#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gnt s LEU 2 N 0.00 2.38 0.00 -0.89 1.43 -1.26 -4.96 118.68 115.38 3gnt s LEU 2 Ca 0.00 -0.70 0.00 0.00 -1.03 0.00 0.00 54.13 52.40 3gnt s LEU 2 Cb 0.00 -1.29 0.00 0.00 0.03 0.00 0.00 46.19 44.93 3gnt s LEU 2 CO 0.00 0.19 0.00 0.59 0.23 0.00 0.00 176.35 177.36 3gnt n ASN 3 N 0.98 -0.42 0.14 2.29 3.02 -1.26 -4.80 115.26 115.22 3gnt n ASN 3 Ca -0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.38 3gnt n ASN 3 Cb 0.53 -0.10 0.00 0.00 -0.61 0.00 0.00 39.78 39.59 3gnt n ASN 3 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3gnt n LEU 4 N -0.26 -0.08 -4.10 3.41 4.77 -1.26 -4.23 117.00 115.25 3gnt n LEU 4 Ca 0.00 0.47 -0.21 0.00 -0.03 0.00 0.00 56.01 56.24 3gnt n LEU 4 Cb 0.10 0.36 -0.15 0.00 -2.33 0.00 0.00 43.42 41.40 3gnt n LEU 4 CO 0.00 -0.79 -0.47 -1.83 -1.33 0.00 0.00 177.39 172.97 3gnt s GLU 5 N -2.00 1.05 0.00 3.23 -1.05 -1.25 -3.45 118.70 115.24 3gnt s GLU 5 Ca 0.00 -0.50 0.00 0.00 -0.15 0.00 0.00 54.97 54.32 3gnt s GLU 5 Cb 0.00 -1.02 0.00 0.00 -0.44 0.00 0.00 34.13 32.67 3gnt s GLU 5 CO 0.00 0.28 0.00 0.09 0.95 0.00 0.00 175.26 176.58 3gnt n ASN 6 N 2.67 0.00 -4.86 0.83 5.03 0.21 -4.89 115.26 114.24 3gnt n ASN 6 Ca -0.14 0.00 -0.32 0.00 0.87 0.00 0.00 54.58 54.99 3gnt n ASN 6 Cb 0.55 0.00 -0.05 0.00 -1.02 0.00 0.00 39.78 39.26 3gnt n ASN 6 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 3gnt s LYS 7 N -0.21 3.91 -0.08 3.52 1.02 -1.26 -4.51 119.74 122.14 3gnt s LYS 7 Ca 0.00 0.53 0.02 0.00 0.02 0.00 0.00 55.97 56.54 3gnt s LYS 7 Cb 0.00 -2.48 -0.02 0.00 -0.52 0.00 0.00 37.83 34.80 3gnt s LYS 7 CO 0.00 0.17 -0.13 0.99 -0.92 0.00 0.00 175.35 175.47 3gnt s THR 8 N -1.99 3.17 0.02 2.17 2.01 -1.20 -0.42 115.64 119.40 3gnt s THR 8 Ca 0.52 -0.66 0.03 0.00 0.31 0.00 0.00 61.69 61.88 3gnt s THR 8 Cb -0.10 -2.28 -0.01 0.00 0.01 0.00 0.00 72.50 70.11 3gnt s THR 8 CO 0.20 0.57 -0.09 -0.31 -0.69 0.00 0.00 174.62 174.31 3gnt s TYR 9 N -0.42 0.76 -0.41 4.92 2.02 0.85 0.22 117.35 125.28 3gnt s TYR 9 Ca 0.05 -0.27 0.03 0.00 -0.37 0.00 0.00 57.07 56.51 3gnt s TYR 9 Cb -0.12 -0.47 0.11 0.00 -0.40 0.00 0.00 41.96 41.08 3gnt s TYR 9 CO 0.02 -0.02 0.15 0.08 -1.57 0.00 0.00 175.55 174.21 3gnt s VAL 10 N -0.62 2.54 -0.75 0.71 1.01 -1.12 0.36 120.40 122.52 3gnt s VAL 10 Ca -0.01 -2.64 -0.26 0.00 0.00 0.00 0.00 61.98 59.08 3gnt s VAL 10 Cb -0.06 -2.82 -0.01 0.00 0.00 0.00 0.00 36.38 33.49 3gnt s VAL 10 CO 0.00 -0.68 1.76 -0.63 0.00 0.00 0.00 175.10 175.55 3gnt s ILE 11 N 0.52 3.49 -0.00 2.22 1.09 0.90 -2.71 121.20 126.71 3gnt s ILE 11 Ca 0.13 -0.02 -0.19 0.00 -1.10 0.00 0.00 60.65 59.47 3gnt s ILE 11 Cb -0.21 -4.21 -0.06 0.00 -1.06 0.00 0.00 42.46 36.92 3gnt s ILE 11 CO -0.05 -1.16 0.54 -0.04 -0.10 0.00 0.00 174.94 174.13 3gnt s MET 12 N 6.65 4.22 0.00 2.79 -1.94 -0.91 -3.01 119.30 127.10 3gnt s MET 12 Ca 0.61 0.63 0.00 0.00 -1.71 0.00 0.00 55.69 55.22 3gnt s MET 12 Cb -0.09 -3.31 0.00 0.00 2.01 0.00 0.00 34.83 33.44 3gnt s MET 12 CO 0.11 0.46 0.00 0.41 -0.01 0.00 0.00 175.02 175.99 3gnt n GLY 13 N 2.29 0.13 3.63 -0.03 0.00 -1.26 -3.63 105.19 106.32 3gnt n GLY 13 Ca -0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.50 3gnt n GLY 13 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gnt s ILE 14 N -0.68 3.90 -0.16 -0.61 1.01 -1.26 -4.76 121.20 118.65 3gnt s ILE 14 Ca 0.00 1.01 -0.22 0.00 0.00 0.00 0.00 60.65 61.44 3gnt s ILE 14 Cb 0.00 -3.91 -0.20 0.00 0.01 0.00 0.00 42.46 38.36 3gnt s ILE 14 CO 0.00 -0.38 0.45 0.00 0.00 0.00 0.00 174.94 175.02 3gnt h ALA 15 N 10.06 0.08 -3.00 9.38 0.00 -1.94 -3.46 119.26 130.38 3gnt h ALA 15 Ca -0.30 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 53.94 3gnt h ALA 15 Cb 1.13 0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.18 3gnt h ALA 15 CO 1.02 0.25 0.00 0.27 0.00 0.00 0.00 179.25 180.79 3gnt n ASN 16 N -4.57 0.00 0.00 0.00 6.94 -1.26 -4.86 115.26 111.50 3gnt n ASN 16 Ca -0.16 0.00 0.04 0.00 -0.02 0.00 0.00 54.58 54.44 3gnt n ASN 16 Cb 0.48 0.00 0.17 0.00 -2.36 0.00 0.00 39.78 38.07 3gnt n ASN 16 CO 0.00 0.00 0.00 1.17 -1.03 0.00 0.00 177.26 177.40 3gnt n LYS 17 N 0.00 0.00 -0.15 -3.83 4.81 -1.26 -2.17 118.16 115.56 3gnt n LYS 17 Ca 0.00 0.36 0.05 0.00 -0.87 0.00 0.00 58.31 57.84 3gnt n LYS 17 Cb 0.00 -1.50 0.13 0.00 0.02 0.00 0.00 35.03 33.68 3gnt n LYS 17 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 3gnt n ARG 18 N -1.49 2.81 -2.75 1.64 3.00 -1.26 -4.87 116.66 113.74 3gnt n ARG 18 Ca 0.02 -1.96 -0.41 0.00 -0.00 0.00 0.00 57.85 55.50 3gnt n ARG 18 Cb 0.09 -1.24 -0.05 0.00 0.00 0.00 0.00 32.46 31.27 3gnt n ARG 18 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 3gnt s SER 19 N -0.99 7.52 0.39 6.15 0.01 -0.92 -4.81 113.70 121.04 3gnt s SER 19 Ca 0.20 1.82 0.21 0.00 1.31 0.00 0.00 55.95 59.49 3gnt s SER 19 Cb 0.11 -2.59 1.21 0.00 0.21 0.00 0.00 66.02 64.95 3gnt s SER 19 CO 0.14 -0.01 1.68 0.40 0.41 0.00 0.00 173.24 175.87 3gnt h ILE 20 N 3.82 0.31 0.00 1.44 2.04 -1.90 2.01 117.51 125.23 3gnt h ILE 20 Ca -0.43 -0.09 -0.04 0.00 1.00 0.00 0.00 64.86 65.29 3gnt h ILE 20 Cb 1.21 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 3gnt h ILE 20 CO 0.71 0.05 -0.21 0.00 0.00 0.00 0.00 178.15 178.70 3gnt h ALA 21 N 1.69 0.91 -0.07 1.87 0.00 -1.87 1.85 119.26 123.64 3gnt h ALA 21 Ca 0.72 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 55.31 3gnt h ALA 21 Cb 1.92 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.67 3gnt h ALA 21 CO -0.45 0.26 -0.53 0.35 0.00 0.00 0.00 179.25 178.89 3gnt h PHE 22 N 0.00 0.25 -0.99 0.00 3.57 0.29 -2.72 116.94 117.33 3gnt h PHE 22 Ca -0.00 -0.08 0.21 0.00 3.53 0.00 0.00 57.97 61.62 3gnt h PHE 22 Cb 0.97 -0.05 -0.10 0.00 2.79 0.00 0.00 35.95 39.56 3gnt h PHE 22 CO 0.00 0.69 0.62 0.78 -2.23 0.00 0.00 178.31 178.17 3gnt h GLY 23 N 1.42 1.58 0.27 2.40 0.00 0.43 0.20 103.07 109.37 3gnt h GLY 23 Ca 0.00 -0.31 -0.11 0.00 0.00 0.00 0.00 47.33 46.92 3gnt h GLY 23 CO 0.08 -0.08 -0.51 -2.08 0.00 0.00 0.00 176.54 173.95 3gnt h VAL 24 N 0.65 1.55 -0.56 4.60 2.07 -1.12 -2.07 116.25 121.38 3gnt h VAL 24 Ca 0.57 -2.40 0.06 0.00 0.82 0.00 0.00 66.70 65.76 3gnt h VAL 24 Cb 1.05 3.16 -0.08 0.00 -1.52 0.00 0.00 31.29 33.90 3gnt h VAL 24 CO -0.35 0.62 -0.29 0.00 0.02 0.00 0.00 177.57 177.57 3gnt n ALA 25 N -2.74 -0.26 -0.13 1.67 0.00 -1.08 -1.29 120.51 116.68 3gnt n ALA 25 Ca -0.15 0.51 0.17 0.00 0.00 0.00 0.00 53.44 53.97 3gnt n ALA 25 Cb 0.65 -0.14 0.56 0.00 0.00 0.00 0.00 19.45 20.52 3gnt n ALA 25 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3gnt h LYS 26 N 0.00 0.28 0.00 0.00 1.63 0.10 1.64 116.57 120.22 3gnt h LYS 26 Ca 0.13 -0.02 -0.40 0.00 -0.85 0.00 0.00 60.65 59.51 3gnt h LYS 26 Cb 0.27 -0.06 -0.06 0.00 -0.60 0.00 0.00 32.23 31.77 3gnt h LYS 26 CO -0.54 0.18 -2.17 0.28 -3.45 0.00 0.00 179.45 173.76 3gnt n VAL 27 N -4.44 1.53 0.20 2.00 0.31 -1.00 -3.40 118.33 113.52 3gnt n VAL 27 Ca 0.14 -0.28 0.06 0.00 -0.01 0.00 0.00 64.34 64.24 3gnt n VAL 27 Cb 0.58 -1.93 0.55 0.00 -0.91 0.00 0.00 33.84 32.13 3gnt n VAL 27 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3gnt h LEU 28 N -0.99 0.10 0.08 7.52 3.38 -1.16 0.25 115.31 124.49 3gnt h LEU 28 Ca -0.60 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.38 3gnt h LEU 28 Cb 1.53 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 42.23 3gnt h LEU 28 CO -0.36 0.14 -0.16 -0.78 0.09 0.00 0.00 178.44 177.37 3gnt h ASP 29 N 0.11 -0.44 -0.57 -0.43 3.58 0.23 -2.77 116.42 116.14 3gnt h ASP 29 Ca 0.03 0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.52 3gnt h ASP 29 Cb 0.10 0.17 -0.03 0.00 1.72 0.00 0.00 39.33 41.29 3gnt h ASP 29 CO 0.00 -0.23 0.30 -0.61 -2.88 0.00 0.00 179.24 175.83 3gnt h GLN 30 N -0.30 0.81 0.00 0.28 4.15 -1.00 0.13 115.11 119.18 3gnt h GLN 30 Ca 0.03 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.34 3gnt h GLN 30 Cb 0.32 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.86 3gnt h GLN 30 CO -0.10 0.63 0.00 1.28 -1.93 0.00 0.00 178.83 178.72 3gnt n LEU 31 N -4.58 0.00 0.00 -2.39 7.99 -0.62 -4.88 117.00 112.52 3gnt n LEU 31 Ca 0.03 0.07 0.00 0.00 -0.01 0.00 0.00 56.01 56.10 3gnt n LEU 31 Cb 0.10 -0.07 0.00 0.00 -0.11 0.00 0.00 43.42 43.34 3gnt n LEU 31 CO 0.37 -0.05 0.00 0.61 -1.51 0.00 0.00 177.39 176.81 3gnt n GLY 32 N -0.41 1.19 3.84 -0.72 0.00 0.46 -3.78 105.19 105.77 3gnt n GLY 32 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 3gnt n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gnt s ALA 33 N -2.00 3.77 -0.01 4.61 0.00 -1.05 0.63 121.76 127.72 3gnt s ALA 33 Ca 0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 51.96 51.48 3gnt s ALA 33 Cb 0.00 -2.18 -0.04 0.00 0.00 0.00 0.00 23.12 20.90 3gnt s ALA 33 CO 0.00 0.50 0.15 -1.59 0.00 0.00 0.00 175.76 174.82 3gnt s LYS 34 N -0.85 3.33 -0.11 0.00 0.00 0.45 -4.69 119.74 117.85 3gnt s LYS 34 Ca 0.18 -0.36 -0.06 0.00 0.00 0.00 0.00 55.97 55.73 3gnt s LYS 34 Cb -0.14 -3.03 0.05 0.00 0.00 0.00 0.00 37.83 34.71 3gnt s LYS 34 CO 0.07 0.67 0.27 -1.17 0.00 0.00 0.00 175.35 175.19 3gnt s LEU 35 N -1.85 0.38 0.11 2.77 0.20 -1.22 -0.11 118.68 118.97 3gnt s LEU 35 Ca 0.25 0.57 0.07 0.00 0.69 0.00 0.00 54.13 55.72 3gnt s LEU 35 Cb -0.12 0.82 -0.04 0.00 -0.43 0.00 0.00 46.19 46.42 3gnt s LEU 35 CO 0.17 -0.17 -0.18 -0.69 -0.29 0.00 0.00 176.35 175.19 3gnt s VAL 36 N 1.23 1.54 0.01 1.68 1.01 1.11 -4.86 120.40 122.13 3gnt s VAL 36 Ca -0.09 -1.61 0.02 0.00 0.00 0.00 0.00 61.98 60.31 3gnt s VAL 36 Cb -0.10 -1.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.75 3gnt s VAL 36 CO -0.09 -0.21 -0.08 -0.36 0.00 0.00 0.00 175.10 174.37 3gnt s PHE 37 N -1.55 0.66 0.51 5.22 0.08 -1.19 0.31 117.98 122.01 3gnt s PHE 37 Ca 0.07 -0.25 0.01 0.00 0.12 0.00 0.00 56.93 56.88 3gnt s PHE 37 Cb -0.08 -0.41 -0.01 0.00 -0.57 0.00 0.00 43.02 41.95 3gnt s PHE 37 CO 0.04 -0.03 0.03 0.95 -0.10 0.00 0.00 175.22 176.11 3gnt s THR 38 N -0.60 0.92 -0.28 0.64 -4.23 -1.16 -1.82 115.64 109.10 3gnt s THR 38 Ca -0.02 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.29 3gnt s THR 38 Cb -0.05 -2.08 0.13 0.00 1.34 0.00 0.00 72.50 71.83 3gnt s THR 38 CO 0.00 0.00 0.97 -0.72 -0.54 0.00 0.00 174.62 174.33 3gnt s TYR 39 N -2.96 -0.58 -0.22 3.99 -0.85 -1.23 -4.10 117.35 111.41 3gnt s TYR 39 Ca 0.05 1.27 -0.20 0.00 -0.52 0.00 0.00 57.07 57.67 3gnt s TYR 39 Cb 0.00 0.38 -0.18 0.00 0.38 0.00 0.00 41.96 42.54 3gnt s TYR 39 CO 0.03 -0.28 0.11 0.54 -1.52 0.00 0.00 175.55 174.43 3gnt n ARG 40 N 3.00 0.57 -3.88 -3.49 1.74 -1.25 0.13 116.66 113.48 3gnt n ARG 40 Ca -0.16 0.51 -0.21 0.00 -0.77 0.00 0.00 57.85 57.23 3gnt n ARG 40 Cb 0.57 -1.70 -0.03 0.00 -1.02 0.00 0.00 32.46 30.28 3gnt n ARG 40 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3gnt s LYS 41 N -2.39 2.88 0.00 5.56 1.02 -1.26 -4.67 119.74 120.88 3gnt s LYS 41 Ca -0.31 -1.15 0.13 0.00 0.02 0.00 0.00 55.97 54.67 3gnt s LYS 41 Cb 0.08 -2.57 0.60 0.00 -0.52 0.00 0.00 37.83 35.42 3gnt s LYS 41 CO 0.58 0.21 1.41 -0.85 -0.92 0.00 0.00 175.35 175.78 3gnt n GLU 42 N -1.34 0.05 0.00 1.68 0.00 -1.26 -2.34 120.64 117.42 3gnt n GLU 42 Ca -0.04 0.24 0.00 0.00 0.00 0.00 0.00 57.16 57.36 3gnt n GLU 42 Cb 0.59 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.53 3gnt n GLU 42 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 3gnt n ARG 43 N -1.45 1.59 0.00 3.44 0.00 -1.26 -4.04 116.66 114.94 3gnt n ARG 43 Ca 0.04 0.00 0.05 0.00 -0.00 0.00 0.00 57.85 57.95 3gnt n ARG 43 Cb 0.14 -0.38 0.26 0.00 0.00 0.00 0.00 32.46 32.48 3gnt n ARG 43 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 3gnt n SER 44 N -0.33 0.00 0.02 6.15 7.64 -0.99 0.39 113.62 126.51 3gnt n SER 44 Ca 0.00 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.25 3gnt n SER 44 Cb 0.00 -0.42 -0.09 0.00 -1.01 0.00 0.00 64.21 62.69 3gnt n SER 44 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 3gnt n ARG 45 N -1.42 0.63 -0.34 1.43 0.63 -1.26 0.85 116.66 117.17 3gnt n ARG 45 Ca 0.04 0.17 0.14 0.00 -0.92 0.00 0.00 57.85 57.28 3gnt n ARG 45 Cb 0.12 -1.76 0.29 0.00 0.45 0.00 0.00 32.46 31.55 3gnt n ARG 45 CO 0.00 0.00 0.00 0.87 -2.51 0.00 0.00 177.63 175.99 3gnt h LYS 46 N 0.00 0.01 0.03 -0.14 1.79 0.73 -3.11 116.57 115.88 3gnt h LYS 46 Ca -0.18 -0.00 -0.30 0.00 -2.18 0.00 0.00 60.65 57.99 3gnt h LYS 46 Cb 1.57 -0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 32.19 3gnt h LYS 46 CO 0.04 0.01 -1.64 0.39 -1.08 0.00 0.00 179.45 177.16 3gnt n GLU 47 N -5.49 0.62 -0.35 3.15 1.02 0.25 -3.77 120.64 116.08 3gnt n GLU 47 Ca 0.23 0.45 0.33 0.00 -0.02 0.00 0.00 57.16 58.15 3gnt n GLU 47 Cb 0.75 -1.70 0.69 0.00 -0.02 0.00 0.00 31.44 31.16 3gnt n GLU 47 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3gnt h LEU 48 N -0.70 0.12 0.40 -4.62 -0.00 -0.25 -0.39 115.31 109.88 3gnt h LEU 48 Ca -0.42 0.03 -0.01 0.00 -0.00 0.00 0.00 57.88 57.48 3gnt h LEU 48 Cb 1.55 0.01 -0.02 0.00 -0.00 0.00 0.00 40.66 42.20 3gnt h LEU 48 CO -0.16 0.01 -0.38 1.05 -0.00 0.00 0.00 178.44 178.96 3gnt h GLU 49 N 0.10 -0.77 0.00 1.13 4.11 -1.63 0.82 114.58 118.34 3gnt h GLU 49 Ca 0.60 0.05 0.00 0.00 0.07 0.00 0.00 59.36 60.09 3gnt h GLU 49 Cb 2.17 0.17 0.00 0.00 0.50 0.00 0.00 28.75 31.59 3gnt h GLU 49 CO -0.10 -0.51 0.66 -0.22 0.07 0.00 0.00 179.01 178.90 3gnt h LYS 50 N -0.79 0.00 -4.33 1.06 1.63 -1.22 -3.40 116.57 109.51 3gnt h LYS 50 Ca -0.03 0.00 -0.74 0.00 -0.85 0.00 0.00 60.65 59.02 3gnt h LYS 50 Cb 0.70 0.00 -0.22 0.00 -0.60 0.00 0.00 32.23 32.11 3gnt h LYS 50 CO -0.05 0.00 0.23 -0.51 -3.45 0.00 0.00 179.45 175.67 3gnt s LEU 51 N -5.26 6.00 0.00 5.20 1.43 0.28 -4.50 118.68 121.83 3gnt s LEU 51 Ca -0.02 -2.15 0.00 0.00 -1.03 0.00 0.00 54.13 50.93 3gnt s LEU 51 Cb 0.04 -2.27 0.00 0.00 0.03 0.00 0.00 46.19 43.99 3gnt s LEU 51 CO 0.13 -0.84 0.00 -0.11 0.23 0.00 0.00 176.35 175.76 3gnt n LEU 52 N 5.24 0.00 0.00 1.79 0.00 -1.26 -4.91 117.00 117.86 3gnt n LEU 52 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.08 3gnt n LEU 52 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.88 3gnt n LEU 52 CO 0.45 0.00 0.00 -0.62 0.00 0.00 0.00 177.39 177.22 3gnt n GLU 53 N 0.00 0.00 0.00 1.96 1.02 -1.26 -4.81 120.64 117.54 3gnt n GLU 53 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3gnt n GLU 53 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 3gnt n GLU 53 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 3gnt n GLN 54 N 0.00 0.00 -0.34 3.49 -0.06 -1.26 -5.06 117.38 114.15 3gnt n GLN 54 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 3gnt n GLN 54 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 3gnt n GLN 54 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 3gnt n LEU 55 N 0.00 0.15 -4.84 1.69 4.32 -1.26 -4.70 117.00 112.36 3gnt n LEU 55 Ca 0.00 0.00 -0.37 0.00 -0.02 0.00 0.00 56.01 55.62 3gnt n LEU 55 Cb 0.00 -0.34 -0.06 0.00 -1.62 0.00 0.00 43.42 41.40 3gnt n LEU 55 CO 0.00 -0.08 -0.12 0.21 -1.22 0.00 0.00 177.39 176.19 3gnt s ASN 56 N -3.00 6.43 -0.18 -1.43 3.84 -1.26 -5.03 114.94 114.31 3gnt s ASN 56 Ca 0.00 0.51 0.03 0.00 0.21 0.00 0.00 52.86 53.61 3gnt s ASN 56 Cb 0.00 -2.11 -0.13 0.00 -0.55 0.00 0.00 41.25 38.46 3gnt s ASN 56 CO 0.00 0.34 -0.14 0.00 -2.79 0.00 0.00 177.10 174.51 3gnt n GLN 57 N 2.30 0.59 -1.87 0.43 3.00 -1.26 -4.81 117.38 115.76 3gnt n GLN 57 Ca -0.18 0.10 0.00 0.00 -0.01 0.00 0.00 57.00 56.91 3gnt n GLN 57 Cb 0.54 -1.38 0.00 0.00 0.00 0.00 0.00 30.24 29.40 3gnt n GLN 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 3gnt n PRO 58 N -3.00 1.07 -0.08 -1.09 -0.05 -1.26 -4.83 135.00 125.76 3gnt n PRO 58 Ca -0.32 0.00 -0.13 0.00 -0.05 0.00 0.00 63.50 63.00 3gnt n PRO 58 Cb 0.87 0.00 -0.05 0.00 -0.05 0.00 0.00 33.50 34.27 3gnt n PRO 58 CO 0.00 0.00 0.00 1.05 -0.05 0.00 0.00 175.50 176.50 3gnt h GLU 59 N 0.00 0.61 -3.60 0.54 4.11 -1.95 -3.38 114.58 110.90 3gnt h GLU 59 Ca 0.00 -0.32 -0.74 0.00 0.07 0.00 0.00 59.36 58.37 3gnt h GLU 59 Cb 0.00 0.01 -0.31 0.00 0.50 0.00 0.00 28.75 28.95 3gnt h GLU 59 CO 0.00 0.91 -0.05 0.00 0.07 0.00 0.00 179.01 179.94 3gnt s ALA 60 N -4.36 4.04 -1.56 1.06 0.00 -1.26 -4.95 121.76 114.73 3gnt s ALA 60 Ca -0.13 -3.48 -0.05 0.00 0.00 0.00 0.00 51.96 48.30 3gnt s ALA 60 Cb 0.08 -3.10 0.05 0.00 0.00 0.00 0.00 23.12 20.15 3gnt s ALA 60 CO 0.81 -2.19 0.34 0.72 0.00 0.00 0.00 175.76 175.43 3gnt n HIS 61 N 3.30 -1.47 -2.78 0.00 -0.00 -1.26 -4.17 115.22 108.84 3gnt n HIS 61 Ca 0.15 0.70 -0.34 0.00 -0.00 0.00 0.00 57.72 58.23 3gnt n HIS 61 Cb 0.41 -3.08 -0.07 0.00 -0.00 0.00 0.00 29.99 27.26 3gnt n HIS 61 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 3gnt s LEU 62 N -7.20 4.01 0.08 2.41 2.01 -1.26 -3.19 118.68 115.54 3gnt s LEU 62 Ca 0.20 1.75 -0.17 0.00 0.01 0.00 0.00 54.13 55.92 3gnt s LEU 62 Cb -0.11 -4.43 0.04 0.00 0.01 0.00 0.00 46.19 41.69 3gnt s LEU 62 CO 0.95 -0.34 0.40 -0.31 1.01 0.00 0.00 176.35 178.06 3gnt s TYR 63 N -2.04 -0.23 -0.05 0.29 2.02 -0.76 -4.98 117.35 111.59 3gnt s TYR 63 Ca 0.60 0.06 0.04 0.00 -0.37 0.00 0.00 57.07 57.41 3gnt s TYR 63 Cb -0.12 0.23 -0.00 0.00 -0.40 0.00 0.00 41.96 41.67 3gnt s TYR 63 CO 0.16 -0.63 -0.19 -1.14 -1.57 0.00 0.00 175.55 172.18 3gnt s GLN 64 N -3.11 2.09 -0.12 -0.62 0.74 -1.26 -3.47 119.66 113.91 3gnt s GLN 64 Ca -0.01 -0.68 -0.05 0.00 0.05 0.00 0.00 55.36 54.66 3gnt s GLN 64 Cb 0.01 -1.75 0.06 0.00 1.10 0.00 0.00 33.01 32.42 3gnt s GLN 64 CO -0.07 0.24 0.26 0.42 -0.55 0.00 0.00 175.29 175.59 3gnt s ILE 65 N 0.09 -0.33 -0.46 -2.34 1.01 0.12 -4.85 121.20 114.43 3gnt s ILE 65 Ca -0.07 0.26 0.24 0.00 0.00 0.00 0.00 60.65 61.08 3gnt s ILE 65 Cb -0.13 -0.42 0.16 0.00 0.01 0.00 0.00 42.46 42.08 3gnt s ILE 65 CO 0.03 0.11 1.39 -0.78 0.00 0.00 0.00 174.94 175.69 3gnt h ASP 66 N 8.06 0.00 -4.88 3.58 1.82 -1.83 -3.33 116.42 119.83 3gnt h ASP 66 Ca -0.20 -0.05 -0.41 0.00 -0.39 0.00 0.00 57.03 55.99 3gnt h ASP 66 Cb 1.12 0.00 0.09 0.00 0.68 0.00 0.00 39.33 41.22 3gnt h ASP 66 CO 0.19 0.02 -0.63 0.55 -1.61 0.00 0.00 179.24 177.76 3gnt n VAL 67 N -2.62 -2.32 -3.41 2.25 3.14 -1.26 -4.92 118.33 109.19 3gnt n VAL 67 Ca 0.03 0.00 -0.26 0.00 -2.96 0.00 0.00 64.34 61.15 3gnt n VAL 67 Cb 0.50 -3.66 -0.09 0.00 -1.06 0.00 0.00 33.84 29.53 3gnt n VAL 67 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3gnt n GLN 68 N -4.34 0.96 -2.88 1.45 3.00 -1.26 -4.86 117.38 109.44 3gnt n GLN 68 Ca -0.08 -3.61 -0.02 0.00 -0.01 0.00 0.00 57.00 53.28 3gnt n GLN 68 Cb 0.60 -1.70 0.01 0.00 0.00 0.00 0.00 30.24 29.15 3gnt n GLN 68 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.06 175.52 3gnt s SER 69 N -0.97 -1.25 0.21 1.08 1.04 -1.26 -4.96 113.70 107.59 3gnt s SER 69 Ca 0.33 -1.17 -0.17 0.00 0.48 0.00 0.00 55.95 55.43 3gnt s SER 69 Cb 0.09 1.62 0.21 0.00 0.10 0.00 0.00 66.02 68.03 3gnt s SER 69 CO -0.14 -0.08 1.59 0.44 0.98 0.00 0.00 173.24 176.04 3gnt h ASP 70 N 5.52 -0.97 0.65 7.02 3.32 -2.01 0.21 116.42 130.16 3gnt h ASP 70 Ca 0.04 0.23 0.00 0.00 0.02 0.00 0.00 57.03 57.32 3gnt h ASP 70 Cb 1.15 0.53 0.00 0.00 0.22 0.00 0.00 39.33 41.23 3gnt h ASP 70 CO 0.02 -0.28 -0.03 -0.62 -1.72 0.00 0.00 179.24 176.61 3gnt n GLU 71 N -5.46 0.34 0.01 3.56 -0.58 -1.26 -2.25 120.64 114.99 3gnt n GLU 71 Ca 0.07 -0.02 -0.17 0.00 -0.42 0.00 0.00 57.16 56.61 3gnt n GLU 71 Cb 0.37 -1.50 -0.12 0.00 -0.57 0.00 0.00 31.44 29.62 3gnt n GLU 71 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 3gnt h GLU 72 N 0.06 0.35 -0.02 3.49 4.81 -0.99 -3.26 114.58 119.02 3gnt h GLU 72 Ca 0.00 -0.40 -0.18 0.00 -0.13 0.00 0.00 59.36 58.65 3gnt h GLU 72 Cb 0.35 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.84 3gnt h GLU 72 CO 0.00 1.10 -0.78 -0.39 -0.73 0.00 0.00 179.01 178.20 3gnt h VAL 73 N -0.22 1.47 -0.26 0.32 -1.51 -1.11 -2.27 116.25 112.66 3gnt h VAL 73 Ca -0.08 -2.43 0.06 0.00 -1.23 0.00 0.00 66.70 63.03 3gnt h VAL 73 Cb 1.31 2.32 -0.07 0.00 -2.13 0.00 0.00 31.29 32.72 3gnt h VAL 73 CO 0.11 0.71 -0.25 0.40 -1.23 0.00 0.00 177.57 177.31 3gnt h ILE 74 N 0.12 0.38 -0.44 7.19 2.04 -1.61 1.41 117.51 126.58 3gnt h ILE 74 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.83 3gnt h ILE 74 Cb 1.37 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 37.83 3gnt h ILE 74 CO 0.12 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.86 3gnt n ASN 75 N -5.38 3.97 -0.04 1.72 4.13 -1.14 -0.23 115.26 118.29 3gnt n ASN 75 Ca -0.01 -2.49 -0.01 0.00 1.68 0.00 0.00 54.58 53.75 3gnt n ASN 75 Cb 0.30 -0.56 -0.00 0.00 -1.54 0.00 0.00 39.78 37.97 3gnt n ASN 75 CO 0.00 0.00 0.00 1.23 0.28 0.00 0.00 177.26 178.77 3gnt h GLY 76 N 4.46 0.00 2.00 7.41 0.00 -0.69 0.21 103.07 116.46 3gnt h GLY 76 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.22 3gnt h GLY 76 CO 0.26 0.00 -0.52 0.74 0.00 0.00 0.00 176.54 177.02 3gnt h PHE 77 N -0.60 0.00 -0.08 5.60 -1.00 0.21 -2.08 116.94 118.99 3gnt h PHE 77 Ca 0.00 0.00 -0.12 0.00 2.81 0.00 0.00 57.97 60.66 3gnt h PHE 77 Cb 0.16 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.72 3gnt h PHE 77 CO -0.07 0.52 -0.42 1.49 -1.61 0.00 0.00 178.31 178.22 3gnt h GLU 78 N 0.00 0.43 -0.04 1.51 4.81 -0.74 1.15 114.58 121.69 3gnt h GLU 78 Ca -0.01 -0.35 0.01 0.00 -0.13 0.00 0.00 59.36 58.88 3gnt h GLU 78 Cb 1.34 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.79 3gnt h GLU 78 CO 0.07 0.99 -0.09 0.37 -0.73 0.00 0.00 179.01 179.62 3gnt h GLN 79 N -0.02 -0.08 -0.99 1.92 -0.00 -0.38 -0.25 115.11 115.31 3gnt h GLN 79 Ca -0.03 0.01 0.23 0.00 -0.00 0.00 0.00 58.65 58.85 3gnt h GLN 79 Cb 1.07 0.02 -0.09 0.00 0.00 0.00 0.00 27.48 28.48 3gnt h GLN 79 CO 0.09 -0.05 0.63 0.82 0.00 0.00 0.00 178.83 180.31 3gnt h ILE 80 N -0.08 0.62 0.21 2.39 2.04 -1.24 -2.63 117.51 118.82 3gnt h ILE 80 Ca 0.01 -0.17 -0.00 0.00 1.00 0.00 0.00 64.86 65.69 3gnt h ILE 80 Cb 0.10 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.23 3gnt h ILE 80 CO -0.08 0.09 -0.35 1.23 0.00 0.00 0.00 178.15 179.04 3gnt h GLY 81 N 0.51 -1.14 1.74 5.37 0.00 0.31 0.37 103.07 110.23 3gnt h GLY 81 Ca 0.55 0.55 0.02 0.00 0.00 0.00 0.00 47.33 48.46 3gnt h GLY 81 CO -0.29 -0.34 0.11 0.50 0.00 0.00 0.00 176.54 176.52 3gnt h LYS 82 N -0.60 0.00 0.02 4.80 1.57 -0.98 -2.81 116.57 118.57 3gnt h LYS 82 Ca -0.02 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3gnt h LYS 82 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.87 3gnt h LYS 82 CO -0.12 0.00 -0.01 -0.44 -0.57 0.00 0.00 179.45 178.31 3gnt h ASP 83 N 0.00 -0.02 0.00 0.86 5.19 -0.99 -3.42 116.42 118.04 3gnt h ASP 83 Ca 0.04 -0.50 -0.13 0.00 -0.62 0.00 0.00 57.03 55.82 3gnt h ASP 83 Cb 0.25 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.75 3gnt h ASP 83 CO -0.00 0.72 -0.73 -0.37 -3.12 0.00 0.00 179.24 175.75 3gnt h VAL 84 N -0.99 1.09 0.00 -1.35 -1.51 -0.40 -3.51 116.25 109.58 3gnt h VAL 84 Ca -0.00 -2.08 0.00 0.00 -1.23 0.00 0.00 66.70 63.38 3gnt h VAL 84 Cb 0.52 2.32 0.00 0.00 -2.13 0.00 0.00 31.29 32.00 3gnt h VAL 84 CO 0.00 0.37 0.00 0.61 -1.23 0.00 0.00 177.57 177.32 3gnt n GLY 85 N 1.52 0.97 3.95 5.19 0.00 -1.06 -5.11 105.19 110.67 3gnt n GLY 85 Ca -0.21 -1.91 -0.26 0.00 0.00 0.00 0.00 46.02 43.63 3gnt n GLY 85 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gnt s ASN 86 N -4.00 4.01 0.18 1.61 6.03 -1.26 -4.43 114.94 117.09 3gnt s ASN 86 Ca 0.00 0.07 0.11 0.00 -1.03 0.00 0.00 52.86 52.01 3gnt s ASN 86 Cb 0.00 -0.40 -0.04 0.00 -3.03 0.00 0.00 41.25 37.78 3gnt s ASN 86 CO 0.00 -2.12 -0.23 -0.51 -2.03 0.00 0.00 177.10 172.21 3gnt s ILE 87 N -3.44 2.25 -0.50 0.54 1.10 -1.23 -4.92 121.20 114.99 3gnt s ILE 87 Ca 0.68 -1.99 0.24 0.00 -0.51 0.00 0.00 60.65 59.06 3gnt s ILE 87 Cb -0.06 -2.06 0.14 0.00 0.15 0.00 0.00 42.46 40.63 3gnt s ILE 87 CO 0.48 -0.14 1.39 0.44 -2.11 0.00 0.00 174.94 175.00 3gnt h ASP 88 N 3.25 0.00 0.00 4.50 3.32 0.23 -3.39 116.42 124.33 3gnt h ASP 88 Ca -0.46 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.52 3gnt h ASP 88 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 3gnt h ASP 88 CO 0.48 0.04 0.00 0.61 -1.72 0.00 0.00 179.24 178.64 3gnt n GLY 89 N 1.24 1.37 3.09 2.75 0.00 -0.17 -3.35 105.19 110.11 3gnt n GLY 89 Ca 0.03 -1.10 -0.18 0.00 0.00 0.00 0.00 46.02 44.77 3gnt n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gnt s VAL 90 N -2.00 0.88 -0.48 1.61 1.01 -0.24 -2.80 120.40 118.38 3gnt s VAL 90 Ca 0.00 -0.86 -0.02 0.00 0.00 0.00 0.00 61.98 61.10 3gnt s VAL 90 Cb 0.00 -0.81 0.13 0.00 0.00 0.00 0.00 36.38 35.69 3gnt s VAL 90 CO 0.00 -0.03 0.28 -0.47 0.00 0.00 0.00 175.10 174.88 3gnt s TYR 91 N -0.79 3.52 0.38 5.22 5.04 -1.10 -0.83 117.35 128.79 3gnt s TYR 91 Ca -0.00 -2.55 -0.12 0.00 -2.44 0.00 0.00 57.07 51.96 3gnt s TYR 91 Cb -0.07 -3.20 -0.07 0.00 0.35 0.00 0.00 41.96 38.97 3gnt s TYR 91 CO 0.01 -0.92 0.76 -1.58 -1.34 0.00 0.00 175.55 172.48 3gnt s HIS 92 N 0.72 3.44 0.00 4.97 5.65 0.82 -2.15 115.29 128.74 3gnt s HIS 92 Ca 0.11 1.11 0.00 0.00 0.25 0.00 0.00 55.06 56.53 3gnt s HIS 92 Cb -0.22 -2.48 0.00 0.00 -1.18 0.00 0.00 32.58 28.70 3gnt s HIS 92 CO -0.04 -0.05 0.00 0.43 -0.65 0.00 0.00 174.74 174.43 3gnt n SER 93 N -1.01 0.00 -1.62 9.88 7.64 -1.24 -2.78 113.62 124.50 3gnt n SER 93 Ca 0.03 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.74 3gnt n SER 93 Cb 0.54 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.68 3gnt n SER 93 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3gnt n ILE 120 N 0.00 0.00 -2.72 0.44 5.41 -1.26 -4.74 119.36 116.49 3gnt n ILE 120 Ca 0.00 0.00 -0.08 0.00 1.00 0.00 0.00 62.75 63.67 3gnt n ILE 120 Cb 0.00 -0.18 0.10 0.00 -0.71 0.00 0.00 39.64 38.85 3gnt n ILE 120 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 3gnt n SER 121 N 3.55 -2.07 -4.87 4.38 2.88 -1.26 -4.84 113.62 111.39 3gnt n SER 121 Ca 0.23 -3.18 -0.30 0.00 -1.33 0.00 0.00 58.87 54.29 3gnt n SER 121 Cb 0.00 1.49 -0.03 0.00 -0.75 0.00 0.00 64.21 64.92 3gnt n SER 121 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3gnt s SER 122 N -1.28 6.55 -0.19 -3.46 0.15 -1.26 -4.83 113.70 109.36 3gnt s SER 122 Ca 0.22 1.15 -0.04 0.00 0.70 0.00 0.00 55.95 57.98 3gnt s SER 122 Cb 0.34 -2.33 -0.02 0.00 -1.71 0.00 0.00 66.02 62.30 3gnt s SER 122 CO -0.07 -0.38 -0.02 -0.47 1.20 0.00 0.00 173.24 173.50 3gnt s TYR 123 N -2.33 3.01 0.00 3.44 6.04 -1.26 -4.83 117.35 121.41 3gnt s TYR 123 Ca 0.52 -0.54 0.06 0.00 0.04 0.00 0.00 57.07 57.15 3gnt s TYR 123 Cb -0.10 -2.06 0.09 0.00 -1.04 0.00 0.00 41.96 38.85 3gnt s TYR 123 CO 0.30 -0.27 1.02 -1.13 -1.54 0.00 0.00 175.55 173.93 3gnt n SER 124 N 4.22 0.20 -0.04 4.32 3.41 -1.26 -4.82 113.62 119.66 3gnt n SER 124 Ca -0.17 -1.96 -0.05 0.00 -0.26 0.00 0.00 58.87 56.43 3gnt n SER 124 Cb 0.52 -0.21 -0.04 0.00 -0.26 0.00 0.00 64.21 64.22 3gnt n SER 124 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3gnt n LEU 125 N 0.11 1.92 0.35 1.04 7.94 -1.26 0.73 117.00 127.82 3gnt n LEU 125 Ca 0.01 -0.03 -0.18 0.00 -1.11 0.00 0.00 56.01 54.71 3gnt n LEU 125 Cb 0.79 -0.12 -0.09 0.00 0.53 0.00 0.00 43.42 44.53 3gnt n LEU 125 CO -0.01 0.46 0.64 0.74 -1.11 0.00 0.00 177.39 178.11 3gnt h THR 126 N 0.00 0.30 0.51 1.96 2.02 -1.94 0.18 112.91 115.94 3gnt h THR 126 Ca -0.17 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 66.98 3gnt h THR 126 Cb 1.31 0.30 0.01 0.00 -1.74 0.00 0.00 68.15 68.02 3gnt h THR 126 CO -0.01 0.00 -0.25 0.40 0.37 0.00 0.00 175.52 176.03 3gnt h ILE 127 N -0.90 0.00 -1.14 3.11 2.04 -1.92 -0.33 117.51 118.37 3gnt h ILE 127 Ca -0.08 -0.02 0.33 0.00 1.00 0.00 0.00 64.86 66.09 3gnt h ILE 127 Cb 0.71 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.75 3gnt h ILE 127 CO 0.11 0.00 0.90 0.52 0.00 0.00 0.00 178.15 179.68 3gnt n VAL 128 N -3.92 0.00 -0.09 1.67 0.31 0.22 -1.37 118.33 115.15 3gnt n VAL 128 Ca -0.09 0.94 -0.12 0.00 -0.01 0.00 0.00 64.34 65.06 3gnt n VAL 128 Cb 0.27 -1.59 -0.10 0.00 -0.91 0.00 0.00 33.84 31.51 3gnt n VAL 128 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3gnt n ALA 129 N -2.42 1.59 0.88 3.52 0.00 0.61 -1.76 120.51 122.92 3gnt n ALA 129 Ca 0.26 -0.87 0.13 0.00 0.00 0.00 0.00 53.44 52.96 3gnt n ALA 129 Cb 1.25 0.02 0.50 0.00 0.00 0.00 0.00 19.45 21.22 3gnt n ALA 129 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3gnt n HIS 130 N -2.96 0.28 0.01 0.00 8.25 -0.20 -1.34 115.22 119.26 3gnt n HIS 130 Ca -0.32 0.08 -0.18 0.00 -0.26 0.00 0.00 57.72 57.04 3gnt n HIS 130 Cb 0.90 -0.60 -0.14 0.00 1.12 0.00 0.00 29.99 31.26 3gnt n HIS 130 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 3gnt h GLU 131 N 0.00 0.20 -0.85 -0.41 4.39 -1.30 -3.37 114.58 113.23 3gnt h GLU 131 Ca 0.00 -0.34 0.21 0.00 0.34 0.00 0.00 59.36 59.57 3gnt h GLU 131 Cb 0.58 0.13 -0.15 0.00 -0.10 0.00 0.00 28.75 29.21 3gnt h GLU 131 CO 0.00 1.16 0.06 0.00 -1.16 0.00 0.00 179.01 179.07 3gnt h ALA 132 N 0.04 0.99 -0.70 3.43 0.00 -1.28 -3.23 119.26 118.51 3gnt h ALA 132 Ca -0.11 0.27 0.10 0.00 0.00 0.00 0.00 54.91 55.17 3gnt h ALA 132 Cb 1.45 0.45 -0.11 0.00 0.00 0.00 0.00 17.79 19.57 3gnt h ALA 132 CO 0.09 -0.47 -0.30 1.17 0.00 0.00 0.00 179.25 179.75 3gnt n LYS 133 N -5.36 -0.19 0.00 0.00 0.00 -0.45 -1.87 118.16 110.29 3gnt n LYS 133 Ca 0.18 1.08 0.00 0.00 0.00 0.00 0.00 58.31 59.57 3gnt n LYS 133 Cb 0.59 -1.60 0.00 0.00 0.00 0.00 0.00 35.03 34.02 3gnt n LYS 133 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 3gnt n LYS 134 N -5.02 0.90 0.00 1.64 2.85 -1.22 -2.12 118.16 115.20 3gnt n LYS 134 Ca 0.06 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.32 3gnt n LYS 134 Cb 0.27 -1.12 0.00 0.00 -0.65 0.00 0.00 35.03 33.53 3gnt n LYS 134 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 177.40 178.82 3gnt n LEU 135 N 0.46 0.00 -4.45 -5.58 -0.00 -0.78 -4.93 117.00 101.72 3gnt n LEU 135 Ca 0.00 -0.11 -0.44 0.00 -0.00 0.00 0.00 56.01 55.46 3gnt n LEU 135 Cb 0.41 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.81 3gnt n LEU 135 CO 0.00 0.00 1.04 -0.04 -0.00 0.00 0.00 177.39 178.39 3gnt s MET 136 N -1.07 3.68 -0.01 1.47 -1.94 -0.90 -3.58 119.30 116.94 3gnt s MET 136 Ca 0.00 -1.91 0.22 0.00 -1.71 0.00 0.00 55.69 52.29 3gnt s MET 136 Cb 0.00 -4.93 -0.30 0.00 2.01 0.00 0.00 34.83 31.61 3gnt s MET 136 CO 0.00 -1.76 0.59 -0.35 -0.01 0.00 0.00 175.02 173.49 3gnt n PRO 137 N 6.35 0.53 -0.04 2.03 -0.04 -1.26 -3.82 135.00 138.74 3gnt n PRO 137 Ca 0.26 -0.15 -0.01 0.00 -0.04 0.00 0.00 63.50 63.56 3gnt n PRO 137 Cb 0.48 -1.53 -0.15 0.00 -0.04 0.00 0.00 33.50 32.26 3gnt n PRO 137 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3gnt n GLU 138 N -2.13 0.67 0.00 0.54 -0.58 -1.26 -5.08 120.64 112.79 3gnt n GLU 138 Ca -0.02 -0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.68 3gnt n GLU 138 Cb 0.52 -1.57 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 3gnt n GLU 138 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3gnt n GLY 139 N 1.51 0.82 0.00 0.62 0.00 -1.25 -4.88 105.19 102.01 3gnt n GLY 139 Ca -0.18 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 43.83 3gnt n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gnt n GLY 140 N 0.00 -0.59 3.34 -0.02 0.00 -1.17 -4.71 105.19 102.04 3gnt n GLY 140 Ca 0.00 -0.57 -0.13 0.00 0.00 0.00 0.00 46.02 45.33 3gnt n GLY 140 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3gnt s SER 141 N -4.00 -0.32 -0.23 1.61 0.15 -1.21 0.34 113.70 110.04 3gnt s SER 141 Ca 0.00 -0.00 -0.15 0.00 0.70 0.00 0.00 55.95 56.50 3gnt s SER 141 Cb 0.00 0.45 0.07 0.00 -1.71 0.00 0.00 66.02 64.83 3gnt s SER 141 CO 0.00 -0.71 0.57 -0.63 1.20 0.00 0.00 173.24 173.67 3gnt s ILE 142 N -2.68 -0.01 -0.01 6.45 1.01 0.13 -1.08 121.20 125.01 3gnt s ILE 142 Ca -0.04 0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.64 3gnt s ILE 142 Cb -0.00 -0.82 0.02 0.00 0.01 0.00 0.00 42.46 41.66 3gnt s ILE 142 CO -0.04 0.01 0.01 -0.69 0.00 0.00 0.00 174.94 174.24 3gnt s VAL 143 N 1.24 0.02 -0.06 2.92 1.01 -0.01 -1.56 120.40 123.96 3gnt s VAL 143 Ca -0.07 0.09 -0.09 0.00 0.00 0.00 0.00 61.98 61.91 3gnt s VAL 143 Cb -0.06 -0.09 0.02 0.00 0.00 0.00 0.00 36.38 36.25 3gnt s VAL 143 CO -0.13 0.06 0.22 0.00 0.00 0.00 0.00 175.10 175.26 3gnt s ALA 144 N 0.57 -0.55 -0.21 5.51 0.00 -0.83 0.29 121.76 126.53 3gnt s ALA 144 Ca -0.05 0.45 -0.02 0.00 0.00 0.00 0.00 51.96 52.34 3gnt s ALA 144 Cb -0.07 -0.22 0.06 0.00 0.00 0.00 0.00 23.12 22.89 3gnt s ALA 144 CO -0.01 -0.15 0.01 0.99 0.00 0.00 0.00 175.76 176.59 3gnt s THR 145 N -0.40 0.82 0.79 0.00 2.01 -1.12 -1.05 115.64 116.70 3gnt s THR 145 Ca -0.05 -0.76 -0.12 0.00 0.31 0.00 0.00 61.69 61.07 3gnt s THR 145 Cb -0.03 -1.26 0.07 0.00 0.01 0.00 0.00 72.50 71.28 3gnt s THR 145 CO 0.01 -0.19 1.16 0.28 -0.69 0.00 0.00 174.62 175.20 3gnt s THR 146 N 1.72 2.34 -0.45 -0.82 -1.32 -1.05 -4.74 115.64 111.33 3gnt s THR 146 Ca -0.02 0.11 0.07 0.00 -1.21 0.00 0.00 61.69 60.63 3gnt s THR 146 Cb -0.18 -3.10 0.23 0.00 -1.51 0.00 0.00 72.50 67.95 3gnt s THR 146 CO -0.08 -0.14 0.68 0.00 -2.21 0.00 0.00 174.62 172.87 3gnt n TYR 147 N -3.26 -2.07 0.00 9.09 9.36 -1.26 -3.30 117.16 125.71 3gnt n TYR 147 Ca 0.08 -2.53 0.00 0.00 3.32 0.00 0.00 57.90 58.77 3gnt n TYR 147 Cb 0.60 0.73 0.00 0.00 -0.63 0.00 0.00 39.34 40.04 3gnt n TYR 147 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 3gnt n LYS 164 N 1.81 0.00 -0.17 2.98 4.76 -1.26 -4.97 118.16 121.31 3gnt n LYS 164 Ca 0.16 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.60 3gnt n LYS 164 Cb 0.57 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.76 3gnt n LYS 164 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3gnt n ALA 165 N 0.00 1.11 -1.38 7.82 0.00 -1.26 -5.06 120.51 121.74 3gnt n ALA 165 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 3gnt n ALA 165 Cb 0.00 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.55 3gnt n ALA 165 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3gnt n SER 166 N 0.00 1.17 0.00 0.00 2.88 -1.26 -5.03 113.62 111.37 3gnt n SER 166 Ca 0.00 0.69 0.00 0.00 -1.33 0.00 0.00 58.87 58.23 3gnt n SER 166 Cb 0.39 -1.49 0.00 0.00 -0.75 0.00 0.00 64.21 62.36 3gnt n SER 166 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3gnt n LEU 167 N -2.32 0.00 0.00 2.46 -0.00 -1.26 -5.09 117.00 110.80 3gnt n LEU 167 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.15 3gnt n LEU 167 Cb 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.91 3gnt n LEU 167 CO 0.48 0.00 0.00 1.21 -0.00 0.00 0.00 177.39 179.08 3gnt n GLU 168 N 0.00 0.00 0.00 1.96 2.13 -1.26 -4.69 120.64 118.78 3gnt n GLU 168 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3gnt n GLU 168 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 3gnt n GLU 168 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3gnt n ALA 169 N 0.00 0.00 -0.15 4.31 0.00 -1.26 -4.62 120.51 118.79 3gnt n ALA 169 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 3gnt n ALA 169 Cb 0.00 0.00 0.29 0.00 0.00 0.00 0.00 19.45 19.74 3gnt n ALA 169 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3gnt n ASN 170 N 0.00 3.80 -0.19 0.00 6.94 -1.26 -3.34 115.26 121.21 3gnt n ASN 170 Ca 0.00 -2.00 -0.09 0.00 -0.02 0.00 0.00 54.58 52.48 3gnt n ASN 170 Cb 0.00 -0.41 0.04 0.00 -2.36 0.00 0.00 39.78 37.05 3gnt n ASN 170 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 3gnt h VAL 171 N 4.34 1.26 0.94 3.53 2.07 -1.93 -0.92 116.25 125.54 3gnt h VAL 171 Ca 0.00 -1.17 -0.05 0.00 0.82 0.00 0.00 66.70 66.31 3gnt h VAL 171 Cb 0.99 0.84 0.01 0.00 -1.52 0.00 0.00 31.29 31.61 3gnt h VAL 171 CO 0.00 0.42 -0.45 0.11 0.02 0.00 0.00 177.57 177.67 3gnt h LYS 172 N 0.94 -1.21 -0.29 1.57 1.79 -1.80 -0.71 116.57 116.85 3gnt h LYS 172 Ca 0.16 0.08 0.07 0.00 -2.18 0.00 0.00 60.65 58.78 3gnt h LYS 172 Cb 0.58 0.28 -0.08 0.00 -1.58 0.00 0.00 32.23 31.43 3gnt h LYS 172 CO 0.03 -0.81 -0.25 1.88 -1.08 0.00 0.00 179.45 179.23 3gnt h TYR 173 N -1.34 -0.65 0.00 -1.35 0.05 -1.64 0.31 116.97 112.35 3gnt h TYR 173 Ca -0.13 0.04 -0.10 0.00 0.05 0.00 0.00 58.73 58.60 3gnt h TYR 173 Cb 0.96 0.33 -0.01 0.00 1.01 0.00 0.00 36.73 39.02 3gnt h TYR 173 CO 0.00 -0.32 -0.47 -0.07 -1.05 0.00 0.00 178.16 176.25 3gnt h LEU 174 N -0.23 0.00 -0.41 3.88 3.38 -1.23 0.04 115.31 120.75 3gnt h LEU 174 Ca 0.15 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.19 3gnt h LEU 174 Cb 0.47 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.16 3gnt h LEU 174 CO -0.43 0.47 0.08 0.00 0.09 0.00 0.00 178.44 178.66 3gnt h ALA 175 N 1.53 0.44 -1.24 1.53 0.00 0.11 -2.64 119.26 119.00 3gnt h ALA 175 Ca -0.00 0.08 0.40 0.00 0.00 0.00 0.00 54.91 55.39 3gnt h ALA 175 Cb 1.10 0.10 -0.09 0.00 0.00 0.00 0.00 17.79 18.90 3gnt h ALA 175 CO 0.06 -0.32 0.84 1.28 0.00 0.00 0.00 179.25 181.11 3gnt n LEU 176 N -5.10 0.11 -0.12 0.00 7.99 0.14 -1.40 117.00 118.62 3gnt n LEU 176 Ca 0.03 0.98 -0.23 0.00 -0.01 0.00 0.00 56.01 56.77 3gnt n LEU 176 Cb 0.19 -0.48 -0.08 0.00 -0.11 0.00 0.00 43.42 42.93 3gnt n LEU 176 CO 0.23 -1.04 -1.22 -0.67 -1.51 0.00 0.00 177.39 173.18 3gnt n ASP 177 N -3.99 1.90 -0.00 -1.43 2.03 -1.00 -3.99 116.55 110.06 3gnt n ASP 177 Ca 0.33 0.33 0.11 0.00 0.52 0.00 0.00 54.79 56.07 3gnt n ASP 177 Cb 1.35 -0.77 0.01 0.00 -0.72 0.00 0.00 41.12 40.99 3gnt n ASP 177 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3gnt n LEU 178 N -4.26 0.83 -0.34 -2.67 4.32 -1.18 -4.17 117.00 109.53 3gnt n LEU 178 Ca -0.42 -0.32 0.07 0.00 -0.02 0.00 0.00 56.01 55.31 3gnt n LEU 178 Cb 0.78 -0.09 0.16 0.00 -1.62 0.00 0.00 43.42 42.65 3gnt n LEU 178 CO 0.08 0.21 0.70 1.23 -1.22 0.00 0.00 177.39 178.38 3gnt h GLY 179 N 5.00 0.79 2.00 -0.72 0.00 -1.23 2.12 103.07 111.04 3gnt h GLY 179 Ca 0.00 0.27 -0.05 0.00 0.00 0.00 0.00 47.33 47.56 3gnt h GLY 179 CO 0.00 -0.38 -0.22 -2.55 0.00 0.00 0.00 176.54 173.39 3gnt h PRO 180 N 0.01 0.00 0.00 4.80 0.11 -1.78 1.61 132.00 136.74 3gnt h PRO 180 Ca 0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.59 3gnt h PRO 180 Cb 0.79 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.90 3gnt h PRO 180 CO -0.95 0.22 0.00 -0.25 -0.21 0.00 0.00 178.00 176.81 3gnt n ASP 181 N -3.70 0.00 -3.43 -2.05 8.00 0.70 -4.74 116.55 111.32 3gnt n ASP 181 Ca -0.01 -0.92 -0.18 0.00 0.71 0.00 0.00 54.79 54.38 3gnt n ASP 181 Cb 0.33 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.50 3gnt n ASP 181 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3gnt n ASN 182 N -0.70 -4.14 -4.02 -2.24 5.15 0.55 -4.48 115.26 105.38 3gnt n ASN 182 Ca 0.05 -0.73 -0.21 0.00 -0.60 0.00 0.00 54.58 53.09 3gnt n ASN 182 Cb 0.03 -4.80 -0.15 0.00 -0.53 0.00 0.00 39.78 34.32 3gnt n ASN 182 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3gnt s ILE 183 N -3.44 0.85 -0.21 -1.44 1.09 0.15 -3.06 121.20 115.15 3gnt s ILE 183 Ca 0.24 -0.41 -0.06 0.00 -1.10 0.00 0.00 60.65 59.32 3gnt s ILE 183 Cb -0.04 -0.75 -0.03 0.00 -1.06 0.00 0.00 42.46 40.58 3gnt s ILE 183 CO 0.76 0.26 0.03 -0.13 -0.10 0.00 0.00 174.94 175.76 3gnt s ARG 184 N 0.11 3.68 -0.20 2.79 0.52 0.15 -3.33 118.95 122.69 3gnt s ARG 184 Ca -0.02 -0.48 0.01 0.00 -0.52 0.00 0.00 55.73 54.71 3gnt s ARG 184 Cb -0.08 -3.18 0.02 0.00 0.52 0.00 0.00 34.95 32.23 3gnt s ARG 184 CO 0.00 -0.01 -0.17 0.54 0.02 0.00 0.00 175.30 175.68 3gnt s VAL 185 N 1.11 2.22 0.02 3.52 0.11 -1.26 0.21 120.40 126.32 3gnt s VAL 185 Ca 0.03 -0.99 0.00 0.00 -2.93 0.00 0.00 61.98 58.10 3gnt s VAL 185 Cb -0.14 -1.99 -0.02 0.00 -1.53 0.00 0.00 36.38 32.70 3gnt s VAL 185 CO 0.02 0.45 -0.03 0.20 -3.33 0.00 0.00 175.10 172.42 3gnt s ASN 186 N 1.29 0.23 -0.15 3.54 0.01 -0.60 -0.93 114.94 118.32 3gnt s ASN 186 Ca 0.03 -0.46 -0.02 0.00 -0.71 0.00 0.00 52.86 51.71 3gnt s ASN 186 Cb -0.14 0.09 -0.02 0.00 0.41 0.00 0.00 41.25 41.59 3gnt s ASN 186 CO -0.11 -0.27 -0.10 0.00 -1.51 0.00 0.00 177.10 175.11 3gnt s ALA 187 N -1.33 2.75 -0.15 0.60 0.00 0.25 -1.97 121.76 121.90 3gnt s ALA 187 Ca -0.15 -0.89 -0.06 0.00 0.00 0.00 0.00 51.96 50.87 3gnt s ALA 187 Cb -0.09 -1.36 -0.04 0.00 0.00 0.00 0.00 23.12 21.63 3gnt s ALA 187 CO -0.01 0.18 0.04 0.42 0.00 0.00 0.00 175.76 176.39 3gnt s ILE 188 N 0.45 4.58 -0.19 0.00 1.01 -0.21 0.09 121.20 126.93 3gnt s ILE 188 Ca -0.07 -0.12 0.01 0.00 0.00 0.00 0.00 60.65 60.46 3gnt s ILE 188 Cb -0.15 -3.02 0.04 0.00 0.01 0.00 0.00 42.46 39.34 3gnt s ILE 188 CO 0.04 0.51 -0.11 -0.94 0.00 0.00 0.00 174.94 174.44 3gnt s SER 189 N -0.00 3.27 -0.02 3.58 1.04 -0.47 -2.52 113.70 118.58 3gnt s SER 189 Ca 0.05 -0.82 -0.07 0.00 0.48 0.00 0.00 55.95 55.59 3gnt s SER 189 Cb -0.12 -1.21 -0.05 0.00 0.10 0.00 0.00 66.02 64.73 3gnt s SER 189 CO 0.01 -0.13 0.25 0.00 0.98 0.00 0.00 173.24 174.35 3gnt s ALA 190 N 1.42 3.85 1.00 5.32 0.00 -1.21 -2.56 121.76 129.57 3gnt s ALA 190 Ca -0.00 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.39 3gnt s ALA 190 Cb -0.16 -2.07 0.00 0.00 0.00 0.00 0.00 23.12 20.90 3gnt s ALA 190 CO -0.09 0.63 0.00 0.41 0.00 0.00 0.00 175.76 176.72 3gnt n GLY 191 N 1.32 -1.96 3.83 0.00 0.00 -1.22 -4.53 105.19 102.63 3gnt n GLY 191 Ca -0.13 -1.51 -0.36 0.00 0.00 0.00 0.00 46.02 44.02 3gnt n GLY 191 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3gnt s PRO 192 N -2.27 4.13 -0.11 1.61 0.02 -1.26 -4.97 135.00 132.15 3gnt s PRO 192 Ca 0.00 0.69 -0.12 0.00 0.02 0.00 0.00 61.00 61.58 3gnt s PRO 192 Cb 0.00 -2.95 -0.05 0.00 0.02 0.00 0.00 34.50 31.52 3gnt s PRO 192 CO 0.00 0.47 0.28 0.42 -0.33 0.00 0.00 177.00 177.84 3gnt s ILE 193 N -1.44 5.29 0.00 2.83 1.09 -1.26 -4.06 121.20 123.64 3gnt s ILE 193 Ca 0.39 0.53 0.00 0.00 -1.10 0.00 0.00 60.65 60.47 3gnt s ILE 193 Cb -0.16 -3.59 0.00 0.00 -1.06 0.00 0.00 42.46 37.64 3gnt s ILE 193 CO 0.20 0.49 0.00 -1.14 -0.10 0.00 0.00 174.94 174.39 3gnt n ARG 194 N 2.77 0.00 0.00 2.79 0.63 -1.26 -5.10 116.66 116.48 3gnt n ARG 194 Ca -0.14 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.79 3gnt n ARG 194 Cb 0.53 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.44 3gnt n ARG 194 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 3gnt n LEU 208 N 0.00 0.00 -0.27 6.15 7.94 -1.26 -5.17 117.00 124.39 3gnt n LEU 208 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3gnt n LEU 208 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 3gnt n LEU 208 CO 0.00 0.00 0.26 0.29 -1.11 0.00 0.00 177.39 176.83 3gnt n LYS 209 N 0.00 0.07 -0.05 1.96 4.01 -1.26 -2.87 118.16 120.02 3gnt n LYS 209 Ca 0.00 -0.82 -0.05 0.00 -0.51 0.00 0.00 58.31 56.92 3gnt n LYS 209 Cb 0.00 -0.53 -0.07 0.00 -0.51 0.00 0.00 35.03 33.92 3gnt n LYS 209 CO 0.00 0.00 0.00 -1.91 -1.11 0.00 0.00 177.40 174.38 3gnt n GLU 210 N -0.03 2.06 0.38 1.97 2.13 -1.26 -4.62 120.64 121.27 3gnt n GLU 210 Ca 0.00 0.01 -0.15 0.00 0.66 0.00 0.00 57.16 57.68 3gnt n GLU 210 Cb 0.61 -1.24 -0.07 0.00 0.27 0.00 0.00 31.44 31.01 3gnt n GLU 210 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 3gnt h ILE 211 N 0.00 0.00 -1.36 6.31 2.04 -1.93 0.54 117.51 123.11 3gnt h ILE 211 Ca -0.25 -0.14 0.41 0.00 1.00 0.00 0.00 64.86 65.88 3gnt h ILE 211 Cb 1.54 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 37.55 3gnt h ILE 211 CO 0.00 0.00 0.96 -0.62 0.00 0.00 0.00 178.15 178.49 3gnt n GLU 212 N -5.03 -0.01 -0.07 2.37 1.02 -1.14 0.14 120.64 117.94 3gnt n GLU 212 Ca -0.12 0.83 -0.17 0.00 -0.02 0.00 0.00 57.16 57.68 3gnt n GLU 212 Cb 0.39 -1.84 -0.14 0.00 -0.02 0.00 0.00 31.44 29.83 3gnt n GLU 212 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3gnt n GLU 213 N -3.58 0.69 -0.00 3.49 1.02 -0.99 -3.75 120.64 117.51 3gnt n GLU 213 Ca 0.32 0.18 0.09 0.00 -0.02 0.00 0.00 57.16 57.73 3gnt n GLU 213 Cb 1.41 -1.62 -0.13 0.00 -0.02 0.00 0.00 31.44 31.09 3gnt n GLU 213 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3gnt n ARG 214 N -3.22 0.76 -2.57 3.49 1.74 0.38 -4.88 116.66 112.37 3gnt n ARG 214 Ca -0.35 -0.09 -0.41 0.00 -0.77 0.00 0.00 57.85 56.23 3gnt n ARG 214 Cb 1.04 -1.41 -0.04 0.00 -1.02 0.00 0.00 32.46 31.04 3gnt n ARG 214 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3gnt s ALA 215 N -3.02 3.34 0.23 7.54 0.00 -0.30 -4.94 121.76 124.62 3gnt s ALA 215 Ca 0.00 0.76 -0.03 0.00 0.00 0.00 0.00 51.96 52.69 3gnt s ALA 215 Cb 0.13 -3.33 0.25 0.00 0.00 0.00 0.00 23.12 20.17 3gnt s ALA 215 CO 0.77 -0.14 1.67 -1.35 0.00 0.00 0.00 175.76 176.71 3gnt h PRO 216 N 5.10 0.74 -0.07 0.00 0.11 -1.85 0.12 132.00 136.16 3gnt h PRO 216 Ca -0.44 -0.27 0.00 0.00 0.11 0.00 0.00 66.00 65.40 3gnt h PRO 216 Cb 1.21 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3gnt h PRO 216 CO 0.72 0.87 0.00 1.28 -0.21 0.00 0.00 178.00 180.65 3gnt n LEU 217 N -4.14 0.07 -2.55 2.35 4.32 -1.16 -4.87 117.00 111.03 3gnt n LEU 217 Ca 0.01 -0.04 -0.19 0.00 -0.02 0.00 0.00 56.01 55.77 3gnt n LEU 217 Cb 0.40 -0.04 -0.00 0.00 -1.62 0.00 0.00 43.42 42.16 3gnt n LEU 217 CO 0.43 0.02 -0.19 0.29 -1.22 0.00 0.00 177.39 176.72 3gnt n LYS 218 N -0.42 -2.39 -1.65 3.23 4.01 0.43 -4.85 118.16 116.51 3gnt n LYS 218 Ca 0.00 0.87 -0.01 0.00 -0.51 0.00 0.00 58.31 58.65 3gnt n LYS 218 Cb 0.02 -5.55 0.01 0.00 -0.51 0.00 0.00 35.03 28.99 3gnt n LYS 218 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18 3gnt n ARG 219 N -3.15 0.20 -4.38 1.97 1.85 -1.25 -4.85 116.66 107.06 3gnt n ARG 219 Ca -0.19 -0.41 -0.22 0.00 -1.00 0.00 0.00 57.85 56.03 3gnt n ARG 219 Cb 0.65 0.52 -0.08 0.00 -1.05 0.00 0.00 32.46 32.50 3gnt n ARG 219 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 3gnt s ASN 220 N -1.44 2.07 0.90 2.89 4.22 -1.26 -4.28 114.94 118.05 3gnt s ASN 220 Ca 0.04 -1.71 -0.14 0.00 -2.14 0.00 0.00 52.86 48.90 3gnt s ASN 220 Cb -0.01 0.54 0.15 0.00 1.28 0.00 0.00 41.25 43.20 3gnt s ASN 220 CO 0.02 -1.00 1.24 0.68 -2.04 0.00 0.00 177.10 176.00 3gnt s VAL 221 N -3.38 1.98 0.00 3.54 -7.23 -1.26 -5.03 120.40 109.02 3gnt s VAL 221 Ca 0.33 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.50 3gnt s VAL 221 Cb 0.03 -2.96 0.00 0.00 0.56 0.00 0.00 36.38 34.00 3gnt s VAL 221 CO 0.21 0.00 0.00 -0.90 -0.31 0.00 0.00 175.10 174.10 3gnt n ASP 222 N -3.61 0.57 -0.17 4.85 5.68 -1.26 -4.51 116.55 118.09 3gnt n ASP 222 Ca 0.11 -0.48 -0.04 0.00 -0.50 0.00 0.00 54.79 53.88 3gnt n ASP 222 Cb 0.60 0.00 0.03 0.00 -1.14 0.00 0.00 41.12 40.61 3gnt n ASP 222 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 3gnt h GLN 223 N 0.00 -0.10 -0.00 0.11 7.50 -1.94 -1.12 115.11 119.56 3gnt h GLN 223 Ca 0.00 0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.16 3gnt h GLN 223 Cb 0.00 0.02 0.00 0.00 0.05 0.00 0.00 27.48 27.55 3gnt h GLN 223 CO 0.00 -0.07 -0.09 0.28 -1.50 0.00 0.00 178.83 177.45 3gnt n VAL 224 N -5.42 0.00 0.30 -0.54 0.31 -1.26 0.33 118.33 112.05 3gnt n VAL 224 Ca 0.05 -0.02 0.08 0.00 -0.01 0.00 0.00 64.34 64.44 3gnt n VAL 224 Cb 0.33 -0.28 -0.11 0.00 -0.91 0.00 0.00 33.84 32.86 3gnt n VAL 224 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3gnt n GLU 225 N -1.26 0.96 0.07 5.55 1.02 -0.92 -1.40 120.64 124.66 3gnt n GLU 225 Ca 0.11 -0.09 -0.21 0.00 -0.02 0.00 0.00 57.16 56.95 3gnt n GLU 225 Cb 0.29 -1.34 -0.14 0.00 -0.02 0.00 0.00 31.44 30.23 3gnt n GLU 225 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3gnt h VAL 226 N 0.00 1.42 -0.86 2.62 2.07 0.40 -2.60 116.25 119.30 3gnt h VAL 226 Ca 0.00 -2.47 0.15 0.00 0.82 0.00 0.00 66.70 65.20 3gnt h VAL 226 Cb 0.61 2.99 -0.15 0.00 -1.52 0.00 0.00 31.29 33.22 3gnt h VAL 226 CO 0.00 0.72 -0.33 1.23 0.02 0.00 0.00 177.57 179.20 3gnt h GLY 227 N -0.13 0.16 1.37 2.17 0.00 0.08 -2.04 103.07 104.68 3gnt h GLY 227 Ca -0.16 0.44 -0.22 0.00 0.00 0.00 0.00 47.33 47.39 3gnt h GLY 227 CO 0.18 -0.24 -0.86 0.50 0.00 0.00 0.00 176.54 176.12 3gnt h LYS 228 N -0.05 0.60 -0.98 4.80 1.57 -1.19 -2.19 116.57 119.13 3gnt h LYS 228 Ca 0.34 -0.55 0.07 0.00 -1.87 0.00 0.00 60.65 58.63 3gnt h LYS 228 Cb 0.60 0.14 -0.07 0.00 0.08 0.00 0.00 32.23 32.98 3gnt h LYS 228 CO -0.89 1.17 0.63 1.15 -0.57 0.00 0.00 179.45 180.94 3gnt h THR 229 N 0.38 1.07 -0.76 -0.16 2.02 -1.05 -1.45 112.91 112.95 3gnt h THR 229 Ca -0.07 -0.39 0.17 0.00 0.77 0.00 0.00 66.41 66.89 3gnt h THR 229 Cb 1.49 -0.16 -0.13 0.00 -1.74 0.00 0.00 68.15 67.60 3gnt h THR 229 CO 0.16 0.21 -0.02 0.00 0.37 0.00 0.00 175.52 176.24 3gnt h ALA 230 N 1.45 0.76 0.00 6.16 0.00 -1.11 0.25 119.26 126.77 3gnt h ALA 230 Ca 0.43 0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.59 3gnt h ALA 230 Cb 0.19 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3gnt h ALA 230 CO -0.18 -0.43 -0.17 0.00 0.00 0.00 0.00 179.25 178.47 3gnt h ALA 231 N 1.72 0.91 -0.96 0.00 0.00 -0.74 0.33 119.26 120.52 3gnt h ALA 231 Ca 0.41 0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.44 3gnt h ALA 231 Cb 0.72 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.42 3gnt h ALA 231 CO -0.68 0.00 0.59 -0.92 0.00 0.00 0.00 179.25 178.24 3gnt h TYR 232 N 0.00 1.06 0.03 0.00 3.20 0.34 0.58 116.97 122.19 3gnt h TYR 232 Ca 0.00 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.90 3gnt h TYR 232 Cb 0.95 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.89 3gnt h TYR 232 CO 0.00 0.41 -0.02 -0.07 -1.64 0.00 0.00 178.16 176.84 3gnt h LEU 233 N 0.93 -0.04 -1.50 2.82 3.38 0.77 -2.62 115.31 119.06 3gnt h LEU 233 Ca 0.48 -0.61 0.04 0.00 0.09 0.00 0.00 57.88 57.87 3gnt h LEU 233 Cb 0.49 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 3gnt h LEU 233 CO -0.27 0.63 0.38 -0.07 0.09 0.00 0.00 178.44 179.19 3gnt h LEU 234 N -0.74 0.56-10.21 1.67 4.07 -0.49 -3.45 115.31 106.72 3gnt h LEU 234 Ca -0.00 -0.01 -0.46 0.00 0.08 0.00 0.00 57.88 57.49 3gnt h LEU 234 Cb 0.65 -0.13 0.20 0.00 1.08 0.00 0.00 40.66 42.46 3gnt h LEU 234 CO 0.01 0.38 0.09 -0.94 -1.08 0.00 0.00 178.44 176.90 3gnt s SER 235 N -6.44 1.70 0.00 -0.43 1.04 0.20 -4.91 113.70 104.86 3gnt s SER 235 Ca -0.09 1.56 0.16 0.00 0.48 0.00 0.00 55.95 58.06 3gnt s SER 235 Cb 0.18 -2.27 0.78 0.00 0.10 0.00 0.00 66.02 64.81 3gnt s SER 235 CO 0.75 -3.76 1.47 0.47 0.98 0.00 0.00 173.24 173.14 3gnt n ASP 236 N -4.63 0.00 0.00 7.02 8.00 -1.26 -4.01 116.55 121.67 3gnt n ASP 236 Ca 0.05 0.15 0.06 0.00 0.71 0.00 0.00 54.79 55.76 3gnt n ASP 236 Cb 0.54 -0.33 0.30 0.00 -0.02 0.00 0.00 41.12 41.61 3gnt n ASP 236 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 3gnt n LEU 237 N -1.33 0.00 -0.60 0.64 7.94 -1.26 -2.07 117.00 120.31 3gnt n LEU 237 Ca 0.07 0.41 0.06 0.00 -1.11 0.00 0.00 56.01 55.44 3gnt n LEU 237 Cb 0.14 -0.41 0.14 0.00 0.53 0.00 0.00 43.42 43.82 3gnt n LEU 237 CO 0.13 -0.23 0.36 -1.54 -1.11 0.00 0.00 177.39 174.99 3gnt n SER 238 N -1.41 1.59 0.00 1.96 3.41 -1.26 -4.79 113.62 113.12 3gnt n SER 238 Ca 0.04 -3.17 0.09 0.00 -0.26 0.00 0.00 58.87 55.57 3gnt n SER 238 Cb 0.13 -0.43 0.49 0.00 -0.26 0.00 0.00 64.21 64.14 3gnt n SER 238 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3gnt n SER 239 N -0.82 0.00 -0.75 4.04 3.41 -0.88 -0.21 113.62 118.41 3gnt n SER 239 Ca 0.14 -0.15 0.07 0.00 -0.26 0.00 0.00 58.87 58.68 3gnt n SER 239 Cb 0.76 -0.21 0.16 0.00 -0.26 0.00 0.00 64.21 64.66 3gnt n SER 239 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gnt n GLY 240 N 0.24 1.92 3.36 5.00 0.00 -1.26 -4.99 105.19 109.46 3gnt n GLY 240 Ca 0.10 -0.46 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 3gnt n GLY 240 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gnt s VAL 241 N -1.05 2.63 -0.27 1.61 1.01 0.70 -5.08 120.40 119.95 3gnt s VAL 241 Ca 0.26 -0.85 -0.35 0.00 0.00 0.00 0.00 61.98 61.04 3gnt s VAL 241 Cb 0.14 -2.03 0.16 0.00 0.00 0.00 0.00 36.38 34.66 3gnt s VAL 241 CO 0.20 0.56 1.33 0.28 0.00 0.00 0.00 175.10 177.47 3gnt s THR 242 N -0.17 0.00 -0.64 3.92 -1.32 -1.26 -4.76 115.64 111.41 3gnt s THR 242 Ca -0.02 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.46 3gnt s THR 242 Cb -0.14 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.85 3gnt s THR 242 CO 0.03 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.05 3gnt n GLY 243 N 0.15 0.64 3.75 6.08 0.00 -0.11 -5.01 105.19 110.69 3gnt n GLY 243 Ca 0.03 -0.72 -0.24 0.00 0.00 0.00 0.00 46.02 45.08 3gnt n GLY 243 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gnt s GLU 244 N -3.08 2.70 -0.04 1.61 0.41 -1.24 -4.57 118.70 114.49 3gnt s GLU 244 Ca 0.00 -1.07 -0.02 0.00 -0.41 0.00 0.00 54.97 53.47 3gnt s GLU 244 Cb 0.00 -2.48 0.03 0.00 -1.78 0.00 0.00 34.13 29.91 3gnt s GLU 244 CO 0.00 0.43 0.07 1.21 -0.49 0.00 0.00 175.26 176.48 3gnt s ASN 245 N -3.41 0.91 -0.20 -0.19 3.04 -1.24 0.84 114.94 114.68 3gnt s ASN 245 Ca 0.31 0.10 -0.05 0.00 0.04 0.00 0.00 52.86 53.26 3gnt s ASN 245 Cb -0.09 -0.08 -0.02 0.00 -1.54 0.00 0.00 41.25 39.52 3gnt s ASN 245 CO 0.22 -0.23 -0.01 -0.63 -3.04 0.00 0.00 177.10 173.42 3gnt s ILE 246 N 1.99 3.87 -0.39 -5.21 -1.09 0.11 -4.89 121.20 115.59 3gnt s ILE 246 Ca 0.02 -0.34 -0.23 0.00 -2.23 0.00 0.00 60.65 57.87 3gnt s ILE 246 Cb -0.12 -2.75 0.01 0.00 -1.58 0.00 0.00 42.46 38.03 3gnt s ILE 246 CO -0.03 0.43 0.80 -1.00 -1.23 0.00 0.00 174.94 173.90 3gnt s HIS 247 N 1.02 3.07 -1.13 3.97 3.76 -1.26 -1.37 115.29 123.34 3gnt s HIS 247 Ca 0.02 0.44 -0.06 0.00 -0.15 0.00 0.00 55.06 55.31 3gnt s HIS 247 Cb -0.14 -3.52 0.27 0.00 1.11 0.00 0.00 32.58 30.30 3gnt s HIS 247 CO 0.01 -0.83 1.54 0.28 -0.85 0.00 0.00 174.74 174.90 3gnt n VAL 248 N 5.93 5.04 -1.80 -0.90 0.31 -1.06 -4.65 118.33 121.20 3gnt n VAL 248 Ca 0.03 -5.52 0.05 0.00 -0.01 0.00 0.00 64.34 58.89 3gnt n VAL 248 Cb 0.48 -2.19 0.10 0.00 -0.91 0.00 0.00 33.84 31.32 3gnt n VAL 248 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 3gnt n ASP 249 N 2.10 1.29 -1.46 4.52 5.75 -1.26 -3.44 116.55 124.05 3gnt n ASP 249 Ca 0.29 -2.78 -0.11 0.00 -0.01 0.00 0.00 54.79 52.18 3gnt n ASP 249 Cb 0.34 -0.37 -0.04 0.00 -1.03 0.00 0.00 41.12 40.02 3gnt n ASP 249 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 3gnt n SER 250 N -0.52 -2.99 0.00 -1.12 7.64 -1.26 -2.22 113.62 113.15 3gnt n SER 250 Ca 0.11 0.27 0.00 0.00 1.01 0.00 0.00 58.87 60.25 3gnt n SER 250 Cb 0.80 -2.83 0.00 0.00 -1.01 0.00 0.00 64.21 61.17 3gnt n SER 250 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3gnt n GLY 251 N -0.28 0.70 0.29 0.23 0.00 -1.26 -2.99 105.19 101.89 3gnt n GLY 251 Ca -0.11 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.93 3gnt n GLY 251 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3gnt h PHE 252 N 0.00 0.52 0.00 1.61 3.57 -1.82 0.18 116.94 121.00 3gnt h PHE 252 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 3gnt h PHE 252 Cb 0.00 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 38.58 3gnt h PHE 252 CO 0.00 0.42 0.13 -2.39 -2.23 0.00 0.00 178.31 174.24 3gnt n HIS 253 N -4.38 0.00 1.11 0.41 1.44 -1.26 -3.20 115.22 109.34 3gnt n HIS 253 Ca 0.02 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.75 3gnt n HIS 253 Cb 0.15 -0.34 0.07 0.00 0.12 0.00 0.00 29.99 29.98 3gnt n HIS 253 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3gnt n ALA 254 N -1.34 2.62 0.00 1.59 0.00 0.64 -5.22 120.51 118.80 3gnt n ALA 254 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.15 3gnt n ALA 254 Cb 0.13 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.57 3gnt n ALA 254 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94