 0.24 -0.21 0.01 0.00 -1.41 0.00 0.00 60.65 59.28 1fof s ILE 22 Cb 0.06 -0.24 -0.01 0.00 0.13 0.00 0.00 42.46 42.39 1fof s ILE 22 CO 0.02 -0.11 -0.05 -0.89 -1.91 0.00 0.00 174.94 172.01 1fof s THR 23 N -0.34 0.31 0.03 4.00 2.01 -0.24 -4.94 115.64 116.46 1fof s THR 23 Ca -0.04 -0.56 -0.15 0.00 0.31 0.00 0.00 61.69 61.25 1fof s THR 23 Cb -0.03 -0.34 -0.06 0.00 0.01 0.00 0.00 72.50 72.08 1fof s THR 23 CO 0.00 -0.17 0.45 -0.70 -0.69 0.00 0.00 174.62 173.51 1fof s GLU 24 N -0.78 3.96 0.40 4.92 2.12 -1.26 -1.68 118.70 126.38 1fof s GLU 24 Ca -0.05 0.45 0.03 0.00 0.36 0.00 0.00 54.97 55.76 1fof s GLU 24 Cb -0.05 -3.18 -0.01 0.00 0.26 0.00 0.00 34.13 31.14 1fof s GLU 24 CO -0.00 0.65 0.12 0.27 -0.54 0.00 0.00 175.26 175.77 1fof n ASN 25 N 1.64 1.48 0.00 -1.70 2.04 0.19 -4.90 115.26 114.00 1fof n ASN 25 Ca -0.12 -3.10 0.00 0.00 -0.44 0.00 0.00 54.58 50.92 1fof n ASN 25 Cb 0.52 0.91 0.00 0.00 -2.53 0.00 0.00 39.78 38.68 1fof n ASN 25 CO 0.00 0.00 0.00 0.35 -0.44 0.00 0.00 177.26 177.17 1fof n THR 26 N -0.92 0.00 0.17 5.53 -2.24 -1.26 -4.44 114.28 111.11 1fof n THR 26 Ca -0.07 -0.12 0.02 0.00 -2.27 0.00 0.00 64.05 61.61 1fof n THR 26 Cb 0.59 1.00 0.10 0.00 -2.10 0.00 0.00 70.33 69.91 1fof n THR 26 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1fof n SER 27 N -0.24 0.00 -0.01 3.42 3.41 -1.26 -1.98 113.62 116.97 1fof n SER 27 Ca 0.00 0.38 0.08 0.00 -0.26 0.00 0.00 58.87 59.08 1fof n SER 27 Cb 0.00 -0.41 -0.12 0.00 -0.26 0.00 0.00 64.21 63.42 1fof n SER 27 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1fof n TRP 28 N -1.41 0.00 -0.34 7.33 8.01 -1.26 -4.59 117.44 125.18 1fof n TRP 28 Ca 0.01 0.00 0.23 0.00 -1.31 0.00 0.00 57.50 56.44 1fof n TRP 28 Cb 0.04 -0.27 0.50 0.00 -2.01 0.00 0.00 31.31 29.57 1fof n TRP 28 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.69 175.77 1fof h ASN 29 N 0.00 0.47 -0.97 -0.99 2.35 -1.74 -0.43 115.58 114.27 1fof h ASN 29 Ca 0.00 0.10 0.14 0.00 -0.55 0.00 0.00 56.30 55.99 1fof h ASN 29 Cb 0.65 0.03 -0.08 0.00 0.05 0.00 0.00 38.32 38.97 1fof h ASN 29 CO 0.00 0.05 0.61 0.07 -1.65 0.00 0.00 177.43 176.52 1fof h LYS 30 N 0.39 0.84 -0.09 0.81 2.10 -1.81 0.15 116.57 118.96 1fof h LYS 30 Ca 0.63 -0.05 -0.04 0.00 -2.00 0.00 0.00 60.65 59.19 1fof h LYS 30 Cb 1.57 -0.19 -0.01 0.00 -0.90 0.00 0.00 32.23 32.70 1fof h LYS 30 CO -0.35 0.55 -0.12 0.93 -2.00 0.00 0.00 179.45 178.47 1fof h GLU 31 N 0.86 0.13 0.02 0.07 4.39 -1.40 -1.45 114.58 117.21 1fof h GLU 31 Ca 0.49 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 60.14 1fof h GLU 31 Cb 0.62 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 1fof h GLU 31 CO -0.26 0.26 -0.13 0.74 -1.16 0.00 0.00 179.01 178.46 1fof h PHE 32 N 0.13 0.08 -0.80 4.33 -1.00 -1.10 -3.35 116.94 115.23 1fof h PHE 32 Ca 0.03 -0.06 -0.02 0.00 2.81 0.00 0.00 57.97 60.72 1fof h PHE 32 Cb 0.29 -0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.81 1fof h PHE 32 CO 0.00 1.05 0.40 0.66 -1.61 0.00 0.00 178.31 178.82 1fof h SER 33 N -0.91 1.02 -0.55 2.17 4.64 -1.14 -0.23 113.55 118.56 1fof h SER 33 Ca -0.02 -0.11 0.13 0.00 -0.47 0.00 0.00 61.79 61.32 1fof h SER 33 Cb 1.10 -0.26 -0.03 0.00 -0.31 0.00 0.00 62.40 62.90 1fof h SER 33 CO 0.02 0.85 0.38 0.00 -0.87 0.00 0.00 176.83 177.21 1fof h ALA 34 N 1.31 2.29 -0.30 5.18 0.00 -1.42 -0.11 119.26 126.20 1fof h ALA 34 Ca 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1fof h ALA 34 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1fof h ALA 34 CO -0.04 -0.43 0.00 0.39 0.00 0.00 0.00 179.25 179.17 1fof n GLU 35 N -4.43 2.17 -3.74 0.00 -0.58 -0.94 -4.98 120.64 108.14 1fof n GLU 35 Ca 0.10 -1.94 -0.23 0.00 -0.42 0.00 0.00 57.16 54.67 1fof n GLU 35 Cb 0.50 -1.34 0.03 0.00 -0.57 0.00 0.00 31.44 30.06 1fof n GLU 35 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1fof n ALA 36 N 0.89 -1.86 -2.70 0.62 0.00 -0.06 -4.97 120.51 112.43 1fof n ALA 36 Ca 0.13 -0.09 -0.34 0.00 0.00 0.00 0.00 53.44 53.14 1fof n ALA 36 Cb 0.45 -2.49 -0.11 0.00 0.00 0.00 0.00 19.45 17.30 1fof n ALA 36 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1fof s VAL 37 N -3.59 3.94 -0.46 0.00 1.01 -0.21 -5.01 120.40 116.08 1fof s VAL 37 Ca 0.14 -0.38 -0.13 0.00 0.00 0.00 0.00 61.98 61.61 1fof s VAL 37 Cb -0.07 -2.65 0.08 0.00 0.00 0.00 0.00 36.38 33.74 1fof s VAL 37 CO 0.81 0.58 0.35 0.20 0.00 0.00 0.00 175.10 177.04 1fof s ASN 38 N -0.56 5.96 0.07 3.32 0.02 -1.26 -4.57 114.94 117.92 1fof s ASN 38 Ca 0.09 -1.42 -0.04 0.00 -1.02 0.00 0.00 52.86 50.47 1fof s ASN 38 Cb -0.12 -2.11 0.01 0.00 0.02 0.00 0.00 41.25 39.05 1fof s ASN 38 CO 0.02 -0.62 0.19 0.61 0.02 0.00 0.00 177.10 177.33 1fof n GLY 39 N 5.10 1.56 3.12 0.66 0.00 -1.26 -1.73 105.19 112.63 1fof n GLY 39 Ca -0.12 -1.03 -0.12 0.00 0.00 0.00 0.00 46.02 44.75 1fof n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fof s VAL 40 N -2.69 0.07 -0.04 1.61 0.11 -0.60 -4.84 120.40 114.02 1fof s VAL 40 Ca 0.04 -0.57 0.03 0.00 -2.93 0.00 0.00 61.98 58.56 1fof s VAL 40 Cb -0.01 -0.43 0.00 0.00 -1.53 0.00 0.00 36.38 34.41 1fof s VAL 40 CO 0.02 -0.31 -0.14 0.12 -3.33 0.00 0.00 175.10 171.46 1fof s PHE 41 N -1.17 1.46 -0.13 1.54 5.99 -1.26 -2.35 117.98 122.06 1fof s PHE 41 Ca -0.13 -0.43 0.02 0.00 0.00 0.00 0.00 56.93 56.39 1fof s PHE 41 Cb -0.06 -1.01 0.01 0.00 0.00 0.00 0.00 43.02 41.96 1fof s PHE 41 CO 0.02 -0.17 -0.19 0.08 -0.00 0.00 0.00 175.22 174.96 1fof s VAL 42 N 0.20 1.82 -0.11 3.12 1.01 -0.29 -3.47 120.40 122.68 1fof s VAL 42 Ca -0.06 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.10 1fof s VAL 42 Cb -0.12 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.65 1fof s VAL 42 CO 0.02 0.50 -0.11 -0.22 0.00 0.00 0.00 175.10 175.29 1fof s LEU 43 N 0.99 1.47 -0.03 3.92 2.96 -0.45 -1.65 118.68 125.88 1fof s LEU 43 Ca -0.04 -0.36 0.07 0.00 -0.22 0.00 0.00 54.13 53.57 1fof s LEU 43 Cb -0.15 -0.95 -0.01 0.00 0.50 0.00 0.00 46.19 45.58 1fof s LEU 43 CO -0.04 -0.05 -0.23 0.00 -1.32 0.00 0.00 176.35 174.71 1fof s LYS 45 N -0.36 3.81 0.12 0.00 2.20 0.68 -1.39 119.74 124.80 1fof s LYS 45 Ca 0.03 -0.22 -0.23 0.00 -0.36 0.00 0.00 55.97 55.19 1fof s LYS 45 Cb -0.11 -3.72 -0.04 0.00 -1.51 0.00 0.00 37.83 32.45 1fof s LYS 45 CO 0.01 -0.36 1.67 1.03 -0.36 0.00 0.00 175.35 177.33 1fof h SER 46 N 8.33 -0.47 -0.86 1.43 0.87 -1.49 0.31 113.55 121.68 1fof h SER 46 Ca -0.31 0.08 0.14 0.00 -1.23 0.00 0.00 61.79 60.46 1fof h SER 46 Cb 1.16 0.21 -0.09 0.00 -0.44 0.00 0.00 62.40 63.24 1fof h SER 46 CO 0.65 -0.21 0.47 0.77 -0.53 0.00 0.00 176.83 177.98 1fof h SER 47 N -0.22 0.60 0.03 6.23 4.64 -1.94 -2.26 113.55 120.62 1fof h SER 47 Ca 0.07 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1fof h SER 47 Cb 0.33 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1fof h SER 47 CO -0.20 0.28 -0.34 -1.54 -0.87 0.00 0.00 176.83 174.16 1fof n SER 48 N -4.82 1.99 -3.76 4.97 3.41 -1.16 -4.96 113.62 109.30 1fof n SER 48 Ca 0.17 -1.49 -0.29 0.00 -0.26 0.00 0.00 58.87 57.00 1fof n SER 48 Cb 0.40 0.32 0.02 0.00 -0.26 0.00 0.00 64.21 64.69 1fof n SER 48 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1fof n LYS 49 N 0.11 -5.29 -4.94 4.33 5.02 0.08 -4.81 118.16 112.65 1fof n LYS 49 Ca 0.11 0.62 -0.33 0.00 -2.02 0.00 0.00 58.31 56.69 1fof n LYS 49 Cb 0.46 -5.49 -0.15 0.00 -0.02 0.00 0.00 35.03 29.84 1fof n LYS 49 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1fof s SER 50 N -3.17 3.72 0.16 4.39 0.15 -1.07 -0.80 113.70 117.09 1fof s SER 50 Ca 0.60 -0.37 0.10 0.00 0.70 0.00 0.00 55.95 56.99 1fof s SER 50 Cb -0.30 -1.32 -0.04 0.00 -1.71 0.00 0.00 66.02 62.65 1fof s SER 50 CO 0.74 0.21 -0.21 0.00 1.20 0.00 0.00 173.24 175.18 1fof s ALA 52 N -1.43 0.94 0.05 0.00 0.00 0.07 -1.08 121.76 120.30 1fof s ALA 52 Ca 0.19 -0.64 -0.14 0.00 0.00 0.00 0.00 51.96 51.37 1fof s ALA 52 Cb -0.09 -0.16 0.02 0.00 0.00 0.00 0.00 23.12 22.88 1fof s ALA 52 CO 0.10 0.18 0.31 -0.08 0.00 0.00 0.00 175.76 176.27 1fof s THR 53 N -0.64 0.08 -0.60 0.00 -1.32 -0.67 -1.34 115.64 111.14 1fof s THR 53 Ca 0.01 -0.69 0.24 0.00 -1.21 0.00 0.00 61.69 60.04 1fof s THR 53 Cb -0.06 -0.97 0.14 0.00 -1.51 0.00 0.00 72.50 70.10 1fof s THR 53 CO 0.00 -0.38 1.45 -0.55 -2.21 0.00 0.00 174.62 172.93 1fof h ASN 54 N 3.14 0.00 -2.02 8.08 -1.07 -1.77 0.56 115.58 122.50 1fof h ASN 54 Ca -0.32 -0.11 -0.34 0.00 0.07 0.00 0.00 56.30 55.60 1fof h ASN 54 Cb 1.20 0.00 -0.32 0.00 -2.07 0.00 0.00 38.32 37.13 1fof h ASN 54 CO 0.46 0.05 -0.66 -0.62 0.07 0.00 0.00 177.43 176.74 1fof s ASP 55 N -4.64 1.35 0.26 6.14 -1.08 -1.26 -4.74 116.67 112.70 1fof s ASP 55 Ca 0.07 -1.16 -0.03 0.00 -0.52 0.00 0.00 52.55 50.91 1fof s ASP 55 Cb 0.12 0.57 0.38 0.00 -1.46 0.00 0.00 42.92 42.52 1fof s ASP 55 CO 0.69 -0.32 1.89 -0.07 0.52 0.00 0.00 175.17 177.88 1fof h LEU 56 N 7.64 1.07 0.63 -1.34 3.38 -1.95 0.59 115.31 125.33 1fof h LEU 56 Ca -0.04 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1fof h LEU 56 Cb 1.07 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 41.59 1fof h LEU 56 CO 0.26 0.70 -0.30 0.00 0.09 0.00 0.00 178.44 179.19 1fof h ALA 57 N 1.44 -0.84 0.00 1.53 0.00 -2.00 -2.99 119.26 116.39 1fof h ALA 57 Ca 0.42 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 1fof h ALA 57 Cb 0.10 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1fof h ALA 57 CO -0.15 -0.95 -0.27 -0.09 0.00 0.00 0.00 179.25 177.79 1fof h ARG 58 N -0.90 0.00 -0.13 0.00 2.43 -1.91 -2.13 114.38 111.74 1fof h ARG 58 Ca -0.09 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.12 1fof h ARG 58 Cb 0.67 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.21 1fof h ARG 58 CO 0.14 0.27 0.11 0.00 -1.51 0.00 0.00 179.97 178.98 1fof h ALA 59 N 1.73 1.92 -0.01 2.80 0.00 -0.74 -1.09 119.26 123.87 1fof h ALA 59 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1fof h ALA 59 Cb 0.50 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1fof h ALA 59 CO 0.04 -0.17 -0.56 0.43 0.00 0.00 0.00 179.25 178.99 1fof n SER 60 N -4.18 1.63 -4.76 0.00 7.64 -0.82 -2.30 113.62 110.82 1fof n SER 60 Ca 0.00 -1.28 -0.39 0.00 1.01 0.00 0.00 58.87 58.21 1fof n SER 60 Cb 0.22 0.53 -0.04 0.00 -1.01 0.00 0.00 64.21 63.91 1fof n SER 60 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1fof s LYS 61 N -2.61 4.51 -0.18 1.43 1.02 -0.41 -4.77 119.74 118.73 1fof s LYS 61 Ca 0.17 1.71 -0.07 0.00 0.02 0.00 0.00 55.97 57.79 1fof s LYS 61 Cb 0.18 -3.00 -0.04 0.00 -0.52 0.00 0.00 37.83 34.44 1fof s LYS 61 CO 0.63 0.12 0.06 -1.21 -0.92 0.00 0.00 175.35 174.03 1fof s GLU 62 N -1.74 3.93 0.28 1.68 2.02 -1.26 -4.03 118.70 119.57 1fof s GLU 62 Ca 0.48 -0.35 0.06 0.00 0.02 0.00 0.00 54.97 55.18 1fof s GLU 62 Cb -0.29 -3.19 -0.06 0.00 0.10 0.00 0.00 34.13 30.69 1fof s GLU 62 CO 0.37 0.30 -0.03 0.71 0.02 0.00 0.00 175.26 176.63 1fof s TYR 63 N 0.29 1.90 0.24 1.61 1.51 -0.16 -4.60 117.35 118.14 1fof s TYR 63 Ca 0.03 -0.77 -0.31 0.00 -1.01 0.00 0.00 57.07 55.01 1fof s TYR 63 Cb -0.12 -1.12 -0.13 0.00 -0.11 0.00 0.00 41.96 40.48 1fof s TYR 63 CO 0.00 0.19 1.47 1.28 -1.11 0.00 0.00 175.55 177.38 1fof n LEU 64 N -0.58 3.38 0.12 -1.29 4.77 -1.26 -0.73 117.00 121.41 1fof n LEU 64 Ca -0.05 1.14 -0.01 0.00 -0.03 0.00 0.00 56.01 57.05 1fof n LEU 64 Cb 0.64 -1.46 0.23 0.00 -2.33 0.00 0.00 43.42 40.49 1fof n LEU 64 CO 0.40 -0.33 0.60 -0.65 -1.33 0.00 0.00 177.39 176.08 1fof h PRO 65 N 4.52 0.13 0.00 3.23 0.11 -1.75 -3.46 132.00 134.78 1fof h PRO 65 Ca -0.45 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1fof h PRO 65 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1fof h PRO 65 CO 0.78 0.58 0.00 0.00 -0.21 0.00 0.00 178.00 179.15 1fof n ALA 66 N -2.46 0.00 0.17 -0.75 0.00 -0.49 -1.91 120.51 115.08 1fof n ALA 66 Ca -0.02 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.46 1fof n ALA 66 Cb 0.52 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.16 1fof n ALA 66 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1fof n SER 67 N -0.77 0.12 0.16 0.00 7.64 -1.26 -1.42 113.62 118.09 1fof n SER 67 Ca 0.00 0.55 0.13 0.00 1.01 0.00 0.00 58.87 60.56 1fof n SER 67 Cb 0.00 -0.57 0.55 0.00 -1.01 0.00 0.00 64.21 63.18 1fof n SER 67 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1fof h THR 68 N 0.00 0.00 0.00 0.44 1.35 -1.38 -0.93 112.91 112.39 1fof h THR 68 Ca 0.00 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 1fof h THR 68 Cb 0.08 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.51 1fof h THR 68 CO 0.00 0.00 0.00 0.33 -0.25 0.00 0.00 175.52 175.60 1fof n PHE 69 N -2.40 0.62 0.31 4.73 7.35 -0.51 -2.43 117.46 125.13 1fof n PHE 69 Ca 0.01 0.24 0.18 0.00 -0.76 0.00 0.00 57.45 57.12 1fof n PHE 69 Cb 0.22 -0.88 1.00 0.00 0.35 0.00 0.00 39.48 40.17 1fof n PHE 69 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 1fof h LYS 70 N 0.00 0.00 0.53 -4.13 1.57 -1.38 -0.78 116.57 112.38 1fof h LYS 70 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1fof h LYS 70 Cb 0.36 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.67 1fof h LYS 70 CO 0.00 0.01 -0.25 0.82 -0.57 0.00 0.00 179.45 179.46 1fof h ILE 71 N 0.00 0.00 -0.20 1.86 2.04 -1.70 0.15 117.51 119.67 1fof h ILE 71 Ca -0.00 -0.31 -0.06 0.00 1.00 0.00 0.00 64.86 65.49 1fof h ILE 71 Cb 0.04 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.10 1fof h ILE 71 CO 0.00 0.00 -0.16 1.55 0.00 0.00 0.00 178.15 179.54 1fof h PRO 72 N -1.02 0.33 -0.69 2.37 0.13 -1.73 -2.26 132.00 129.13 1fof h PRO 72 Ca -0.07 -0.09 -0.01 0.00 -0.87 0.00 0.00 66.00 64.96 1fof h PRO 72 Cb 0.54 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 31.60 1fof h PRO 72 CO 0.12 0.49 0.39 -0.97 -0.23 0.00 0.00 178.00 177.80 1fof h ASN 73 N 0.30 0.86 -0.40 1.44 -0.00 -1.17 0.23 115.58 116.84 1fof h ASN 73 Ca 0.06 -0.09 -0.03 0.00 -0.00 0.00 0.00 56.30 56.24 1fof h ASN 73 Cb 0.47 -0.22 -0.02 0.00 -0.00 0.00 0.00 38.32 38.55 1fof h ASN 73 CO 0.03 0.70 0.12 0.00 -0.00 0.00 0.00 177.43 178.28 1fof h ALA 74 N 1.20 0.52 -0.28 1.57 0.00 -0.61 0.27 119.26 121.93 1fof h ALA 74 Ca 0.24 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1fof h ALA 74 Cb 0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1fof h ALA 74 CO -0.04 0.17 0.17 0.82 0.00 0.00 0.00 179.25 180.37 1fof h ILE 75 N 0.50 1.10 -0.66 0.00 2.04 -0.98 -1.69 117.51 117.81 1fof h ILE 75 Ca 0.13 -0.23 -0.06 0.00 1.00 0.00 0.00 64.86 65.69 1fof h ILE 75 Cb 0.26 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 1fof h ILE 75 CO -0.00 0.10 0.16 0.40 0.00 0.00 0.00 178.15 178.80 1fof h ILE 76 N 0.36 1.25 -0.92 -0.67 2.04 -0.85 0.16 117.51 118.89 1fof h ILE 76 Ca 0.10 -0.94 -0.01 0.00 1.00 0.00 0.00 64.86 65.01 1fof h ILE 76 Cb 0.01 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 1fof h ILE 76 CO -0.02 0.36 0.54 1.23 0.00 0.00 0.00 178.15 180.26 1fof h GLY 77 N 1.06 1.35 0.70 5.37 0.00 -0.62 -0.58 103.07 110.36 1fof h GLY 77 Ca 0.21 -0.58 -0.08 0.00 0.00 0.00 0.00 47.33 46.88 1fof h GLY 77 CO 0.00 0.56 -0.24 1.41 0.00 0.00 0.00 176.54 178.27 1fof h LEU 78 N 1.28 0.38 -1.41 3.11 3.38 -0.97 0.78 115.31 121.86 1fof h LEU 78 Ca 0.33 -0.58 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 1fof h LEU 78 Cb -0.03 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1fof h LEU 78 CO -0.06 0.89 0.15 -0.08 0.09 0.00 0.00 178.44 179.43 1fof h GLU 79 N -0.11 0.54 0.00 1.13 4.57 -0.77 -2.16 114.58 117.78 1fof h GLU 79 Ca -0.00 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 1fof h GLU 79 Cb 0.84 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.33 1fof h GLU 79 CO 0.05 0.46 -0.38 0.25 -1.18 0.00 0.00 179.01 178.21 1fof n THR 80 N -4.38 0.00 -0.20 0.32 -2.24 -0.24 -4.94 114.28 102.60 1fof n THR 80 Ca 0.02 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1fof n THR 80 Cb 0.15 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 1fof n THR 80 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fof n GLY 81 N 1.50 0.94 0.31 3.38 0.00 -0.81 -4.92 105.19 105.59 1fof n GLY 81 Ca 0.06 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.06 1fof n GLY 81 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1fof h VAL 82 N 0.00 1.13 -3.66 1.61 2.07 -1.24 -3.33 116.25 112.83 1fof h VAL 82 Ca 0.00 -0.35 -0.67 0.00 0.82 0.00 0.00 66.70 66.50 1fof h VAL 82 Cb 0.00 0.01 -0.18 0.00 -1.52 0.00 0.00 31.29 29.60 1fof h VAL 82 CO 0.00 0.19 -0.35 -0.63 0.02 0.00 0.00 177.57 176.80 1fof s ILE 83 N -6.10 5.21 0.11 4.57 1.01 0.06 -4.99 121.20 121.07 1fof s ILE 83 Ca -0.13 -0.10 -0.28 0.00 0.00 0.00 0.00 60.65 60.14 1fof s ILE 83 Cb 0.17 -3.81 -0.08 0.00 0.01 0.00 0.00 42.46 38.74 1fof s ILE 83 CO 0.79 -0.10 1.63 0.50 0.00 0.00 0.00 174.94 177.75 1fof h LYS 84 N 8.50 -0.49 0.00 2.79 3.64 -1.87 -3.39 116.57 125.75 1fof h LYS 84 Ca -0.30 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.14 1fof h LYS 84 Cb 1.14 0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1fof h LYS 84 CO 0.68 -0.33 0.16 0.27 -2.27 0.00 0.00 179.45 177.97 1fof n ASN 85 N -5.40 -0.78 0.28 4.20 0.23 -1.26 -5.01 115.26 107.52 1fof n ASN 85 Ca -0.07 -1.49 0.13 0.00 -0.53 0.00 0.00 54.58 52.62 1fof n ASN 85 Cb 0.31 1.29 0.80 0.00 -2.08 0.00 0.00 39.78 40.10 1fof n ASN 85 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1fof h GLU 86 N 0.00 0.00 -0.29 -3.83 4.11 -1.98 -1.84 114.58 110.75 1fof h GLU 86 Ca -0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.31 1fof h GLU 86 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1fof h GLU 86 CO 0.15 0.05 0.00 0.72 0.07 0.00 0.00 179.01 180.00 1fof n HIS 87 N -3.93 0.38 -1.62 2.06 8.25 -1.26 -4.64 115.22 114.46 1fof n HIS 87 Ca -0.03 -0.19 -0.49 0.00 -0.26 0.00 0.00 57.72 56.76 1fof n HIS 87 Cb 0.14 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.20 1fof n HIS 87 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 1fof n GLN 88 N 0.65 1.59 -4.43 -0.41 -0.06 -0.69 -4.97 117.38 109.05 1fof n GLN 88 Ca 0.16 0.57 -0.34 0.00 -2.00 0.00 0.00 57.00 55.40 1fof n GLN 88 Cb 0.38 -2.24 -0.14 0.00 -4.06 0.00 0.00 30.24 24.18 1fof n GLN 88 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 1fof s VAL 89 N 0.49 3.25 -0.78 1.69 1.01 -1.26 -3.79 120.40 121.01 1fof s VAL 89 Ca 0.79 -0.57 -0.18 0.00 0.00 0.00 0.00 61.98 62.02 1fof s VAL 89 Cb -0.81 -2.41 0.14 0.00 0.00 0.00 0.00 36.38 33.30 1fof s VAL 89 CO 0.45 0.49 0.88 -0.36 0.00 0.00 0.00 175.10 176.56 1fof s PHE 90 N 0.72 3.23 0.26 5.22 0.40 0.17 -4.92 117.98 123.05 1fof s PHE 90 Ca -0.04 -1.37 -0.30 0.00 -0.60 0.00 0.00 56.93 54.62 1fof s PHE 90 Cb -0.15 -4.07 -0.10 0.00 0.51 0.00 0.00 43.02 39.21 1fof s PHE 90 CO 0.02 -1.30 1.44 0.15 0.70 0.00 0.00 175.22 176.23 1fof s LYS 91 N 2.08 4.26 -0.01 0.44 1.02 -1.26 -2.21 119.74 124.06 1fof s LYS 91 Ca 0.21 2.31 -0.30 0.00 0.02 0.00 0.00 55.97 58.21 1fof s LYS 91 Cb -0.13 -3.10 -0.03 0.00 -0.52 0.00 0.00 37.83 34.05 1fof s LYS 91 CO -0.03 -0.42 1.00 -0.46 -0.92 0.00 0.00 175.35 174.52 1fof s TRP 92 N -0.07 3.62 -1.55 3.18 -0.00 -1.26 -4.92 118.94 117.94 1fof s TRP 92 Ca 0.59 1.66 0.00 0.00 -0.00 0.00 0.00 56.10 58.35 1fof s TRP 92 Cb -0.42 -3.15 0.00 0.00 -0.00 0.00 0.00 33.47 29.90 1fof s TRP 92 CO 0.44 -0.13 0.61 -0.40 -0.00 0.00 0.00 176.95 177.48 1fof n ASP 93 N 4.06 0.35 0.00 5.86 5.75 -1.26 -4.82 116.55 126.50 1fof n ASP 93 Ca 0.07 -1.58 0.00 0.00 -0.01 0.00 0.00 54.79 53.27 1fof n ASP 93 Cb 0.50 -0.18 0.00 0.00 -1.03 0.00 0.00 41.12 40.42 1fof n ASP 93 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1fof n GLY 94 N 0.21 1.31 3.75 6.12 0.00 -1.26 -4.93 105.19 110.39 1fof n GLY 94 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1fof n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fof s LYS 95 N 0.00 4.50 0.42 1.61 1.02 -1.26 -4.96 119.74 121.07 1fof s LYS 95 Ca 0.00 1.95 -0.22 0.00 0.02 0.00 0.00 55.97 57.72 1fof s LYS 95 Cb 0.00 -3.18 -0.14 0.00 -0.52 0.00 0.00 37.83 33.99 1fof s LYS 95 CO 0.00 -0.03 0.36 -2.30 -0.92 0.00 0.00 175.35 172.46 1fof n PRO 96 N 1.71 0.34 -4.07 -1.68 -0.02 -1.26 -5.00 135.00 125.01 1fof n PRO 96 Ca 0.02 0.12 -0.13 0.00 -2.02 0.00 0.00 63.50 61.50 1fof n PRO 96 Cb 0.44 -1.32 -0.11 0.00 -0.02 0.00 0.00 33.50 32.49 1fof n PRO 96 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1fof s ARG 97 N -1.38 0.55 0.53 -0.52 0.52 -1.26 -5.03 118.95 112.35 1fof s ARG 97 Ca 0.62 -0.82 0.41 0.00 -0.52 0.00 0.00 55.73 55.42 1fof s ARG 97 Cb -0.61 -0.26 1.59 0.00 0.52 0.00 0.00 34.95 36.19 1fof s ARG 97 CO 0.60 0.04 1.68 0.00 0.02 0.00 0.00 175.30 177.63 1fof h ALA 98 N 4.33 3.34 -3.47 2.13 0.00 -1.99 -3.40 119.26 120.20 1fof h ALA 98 Ca -0.36 -0.02 -0.49 0.00 0.00 0.00 0.00 54.91 54.04 1fof h ALA 98 Cb 1.20 0.13 -0.21 0.00 0.00 0.00 0.00 17.79 18.91 1fof h ALA 98 CO 0.43 -1.83 -0.80 -1.64 0.00 0.00 0.00 179.25 175.42 1fof s MET 99 N -4.99 1.01 0.21 0.00 -1.94 -1.26 -5.04 119.30 107.29 1fof s MET 99 Ca -0.06 -1.11 0.01 0.00 -1.71 0.00 0.00 55.69 52.83 1fof s MET 99 Cb 0.26 -1.14 0.18 0.00 2.01 0.00 0.00 34.83 36.14 1fof s MET 99 CO 0.85 0.26 1.53 0.87 -0.01 0.00 0.00 175.02 178.51 1fof h LYS 100 N 4.06 0.39 0.00 2.03 1.57 -1.97 -2.83 116.57 119.81 1fof h LYS 100 Ca -0.43 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.09 1fof h LYS 100 Cb 1.19 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1fof h LYS 100 CO 0.41 0.86 0.00 0.00 -0.57 0.00 0.00 179.45 180.16 1fof n GLN 101 N -3.91 0.15 0.08 3.15 10.64 -1.26 -1.70 117.38 124.52 1fof n GLN 101 Ca -0.03 0.35 0.12 0.00 -1.83 0.00 0.00 57.00 55.61 1fof n GLN 101 Cb 0.62 -1.76 0.18 0.00 -0.86 0.00 0.00 30.24 28.41 1fof n GLN 101 CO 0.00 0.00 0.00 -1.49 -1.83 0.00 0.00 177.06 173.74 1fof h TRP 102 N 0.00 0.00 -1.65 2.61 6.55 -1.87 -3.41 115.95 118.18 1fof h TRP 102 Ca 0.00 0.00 -0.74 0.00 0.95 0.00 0.00 58.89 59.10 1fof h TRP 102 Cb 0.37 0.00 -0.15 0.00 -0.86 0.00 0.00 29.16 28.52 1fof h TRP 102 CO 0.00 0.00 1.77 0.39 -1.05 0.00 0.00 178.44 179.55 1fof n GLU 103 N -2.22 3.41 0.00 0.49 1.02 -0.69 -4.86 120.64 117.80 1fof n GLU 103 Ca 0.03 -3.62 0.00 0.00 -0.02 0.00 0.00 57.16 53.56 1fof n GLU 103 Cb 0.45 -3.06 0.00 0.00 -0.02 0.00 0.00 31.44 28.81 1fof n GLU 103 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1fof n ARG 104 N 5.33 0.00 -2.15 3.49 1.85 -1.26 -5.05 116.66 118.87 1fof n ARG 104 Ca 0.40 0.00 -0.38 0.00 -1.00 0.00 0.00 57.85 56.86 1fof n ARG 104 Cb 0.41 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.81 1fof n ARG 104 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1fof s ASP 105 N 0.00 6.25 0.03 2.89 1.01 -1.26 -4.25 116.67 121.34 1fof s ASP 105 Ca 0.00 2.50 0.01 0.00 0.71 0.00 0.00 52.55 55.77 1fof s ASP 105 Cb 0.00 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 41.29 1fof s ASP 105 CO 0.00 -0.87 -0.05 -0.76 0.21 0.00 0.00 175.17 173.70 1fof s LEU 106 N -2.67 2.24 0.00 1.23 1.43 -0.94 -4.96 118.68 115.02 1fof s LEU 106 Ca 0.60 -0.52 -0.03 0.00 -1.03 0.00 0.00 54.13 53.15 1fof s LEU 106 Cb -0.34 -0.01 0.16 0.00 0.03 0.00 0.00 46.19 46.03 1fof s LEU 106 CO 0.43 -0.26 1.06 0.35 0.23 0.00 0.00 176.35 178.16 1fof n THR 107 N 1.56 0.00 0.12 5.49 -2.24 -1.26 0.43 114.28 118.38 1fof n THR 107 Ca -0.23 -1.49 -0.14 0.00 -2.27 0.00 0.00 64.05 59.92 1fof n THR 107 Cb 0.55 -0.99 -0.08 0.00 -2.10 0.00 0.00 70.33 67.71 1fof n THR 107 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1fof h LEU 108 N 0.00 -0.21 -0.94 3.22 5.85 -1.82 0.13 115.31 121.53 1fof h LEU 108 Ca -0.35 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.33 1fof h LEU 108 Cb 1.23 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.26 1fof h LEU 108 CO 0.35 -0.09 0.62 -0.09 -0.34 0.00 0.00 178.44 178.90 1fof h ARG 109 N -0.33 1.23 -0.52 1.25 2.43 -1.93 0.09 114.38 116.61 1fof h ARG 109 Ca -0.03 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1fof h ARG 109 Cb 0.25 -0.28 -0.03 0.00 -0.42 0.00 0.00 29.97 29.50 1fof h ARG 109 CO 0.04 0.82 0.33 0.78 -1.51 0.00 0.00 179.97 180.43 1fof h GLY 110 N 1.27 0.74 1.36 2.80 0.00 -1.84 -0.91 103.07 106.50 1fof h GLY 110 Ca 0.35 -0.30 -0.09 0.00 0.00 0.00 0.00 47.33 47.29 1fof h GLY 110 CO -0.08 0.29 -0.12 0.00 0.00 0.00 0.00 176.54 176.63 1fof h ALA 111 N 1.17 1.00 -0.39 3.60 0.00 -0.12 -2.63 119.26 121.89 1fof h ALA 111 Ca 0.19 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1fof h ALA 111 Cb -0.04 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1fof h ALA 111 CO -0.04 0.60 0.06 0.82 0.00 0.00 0.00 179.25 180.69 1fof h ILE 112 N 0.69 1.24 0.18 0.00 2.04 -0.56 -2.13 117.51 118.96 1fof h ILE 112 Ca 0.11 -0.87 -0.01 0.00 1.00 0.00 0.00 64.86 65.10 1fof h ILE 112 Cb 0.60 1.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.74 1fof h ILE 112 CO 0.04 0.30 -0.08 1.56 0.00 0.00 0.00 178.15 179.96 1fof h GLN 113 N 0.49 -0.23 0.00 2.37 4.20 -1.10 -2.93 115.11 117.91 1fof h GLN 113 Ca 0.12 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1fof h GLN 113 Cb 0.37 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.20 1fof h GLN 113 CO 0.01 0.19 0.00 1.33 -0.67 0.00 0.00 178.83 179.68 1fof n VAL 114 N -4.94 0.49 -3.95 -0.54 0.24 -1.00 -4.84 118.33 103.79 1fof n VAL 114 Ca -0.08 0.12 -0.37 0.00 -2.04 0.00 0.00 64.34 61.97 1fof n VAL 114 Cb 0.26 -0.89 0.01 0.00 -1.47 0.00 0.00 33.84 31.75 1fof n VAL 114 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1fof n SER 115 N -1.23 -3.43 -4.55 -1.34 7.64 -0.85 -4.80 113.62 105.06 1fof n SER 115 Ca 0.08 -1.16 -0.33 0.00 1.01 0.00 0.00 58.87 58.46 1fof n SER 115 Cb 0.10 -2.44 -0.04 0.00 -1.01 0.00 0.00 64.21 60.82 1fof n SER 115 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fof s ALA 116 N -3.66 1.94 0.19 -0.43 0.00 -0.90 -4.86 121.76 114.04 1fof s ALA 116 Ca 0.36 -1.00 -0.15 0.00 0.00 0.00 0.00 51.96 51.17 1fof s ALA 116 Cb -0.17 -4.41 0.18 0.00 0.00 0.00 0.00 23.12 18.72 1fof s ALA 116 CO 0.93 -4.30 1.64 0.28 0.00 0.00 0.00 175.76 174.30 1fof h VAL 117 N 7.06 0.42 -0.92 0.00 2.07 -1.90 -1.99 116.25 120.99 1fof h VAL 117 Ca -0.11 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.62 1fof h VAL 117 Cb 1.10 0.42 -0.12 0.00 -1.52 0.00 0.00 31.29 31.18 1fof h VAL 117 CO 1.21 0.00 0.47 1.55 0.02 0.00 0.00 177.57 180.82 1fof h PRO 118 N -0.02 0.51 -0.25 1.57 0.13 -1.99 0.65 132.00 132.60 1fof h PRO 118 Ca 0.26 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 65.36 1fof h PRO 118 Cb 0.42 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 31.42 1fof h PRO 118 CO -0.57 0.34 0.16 0.28 -0.23 0.00 0.00 178.00 177.97 1fof h VAL 119 N 0.52 1.08 0.00 1.56 2.07 -1.77 -2.16 116.25 117.55 1fof h VAL 119 Ca 0.56 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.89 1fof h VAL 119 Cb 0.99 0.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1fof h VAL 119 CO -0.47 0.08 0.00 -0.26 0.02 0.00 0.00 177.57 176.95 1fof h PHE 120 N 0.32 0.00 -0.20 1.57 -1.00 -1.26 -2.45 116.94 113.92 1fof h PHE 120 Ca 0.09 0.00 -0.17 0.00 2.81 0.00 0.00 57.97 60.70 1fof h PHE 120 Cb -0.00 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.56 1fof h PHE 120 CO -0.05 0.00 -0.58 1.96 -1.61 0.00 0.00 178.31 178.03 1fof h GLN 121 N 0.00 0.63 -0.33 1.51 4.20 -0.60 -1.29 115.11 119.23 1fof h GLN 121 Ca 0.00 -0.42 -0.05 0.00 0.06 0.00 0.00 58.65 58.24 1fof h GLN 121 Cb 0.80 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.62 1fof h GLN 121 CO 0.00 1.04 0.00 0.37 -0.67 0.00 0.00 178.83 179.57 1fof h GLN 122 N 0.48 0.59 -0.20 1.46 5.75 -1.22 -1.72 115.11 120.25 1fof h GLN 122 Ca 0.00 -0.19 0.02 0.00 -0.15 0.00 0.00 58.65 58.33 1fof h GLN 122 Cb 1.15 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.63 1fof h GLN 122 CO 0.11 0.72 0.07 0.82 -2.65 0.00 0.00 178.83 177.90 1fof h ILE 123 N 0.40 0.96 -0.68 2.39 2.04 -1.31 -1.41 117.51 119.89 1fof h ILE 123 Ca 0.09 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 65.90 1fof h ILE 123 Cb 0.45 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 1fof h ILE 123 CO 0.02 0.03 0.45 0.00 0.00 0.00 0.00 178.15 178.65 1fof h ALA 124 N 1.12 0.86 -0.73 1.87 0.00 -1.16 0.18 119.26 121.40 1fof h ALA 124 Ca 0.09 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1fof h ALA 124 Cb 0.05 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 1fof h ALA 124 CO -0.08 0.30 0.48 0.00 0.00 0.00 0.00 179.25 179.94 1fof h ARG 125 N 0.92 0.97 -0.18 0.00 3.08 -0.96 -1.01 114.38 117.21 1fof h ARG 125 Ca 0.25 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 60.09 1fof h ARG 125 Cb -0.10 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.73 1fof h ARG 125 CO -0.05 0.65 -0.49 0.93 -1.07 0.00 0.00 179.97 179.93 1fof h GLU 126 N 0.99 0.47 -0.53 0.04 5.08 -0.77 -2.96 114.58 116.90 1fof h GLU 126 Ca 0.27 -0.27 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1fof h GLU 126 Cb -0.10 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1fof h GLU 126 CO -0.06 0.86 0.22 0.28 -1.00 0.00 0.00 179.01 179.31 1fof h VAL 127 N 0.38 1.21 0.00 3.13 2.07 -0.54 -3.49 116.25 119.00 1fof h VAL 127 Ca 0.02 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 66.88 1fof h VAL 127 Cb 1.00 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 1fof h VAL 127 CO 0.09 0.25 0.00 0.61 0.02 0.00 0.00 177.57 178.54 1fof n GLY 128 N -0.82 -0.82 0.23 2.17 0.00 -0.42 -4.40 105.19 101.13 1fof n GLY 128 Ca 0.02 -1.55 -0.08 0.00 0.00 0.00 0.00 46.02 44.41 1fof n GLY 128 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1fof h GLU 129 N 0.00 0.74 -0.05 1.61 4.81 -1.88 -1.52 114.58 118.29 1fof h GLU 129 Ca 0.00 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1fof h GLU 129 Cb 0.00 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.26 1fof h GLU 129 CO 0.00 0.66 0.03 0.28 -0.73 0.00 0.00 179.01 179.25 1fof h VAL 130 N 0.66 1.01 -0.42 0.32 2.07 -2.00 -0.66 116.25 117.24 1fof h VAL 130 Ca 0.17 -0.03 -0.15 0.00 0.82 0.00 0.00 66.70 67.51 1fof h VAL 130 Cb 0.19 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1fof h VAL 130 CO -0.01 0.01 -0.32 0.03 0.02 0.00 0.00 177.57 177.30 1fof h ARG 131 N 0.06 0.95 -0.39 1.57 3.08 -1.76 -1.65 114.38 116.25 1fof h ARG 131 Ca 0.02 -0.47 0.03 0.00 0.07 0.00 0.00 59.98 59.63 1fof h ARG 131 Cb -0.01 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.01 1fof h ARG 131 CO -0.00 1.13 0.20 1.98 -1.07 0.00 0.00 179.97 182.21 1fof h MET 132 N 0.78 0.40 -0.73 0.04 4.05 -1.15 -0.99 114.93 117.33 1fof h MET 132 Ca 0.08 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.48 1fof h MET 132 Cb 0.91 -0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.59 1fof h MET 132 CO 0.08 0.26 0.47 0.37 0.23 0.00 0.00 176.91 178.33 1fof h GLN 133 N 0.41 0.97 0.08 0.39 5.75 -1.03 -1.98 115.11 119.70 1fof h GLN 133 Ca 0.16 -0.07 0.01 0.00 -0.15 0.00 0.00 58.65 58.60 1fof h GLN 133 Cb 0.06 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.38 1fof h GLN 133 CO -0.10 0.65 -0.11 -0.22 -2.65 0.00 0.00 178.83 176.40 1fof h LYS 134 N 0.99 -0.21 -0.38 1.69 3.64 -0.47 -2.25 116.57 119.58 1fof h LYS 134 Ca 0.27 0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.57 1fof h LYS 134 Cb -0.10 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.76 1fof h LYS 134 CO -0.06 -0.14 -0.15 1.88 -2.27 0.00 0.00 179.45 178.71 1fof h TYR 135 N -0.22 0.77 0.00 1.91 -1.99 -1.06 -1.87 116.97 114.51 1fof h TYR 135 Ca 0.01 -0.15 -0.05 0.00 2.00 0.00 0.00 58.73 60.55 1fof h TYR 135 Cb 0.23 -0.20 -0.01 0.00 2.00 0.00 0.00 36.73 38.76 1fof h TYR 135 CO -0.13 0.81 -0.24 -0.07 -0.00 0.00 0.00 178.16 178.53 1fof h LEU 136 N 0.63 0.00 -0.10 3.88 3.38 -1.25 0.45 115.31 122.30 1fof h LEU 136 Ca 0.10 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.97 1fof h LEU 136 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1fof h LEU 136 CO 0.04 0.24 -0.33 0.50 0.09 0.00 0.00 178.44 178.98 1fof h LYS 137 N 0.00 0.40 -0.58 1.13 3.64 -1.01 -0.44 116.57 119.71 1fof h LYS 137 Ca -0.00 -0.30 -0.05 0.00 -1.27 0.00 0.00 60.65 59.03 1fof h LYS 137 Cb 0.47 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.32 1fof h LYS 137 CO 0.03 0.92 0.17 0.87 -2.27 0.00 0.00 179.45 179.17 1fof h LYS 138 N -0.05 0.88 -0.00 1.90 1.57 -0.67 -2.11 116.57 118.09 1fof h LYS 138 Ca -0.01 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 1fof h LYS 138 Cb 0.96 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.13 1fof h LYS 138 CO 0.07 0.77 -0.08 1.19 -0.57 0.00 0.00 179.45 180.83 1fof n PHE 139 N -4.28 0.00 -3.84 -1.35 3.72 0.15 -4.76 117.46 107.11 1fof n PHE 139 Ca 0.04 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.20 1fof n PHE 139 Cb 0.21 -0.34 0.01 0.00 -0.94 0.00 0.00 39.48 38.42 1fof n PHE 139 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1fof n SER 140 N -1.32 -1.59 -4.49 4.37 7.64 -0.31 -4.87 113.62 113.04 1fof n SER 140 Ca 0.11 -0.88 -0.43 0.00 1.01 0.00 0.00 58.87 58.68 1fof n SER 140 Cb 0.30 -3.67 -0.04 0.00 -1.01 0.00 0.00 64.21 59.79 1fof n SER 140 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1fof s TYR 141 N -3.68 2.62 0.00 1.43 5.04 -0.39 -4.96 117.35 117.41 1fof s TYR 141 Ca 0.14 -0.30 0.00 0.00 -2.44 0.00 0.00 57.07 54.48 1fof s TYR 141 Cb -0.07 -4.31 0.00 0.00 0.35 0.00 0.00 41.96 37.92 1fof s TYR 141 CO 0.84 -1.66 0.00 0.41 -1.34 0.00 0.00 175.55 173.80 1fof n GLY 142 N 5.28 1.85 0.00 8.97 0.00 -1.26 -1.84 105.19 118.18 1fof n GLY 142 Ca -0.01 -0.44 0.14 0.00 0.00 0.00 0.00 46.02 45.71 1fof n GLY 142 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1fof n ASN 143 N -1.32 0.00 -2.19 1.61 0.23 -0.07 -4.89 115.26 108.62 1fof n ASN 143 Ca 0.00 -1.07 -0.12 0.00 -0.53 0.00 0.00 54.58 52.86 1fof n ASN 143 Cb 0.00 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 37.68 1fof n ASN 143 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1fof n GLN 144 N -0.95 -2.02 -3.24 -3.83 6.02 -0.77 -4.92 117.38 107.68 1fof n GLN 144 Ca 0.21 0.62 -0.44 0.00 -0.01 0.00 0.00 57.00 57.38 1fof n GLN 144 Cb 0.10 -5.13 -0.06 0.00 1.02 0.00 0.00 30.24 26.16 1fof n GLN 144 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1fof s ASN 145 N -2.03 6.19 -0.16 1.08 3.84 -1.26 -4.91 114.94 117.69 1fof s ASN 145 Ca 0.00 -1.15 0.16 0.00 0.21 0.00 0.00 52.86 52.08 1fof s ASN 145 Cb 0.00 -2.25 0.72 0.00 -0.55 0.00 0.00 41.25 39.17 1fof s ASN 145 CO 0.00 -0.83 1.64 2.30 -2.79 0.00 0.00 177.10 177.42 1fof n ILE 146 N 5.45 2.19 -2.07 -5.21 -5.35 -1.26 -1.73 119.36 111.38 1fof n ILE 146 Ca -0.09 -1.34 -0.34 0.00 -0.27 0.00 0.00 62.75 60.71 1fof n ILE 146 Cb 0.44 -0.04 0.02 0.00 -1.74 0.00 0.00 39.64 38.32 1fof n ILE 146 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1fof s SER 147 N -0.98 5.57 0.00 7.28 1.04 -1.26 -4.34 113.70 121.00 1fof s SER 147 Ca 0.51 2.03 0.00 0.00 0.48 0.00 0.00 55.95 58.97 1fof s SER 147 Cb 0.35 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.91 1fof s SER 147 CO 0.20 -1.32 0.00 0.61 0.98 0.00 0.00 173.24 173.71 1fof n GLY 148 N -0.30 1.70 0.00 7.32 0.00 -1.26 -3.08 105.19 109.57 1fof n GLY 148 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1fof n GLY 148 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fof n GLY 149 N -0.88 1.20 0.41 -0.02 0.00 -1.26 -4.03 105.19 100.61 1fof n GLY 149 Ca 0.00 -1.10 0.22 0.00 0.00 0.00 0.00 46.02 45.13 1fof n GLY 149 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1fof h ILE 150 N 0.00 0.30 -0.25 -0.61 6.09 -1.95 0.21 117.51 121.31 1fof h ILE 150 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1fof h ILE 150 Cb 0.00 0.55 0.00 0.00 0.47 0.00 0.00 36.82 37.84 1fof h ILE 150 CO 0.00 0.00 0.00 -0.90 -3.07 0.00 0.00 178.15 174.18 1fof n ASP 151 N -3.62 3.74 0.00 2.19 3.85 -1.26 -4.60 116.55 116.85 1fof n ASP 151 Ca 0.10 -2.96 0.00 0.00 -0.71 0.00 0.00 54.79 51.21 1fof n ASP 151 Cb 0.75 -0.52 0.00 0.00 -1.35 0.00 0.00 41.12 40.00 1fof n ASP 151 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1fof n LYS 152 N -0.50 4.80 -0.34 0.11 4.01 0.59 -4.85 118.16 121.98 1fof n LYS 152 Ca 0.20 0.00 0.25 0.00 -0.51 0.00 0.00 58.31 58.25 1fof n LYS 152 Cb 0.85 -0.50 0.53 0.00 -0.51 0.00 0.00 35.03 35.40 1fof n LYS 152 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1fof h PHE 153 N 0.00 0.64 0.00 2.13 -5.15 -1.26 0.21 116.94 113.51 1fof h PHE 153 Ca 0.00 0.02 0.00 0.00 -0.20 0.00 0.00 57.97 57.79 1fof h PHE 153 Cb 0.00 -0.18 0.00 0.00 0.22 0.00 0.00 35.95 35.99 1fof h PHE 153 CO 0.00 0.02 -0.40 -2.67 -2.00 0.00 0.00 178.31 173.26 1fof n TRP 154 N -4.64 0.33 -0.12 6.09 2.14 -1.26 -2.12 117.44 117.85 1fof n TRP 154 Ca 0.27 0.10 -0.25 0.00 2.07 0.00 0.00 57.50 59.68 1fof n TRP 154 Cb 0.95 -0.53 -0.10 0.00 -0.81 0.00 0.00 31.31 30.82 1fof n TRP 154 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 1fof n LEU 155 N -1.83 1.92 -0.48 5.67 4.77 0.54 -1.39 117.00 126.20 1fof n LEU 155 Ca 0.05 0.38 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 1fof n LEU 155 Cb 0.39 -0.87 0.00 0.00 -2.33 0.00 0.00 43.42 40.61 1fof n LEU 155 CO 0.34 0.40 0.25 -1.84 -1.33 0.00 0.00 177.39 175.21 1fof n GLU 156 N -4.33 0.00 0.00 3.23 0.28 -0.01 -4.87 120.64 114.94 1fof n GLU 156 Ca -0.44 -0.95 0.00 0.00 -0.16 0.00 0.00 57.16 55.61 1fof n GLU 156 Cb 0.78 -0.49 0.00 0.00 1.43 0.00 0.00 31.44 33.16 1fof n GLU 156 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1fof n GLY 157 N 0.00 1.63 0.05 -1.84 0.00 -0.90 -4.93 105.19 99.19 1fof n GLY 157 Ca 0.00 -1.78 0.11 0.00 0.00 0.00 0.00 46.02 44.35 1fof n GLY 157 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1fof n GLN 158 N 0.00 0.14 -1.97 1.61 1.13 -1.18 -4.94 117.38 112.17 1fof n GLN 158 Ca 0.00 -0.10 -0.42 0.00 -1.94 0.00 0.00 57.00 54.54 1fof n GLN 158 Cb 0.00 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 28.83 1fof n GLN 158 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1fof s LEU 159 N -2.93 4.38 0.01 1.08 2.96 -0.71 -4.71 118.68 118.75 1fof s LEU 159 Ca 0.11 2.65 0.00 0.00 -0.22 0.00 0.00 54.13 56.67 1fof s LEU 159 Cb 0.17 -3.61 -0.01 0.00 0.50 0.00 0.00 46.19 43.24 1fof s LEU 159 CO 0.76 -0.76 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.88 1fof s ARG 160 N 0.33 0.15 -0.07 1.98 1.81 -1.26 -4.04 118.95 117.84 1fof s ARG 160 Ca 0.64 -0.26 -0.14 0.00 -1.72 0.00 0.00 55.73 54.25 1fof s ARG 160 Cb -0.43 0.03 0.03 0.00 -0.45 0.00 0.00 34.95 34.13 1fof s ARG 160 CO 0.38 -0.02 0.34 -1.50 -0.68 0.00 0.00 175.30 173.82 1fof s ILE 161 N -0.61 0.03 0.46 1.52 2.07 0.09 -0.89 121.20 123.87 1fof s ILE 161 Ca -0.06 -0.25 0.02 0.00 -1.41 0.00 0.00 60.65 58.95 1fof s ILE 161 Cb -0.04 -0.57 0.01 0.00 0.13 0.00 0.00 42.46 41.99 1fof s ILE 161 CO -0.00 -0.14 0.67 -0.94 -1.91 0.00 0.00 174.94 172.62 1fof s SER 162 N -0.63 5.65 0.23 4.50 1.04 -1.26 -0.99 113.70 122.24 1fof s SER 162 Ca -0.07 0.06 -0.06 0.00 0.48 0.00 0.00 55.95 56.36 1fof s SER 162 Cb -0.04 -1.20 0.23 0.00 0.10 0.00 0.00 66.02 65.11 1fof s SER 162 CO 0.03 -0.82 1.78 0.00 0.98 0.00 0.00 173.24 175.21 1fof h ALA 163 N 0.38 1.07 -0.51 5.32 0.00 -1.68 -0.73 119.26 123.11 1fof h ALA 163 Ca -0.44 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.22 1fof h ALA 163 Cb 1.27 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1fof h ALA 163 CO 0.54 0.63 0.19 0.28 0.00 0.00 0.00 179.25 180.88 1fof h VAL 164 N 1.02 1.22 -0.27 0.00 2.07 -1.82 -2.01 116.25 116.45 1fof h VAL 164 Ca 0.22 -0.72 -0.07 0.00 0.82 0.00 0.00 66.70 66.95 1fof h VAL 164 Cb 0.29 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 1fof h VAL 164 CO -0.01 0.27 -0.15 -1.13 0.02 0.00 0.00 177.57 176.57 1fof h ASN 165 N 0.69 0.46 -0.33 0.57 -0.00 -1.77 -2.09 115.58 113.11 1fof h ASN 165 Ca 0.17 -0.12 -0.01 0.00 -0.00 0.00 0.00 56.30 56.33 1fof h ASN 165 Cb 0.23 -0.12 -0.02 0.00 -0.00 0.00 0.00 38.32 38.41 1fof h ASN 165 CO -0.01 0.64 0.16 1.56 -0.00 0.00 0.00 177.43 179.78 1fof h GLN 166 N 0.43 0.47 -0.18 6.67 1.08 -0.66 -0.76 115.11 122.16 1fof h GLN 166 Ca 0.08 -0.07 -0.11 0.00 -1.45 0.00 0.00 58.65 57.10 1fof h GLN 166 Cb 0.52 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.85 1fof h GLN 166 CO 0.03 0.43 -0.37 -0.39 -0.95 0.00 0.00 178.83 177.58 1fof h VAL 167 N 0.40 1.29 -0.45 -0.54 -1.51 -1.12 -0.34 116.25 113.99 1fof h VAL 167 Ca 0.11 -1.47 -0.06 0.00 -1.23 0.00 0.00 66.70 64.06 1fof h VAL 167 Cb 0.11 1.56 -0.02 0.00 -2.13 0.00 0.00 31.29 30.81 1fof h VAL 167 CO -0.01 0.45 0.06 -0.33 -1.23 0.00 0.00 177.57 176.51 1fof h GLU 168 N 0.34 0.75 -0.33 5.19 5.08 -1.17 -0.76 114.58 123.67 1fof h GLU 168 Ca 0.04 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.17 1fof h GLU 168 Cb 0.80 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 1fof h GLU 168 CO 0.06 0.78 0.15 0.35 -1.00 0.00 0.00 179.01 179.35 1fof h PHE 169 N 0.61 0.49 -0.27 4.33 3.57 -0.90 -2.40 116.94 122.37 1fof h PHE 169 Ca 0.13 -0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.54 1fof h PHE 169 Cb 0.40 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 1fof h PHE 169 CO 0.03 0.45 -0.12 -0.07 -2.23 0.00 0.00 178.31 176.36 1fof h LEU 170 N 0.40 0.43 -0.55 0.59 3.38 -0.93 -1.97 115.31 116.66 1fof h LEU 170 Ca 0.11 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1fof h LEU 170 Cb 0.15 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1fof h LEU 170 CO -0.01 0.59 -0.02 -0.08 0.09 0.00 0.00 178.44 179.00 1fof h GLU 171 N 0.42 0.99 -0.79 1.13 4.81 -0.94 -0.16 114.58 120.04 1fof h GLU 171 Ca 0.08 -0.33 -0.04 0.00 -0.13 0.00 0.00 59.36 58.94 1fof h GLU 171 Cb 0.46 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.73 1fof h GLU 171 CO 0.03 1.00 0.33 0.77 -0.73 0.00 0.00 179.01 180.41 1fof h SER 172 N 0.87 1.08 0.05 1.04 0.02 -1.10 -0.76 113.55 114.75 1fof h SER 172 Ca 0.15 -0.16 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1fof h SER 172 Cb 0.57 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.83 1fof h SER 172 CO 0.03 0.95 -0.02 0.25 -1.14 0.00 0.00 176.83 176.90 1fof h LEU 173 N 1.15 -0.06 -0.76 5.07 5.85 -1.06 0.58 115.31 126.09 1fof h LEU 173 Ca 0.27 -0.15 0.13 0.00 0.84 0.00 0.00 57.88 58.96 1fof h LEU 173 Cb 0.20 0.01 -0.09 0.00 0.37 0.00 0.00 40.66 41.16 1fof h LEU 173 CO -0.02 0.12 0.34 0.22 -0.34 0.00 0.00 178.44 178.76 1fof h TYR 174 N -0.23 0.59 -0.06 1.25 3.20 -0.72 0.85 116.97 121.85 1fof h TYR 174 Ca -0.01 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1fof h TYR 174 Cb 0.21 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.33 1fof h TYR 174 CO -0.02 0.13 0.00 1.28 -1.64 0.00 0.00 178.16 177.91 1fof n LEU 175 N -4.94 0.69 -2.34 2.82 4.77 -0.32 -4.89 117.00 112.78 1fof n LEU 175 Ca 0.14 -0.28 -0.19 0.00 -0.03 0.00 0.00 56.01 55.65 1fof n LEU 175 Cb 0.38 -0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.41 1fof n LEU 175 CO 0.21 0.14 -0.24 0.59 -1.33 0.00 0.00 177.39 176.76 1fof n ASN 176 N -0.34 -5.40 -0.66 -1.43 3.02 0.29 -4.87 115.26 105.87 1fof n ASN 176 Ca 0.15 0.07 0.12 0.00 -0.03 0.00 0.00 54.58 54.90 1fof n ASN 176 Cb 0.18 -4.53 0.37 0.00 -0.61 0.00 0.00 39.78 35.19 1fof n ASN 176 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1fof n LYS 177 N -2.91 1.90 -1.86 3.52 5.02 0.19 -4.86 118.16 119.16 1fof n LYS 177 Ca -0.22 -1.32 -0.32 0.00 -2.02 0.00 0.00 58.31 54.43 1fof n LYS 177 Cb 0.67 -1.46 0.03 0.00 -0.02 0.00 0.00 35.03 34.24 1fof n LYS 177 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1fof s LEU 178 N -1.83 3.35 -1.19 -0.35 1.43 -1.22 -4.90 118.68 113.97 1fof s LEU 178 Ca 0.35 1.72 -0.18 0.00 -1.03 0.00 0.00 54.13 54.99 1fof s LEU 178 Cb 0.20 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.87 1fof s LEU 178 CO 0.31 -1.26 2.04 -1.20 0.23 0.00 0.00 176.35 176.47 1fof n SER 179 N -2.46 3.49 -3.78 2.29 7.64 -1.26 -4.76 113.62 114.77 1fof n SER 179 Ca 0.08 -2.78 -0.09 0.00 1.01 0.00 0.00 58.87 57.09 1fof n SER 179 Cb 0.53 -1.49 -0.03 0.00 -1.01 0.00 0.00 64.21 62.21 1fof n SER 179 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fof s ALA 180 N 4.55 -1.08 0.60 -0.43 0.00 -1.26 -5.04 121.76 119.10 1fof s ALA 180 Ca 0.53 -0.23 -0.18 0.00 0.00 0.00 0.00 51.96 52.08 1fof s ALA 180 Cb 0.12 0.88 -0.03 0.00 0.00 0.00 0.00 23.12 24.09 1fof s ALA 180 CO 0.02 -0.91 1.18 -1.54 0.00 0.00 0.00 175.76 174.51 1fof s SER 181 N -2.89 5.19 0.29 0.00 1.04 -1.26 -4.89 113.70 111.18 1fof s SER 181 Ca 0.10 2.29 -0.02 0.00 0.48 0.00 0.00 55.95 58.81 1fof s SER 181 Cb -0.03 -2.59 0.45 0.00 0.10 0.00 0.00 66.02 63.95 1fof s SER 181 CO 0.01 -1.59 1.94 0.11 0.98 0.00 0.00 173.24 174.69 1fof h LYS 182 N 0.73 1.09 -0.17 4.02 1.79 -1.93 -2.07 116.57 120.03 1fof h LYS 182 Ca -0.50 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 57.91 1fof h LYS 182 Cb 1.28 -0.25 -0.01 0.00 -1.58 0.00 0.00 32.23 31.68 1fof h LYS 182 CO 0.55 0.72 0.11 0.93 -1.08 0.00 0.00 179.45 180.68 1fof h GLU 183 N 1.12 0.21 -0.26 3.15 3.07 -1.99 -0.18 114.58 119.71 1fof h GLU 183 Ca 0.35 -0.01 -0.10 0.00 -0.50 0.00 0.00 59.36 59.10 1fof h GLU 183 Cb 0.01 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 27.86 1fof h GLU 183 CO -0.11 0.14 -0.27 -0.91 -1.40 0.00 0.00 179.01 176.47 1fof h ASN 184 N 0.22 0.52 -0.46 1.42 2.35 -1.84 -0.45 115.58 117.34 1fof h ASN 184 Ca 0.06 -0.19 -0.12 0.00 -0.55 0.00 0.00 56.30 55.51 1fof h ASN 184 Cb -0.02 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.19 1fof h ASN 184 CO -0.02 0.78 -0.17 1.56 -1.65 0.00 0.00 177.43 177.93 1fof h GLN 185 N 0.45 0.96 -0.65 0.81 4.20 -1.15 -1.90 115.11 117.84 1fof h GLN 185 Ca 0.06 -0.38 -0.05 0.00 0.06 0.00 0.00 58.65 58.34 1fof h GLN 185 Cb 0.71 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.41 1fof h GLN 185 CO 0.05 1.05 0.19 -0.07 -0.67 0.00 0.00 178.83 179.39 1fof h LEU 186 N 0.84 0.96 -0.40 1.46 3.38 -0.68 -0.73 115.31 120.15 1fof h LEU 186 Ca 0.12 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1fof h LEU 186 Cb 0.73 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1fof h LEU 186 CO 0.06 0.92 0.26 0.40 0.09 0.00 0.00 178.44 180.16 1fof h ILE 187 N 0.95 1.11 -0.31 1.22 2.04 -0.83 -2.14 117.51 119.56 1fof h ILE 187 Ca 0.21 -0.23 -0.12 0.00 1.00 0.00 0.00 64.86 65.71 1fof h ILE 187 Cb 0.31 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 36.93 1fof h ILE 187 CO -0.00 0.11 -0.32 0.58 0.00 0.00 0.00 178.15 178.52 1fof h VAL 188 N 0.54 1.28 -0.63 1.67 2.07 -1.16 -2.51 116.25 117.51 1fof h VAL 188 Ca 0.15 -1.44 -0.03 0.00 0.82 0.00 0.00 66.70 66.20 1fof h VAL 188 Cb -0.04 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 1fof h VAL 188 CO -0.03 0.47 0.29 0.11 0.02 0.00 0.00 177.57 178.43 1fof h LYS 189 N 0.56 0.91 -0.31 1.57 1.57 -0.83 -1.94 116.57 118.09 1fof h LYS 189 Ca 0.06 -0.14 -0.12 0.00 -1.87 0.00 0.00 60.65 58.58 1fof h LYS 189 Cb 0.82 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.95 1fof h LYS 189 CO 0.07 0.74 -0.30 1.49 -0.57 0.00 0.00 179.45 180.87 1fof h GLU 190 N 0.86 0.66 0.00 3.15 4.81 -1.32 -2.13 114.58 120.61 1fof h GLU 190 Ca 0.21 -0.29 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 1fof h GLU 190 Cb 0.14 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.50 1fof h GLU 190 CO -0.02 0.89 -0.03 0.00 -0.73 0.00 0.00 179.01 179.11 1fof h ALA 191 N 1.10 1.16 -0.06 2.92 0.00 -1.07 -1.38 119.26 121.93 1fof h ALA 191 Ca 0.07 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1fof h ALA 191 Cb 0.80 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1fof h ALA 191 CO 0.07 0.04 0.00 1.28 0.00 0.00 0.00 179.25 180.64 1fof n LEU 192 N -3.36 1.44 -4.68 0.00 4.77 -0.76 -4.67 117.00 109.74 1fof n LEU 192 Ca -0.02 -0.53 -0.42 0.00 -0.03 0.00 0.00 56.01 55.01 1fof n LEU 192 Cb 0.15 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.18 1fof n LEU 192 CO 0.25 0.26 1.28 -0.69 -1.33 0.00 0.00 177.39 177.16 1fof s VAL 193 N -1.93 3.36 -0.01 4.08 1.01 -0.52 -1.16 120.40 125.24 1fof s VAL 193 Ca 0.36 0.71 0.02 0.00 0.00 0.00 0.00 61.98 63.08 1fof s VAL 193 Cb 0.20 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.09 1fof s VAL 193 CO 0.31 -0.02 0.04 0.35 0.00 0.00 0.00 175.10 175.78 1fof n THR 194 N 4.90 0.03 -3.77 3.92 -2.24 0.53 -4.92 114.28 112.73 1fof n THR 194 Ca 0.15 -0.06 -0.13 0.00 -2.27 0.00 0.00 64.05 61.75 1fof n THR 194 Cb 0.42 0.12 -0.13 0.00 -2.10 0.00 0.00 70.33 68.65 1fof n THR 194 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1fof s GLU 195 N -2.14 0.20 -0.09 -0.78 2.12 -1.11 -5.00 118.70 111.91 1fof s GLU 195 Ca -0.01 0.38 0.02 0.00 0.36 0.00 0.00 54.97 55.72 1fof s GLU 195 Cb 0.01 -0.01 0.02 0.00 0.26 0.00 0.00 34.13 34.41 1fof s GLU 195 CO 0.09 -0.10 -0.12 0.00 -0.54 0.00 0.00 175.26 174.59 1fof s ALA 196 N 0.67 1.41 0.12 6.30 0.00 -1.26 -0.43 121.76 128.57 1fof s ALA 196 Ca -0.05 -0.54 0.01 0.00 0.00 0.00 0.00 51.96 51.39 1fof s ALA 196 Cb -0.06 -0.71 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 1fof s ALA 196 CO -0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 175.76 175.66 1fof s ALA 197 N 0.93 1.06 0.27 0.00 0.00 0.38 -5.03 121.76 119.37 1fof s ALA 197 Ca -0.09 -1.43 -0.04 0.00 0.00 0.00 0.00 51.96 50.40 1fof s ALA 197 Cb -0.15 0.36 0.35 0.00 0.00 0.00 0.00 23.12 23.69 1fof s ALA 197 CO 0.00 -0.30 1.92 -1.35 0.00 0.00 0.00 175.76 176.04 1fof h PRO 198 N 2.88 1.21 -0.00 0.00 0.11 -2.02 -2.84 132.00 131.34 1fof h PRO 198 Ca -0.36 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1fof h PRO 198 Cb 1.18 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1fof h PRO 198 CO 0.64 0.80 -0.52 0.39 -0.21 0.00 0.00 178.00 179.10 1fof n GLU 199 N -4.42 0.15 -3.43 1.05 1.02 -1.26 -4.98 120.64 108.76 1fof n GLU 199 Ca 0.13 -0.09 -0.13 0.00 -0.02 0.00 0.00 57.16 57.05 1fof n GLU 199 Cb 0.07 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 29.97 1fof n GLU 199 CO 0.00 0.00 0.00 1.52 1.18 0.00 0.00 177.13 179.83 1fof s TYR 200 N -2.91 -0.55 -0.06 -0.32 -0.85 -1.07 -2.78 117.35 108.81 1fof s TYR 200 Ca 0.13 0.42 0.02 0.00 -0.52 0.00 0.00 57.07 57.12 1fof s TYR 200 Cb 0.18 0.54 0.01 0.00 0.38 0.00 0.00 41.96 43.07 1fof s TYR 200 CO 0.69 -0.81 -0.12 -1.17 -1.52 0.00 0.00 175.55 172.62 1fof s LEU 201 N -2.55 1.66 -0.19 -3.49 2.96 -0.75 -0.47 118.68 115.84 1fof s LEU 201 Ca -0.00 -0.29 -0.04 0.00 -0.22 0.00 0.00 54.13 53.58 1fof s LEU 201 Cb -0.01 -0.80 -0.02 0.00 0.50 0.00 0.00 46.19 45.86 1fof s LEU 201 CO -0.10 0.04 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.25 1fof s VAL 202 N 0.61 3.76 -0.17 1.68 1.01 0.43 -1.39 120.40 126.33 1fof s VAL 202 Ca -0.13 -0.38 -0.03 0.00 0.00 0.00 0.00 61.98 61.43 1fof s VAL 202 Cb -0.15 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.52 1fof s VAL 202 CO 0.03 0.45 -0.05 -1.00 0.00 0.00 0.00 175.10 174.54 1fof s HIS 203 N 0.89 2.97 0.25 5.22 3.76 -0.51 -0.35 115.29 127.52 1fof s HIS 203 Ca -0.00 -0.52 -0.20 0.00 -0.15 0.00 0.00 55.06 54.20 1fof s HIS 203 Cb -0.14 -1.99 0.02 0.00 1.11 0.00 0.00 32.58 31.58 1fof s HIS 203 CO 0.02 -0.21 0.65 -1.54 -0.85 0.00 0.00 174.74 172.81 1fof s SER 204 N 0.71 -0.28 -0.16 1.40 1.04 -0.31 -0.28 113.70 115.82 1fof s SER 204 Ca -0.02 -0.56 -0.11 0.00 0.48 0.00 0.00 55.95 55.73 1fof s SER 204 Cb -0.15 0.68 0.05 0.00 0.10 0.00 0.00 66.02 66.70 1fof s SER 204 CO 0.02 -1.24 0.41 -0.75 0.98 0.00 0.00 173.24 172.66 1fof s LYS 205 N -3.91 0.42 0.47 4.02 2.47 0.70 -4.80 119.74 119.11 1fof s LYS 205 Ca 0.11 0.69 0.01 0.00 -1.56 0.00 0.00 55.97 55.22 1fof s LYS 205 Cb -0.04 0.08 0.01 0.00 -1.46 0.00 0.00 37.83 36.41 1fof s LYS 205 CO 0.04 -0.12 0.68 0.95 0.16 0.00 0.00 175.35 177.06 1fof s THR 206 N 0.91 3.65 -0.08 3.43 -4.23 -1.26 -1.60 115.64 116.45 1fof s THR 206 Ca -0.06 -0.58 -0.21 0.00 -1.18 0.00 0.00 61.69 59.67 1fof s THR 206 Cb -0.06 -3.35 0.05 0.00 1.34 0.00 0.00 72.50 70.48 1fof s THR 206 CO -0.07 -0.23 0.50 -0.83 -0.54 0.00 0.00 174.62 173.44 1fof s GLY 207 N -4.27 -0.37 -0.29 3.99 0.00 -0.78 -3.33 107.32 102.28 1fof s GLY 207 Ca 0.51 1.02 -0.01 0.00 0.00 0.00 0.00 44.72 46.23 1fof s GLY 207 CO 0.38 0.76 0.54 -0.12 0.00 0.00 0.00 173.10 174.66 1fof s PHE 208 N -0.77 -1.42 -0.14 1.90 5.36 -1.26 -0.02 117.98 121.63 1fof s PHE 208 Ca -0.08 1.47 0.18 0.00 -0.96 0.00 0.00 56.93 57.54 1fof s PHE 208 Cb -0.03 0.42 0.26 0.00 -0.34 0.00 0.00 43.02 43.33 1fof s PHE 208 CO 0.05 -0.85 1.54 0.66 -1.46 0.00 0.00 175.22 175.16 1fof h SER 209 N 8.05 0.00 -4.08 6.13 4.64 -1.57 -3.43 113.55 123.28 1fof h SER 209 Ca -0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 1fof h SER 209 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1fof h SER 209 CO 0.26 0.39 0.00 0.61 -0.87 0.00 0.00 176.83 177.22 1fof n GLY 210 N 1.00 0.99 0.05 -0.77 0.00 -1.26 -4.90 105.19 100.30 1fof n GLY 210 Ca 0.02 -1.97 0.12 0.00 0.00 0.00 0.00 46.02 44.19 1fof n GLY 210 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1fof n VAL 211 N 1.29 0.00 0.00 1.61 0.24 -1.26 -3.68 118.33 116.53 1fof n VAL 211 Ca 0.00 -0.02 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 1fof n VAL 211 Cb 0.00 0.37 0.00 0.00 -1.47 0.00 0.00 33.84 32.74 1fof n VAL 211 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1fof n GLY 212 N 1.47 2.75 3.14 7.63 0.00 -1.26 -3.29 105.19 115.63 1fof n GLY 212 Ca 0.06 0.15 -0.20 0.00 0.00 0.00 0.00 46.02 46.03 1fof n GLY 212 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fof n THR 213 N 0.00 0.00 0.10 2.61 -2.24 -0.58 -4.87 114.28 109.30 1fof n THR 213 Ca 0.00 -2.35 -0.02 0.00 -2.27 0.00 0.00 64.05 59.41 1fof n THR 213 Cb 0.00 1.09 -0.05 0.00 -2.10 0.00 0.00 70.33 69.28 1fof n THR 213 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1fof h GLU 214 N 0.00 0.00 -0.00 -0.78 4.81 -1.92 -0.51 114.58 116.18 1fof h GLU 214 Ca -0.25 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.98 1fof h GLU 214 Cb 1.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.55 1fof h GLU 214 CO 0.37 0.73 -0.01 0.77 -0.73 0.00 0.00 179.01 180.14 1fof h SER 215 N 0.00 0.01 -3.00 1.04 0.02 -1.97 -3.39 113.55 106.27 1fof h SER 215 Ca -0.02 -0.56 -0.60 0.00 -0.84 0.00 0.00 61.79 59.77 1fof h SER 215 Cb 1.58 -0.00 -0.40 0.00 0.14 0.00 0.00 62.40 63.72 1fof h SER 215 CO 0.10 0.57 -0.78 0.20 -1.14 0.00 0.00 176.83 175.78 1fof s ASN 216 N -5.78 3.21 0.83 3.07 0.01 -1.23 -5.13 114.94 109.92 1fof s ASN 216 Ca -0.16 -3.02 -0.10 0.00 -0.71 0.00 0.00 52.86 48.86 1fof s ASN 216 Cb 0.01 -0.95 0.09 0.00 0.41 0.00 0.00 41.25 40.81 1fof s ASN 216 CO 0.68 -0.20 1.11 -2.16 -1.51 0.00 0.00 177.10 175.02 1fof s PRO 217 N -0.12 1.76 0.00 -0.60 0.04 -0.20 -1.53 135.00 134.35 1fof s PRO 217 Ca 0.24 1.28 0.00 0.00 0.04 0.00 0.00 61.00 62.56 1fof s PRO 217 Cb -0.11 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1fof s PRO 217 CO -0.10 -2.03 0.00 0.41 0.04 0.00 0.00 177.00 175.32 1fof n GLY 218 N -0.70 -1.50 3.05 0.56 0.00 0.10 -4.71 105.19 101.98 1fof n GLY 218 Ca 0.10 -1.57 -0.16 0.00 0.00 0.00 0.00 46.02 44.39 1fof n GLY 218 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fof s VAL 219 N -0.68 0.65 -0.01 1.61 0.11 -1.25 -1.47 120.40 119.35 1fof s VAL 219 Ca 0.00 -0.77 0.07 0.00 -2.93 0.00 0.00 61.98 58.35 1fof s VAL 219 Cb 0.00 -0.63 -0.02 0.00 -1.53 0.00 0.00 36.38 34.21 1fof s VAL 219 CO 0.00 -0.12 -0.23 0.00 -3.33 0.00 0.00 175.10 171.42 1fof s ALA 220 N -0.82 1.93 0.23 1.54 0.00 -0.45 -1.36 121.76 122.82 1fof s ALA 220 Ca -0.03 -1.02 0.07 0.00 0.00 0.00 0.00 51.96 50.98 1fof s ALA 220 Cb -0.07 -0.48 -0.05 0.00 0.00 0.00 0.00 23.12 22.53 1fof s ALA 220 CO 0.00 0.47 -0.10 -1.58 0.00 0.00 0.00 175.76 174.55 1fof s TRP 221 N -0.58 1.76 -0.30 0.00 0.52 0.96 -1.39 118.94 119.93 1fof s TRP 221 Ca 0.09 -0.66 -0.00 0.00 0.02 0.00 0.00 56.10 55.55 1fof s TRP 221 Cb -0.09 -0.91 0.19 0.00 -1.15 0.00 0.00 33.47 31.51 1fof s TRP 221 CO -0.01 0.28 0.59 -0.46 0.02 0.00 0.00 176.95 177.38 1fof s TRP 222 N -3.04 -1.63 0.16 -1.98 -0.00 -0.53 -1.86 118.94 110.06 1fof s TRP 222 Ca 0.25 1.60 0.05 0.00 -0.00 0.00 0.00 56.10 58.01 1fof s TRP 222 Cb 0.02 0.52 -0.05 0.00 -0.00 0.00 0.00 33.47 33.96 1fof s TRP 222 CO 0.08 -0.91 -0.10 0.14 -0.00 0.00 0.00 176.95 176.16 1fof s VAL 223 N 2.85 1.27 -5.00 5.86 -7.23 -0.63 -0.74 120.40 116.78 1fof s VAL 223 Ca 0.19 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.27 1fof s VAL 223 Cb -0.14 -1.91 0.00 0.00 0.56 0.00 0.00 36.38 34.89 1fof s VAL 223 CO -0.22 -0.70 0.00 0.61 -0.31 0.00 0.00 175.10 174.49 1fof n GLY 224 N -0.24 -0.37 3.38 2.32 0.00 -0.30 -0.22 105.19 109.76 1fof n GLY 224 Ca -0.10 -1.00 -0.13 0.00 0.00 0.00 0.00 46.02 44.79 1fof n GLY 224 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1fof s TRP 225 N -3.57 -0.40 -0.14 1.61 -2.14 0.61 -0.52 118.94 114.39 1fof s TRP 225 Ca 0.00 0.38 0.02 0.00 2.66 0.00 0.00 56.10 59.16 1fof s TRP 225 Cb 0.00 0.34 0.00 0.00 -3.10 0.00 0.00 33.47 30.71 1fof s TRP 225 CO 0.00 -0.66 -0.19 0.08 -2.66 0.00 0.00 176.95 173.52 1fof s VAL 226 N -2.66 2.34 -0.58 -0.66 1.01 0.16 -1.43 120.40 118.58 1fof s VAL 226 Ca -0.04 -0.89 -0.17 0.00 0.00 0.00 0.00 61.98 60.88 1fof s VAL 226 Cb -0.00 -1.95 0.13 0.00 0.00 0.00 0.00 36.38 34.55 1fof s VAL 226 CO -0.03 0.54 0.59 -1.61 0.00 0.00 0.00 175.10 174.58 1fof s GLU 227 N 0.76 3.05 -0.23 2.72 2.02 -0.48 0.20 118.70 126.73 1fof s GLU 227 Ca -0.07 -1.62 -0.01 0.00 0.02 0.00 0.00 54.97 53.28 1fof s GLU 227 Cb -0.16 -4.30 0.02 0.00 0.10 0.00 0.00 34.13 29.79 1fof s GLU 227 CO -0.00 -1.41 -0.08 0.21 0.02 0.00 0.00 175.26 174.00 1fof s LYS 228 N 1.91 2.94 5.29 1.61 2.36 -0.38 -1.82 119.74 131.64 1fof s LYS 228 Ca 0.07 -0.90 0.00 0.00 -2.55 0.00 0.00 55.97 52.59 1fof s LYS 228 Cb -0.27 -2.92 0.00 0.00 -1.05 0.00 0.00 37.83 33.60 1fof s LYS 228 CO 0.03 -0.34 0.00 0.39 1.55 0.00 0.00 175.35 176.99 1fof n GLU 229 N 4.68 0.00 -0.01 4.03 1.02 -1.12 -0.42 120.64 128.82 1fof n GLU 229 Ca -0.17 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.10 1fof n GLU 229 Cb 0.48 0.00 0.48 0.00 -0.02 0.00 0.00 31.44 32.38 1fof n GLU 229 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1fof n THR 230 N 0.00 0.03 -3.81 2.62 -1.04 -1.26 -4.90 114.28 105.92 1fof n THR 230 Ca 0.00 -0.28 -0.20 0.00 -2.04 0.00 0.00 64.05 61.52 1fof n THR 230 Cb 0.00 0.55 -0.02 0.00 -1.82 0.00 0.00 70.33 69.04 1fof n THR 230 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1fof s GLU 231 N -1.97 3.29 -0.03 -2.82 2.56 0.44 -4.98 118.70 115.18 1fof s GLU 231 Ca 0.37 -0.87 0.01 0.00 0.00 0.00 0.00 54.97 54.48 1fof s GLU 231 Cb 0.21 -2.84 0.02 0.00 2.00 0.00 0.00 34.13 33.52 1fof s GLU 231 CO 0.32 0.30 -0.02 0.08 -0.56 0.00 0.00 175.26 175.38 1fof s VAL 232 N -2.06 0.36 -0.23 3.70 1.01 -1.26 -1.25 120.40 120.66 1fof s VAL 232 Ca 0.38 -0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.32 1fof s VAL 232 Cb -0.09 -0.41 0.03 0.00 0.00 0.00 0.00 36.38 35.91 1fof s VAL 232 CO 0.29 0.18 -0.11 -0.31 0.00 0.00 0.00 175.10 175.15 1fof s TYR 233 N 0.87 3.04 0.00 5.22 1.51 0.13 -1.26 117.35 126.86 1fof s TYR 233 Ca -0.10 -1.75 -0.18 0.00 -1.01 0.00 0.00 57.07 54.03 1fof s TYR 233 Cb -0.13 -1.99 -0.06 0.00 -0.11 0.00 0.00 41.96 39.67 1fof s TYR 233 CO -0.01 -0.78 0.50 -0.06 -1.11 0.00 0.00 175.55 174.10 1fof s PHE 234 N 1.27 3.71 0.03 2.71 0.40 -0.49 0.36 117.98 125.97 1fof s PHE 234 Ca -0.01 1.10 -0.01 0.00 -0.60 0.00 0.00 56.93 57.42 1fof s PHE 234 Cb -0.16 -2.46 -0.02 0.00 0.51 0.00 0.00 43.02 40.89 1fof s PHE 234 CO -0.07 0.49 -0.01 -0.59 0.70 0.00 0.00 175.22 175.75 1fof s PHE 235 N -0.64 0.29 -0.12 0.36 -0.12 0.32 -0.61 117.98 117.46 1fof s PHE 235 Ca 0.27 -0.60 -0.05 0.00 -0.05 0.00 0.00 56.93 56.50 1fof s PHE 235 Cb -0.18 -0.21 0.05 0.00 -0.63 0.00 0.00 43.02 42.06 1fof s PHE 235 CO 0.15 -0.24 0.26 0.00 -0.05 0.00 0.00 175.22 175.34 1fof s ALA 236 N -1.96 -0.58 -0.01 1.99 0.00 -0.66 -1.16 121.76 119.38 1fof s ALA 236 Ca -0.11 1.00 0.05 0.00 0.00 0.00 0.00 51.96 52.90 1fof s ALA 236 Cb -0.06 -0.81 -0.01 0.00 0.00 0.00 0.00 23.12 22.24 1fof s ALA 236 CO -0.03 -0.38 -0.15 0.12 0.00 0.00 0.00 175.76 175.32 1fof s PHE 237 N 1.74 1.32 0.05 0.00 5.36 0.08 -1.13 117.98 125.40 1fof s PHE 237 Ca -0.05 -0.26 -0.13 0.00 -0.96 0.00 0.00 56.93 55.53 1fof s PHE 237 Cb -0.11 -0.85 0.02 0.00 -0.34 0.00 0.00 43.02 41.74 1fof s PHE 237 CO -0.09 -0.02 0.29 0.54 -1.46 0.00 0.00 175.22 174.49 1fof s ASN 238 N -0.39 -0.11 0.08 6.13 2.20 -0.99 -1.45 114.94 120.42 1fof s ASN 238 Ca 0.06 -0.22 -0.18 0.00 -0.94 0.00 0.00 52.86 51.57 1fof s ASN 238 Cb -0.06 0.35 0.04 0.00 -2.00 0.00 0.00 41.25 39.58 1fof s ASN 238 CO -0.00 -0.62 0.43 0.00 -2.94 0.00 0.00 177.10 173.97 1fof s MET 239 N -2.61 1.01 0.33 3.55 0.23 -0.48 -1.56 119.30 119.77 1fof s MET 239 Ca -0.05 -0.50 -0.26 0.00 -1.03 0.00 0.00 55.69 53.86 1fof s MET 239 Cb -0.01 0.45 -0.10 0.00 -1.53 0.00 0.00 34.83 33.65 1fof s MET 239 CO -0.04 -0.38 0.97 -0.51 -2.03 0.00 0.00 175.02 173.03 1fof s ASP 240 N -2.37 7.26 -0.11 -1.18 1.01 -0.71 -1.34 116.67 119.24 1fof s ASP 240 Ca -0.02 1.89 -0.05 0.00 0.71 0.00 0.00 52.55 55.09 1fof s ASP 240 Cb 0.00 -2.58 0.05 0.00 1.01 0.00 0.00 42.92 41.40 1fof s ASP 240 CO -0.07 -0.12 0.24 -0.51 0.21 0.00 0.00 175.17 174.92 1fof s ILE 241 N -1.58 -0.11 0.00 0.77 2.07 -0.54 -4.73 121.20 117.08 1fof s ILE 241 Ca 0.51 0.18 0.00 0.00 -1.41 0.00 0.00 60.65 59.92 1fof s ILE 241 Cb -0.20 -0.39 0.00 0.00 0.13 0.00 0.00 42.46 42.00 1fof s ILE 241 CO 0.26 0.07 0.85 -0.90 -1.91 0.00 0.00 174.94 173.30 1fof n ASP 242 N 4.44 1.51 -3.64 4.50 5.75 -1.26 -0.73 116.55 127.14 1fof n ASP 242 Ca -0.22 -1.71 -0.10 0.00 -0.01 0.00 0.00 54.79 52.75 1fof n ASP 242 Cb 0.52 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.51 1fof n ASP 242 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1fof s ASN 243 N -0.71 -0.06 0.56 -1.12 2.47 -1.26 -4.86 114.94 109.97 1fof s ASN 243 Ca 0.00 0.84 0.29 0.00 0.42 0.00 0.00 52.86 54.41 1fof s ASN 243 Cb 0.00 1.16 1.47 0.00 -1.45 0.00 0.00 41.25 42.43 1fof s ASN 243 CO 0.00 -0.24 1.92 -0.33 -3.72 0.00 0.00 177.10 174.73 1fof h GLU 244 N 8.20 0.00 0.00 0.43 5.08 -1.96 -0.92 114.58 125.42 1fof h GLU 244 Ca -0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1fof h GLU 244 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 1fof h GLU 244 CO 0.13 0.00 0.00 0.66 -1.00 0.00 0.00 179.01 178.80 1fof h SER 245 N 0.00 0.00 0.28 1.42 4.64 -2.03 -1.26 113.55 116.59 1fof h SER 245 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 1fof h SER 245 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1fof h SER 245 CO -0.00 0.00 -0.27 0.29 -0.87 0.00 0.00 176.83 175.98 1fof n LYS 246 N -2.80 0.74 -0.25 4.77 4.76 -0.35 -4.47 118.16 120.55 1fof n LYS 246 Ca -0.02 -0.42 -0.00 0.00 -2.87 0.00 0.00 58.31 55.00 1fof n LYS 246 Cb 0.10 -1.49 0.07 0.00 -1.84 0.00 0.00 35.03 31.86 1fof n LYS 246 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1fof h LEU 247 N 1.02 -0.85 -1.52 -0.35 3.38 -1.38 -0.69 115.31 114.92 1fof h LEU 247 Ca 0.00 0.23 0.08 0.00 0.09 0.00 0.00 57.88 58.28 1fof h LEU 247 Cb 0.49 0.51 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 1fof h LEU 247 CO 0.00 -0.26 0.61 -0.65 0.09 0.00 0.00 178.44 178.23 1fof h PRO 248 N -0.04 0.00 0.00 1.13 0.11 -1.83 -0.77 132.00 130.60 1fof h PRO 248 Ca 0.33 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.40 1fof h PRO 248 Cb 0.55 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 1fof h PRO 248 CO -0.76 0.00 -0.20 -0.07 -0.21 0.00 0.00 178.00 176.76 1fof h LEU 249 N 0.00 0.00 -2.61 2.35 3.38 -1.46 -1.95 115.31 115.03 1fof h LEU 249 Ca 0.14 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.12 1fof h LEU 249 Cb 1.36 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.11 1fof h LEU 249 CO -0.00 0.20 0.04 0.08 0.09 0.00 0.00 178.44 178.85 1fof h ARG 250 N 0.00 0.00 0.00 1.13 0.11 -1.31 -2.20 114.38 112.11 1fof h ARG 250 Ca -0.00 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 59.88 1fof h ARG 250 Cb 0.48 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.53 1fof h ARG 250 CO 0.03 0.00 -1.76 1.63 0.10 0.00 0.00 179.97 179.97 1fof n LYS 251 N -3.51 0.54 -0.23 0.08 5.02 -1.02 -4.50 118.16 114.54 1fof n LYS 251 Ca -0.02 0.07 -0.07 0.00 -2.02 0.00 0.00 58.31 56.27 1fof n LYS 251 Cb 0.12 -1.27 0.04 0.00 -0.02 0.00 0.00 35.03 33.90 1fof n LYS 251 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1fof h SER 252 N 0.00 0.84 0.53 4.39 4.64 -1.27 0.19 113.55 122.88 1fof h SER 252 Ca -0.30 -0.14 -0.03 0.00 -0.47 0.00 0.00 61.79 60.86 1fof h SER 252 Cb 1.48 -0.22 0.01 0.00 -0.31 0.00 0.00 62.40 63.36 1fof h SER 252 CO -0.04 0.74 -0.26 0.40 -0.87 0.00 0.00 176.83 176.81 1fof h ILE 253 N 0.88 0.43 -0.03 0.95 2.04 -1.66 0.09 117.51 120.21 1fof h ILE 253 Ca 0.22 -0.23 -0.06 0.00 1.00 0.00 0.00 64.86 65.80 1fof h ILE 253 Cb 0.13 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 1fof h ILE 253 CO -0.03 0.03 -0.25 1.55 0.00 0.00 0.00 178.15 179.46 1fof h PRO 254 N -0.87 0.05 -0.30 2.37 0.13 -1.77 -1.74 132.00 129.87 1fof h PRO 254 Ca -0.07 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.01 1fof h PRO 254 Cb 0.61 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.72 1fof h PRO 254 CO 0.12 0.30 0.06 1.15 -0.23 0.00 0.00 178.00 179.40 1fof h THR 255 N 0.04 1.23 -0.61 1.56 2.02 -0.81 -0.59 112.91 115.74 1fof h THR 255 Ca 0.01 -0.77 -0.01 0.00 0.77 0.00 0.00 66.41 66.40 1fof h THR 255 Cb 0.47 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 68.01 1fof h THR 255 CO 0.03 0.25 0.33 0.11 0.37 0.00 0.00 175.52 176.61 1fof h LYS 256 N 0.32 0.85 0.04 6.66 1.57 -0.65 0.39 116.57 125.75 1fof h LYS 256 Ca 0.09 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1fof h LYS 256 Cb 0.32 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1fof h LYS 256 CO 0.00 0.63 -0.02 0.82 -0.57 0.00 0.00 179.45 180.32 1fof h ILE 257 N 0.85 1.16 0.00 1.86 2.04 -0.95 -1.18 117.51 121.29 1fof h ILE 257 Ca 0.22 -0.63 -0.05 0.00 1.00 0.00 0.00 64.86 65.39 1fof h ILE 257 Cb 0.04 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.69 1fof h ILE 257 CO -0.03 0.16 -0.26 0.24 0.00 0.00 0.00 178.15 178.26 1fof h MET 258 N -0.33 0.00 -0.31 2.37 2.86 -0.83 -0.75 114.93 117.94 1fof h MET 258 Ca -0.01 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.48 1fof h MET 258 Cb 0.30 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 1fof h MET 258 CO 0.01 0.26 -0.43 0.93 1.06 0.00 0.00 176.91 178.73 1fof h GLU 259 N 0.00 0.79 0.00 1.72 5.08 -0.78 -0.59 114.58 120.80 1fof h GLU 259 Ca -0.00 -0.43 -0.06 0.00 -1.00 0.00 0.00 59.36 57.87 1fof h GLU 259 Cb 0.51 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1fof h GLU 259 CO 0.03 1.06 -0.27 0.77 -1.00 0.00 0.00 179.01 179.61 1fof h SER 260 N 0.64 0.00 0.27 1.42 0.02 -0.33 -1.45 113.55 114.12 1fof h SER 260 Ca 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1fof h SER 260 Cb 1.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.54 1fof h SER 260 CO 0.10 0.27 -0.11 -0.62 -1.14 0.00 0.00 176.83 175.33 1fof n GLU 261 N -3.78 0.85 -1.16 3.45 -0.58 -0.37 -4.92 120.64 114.12 1fof n GLU 261 Ca -0.01 -0.33 -0.05 0.00 -0.42 0.00 0.00 57.16 56.34 1fof n GLU 261 Cb 0.37 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 29.72 1fof n GLU 261 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1fof n GLY 262 N 1.25 0.79 0.12 0.62 0.00 -0.55 -4.93 105.19 102.49 1fof n GLY 262 Ca 0.15 -0.60 -0.20 0.00 0.00 0.00 0.00 46.02 45.37 1fof n GLY 262 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1fof h ILE 263 N 0.00 1.33 -3.34 -0.61 2.04 -1.35 -3.48 117.51 112.10 1fof h ILE 263 Ca -0.11 -2.47 -0.40 0.00 1.00 0.00 0.00 64.86 62.88 1fof h ILE 263 Cb 0.42 3.01 -0.14 0.00 -0.74 0.00 0.00 36.82 39.36 1fof h ILE 263 CO 0.16 0.70 -0.62 0.27 0.00 0.00 0.00 178.15 178.66 1fof s ILE 264 N -2.44 0.89 0.00 -0.67 -4.36 -1.19 -4.94 121.20 108.49 1fof s ILE 264 Ca -0.16 -2.01 0.00 0.00 -0.26 0.00 0.00 60.65 58.22 1fof s ILE 264 Cb 0.02 -2.62 0.00 0.00 1.25 0.00 0.00 42.46 41.11 1fof s ILE 264 CO 0.80 -0.08 0.00 0.61 0.24 0.00 0.00 174.94 176.50