#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fdc s SER 5 N -1.65 5.41 0.17 0.00 0.15 -1.26 -4.92 113.70 111.60 3fdc s SER 5 Ca 0.34 2.76 0.23 0.00 0.70 0.00 0.00 55.95 59.97 3fdc s SER 5 Cb 0.25 -2.64 -0.01 0.00 -1.71 0.00 0.00 66.02 61.91 3fdc s SER 5 CO -0.12 -1.47 1.00 -0.11 1.20 0.00 0.00 173.24 173.74 3fdc n LEU 6 N -0.88 0.75 -4.75 3.45 -0.00 -1.26 -4.93 117.00 109.38 3fdc n LEU 6 Ca 0.09 0.27 -0.36 0.00 -0.00 0.00 0.00 56.01 56.02 3fdc n LEU 6 Cb 0.45 -0.06 0.04 0.00 -0.00 0.00 0.00 43.42 43.85 3fdc n LEU 6 CO 0.53 -0.15 0.83 -0.89 -0.00 0.00 0.00 177.39 177.71 3fdc s THR 7 N -3.36 2.60 -2.08 1.96 2.01 -1.25 -4.67 115.64 110.86 3fdc s THR 7 Ca -0.01 0.36 0.00 0.00 0.31 0.00 0.00 61.69 62.35 3fdc s THR 7 Cb 0.10 -3.08 0.00 0.00 0.01 0.00 0.00 72.50 69.53 3fdc s THR 7 CO 0.80 -0.10 0.00 0.61 -0.69 0.00 0.00 174.62 175.24 3fdc n GLY 8 N 0.43 0.62 3.23 4.40 0.00 0.10 -4.91 105.19 109.06 3fdc n GLY 8 Ca 0.13 -2.13 -0.32 0.00 0.00 0.00 0.00 46.02 43.70 3fdc n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fdc s LYS 9 N -0.83 2.88 0.04 1.61 1.02 -1.26 0.43 119.74 123.62 3fdc s LYS 9 Ca 0.00 -0.88 0.04 0.00 0.02 0.00 0.00 55.97 55.15 3fdc s LYS 9 Cb 0.00 -2.25 -0.02 0.00 -0.52 0.00 0.00 37.83 35.04 3fdc s LYS 9 CO 0.00 0.24 -0.12 -1.58 -0.92 0.00 0.00 175.35 172.97 3fdc s TRP 10 N 0.18 1.07 0.02 3.18 0.52 0.23 -3.16 118.94 120.99 3fdc s TRP 10 Ca -0.14 -0.37 0.06 0.00 0.02 0.00 0.00 56.10 55.67 3fdc s TRP 10 Cb -0.17 -0.63 -0.03 0.00 -1.15 0.00 0.00 33.47 31.49 3fdc s TRP 10 CO 0.07 0.02 -0.15 -0.08 0.02 0.00 0.00 176.95 176.82 3fdc s THR 11 N -0.93 2.97 0.24 2.01 -1.32 0.69 0.17 115.64 119.47 3fdc s THR 11 Ca -0.01 -1.04 0.09 0.00 -1.21 0.00 0.00 61.69 59.52 3fdc s THR 11 Cb -0.08 -2.25 -0.04 0.00 -1.51 0.00 0.00 72.50 68.62 3fdc s THR 11 CO 0.01 0.39 -0.03 0.54 -2.21 0.00 0.00 174.62 173.32 3fdc s ASN 12 N -1.32 4.47 0.50 8.08 2.20 -0.13 -1.26 114.94 127.47 3fdc s ASN 12 Ca 0.15 -0.62 0.34 0.00 -0.94 0.00 0.00 52.86 51.79 3fdc s ASN 12 Cb -0.11 -0.82 1.48 0.00 -2.00 0.00 0.00 41.25 39.81 3fdc s ASN 12 CO 0.05 0.04 1.73 -2.24 -2.94 0.00 0.00 177.10 173.73 3fdc h ASP 13 N 2.22 0.13 1.20 3.54 2.03 -1.85 1.09 116.42 124.78 3fdc h ASP 13 Ca -0.45 0.04 0.00 0.00 -0.73 0.00 0.00 57.03 55.89 3fdc h ASP 13 Cb 1.23 0.02 0.00 0.00 -0.83 0.00 0.00 39.33 39.76 3fdc h ASP 13 CO 0.59 -0.02 0.00 0.18 -1.03 0.00 0.00 179.24 178.96 3fdc n LEU 14 N -4.31 0.62 0.00 0.15 4.77 -1.26 -4.91 117.00 112.05 3fdc n LEU 14 Ca 0.31 0.58 0.00 0.00 -0.03 0.00 0.00 56.01 56.87 3fdc n LEU 14 Cb 1.35 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 42.03 3fdc n LEU 14 CO 0.35 -0.24 0.00 0.61 -1.33 0.00 0.00 177.39 176.78 3fdc n GLY 15 N 1.00 2.23 3.48 -0.72 0.00 0.38 -4.81 105.19 106.75 3fdc n GLY 15 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 3fdc n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fdc s SER 16 N -1.76 0.79 -0.02 1.61 0.01 -1.24 -4.64 113.70 108.44 3fdc s SER 16 Ca 0.00 1.31 0.03 0.00 1.31 0.00 0.00 55.95 58.60 3fdc s SER 16 Cb 0.00 -2.02 -0.00 0.00 0.21 0.00 0.00 66.02 64.21 3fdc s SER 16 CO 0.00 -4.29 -0.11 0.20 0.41 0.00 0.00 173.24 169.45 3fdc s ASN 17 N -2.78 1.41 -0.07 2.44 0.01 -0.72 -0.96 114.94 114.26 3fdc s ASN 17 Ca 0.68 -0.22 0.02 0.00 -0.71 0.00 0.00 52.86 52.63 3fdc s ASN 17 Cb -0.22 -0.26 0.02 0.00 0.41 0.00 0.00 41.25 41.20 3fdc s ASN 17 CO 0.63 0.12 -0.11 -0.32 -1.51 0.00 0.00 177.10 175.90 3fdc s MET 18 N -0.09 1.64 -0.17 -0.60 -2.45 0.44 -1.31 119.30 116.76 3fdc s MET 18 Ca 0.01 -0.38 -0.00 0.00 -1.25 0.00 0.00 55.69 54.07 3fdc s MET 18 Cb -0.07 -1.41 0.00 0.00 1.25 0.00 0.00 34.83 34.61 3fdc s MET 18 CO 0.00 -0.02 -0.14 0.99 1.05 0.00 0.00 175.02 176.90 3fdc s THR 19 N 0.82 2.70 0.09 10.11 2.01 0.33 0.78 115.64 132.47 3fdc s THR 19 Ca -0.12 -0.75 0.10 0.00 0.31 0.00 0.00 61.69 61.23 3fdc s THR 19 Cb -0.15 -2.15 -0.04 0.00 0.01 0.00 0.00 72.50 70.17 3fdc s THR 19 CO 0.02 0.50 -0.25 -0.63 -0.69 0.00 0.00 174.62 173.57 3fdc s ILE 20 N 0.98 2.30 0.00 1.82 1.01 0.17 -0.95 121.20 126.53 3fdc s ILE 20 Ca -0.02 -1.57 0.00 0.00 0.00 0.00 0.00 60.65 59.06 3fdc s ILE 20 Cb -0.15 -1.97 0.00 0.00 0.01 0.00 0.00 42.46 40.35 3fdc s ILE 20 CO -0.03 0.21 0.00 0.61 0.00 0.00 0.00 174.94 175.73 3fdc n GLY 21 N 1.26 1.36 3.69 6.18 0.00 -0.14 -0.73 105.19 116.81 3fdc n GLY 21 Ca -0.17 -1.91 -0.42 0.00 0.00 0.00 0.00 46.02 43.51 3fdc n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fdc s ALA 22 N -2.64 3.51 0.22 4.61 0.00 -1.26 -3.77 121.76 122.42 3fdc s ALA 22 Ca 0.00 0.71 -0.29 0.00 0.00 0.00 0.00 51.96 52.38 3fdc s ALA 22 Cb 0.00 -3.53 -0.09 0.00 0.00 0.00 0.00 23.12 19.50 3fdc s ALA 22 CO 0.00 -0.77 0.90 0.54 0.00 0.00 0.00 175.76 176.44 3fdc s VAL 23 N 2.14 4.15 0.00 0.00 0.11 -1.26 -4.71 120.40 120.83 3fdc s VAL 23 Ca 0.58 2.01 0.00 0.00 -2.93 0.00 0.00 61.98 61.64 3fdc s VAL 23 Cb -0.27 -4.29 0.00 0.00 -1.53 0.00 0.00 36.38 30.29 3fdc s VAL 23 CO 0.24 0.50 0.00 -0.46 -3.33 0.00 0.00 175.10 172.05 3fdc n ASN 24 N 1.56 0.00 0.04 3.54 6.94 -0.89 -4.99 115.26 121.45 3fdc n ASN 24 Ca -0.03 0.00 -0.22 0.00 -0.02 0.00 0.00 54.58 54.31 3fdc n ASN 24 Cb 0.47 0.00 -0.14 0.00 -2.36 0.00 0.00 39.78 37.75 3fdc n ASN 24 CO 0.00 0.00 0.00 0.77 -1.03 0.00 0.00 177.26 177.00 3fdc h SER 25 N 0.00 0.49 0.00 0.53 4.64 -1.97 -3.34 113.55 113.89 3fdc h SER 25 Ca 0.00 -0.90 0.00 0.00 -0.47 0.00 0.00 61.79 60.42 3fdc h SER 25 Cb 0.00 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 61.93 3fdc h SER 25 CO 0.00 1.70 0.00 0.54 -0.87 0.00 0.00 176.83 178.20 3fdc n ARG 26 N -3.77 0.96 0.00 4.77 1.74 -1.26 -4.88 116.66 114.22 3fdc n ARG 26 Ca -0.25 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.83 3fdc n ARG 26 Cb 0.98 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 31.18 3fdc n ARG 26 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3fdc n GLY 27 N 0.68 1.45 3.56 -0.13 0.00 -1.26 -4.74 105.19 104.75 3fdc n GLY 27 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 3fdc n GLY 27 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3fdc s GLU 28 N -0.57 -0.94 0.06 1.61 -1.05 -1.26 -1.39 118.70 115.16 3fdc s GLU 28 Ca 0.00 0.27 -0.27 0.00 -0.15 0.00 0.00 54.97 54.83 3fdc s GLU 28 Cb 0.00 -1.60 0.09 0.00 -0.44 0.00 0.00 34.13 32.18 3fdc s GLU 28 CO 0.00 -3.59 1.19 -0.59 0.95 0.00 0.00 175.26 173.22 3fdc s PHE 29 N -2.81 0.02 0.13 4.83 -0.12 -0.52 -2.10 117.98 117.41 3fdc s PHE 29 Ca 0.68 -0.23 -0.18 0.00 -0.05 0.00 0.00 56.93 57.15 3fdc s PHE 29 Cb -0.15 0.61 0.05 0.00 -0.63 0.00 0.00 43.02 42.89 3fdc s PHE 29 CO 0.58 -0.50 0.46 0.95 -0.05 0.00 0.00 175.22 176.66 3fdc s THR 30 N -2.20 0.05 -0.84 -4.49 -4.23 -1.26 -3.30 115.64 99.36 3fdc s THR 30 Ca 0.23 -0.40 0.00 0.00 -1.18 0.00 0.00 61.69 60.34 3fdc s THR 30 Cb -0.00 -1.11 0.00 0.00 1.34 0.00 0.00 72.50 72.73 3fdc s THR 30 CO 0.01 -0.22 0.00 0.61 -0.54 0.00 0.00 174.62 174.48 3fdc n GLY 31 N -0.24 -1.32 3.70 3.99 0.00 -0.98 -0.96 105.19 109.36 3fdc n GLY 31 Ca -0.16 -0.96 -0.24 0.00 0.00 0.00 0.00 46.02 44.66 3fdc n GLY 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fdc s THR 32 N -2.55 3.81 -0.31 2.61 -4.23 -0.13 0.25 115.64 115.08 3fdc s THR 32 Ca 0.00 -1.62 -0.00 0.00 -1.18 0.00 0.00 61.69 58.89 3fdc s THR 32 Cb 0.00 -3.00 0.14 0.00 1.34 0.00 0.00 72.50 70.97 3fdc s THR 32 CO 0.00 -0.28 0.28 -0.47 -0.54 0.00 0.00 174.62 173.61 3fdc s TYR 33 N -2.08 -0.21 -0.41 3.99 6.14 0.13 -0.52 117.35 124.39 3fdc s TYR 33 Ca 0.31 -0.56 -0.25 0.00 0.64 0.00 0.00 57.07 57.20 3fdc s TYR 33 Cb -0.08 -0.55 0.02 0.00 0.42 0.00 0.00 41.96 41.77 3fdc s TYR 33 CO 0.21 -0.91 0.91 0.99 0.64 0.00 0.00 175.55 177.39 3fdc s THR 34 N 1.98 4.54 0.50 4.34 2.01 -0.43 -3.91 115.64 124.68 3fdc s THR 34 Ca 0.12 0.95 -0.19 0.00 0.31 0.00 0.00 61.69 62.87 3fdc s THR 34 Cb -0.15 -4.37 -0.08 0.00 0.01 0.00 0.00 72.50 67.91 3fdc s THR 34 CO -0.23 -0.67 1.04 0.28 -0.69 0.00 0.00 174.62 174.34 3fdc s THR 35 N 3.57 3.85 -1.26 -0.82 -1.32 -1.26 -1.76 115.64 116.64 3fdc s THR 35 Ca 0.37 1.09 0.13 0.00 -1.21 0.00 0.00 61.69 62.07 3fdc s THR 35 Cb -0.11 -3.45 0.33 0.00 -1.51 0.00 0.00 72.50 67.75 3fdc s THR 35 CO 0.22 -0.31 1.25 0.00 -2.21 0.00 0.00 174.62 173.57 3fdc n ALA 36 N -1.16 2.27 -3.23 11.08 0.00 -1.26 -4.88 120.51 123.33 3fdc n ALA 36 Ca 0.09 -1.07 -0.13 0.00 0.00 0.00 0.00 53.44 52.33 3fdc n ALA 36 Cb 0.53 -0.53 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 3fdc n ALA 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3fdc s VAL 37 N -1.03 0.06 -0.02 0.00 -7.23 -1.26 -4.85 120.40 106.07 3fdc s VAL 37 Ca 0.26 -0.47 -0.04 0.00 -1.81 0.00 0.00 61.98 59.93 3fdc s VAL 37 Cb 0.14 -0.60 0.00 0.00 0.56 0.00 0.00 36.38 36.49 3fdc s VAL 37 CO 0.19 -0.26 0.09 -0.89 -0.31 0.00 0.00 175.10 173.93 3fdc s THR 38 N -1.27 0.03 -1.29 5.32 2.01 -1.26 -5.02 115.64 114.17 3fdc s THR 38 Ca -0.13 -0.25 0.19 0.00 0.31 0.00 0.00 61.69 61.81 3fdc s THR 38 Cb -0.05 -0.22 0.66 0.00 0.01 0.00 0.00 72.50 72.90 3fdc s THR 38 CO 0.04 -0.14 1.57 0.00 -0.69 0.00 0.00 174.62 175.40 3fdc n ALA 39 N 2.53 2.83 -3.62 7.40 0.00 -1.26 -4.95 120.51 123.44 3fdc n ALA 39 Ca -0.16 -1.52 0.00 0.00 0.00 0.00 0.00 53.44 51.76 3fdc n ALA 39 Cb 0.58 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 19.10 3fdc n ALA 39 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 3fdc n THR 40 N 1.15 0.00 -1.12 0.00 5.66 -1.26 -5.06 114.28 113.65 3fdc n THR 40 Ca 0.24 0.00 0.08 0.00 -3.05 0.00 0.00 64.05 61.32 3fdc n THR 40 Cb 0.79 0.00 0.19 0.00 -1.55 0.00 0.00 70.33 69.76 3fdc n THR 40 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 3fdc n SER 41 N -0.90 2.85 -5.00 1.09 7.64 -1.26 -5.04 113.62 112.99 3fdc n SER 41 Ca 0.00 -3.20 -0.18 0.00 1.01 0.00 0.00 58.87 56.50 3fdc n SER 41 Cb 0.00 -0.50 0.01 0.00 -1.01 0.00 0.00 64.21 62.71 3fdc n SER 41 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3fdc s ASN 42 N -2.55 5.64 0.03 6.43 0.01 -1.26 -5.05 114.94 118.19 3fdc s ASN 42 Ca 0.37 -0.33 -0.30 0.00 -0.71 0.00 0.00 52.86 51.89 3fdc s ASN 42 Cb 0.32 -0.76 -0.07 0.00 0.41 0.00 0.00 41.25 41.16 3fdc s ASN 42 CO 0.04 -0.78 1.53 -0.70 -1.51 0.00 0.00 177.10 175.68 3fdc s GLU 43 N -4.39 4.24 -1.16 -0.60 2.56 -1.26 -4.86 118.70 113.22 3fdc s GLU 43 Ca 0.54 2.15 -0.23 0.00 0.00 0.00 0.00 54.97 57.43 3fdc s GLU 43 Cb -0.10 -3.59 -0.09 0.00 2.00 0.00 0.00 34.13 32.35 3fdc s GLU 43 CO 0.34 -0.66 1.94 0.42 -0.56 0.00 0.00 175.26 176.74 3fdc s ILE 44 N 2.55 3.52 -0.07 -3.70 1.09 -1.26 -4.70 121.20 118.64 3fdc s ILE 44 Ca 0.69 -0.86 -0.13 0.00 -1.10 0.00 0.00 60.65 59.25 3fdc s ILE 44 Cb -0.35 -4.51 -0.05 0.00 -1.06 0.00 0.00 42.46 36.48 3fdc s ILE 44 CO 0.29 -0.96 0.33 -0.54 -0.10 0.00 0.00 174.94 173.97 3fdc s LYS 45 N 6.56 3.92 1.00 2.79 1.02 -1.26 -4.96 119.74 128.82 3fdc s LYS 45 Ca 0.69 0.24 -0.16 0.00 0.02 0.00 0.00 55.97 56.76 3fdc s LYS 45 Cb -0.01 -3.27 -0.01 0.00 -0.52 0.00 0.00 37.83 34.01 3fdc s LYS 45 CO 0.12 0.58 -0.12 -1.91 -0.92 0.00 0.00 175.35 173.10 3fdc n GLU 46 N 2.35 -0.47 -3.52 1.68 2.13 -1.26 -4.48 120.64 117.07 3fdc n GLU 46 Ca -0.14 -0.11 -0.13 0.00 0.66 0.00 0.00 57.16 57.43 3fdc n GLU 46 Cb 0.53 -1.55 -0.04 0.00 0.27 0.00 0.00 31.44 30.64 3fdc n GLU 46 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 3fdc s SER 47 N -1.66 -0.48 0.06 4.31 0.01 -1.25 -4.22 113.70 110.48 3fdc s SER 47 Ca 0.51 0.09 -0.14 0.00 1.31 0.00 0.00 55.95 57.72 3fdc s SER 47 Cb -0.16 0.53 -0.06 0.00 0.21 0.00 0.00 66.02 66.54 3fdc s SER 47 CO 0.71 -0.82 0.47 -2.16 0.41 0.00 0.00 173.24 171.85 3fdc s PRO 48 N -2.98 3.94 -0.04 12.44 0.04 -1.26 0.18 135.00 147.33 3fdc s PRO 48 Ca -0.02 0.43 0.06 0.00 0.04 0.00 0.00 61.00 61.51 3fdc s PRO 48 Cb -0.00 -3.11 -0.01 0.00 0.04 0.00 0.00 34.50 31.42 3fdc s PRO 48 CO -0.06 0.60 -0.21 -0.48 0.04 0.00 0.00 177.00 176.90 3fdc s LEU 49 N -1.47 2.00 -0.09 -3.56 -0.00 0.14 -1.73 118.68 113.97 3fdc s LEU 49 Ca 0.30 -0.41 0.02 0.00 -0.00 0.00 0.00 54.13 54.04 3fdc s LEU 49 Cb -0.16 -1.13 -0.02 0.00 -0.00 0.00 0.00 46.19 44.88 3fdc s LEU 49 CO 0.17 0.22 -0.15 -1.00 -0.00 0.00 0.00 176.35 175.59 3fdc s HIS 50 N -0.23 2.73 0.27 3.48 3.76 0.18 -2.33 115.29 123.16 3fdc s HIS 50 Ca 0.01 -0.42 -0.21 0.00 -0.15 0.00 0.00 55.06 54.29 3fdc s HIS 50 Cb -0.11 -1.72 0.04 0.00 1.11 0.00 0.00 32.58 31.90 3fdc s HIS 50 CO 0.01 -0.02 0.80 0.20 -0.85 0.00 0.00 174.74 174.88 3fdc s GLY 51 N -0.20 -0.01 0.10 -2.22 0.00 -1.21 0.99 107.32 104.77 3fdc s GLY 51 Ca 0.00 -0.32 0.03 0.00 0.00 0.00 0.00 44.72 44.44 3fdc s GLY 51 CO 0.03 0.03 -0.09 -1.59 0.00 0.00 0.00 173.10 171.48 3fdc s THR 52 N -3.36 0.86 -0.02 0.90 2.01 -0.43 -1.44 115.64 114.16 3fdc s THR 52 Ca 0.13 -1.73 0.02 0.00 0.31 0.00 0.00 61.69 60.42 3fdc s THR 52 Cb -0.05 -1.45 0.00 0.00 0.01 0.00 0.00 72.50 71.02 3fdc s THR 52 CO 0.07 -0.66 -0.08 -1.83 -0.69 0.00 0.00 174.62 171.43 3fdc s GLU 53 N -3.11 0.86 1.00 4.92 -1.05 -0.49 -0.99 118.70 119.84 3fdc s GLU 53 Ca 0.07 -0.28 -0.15 0.00 -0.15 0.00 0.00 54.97 54.47 3fdc s GLU 53 Cb -0.00 -0.81 0.04 0.00 -0.44 0.00 0.00 34.13 32.91 3fdc s GLU 53 CO -0.01 0.11 0.16 -1.71 0.95 0.00 0.00 175.26 174.76 3fdc n ASN 54 N 3.26 -2.47 -3.50 0.83 2.85 -1.01 -4.32 115.26 110.90 3fdc n ASN 54 Ca -0.18 0.18 -0.11 0.00 -0.11 0.00 0.00 54.58 54.37 3fdc n ASN 54 Cb 0.55 -1.09 -0.10 0.00 1.24 0.00 0.00 39.78 40.38 3fdc n ASN 54 CO 0.00 0.00 0.00 0.42 -2.11 0.00 0.00 177.26 175.57 3fdc s THR 55 N -2.31 -0.55 -0.37 -0.44 -4.23 -1.26 -4.91 115.64 101.57 3fdc s THR 55 Ca 0.55 0.05 0.00 0.00 -1.18 0.00 0.00 61.69 61.11 3fdc s THR 55 Cb -0.17 -0.70 0.12 0.00 1.34 0.00 0.00 72.50 73.09 3fdc s THR 55 CO 0.68 -0.04 0.18 -0.54 -0.54 0.00 0.00 174.62 174.36 3fdc s LYS 58 N 2.52 0.84 0.25 3.99 -0.14 -1.26 -5.13 119.74 120.81 3fdc s LYS 58 Ca 0.06 -1.43 0.04 0.00 -1.36 0.00 0.00 55.97 53.28 3fdc s LYS 58 Cb -0.14 -1.89 -0.03 0.00 -1.68 0.00 0.00 37.83 34.09 3fdc s LYS 58 CO -0.13 -1.11 0.38 0.50 -0.76 0.00 0.00 175.35 174.23 3fdc s ARG 59 N 1.07 3.45 0.13 1.68 3.52 -1.26 -5.04 118.95 122.49 3fdc s ARG 59 Ca 0.14 -0.67 -0.04 0.00 -0.13 0.00 0.00 55.73 55.04 3fdc s ARG 59 Cb -0.21 -2.86 -0.11 0.00 -1.56 0.00 0.00 34.95 30.21 3fdc s ARG 59 CO -0.11 0.40 1.29 1.79 -0.81 0.00 0.00 175.30 177.86 3fdc h THR 60 N 1.17 1.42 -3.54 4.11 1.35 -2.01 -3.40 112.91 112.01 3fdc h THR 60 Ca -0.51 -2.54 -0.71 0.00 -0.55 0.00 0.00 66.41 62.10 3fdc h THR 60 Cb 1.22 2.49 -0.33 0.00 -1.73 0.00 0.00 68.15 69.80 3fdc h THR 60 CO 0.62 0.75 -0.33 -1.10 -0.25 0.00 0.00 175.52 175.21 3fdc s GLN 61 N -3.19 2.62 0.07 4.72 -0.21 -1.26 -4.15 119.66 118.26 3fdc s GLN 61 Ca -0.05 -2.35 -0.11 0.00 0.02 0.00 0.00 55.36 52.87 3fdc s GLN 61 Cb 0.09 -3.83 -0.06 0.00 1.00 0.00 0.00 33.01 30.21 3fdc s GLN 61 CO 0.86 -1.18 0.42 -1.25 -2.12 0.00 0.00 175.29 172.02 3fdc s PRO 62 N 0.28 3.80 0.07 2.91 0.04 -1.26 -4.74 135.00 136.10 3fdc s PRO 62 Ca 0.15 0.24 -0.22 0.00 0.04 0.00 0.00 61.00 61.21 3fdc s PRO 62 Cb -0.20 -3.02 -0.07 0.00 0.04 0.00 0.00 34.50 31.25 3fdc s PRO 62 CO -0.04 0.57 0.65 0.95 0.04 0.00 0.00 177.00 179.18 3fdc s THR 63 N -1.36 4.68 0.15 1.26 -4.23 -1.26 -2.31 115.64 112.58 3fdc s THR 63 Ca 0.32 1.40 0.01 0.00 -1.18 0.00 0.00 61.69 62.24 3fdc s THR 63 Cb -0.14 -3.99 -0.00 0.00 1.34 0.00 0.00 72.50 69.70 3fdc s THR 63 CO 0.17 0.49 0.03 2.22 -0.54 0.00 0.00 174.62 176.99 3fdc n PHE 64 N 2.06 0.20 -3.53 3.99 1.16 0.04 -2.40 117.46 118.99 3fdc n PHE 64 Ca -0.07 -0.85 -0.00 0.00 -1.87 0.00 0.00 57.45 54.65 3fdc n PHE 64 Cb 0.50 -0.05 -0.05 0.00 -1.61 0.00 0.00 39.48 38.27 3fdc n PHE 64 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 3fdc s GLY 65 N -1.87 -0.06 0.05 4.97 0.00 -0.16 -2.67 107.32 107.57 3fdc s GLY 65 Ca 0.04 3.12 -0.00 0.00 0.00 0.00 0.00 44.72 47.88 3fdc s GLY 65 CO 0.03 2.90 -0.04 -0.11 0.00 0.00 0.00 173.10 175.88 3fdc s PHE 66 N 1.84 0.52 -0.15 1.90 -0.12 -0.37 -1.32 117.98 120.28 3fdc s PHE 66 Ca -0.06 -0.91 -0.03 0.00 -0.05 0.00 0.00 56.93 55.88 3fdc s PHE 66 Cb -0.05 -0.37 -0.02 0.00 -0.63 0.00 0.00 43.02 41.95 3fdc s PHE 66 CO -0.16 -0.30 -0.06 0.99 -0.05 0.00 0.00 175.22 175.64 3fdc s THR 67 N -3.25 3.68 -0.39 -4.49 2.01 0.28 -1.11 115.64 112.36 3fdc s THR 67 Ca 0.02 -0.43 -0.07 0.00 0.31 0.00 0.00 61.69 61.52 3fdc s THR 67 Cb 0.03 -2.60 0.07 0.00 0.01 0.00 0.00 72.50 70.01 3fdc s THR 67 CO -0.07 0.50 0.19 -0.69 -0.69 0.00 0.00 174.62 173.86 3fdc s VAL 68 N 0.38 3.85 -0.86 3.82 1.01 -0.59 0.50 120.40 128.51 3fdc s VAL 68 Ca -0.06 -1.46 -0.23 0.00 0.00 0.00 0.00 61.98 60.23 3fdc s VAL 68 Cb -0.15 -3.35 0.06 0.00 0.00 0.00 0.00 36.38 32.94 3fdc s VAL 68 CO 0.04 -0.43 1.27 0.21 0.00 0.00 0.00 175.10 176.18 3fdc s ASN 69 N 1.83 6.37 0.37 3.32 3.04 -0.71 -3.00 114.94 126.17 3fdc s ASN 69 Ca 0.02 -1.17 -0.28 0.00 0.04 0.00 0.00 52.86 51.47 3fdc s ASN 69 Cb -0.22 -2.52 -0.11 0.00 -1.54 0.00 0.00 41.25 36.86 3fdc s ASN 69 CO 0.01 -1.53 1.42 0.79 -3.04 0.00 0.00 177.10 174.75 3fdc n TRP 70 N 8.47 2.74 -0.03 0.43 7.02 -1.24 -4.04 117.44 130.80 3fdc n TRP 70 Ca 0.17 0.48 -0.09 0.00 -1.02 0.00 0.00 57.50 57.03 3fdc n TRP 70 Cb 0.49 -2.49 -0.14 0.00 -2.42 0.00 0.00 31.31 26.75 3fdc n TRP 70 CO 0.00 0.00 0.00 1.17 -2.02 0.00 0.00 177.69 176.84 3fdc n LYS 71 N 0.42 0.64 -0.86 -0.99 3.00 -1.26 -4.27 118.16 114.83 3fdc n LYS 71 Ca 0.03 0.28 -0.17 0.00 -0.00 0.00 0.00 58.31 58.44 3fdc n LYS 71 Cb 0.38 -1.77 0.11 0.00 0.00 0.00 0.00 35.03 33.75 3fdc n LYS 71 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.40 179.37 3fdc n PHE 72 N -3.04 2.07 0.00 5.64 -1.74 -1.26 -4.94 117.46 114.19 3fdc n PHE 72 Ca -0.18 -1.58 0.00 0.00 -0.56 0.00 0.00 57.45 55.13 3fdc n PHE 72 Cb 1.06 -0.80 0.00 0.00 1.52 0.00 0.00 39.48 41.26 3fdc n PHE 72 CO 0.00 0.00 0.00 -1.13 -0.56 0.00 0.00 176.76 175.07 3fdc n SER 73 N -0.51 0.00 -3.81 5.98 3.41 -1.26 -4.81 113.62 112.63 3fdc n SER 73 Ca 0.40 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.59 3fdc n SER 73 Cb 1.16 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 65.10 3fdc n SER 73 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3fdc n GLU 74 N -0.24 2.73 -3.69 4.33 1.02 -1.26 -4.73 120.64 118.79 3fdc n GLU 74 Ca 0.00 -2.58 -0.10 0.00 -0.02 0.00 0.00 57.16 54.46 3fdc n GLU 74 Cb 0.00 -3.27 -0.04 0.00 -0.02 0.00 0.00 31.44 28.11 3fdc n GLU 74 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3fdc s SER 75 N 3.52 -0.29 0.01 1.62 0.01 -1.26 -3.94 113.70 113.37 3fdc s SER 75 Ca 0.49 -0.41 -0.02 0.00 1.31 0.00 0.00 55.95 57.31 3fdc s SER 75 Cb 0.13 0.57 -0.01 0.00 0.21 0.00 0.00 66.02 66.92 3fdc s SER 75 CO -0.05 -1.02 0.02 -0.89 0.41 0.00 0.00 173.24 171.71 3fdc s THR 76 N -3.85 0.09 0.03 1.44 2.01 -1.19 -3.68 115.64 110.49 3fdc s THR 76 Ca 0.08 -0.78 0.06 0.00 0.31 0.00 0.00 61.69 61.35 3fdc s THR 76 Cb -0.01 -0.30 -0.02 0.00 0.01 0.00 0.00 72.50 72.19 3fdc s THR 76 CO -0.05 -0.43 -0.16 -0.89 -0.69 0.00 0.00 174.62 172.40 3fdc s THR 77 N -1.34 1.29 -0.12 -0.82 2.01 -1.16 -0.87 115.64 114.64 3fdc s THR 77 Ca -0.15 -1.00 -0.01 0.00 0.31 0.00 0.00 61.69 60.85 3fdc s THR 77 Cb -0.09 -1.13 0.03 0.00 0.01 0.00 0.00 72.50 71.32 3fdc s THR 77 CO -0.00 0.12 -0.06 0.68 -0.69 0.00 0.00 174.62 174.67 3fdc s VAL 78 N -0.75 0.93 0.08 3.82 -7.23 -0.97 -1.55 120.40 114.73 3fdc s VAL 78 Ca 0.04 -0.28 0.02 0.00 -1.81 0.00 0.00 61.98 59.96 3fdc s VAL 78 Cb -0.08 -1.00 -0.04 0.00 0.56 0.00 0.00 36.38 35.82 3fdc s VAL 78 CO 0.01 0.31 0.11 -0.36 -0.31 0.00 0.00 175.10 174.86 3fdc s PHE 79 N 1.74 3.26 -0.17 2.82 0.40 -0.27 -1.55 117.98 124.21 3fdc s PHE 79 Ca 0.04 0.11 -0.08 0.00 -0.60 0.00 0.00 56.93 56.40 3fdc s PHE 79 Cb -0.13 -1.65 0.06 0.00 0.51 0.00 0.00 43.02 41.82 3fdc s PHE 79 CO -0.08 0.54 0.39 -0.08 0.70 0.00 0.00 175.22 176.69 3fdc s THR 80 N -1.43 -0.17 0.00 0.64 -1.32 0.80 -1.24 115.64 112.91 3fdc s THR 80 Ca 0.31 0.12 0.00 0.00 -1.21 0.00 0.00 61.69 60.91 3fdc s THR 80 Cb -0.12 -0.59 0.00 0.00 -1.51 0.00 0.00 72.50 70.28 3fdc s THR 80 CO 0.23 0.05 0.00 0.61 -2.21 0.00 0.00 174.62 173.30 3fdc n GLY 81 N 4.55 2.85 3.00 6.08 0.00 -1.09 -0.97 105.19 119.60 3fdc n GLY 81 Ca -0.20 -0.62 -0.12 0.00 0.00 0.00 0.00 46.02 45.09 3fdc n GLY 81 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3fdc s GLN 82 N 1.39 0.17 -0.42 1.61 0.74 -0.56 -0.78 119.66 121.81 3fdc s GLN 82 Ca 0.00 0.07 -0.25 0.00 0.05 0.00 0.00 55.36 55.23 3fdc s GLN 82 Cb 0.00 0.08 0.02 0.00 1.10 0.00 0.00 33.01 34.21 3fdc s GLN 82 CO 0.00 -0.03 0.89 0.00 -0.55 0.00 0.00 175.29 175.61 3fdc s PHE 84 N 3.56 2.96 -0.94 0.00 0.08 -0.39 -4.12 117.98 119.13 3fdc s PHE 84 Ca 0.36 -0.02 -0.15 0.00 0.12 0.00 0.00 56.93 57.24 3fdc s PHE 84 Cb -0.11 -1.56 0.20 0.00 -0.57 0.00 0.00 43.02 40.98 3fdc s PHE 84 CO 0.23 0.45 0.98 0.42 -0.10 0.00 0.00 175.22 177.21 3fdc s ILE 85 N -1.21 5.38 -0.67 0.64 -1.09 -1.26 0.10 121.20 123.09 3fdc s ILE 85 Ca 0.23 -2.39 -0.25 0.00 -2.23 0.00 0.00 60.65 56.00 3fdc s ILE 85 Cb -0.11 -4.62 -0.13 0.00 -1.58 0.00 0.00 42.46 36.02 3fdc s ILE 85 CO 0.15 -1.24 2.44 -0.67 -1.23 0.00 0.00 174.94 174.38 3fdc n ASP 86 N 4.64 1.67 0.00 3.58 2.03 0.53 -4.66 116.55 124.34 3fdc n ASP 86 Ca 0.20 -0.71 0.00 0.00 0.52 0.00 0.00 54.79 54.80 3fdc n ASP 86 Cb 0.46 -1.46 0.00 0.00 -0.72 0.00 0.00 41.12 39.40 3fdc n ASP 86 CO 0.00 0.00 0.00 -1.14 -1.92 0.00 0.00 177.20 174.14 3fdc n ARG 87 N 8.66 0.00 -0.09 -0.67 0.63 -1.26 -1.83 116.66 122.10 3fdc n ARG 87 Ca 0.46 0.00 -0.10 0.00 -0.92 0.00 0.00 57.85 57.29 3fdc n ARG 87 Cb 0.42 0.00 -0.02 0.00 0.45 0.00 0.00 32.46 33.31 3fdc n ARG 87 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 3fdc h ASN 88 N 0.00 0.38 0.00 6.15 -0.26 -2.04 -3.46 115.58 116.35 3fdc h ASN 88 Ca 0.00 -0.12 0.00 0.00 -0.56 0.00 0.00 56.30 55.62 3fdc h ASN 88 Cb 0.00 -0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.16 3fdc h ASN 88 CO 0.00 0.39 0.00 0.61 -1.06 0.00 0.00 177.43 177.37 3fdc n GLY 89 N -0.86 0.32 3.71 2.83 0.00 -0.76 -5.15 105.19 105.27 3fdc n GLY 89 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 3fdc n GLY 89 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fdc s LYS 90 N 0.00 4.03 0.54 1.61 -2.85 -1.18 -4.97 119.74 116.92 3fdc s LYS 90 Ca 0.00 -0.26 -0.20 0.00 -1.00 0.00 0.00 55.97 54.51 3fdc s LYS 90 Cb 0.00 -3.32 -0.06 0.00 -2.06 0.00 0.00 37.83 32.40 3fdc s LYS 90 CO 0.00 0.34 1.16 -1.21 0.10 0.00 0.00 175.35 175.74 3fdc s GLU 91 N 0.23 3.34 -0.17 1.78 2.02 -1.26 -0.35 118.70 124.30 3fdc s GLU 91 Ca 0.07 1.71 -0.07 0.00 0.02 0.00 0.00 54.97 56.70 3fdc s GLU 91 Cb -0.12 -2.07 0.07 0.00 0.10 0.00 0.00 34.13 32.11 3fdc s GLU 91 CO -0.01 -0.88 0.37 0.08 0.02 0.00 0.00 175.26 174.85 3fdc s VAL 92 N -1.67 -0.28 -0.36 2.63 1.01 0.12 -4.61 120.40 117.23 3fdc s VAL 92 Ca 0.72 0.15 -0.12 0.00 0.00 0.00 0.00 61.98 62.73 3fdc s VAL 92 Cb -0.27 -0.58 0.00 0.00 0.00 0.00 0.00 36.38 35.54 3fdc s VAL 92 CO 0.30 0.06 0.23 -0.76 0.00 0.00 0.00 175.10 174.94 3fdc s LEU 93 N 1.92 4.65 -0.12 3.92 1.43 -0.30 -1.26 118.68 128.91 3fdc s LEU 93 Ca -0.05 -0.68 -0.09 0.00 -1.03 0.00 0.00 54.13 52.28 3fdc s LEU 93 Cb -0.10 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.98 3fdc s LEU 93 CO -0.12 -0.32 0.17 -0.54 0.23 0.00 0.00 176.35 175.78 3fdc s LYS 94 N 1.66 3.66 0.26 1.70 1.02 -1.15 0.29 119.74 127.17 3fdc s LYS 94 Ca 0.05 -0.08 -0.12 0.00 0.02 0.00 0.00 55.97 55.83 3fdc s LYS 94 Cb -0.18 -3.24 -0.00 0.00 -0.52 0.00 0.00 37.83 33.88 3fdc s LYS 94 CO 0.09 0.66 0.50 0.95 -0.92 0.00 0.00 175.35 176.63 3fdc s THR 95 N -0.72 0.00 0.09 2.17 -4.23 -0.81 -1.50 115.64 110.65 3fdc s THR 95 Ca 0.15 -1.40 0.03 0.00 -1.18 0.00 0.00 61.69 59.29 3fdc s THR 95 Cb -0.12 -2.25 -0.04 0.00 1.34 0.00 0.00 72.50 71.43 3fdc s THR 95 CO 0.04 0.00 -0.09 -0.04 -0.54 0.00 0.00 174.62 173.99 3fdc s MET 96 N -3.89 0.80 0.08 3.99 -1.94 -0.14 -2.05 119.30 116.14 3fdc s MET 96 Ca 0.22 -1.14 -0.05 0.00 -1.71 0.00 0.00 55.69 53.01 3fdc s MET 96 Cb -0.01 -0.42 -0.02 0.00 2.01 0.00 0.00 34.83 36.39 3fdc s MET 96 CO 0.10 0.05 0.09 1.67 -0.01 0.00 0.00 175.02 176.93 3fdc s TRP 97 N -2.58 0.34 -0.21 -0.03 1.48 -0.50 -0.14 118.94 117.30 3fdc s TRP 97 Ca 0.05 -0.82 0.01 0.00 -1.06 0.00 0.00 56.10 54.28 3fdc s TRP 97 Cb -0.02 -0.21 0.04 0.00 -1.16 0.00 0.00 33.47 32.12 3fdc s TRP 97 CO -0.01 -0.48 -0.10 -0.51 -4.06 0.00 0.00 176.95 171.79 3fdc s LEU 98 N -2.90 2.38 -0.61 -4.66 1.43 -0.60 -2.31 118.68 111.41 3fdc s LEU 98 Ca 0.07 -0.95 -0.23 0.00 -1.03 0.00 0.00 54.13 51.99 3fdc s LEU 98 Cb 0.06 -1.25 0.06 0.00 0.03 0.00 0.00 46.19 45.09 3fdc s LEU 98 CO -0.10 -0.15 0.93 -0.22 0.23 0.00 0.00 176.35 177.04 3fdc s LEU 99 N 1.37 4.32 -0.65 1.79 2.96 0.23 -2.30 118.68 126.40 3fdc s LEU 99 Ca -0.02 -0.75 -0.22 0.00 -0.22 0.00 0.00 54.13 52.91 3fdc s LEU 99 Cb -0.17 -2.57 0.07 0.00 0.50 0.00 0.00 46.19 44.03 3fdc s LEU 99 CO -0.08 -1.33 0.95 -0.60 -1.32 0.00 0.00 176.35 173.98 3fdc s ARG 100 N 3.93 3.11 0.71 1.98 6.06 -0.05 -2.14 118.95 132.55 3fdc s ARG 100 Ca 0.25 -0.84 -0.11 0.00 -2.50 0.00 0.00 55.73 52.52 3fdc s ARG 100 Cb -0.15 -4.23 0.02 0.00 0.06 0.00 0.00 34.95 30.65 3fdc s ARG 100 CO 0.14 -1.80 1.08 0.45 -2.50 0.00 0.00 175.30 172.66 3fdc s SER 101 N 3.66 5.36 -0.05 -2.12 0.15 -0.13 -3.17 113.70 117.40 3fdc s SER 101 Ca 0.22 1.32 0.01 0.00 0.70 0.00 0.00 55.95 58.20 3fdc s SER 101 Cb -0.17 -2.16 -0.03 0.00 -1.71 0.00 0.00 66.02 61.94 3fdc s SER 101 CO 0.10 -1.42 -0.06 -0.94 1.20 0.00 0.00 173.24 172.12 3fdc s SER 102 N -4.11 4.71 0.00 5.45 1.04 -1.25 -4.82 113.70 114.71 3fdc s SER 102 Ca 0.58 -0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.97 3fdc s SER 102 Cb -0.12 -1.17 0.00 0.00 0.10 0.00 0.00 66.02 64.82 3fdc s SER 102 CO 0.53 0.34 0.00 1.33 0.98 0.00 0.00 173.24 176.42 3fdc n VAL 103 N 1.99 0.00 -0.01 5.02 0.24 -1.26 -5.08 118.33 119.22 3fdc n VAL 103 Ca -0.17 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.12 3fdc n VAL 103 Cb 0.53 -0.27 -0.01 0.00 -1.47 0.00 0.00 33.84 32.62 3fdc n VAL 103 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3fdc n ASN 104 N -1.41 4.58 -4.49 -1.34 3.02 -1.26 -5.05 115.26 109.30 3fdc n ASN 104 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.24 3fdc n ASN 104 Cb 0.00 0.59 -0.12 0.00 -0.61 0.00 0.00 39.78 39.64 3fdc n ASN 104 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3fdc s ASP 105 N -3.13 4.02 0.00 6.41 2.15 -1.26 -4.99 116.67 119.87 3fdc s ASP 105 Ca -0.01 -0.37 0.00 0.00 0.43 0.00 0.00 52.55 52.61 3fdc s ASP 105 Cb 0.01 -0.72 0.00 0.00 -0.30 0.00 0.00 42.92 41.90 3fdc s ASP 105 CO 0.07 0.25 0.29 0.00 -0.17 0.00 0.00 175.17 175.62 3fdc n ILE 106 N 1.48 0.00 -0.09 4.11 0.00 -1.26 -2.45 119.36 121.15 3fdc n ILE 106 Ca -0.16 0.00 -0.19 0.00 0.00 0.00 0.00 62.75 62.40 3fdc n ILE 106 Cb 0.52 -0.25 -0.06 0.00 0.00 0.00 0.00 39.64 39.85 3fdc n ILE 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3fdc n GLY 107 N 0.12 -0.29 1.32 4.50 0.00 -1.26 -4.59 105.19 104.99 3fdc n GLY 107 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 3fdc n GLY 107 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3fdc n ASP 108 N -3.80 3.41 0.03 1.61 9.92 -1.03 -4.12 116.55 122.57 3fdc n ASP 108 Ca -0.36 -1.89 -0.19 0.00 -0.53 0.00 0.00 54.79 51.83 3fdc n ASP 108 Cb 0.75 -0.67 -0.12 0.00 -0.64 0.00 0.00 41.12 40.44 3fdc n ASP 108 CO 0.00 0.00 0.00 -0.78 0.13 0.00 0.00 177.20 176.55 3fdc h ASP 109 N 1.03 0.59 -0.65 -2.24 3.58 -1.81 -3.33 116.42 113.58 3fdc h ASP 109 Ca 0.00 -0.80 0.12 0.00 0.42 0.00 0.00 57.03 56.77 3fdc h ASP 109 Cb 0.80 -0.18 -0.09 0.00 1.72 0.00 0.00 39.33 41.58 3fdc h ASP 109 CO 0.00 1.32 0.21 4.11 -2.88 0.00 0.00 179.24 182.00 3fdc h TRP 110 N -0.07 0.35 0.00 0.28 5.08 -1.95 0.46 115.95 120.09 3fdc h TRP 110 Ca -0.11 0.03 0.00 0.00 1.08 0.00 0.00 58.89 59.90 3fdc h TRP 110 Cb 1.48 -0.06 0.00 0.00 -3.00 0.00 0.00 29.16 27.58 3fdc h TRP 110 CO 0.15 0.03 0.00 1.63 -1.28 0.00 0.00 178.44 178.97 3fdc n LYS 111 N -5.06 0.41 0.03 0.12 5.02 -1.25 -3.12 118.16 114.31 3fdc n LYS 111 Ca 0.11 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.51 3fdc n LYS 111 Cb 0.34 -1.05 -0.10 0.00 -0.02 0.00 0.00 35.03 34.20 3fdc n LYS 111 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3fdc n ALA 112 N -0.55 2.81 -2.90 7.82 0.00 0.16 -4.94 120.51 122.91 3fdc n ALA 112 Ca 0.01 -0.42 -0.34 0.00 0.00 0.00 0.00 53.44 52.69 3fdc n ALA 112 Cb 0.00 -0.88 -0.11 0.00 0.00 0.00 0.00 19.45 18.47 3fdc n ALA 112 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3fdc s THR 113 N -3.44 4.22 0.05 0.00 2.01 -1.18 -0.95 115.64 116.35 3fdc s THR 113 Ca -0.04 -0.24 0.09 0.00 0.31 0.00 0.00 61.69 61.80 3fdc s THR 113 Cb 0.13 -2.87 -0.03 0.00 0.01 0.00 0.00 72.50 69.74 3fdc s THR 113 CO 0.86 0.49 -0.25 -0.13 -0.69 0.00 0.00 174.62 174.90 3fdc s ARG 114 N 0.33 1.79 0.03 4.92 0.52 -0.91 -4.97 118.95 120.66 3fdc s ARG 114 Ca -0.01 -1.12 0.05 0.00 -0.52 0.00 0.00 55.73 54.12 3fdc s ARG 114 Cb -0.13 -2.00 -0.02 0.00 0.52 0.00 0.00 34.95 33.32 3fdc s ARG 114 CO 0.02 0.51 -0.14 0.54 0.02 0.00 0.00 175.30 176.25 3fdc s VAL 115 N -0.85 1.08 0.02 3.52 0.11 -1.26 0.76 120.40 123.77 3fdc s VAL 115 Ca 0.12 -0.88 -0.29 0.00 -2.93 0.00 0.00 61.98 58.01 3fdc s VAL 115 Cb -0.10 -0.96 0.10 0.00 -1.53 0.00 0.00 36.38 33.89 3fdc s VAL 115 CO 0.03 0.08 1.07 -0.83 -3.33 0.00 0.00 175.10 172.12 3fdc s GLY 116 N -0.91 -0.34 0.37 6.54 0.00 -0.98 -5.01 107.32 106.99 3fdc s GLY 116 Ca 0.02 0.71 0.03 0.00 0.00 0.00 0.00 44.72 45.48 3fdc s GLY 116 CO 0.01 0.19 0.50 0.29 0.00 0.00 0.00 173.10 174.09 3fdc n ILE 117 N -0.37 0.00 -3.19 0.90 -6.64 -1.26 -1.42 119.36 107.39 3fdc n ILE 117 Ca -0.06 -1.00 0.04 0.00 -1.77 0.00 0.00 62.75 59.96 3fdc n ILE 117 Cb 0.61 -0.90 -0.04 0.00 -1.44 0.00 0.00 39.64 37.87 3fdc n ILE 117 CO 0.00 0.00 0.00 0.20 -1.77 0.00 0.00 176.55 174.98 3fdc s ASN 118 N -3.15 -0.10 -0.27 7.28 0.01 -0.87 -4.83 114.94 113.01 3fdc s ASN 118 Ca 0.36 0.13 -0.08 0.00 -0.71 0.00 0.00 52.86 52.55 3fdc s ASN 118 Cb -0.02 1.11 -0.02 0.00 0.41 0.00 0.00 41.25 42.72 3fdc s ASN 118 CO 0.23 -0.02 0.10 -0.63 -1.51 0.00 0.00 177.10 175.27 3fdc s ILE 119 N 2.24 4.42 -0.04 0.60 1.01 -1.26 -1.93 121.20 126.25 3fdc s ILE 119 Ca -0.01 -0.24 -0.04 0.00 0.00 0.00 0.00 60.65 60.36 3fdc s ILE 119 Cb -0.02 -3.13 -0.04 0.00 0.01 0.00 0.00 42.46 39.28 3fdc s ILE 119 CO -0.15 0.25 0.18 -0.36 0.00 0.00 0.00 174.94 174.87 3fdc s PHE 120 N 1.62 3.57 0.12 3.97 0.08 0.14 -2.69 117.98 124.79 3fdc s PHE 120 Ca 0.06 0.43 0.02 0.00 0.12 0.00 0.00 56.93 57.56 3fdc s PHE 120 Cb -0.16 -1.88 -0.04 0.00 -0.57 0.00 0.00 43.02 40.37 3fdc s PHE 120 CO 0.05 0.67 -0.06 0.99 -0.10 0.00 0.00 175.22 176.77 3fdc s THR 121 N -1.24 0.77 -1.09 0.64 2.01 -0.39 -1.15 115.64 115.19 3fdc s THR 121 Ca 0.24 -1.96 -0.22 0.00 0.31 0.00 0.00 61.69 60.05 3fdc s THR 121 Cb -0.13 -1.79 -0.01 0.00 0.01 0.00 0.00 72.50 70.59 3fdc s THR 121 CO 0.14 -0.78 1.78 -0.13 -0.69 0.00 0.00 174.62 174.94 3fdc s ARG 122 N -3.83 3.10 0.00 4.92 0.52 -1.26 -0.22 118.95 122.17 3fdc s ARG 122 Ca 0.15 -1.08 0.03 0.00 -0.52 0.00 0.00 55.73 54.31 3fdc s ARG 122 Cb 0.05 -5.28 0.15 0.00 0.52 0.00 0.00 34.95 30.39 3fdc s ARG 122 CO -0.02 -3.01 0.64 -0.11 0.02 0.00 0.00 175.30 172.82