#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cno n GLN 14 N 0.00 3.29 0.17 -0.14 3.00 -1.26 -4.55 117.38 117.89 3cno n GLN 14 Ca 0.00 -0.10 0.02 0.00 -0.01 0.00 0.00 57.00 56.91 3cno n GLN 14 Cb 0.00 -1.02 0.28 0.00 0.00 0.00 0.00 30.24 29.51 3cno n GLN 14 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.06 177.88 3cno h ILE 15 N 0.19 1.18 0.00 5.09 2.04 -1.99 -2.85 117.51 121.17 3cno h ILE 15 Ca 0.00 -1.69 -0.06 0.00 1.00 0.00 0.00 64.86 64.10 3cno h ILE 15 Cb 0.27 1.95 -0.01 0.00 -0.74 0.00 0.00 36.82 38.29 3cno h ILE 15 CO 0.00 0.46 -0.31 0.50 0.00 0.00 0.00 178.15 178.80 3cno h LYS 16 N 0.00 0.00 -0.14 2.37 1.63 -2.00 -0.55 116.57 117.89 3cno h LYS 16 Ca -0.00 0.00 -0.09 0.00 -0.85 0.00 0.00 60.65 59.71 3cno h LYS 16 Cb 0.92 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.55 3cno h LYS 16 CO 0.06 0.31 -0.26 -0.44 -3.45 0.00 0.00 179.45 175.67 3cno h ASP 17 N 0.00 0.46 0.12 4.20 3.45 -1.86 -3.23 116.42 119.56 3cno h ASP 17 Ca -0.00 -0.55 -0.11 0.00 0.43 0.00 0.00 57.03 56.80 3cno h ASP 17 Cb 0.68 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 39.30 3cno h ASP 17 CO 0.04 0.93 -0.37 -0.07 -1.57 0.00 0.00 179.24 178.19 3cno h LEU 18 N 0.02 0.35 -1.25 1.55 3.38 -1.32 -2.99 115.31 115.05 3cno h LEU 18 Ca 0.01 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 3cno h LEU 18 Cb 0.84 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 3cno h LEU 18 CO 0.06 0.70 -0.00 -0.07 0.09 0.00 0.00 178.44 179.22 3cno h LEU 19 N 0.29 0.47 -1.78 1.67 3.38 -1.19 -2.05 115.31 116.11 3cno h LEU 19 Ca 0.03 -0.09 0.11 0.00 0.09 0.00 0.00 57.88 58.03 3cno h LEU 19 Cb 0.79 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 3cno h LEU 19 CO 0.06 0.54 0.37 -0.09 0.09 0.00 0.00 178.44 179.41 3cno h ARG 20 N 0.49 0.24 0.00 1.13 9.65 -1.54 -2.54 114.38 121.80 3cno h ARG 20 Ca 0.11 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.97 3cno h ARG 20 Cb 0.32 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.85 3cno h ARG 20 CO 0.01 0.16 -0.19 1.28 2.80 0.00 0.00 179.97 184.02 3cno n LEU 21 N -4.45 0.53 -4.45 3.80 4.32 -0.77 -4.94 117.00 111.04 3cno n LEU 21 Ca 0.09 0.41 -0.23 0.00 -0.02 0.00 0.00 56.01 56.26 3cno n LEU 21 Cb 0.43 -0.33 -0.10 0.00 -1.62 0.00 0.00 43.42 41.80 3cno n LEU 21 CO 0.35 -0.07 -0.46 0.68 -1.22 0.00 0.00 177.39 176.67 3cno s VAL 22 N -3.08 2.27 -0.21 4.08 -7.23 -0.96 -4.91 120.40 110.38 3cno s VAL 22 Ca 0.11 -2.34 0.05 0.00 -1.81 0.00 0.00 61.98 57.99 3cno s VAL 22 Cb 0.15 -2.28 -0.06 0.00 0.56 0.00 0.00 36.38 34.74 3cno s VAL 22 CO 0.62 -0.42 0.21 -0.46 -0.31 0.00 0.00 175.10 174.74 3cno n ASN 23 N -0.58 0.82 -4.19 4.85 0.23 -0.87 -4.97 115.26 110.55 3cno n ASN 23 Ca -0.06 -0.52 -0.25 0.00 -0.53 0.00 0.00 54.58 53.22 3cno n ASN 23 Cb 0.61 1.04 -0.15 0.00 -2.08 0.00 0.00 39.78 39.20 3cno n ASN 23 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 3cno s THR 24 N -1.64 1.45 -0.06 5.53 2.01 -0.39 -0.68 115.64 121.85 3cno s THR 24 Ca 0.01 -0.87 0.03 0.00 0.31 0.00 0.00 61.69 61.17 3cno s THR 24 Cb 0.04 -1.22 0.01 0.00 0.01 0.00 0.00 72.50 71.33 3cno s THR 24 CO 0.22 0.34 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.66 3cno s VAL 25 N -0.52 1.25 -0.34 3.82 1.01 0.76 -1.61 120.40 124.77 3cno s VAL 25 Ca 0.07 -0.57 -0.08 0.00 0.00 0.00 0.00 61.98 61.40 3cno s VAL 25 Cb -0.07 -1.12 0.03 0.00 0.00 0.00 0.00 36.38 35.22 3cno s VAL 25 CO -0.00 0.38 0.13 -0.69 0.00 0.00 0.00 175.10 174.91 3cno s VAL 26 N 0.48 4.05 -0.53 2.92 1.01 0.15 -1.39 120.40 127.08 3cno s VAL 26 Ca -0.12 -0.95 -0.21 0.00 0.00 0.00 0.00 61.98 60.70 3cno s VAL 26 Cb -0.15 -3.24 0.05 0.00 0.00 0.00 0.00 36.38 33.05 3cno s VAL 26 CO 0.04 -0.13 0.75 -0.70 0.00 0.00 0.00 175.10 175.05 3cno s GLU 27 N 1.47 3.19 -0.62 2.72 2.12 -0.15 -0.68 118.70 126.74 3cno s GLU 27 Ca 0.00 -0.70 -0.22 0.00 0.36 0.00 0.00 54.97 54.42 3cno s GLU 27 Cb -0.19 -4.10 0.07 0.00 0.26 0.00 0.00 34.13 30.17 3cno s GLU 27 CO 0.04 -1.35 0.90 0.08 -0.54 0.00 0.00 175.26 174.39 3cno s VAL 28 N 3.15 4.43 0.25 3.70 1.01 0.60 -0.95 120.40 132.59 3cno s VAL 28 Ca 0.20 -0.32 0.06 0.00 0.00 0.00 0.00 61.98 61.93 3cno s VAL 28 Cb -0.17 -4.60 -0.03 0.00 0.00 0.00 0.00 36.38 31.57 3cno s VAL 28 CO 0.14 -1.30 0.25 -0.13 0.00 0.00 0.00 175.10 174.06 3cno s ARG 29 N 3.78 3.10 -0.19 2.72 0.52 -0.07 -4.49 118.95 124.31 3cno s ARG 29 Ca 0.22 -0.95 -0.25 0.00 -0.52 0.00 0.00 55.73 54.23 3cno s ARG 29 Cb -0.17 -2.67 -0.01 0.00 0.52 0.00 0.00 34.95 32.61 3cno s ARG 29 CO 0.12 0.41 0.81 0.34 0.02 0.00 0.00 175.30 176.99 3cno s ASP 30 N -3.88 6.89 0.60 0.23 -1.08 -1.26 -1.03 116.67 117.14 3cno s ASP 30 Ca 0.33 1.10 0.30 0.00 -0.52 0.00 0.00 52.55 53.76 3cno s ASP 30 Cb -0.08 -2.44 1.73 0.00 -1.46 0.00 0.00 42.92 40.67 3cno s ASP 30 CO 0.26 -0.41 2.11 0.00 0.52 0.00 0.00 175.17 177.66 3cno h ALA 31 N 7.43 1.69 0.00 3.66 0.00 -1.41 -0.93 119.26 129.70 3cno h ALA 31 Ca -0.28 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 3cno h ALA 31 Cb 1.12 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 3cno h ALA 31 CO 0.84 -0.27 -0.17 0.00 0.00 0.00 0.00 179.25 179.65 3cno h ARG 32 N 0.00 0.00 -1.52 0.00 3.08 -1.88 -3.39 114.38 110.67 3cno h ARG 32 Ca 0.07 0.00 -0.43 0.00 0.07 0.00 0.00 59.98 59.69 3cno h ARG 32 Cb 0.45 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 30.20 3cno h ARG 32 CO -0.00 0.17 -0.85 0.00 -1.07 0.00 0.00 179.97 178.23 3cno n ALA 33 N -2.16 1.06 0.30 0.04 0.00 -0.37 -0.15 120.51 119.23 3cno n ALA 33 Ca 0.02 -2.53 0.18 0.00 0.00 0.00 0.00 53.44 51.11 3cno n ALA 33 Cb 0.49 -1.01 0.96 0.00 0.00 0.00 0.00 19.45 19.89 3cno n ALA 33 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3cno h PRO 34 N 4.59 0.00 0.07 0.00 0.11 -1.72 -1.96 132.00 133.10 3cno h PRO 34 Ca 0.08 0.00 -0.30 0.00 0.11 0.00 0.00 66.00 65.89 3cno h PRO 34 Cb 0.96 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.04 3cno h PRO 34 CO 0.34 0.03 -1.63 0.74 -0.21 0.00 0.00 178.00 177.27 3cno h PHE 35 N 0.00 0.28 -0.33 0.65 -1.00 -1.95 -2.88 116.94 111.71 3cno h PHE 35 Ca -0.00 -0.20 -0.05 0.00 2.81 0.00 0.00 57.97 60.53 3cno h PHE 35 Cb 0.17 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 39.70 3cno h PHE 35 CO 0.00 1.64 0.00 0.00 -1.61 0.00 0.00 178.31 178.34 3cno h ALA 36 N -0.18 1.40 -0.69 2.45 0.00 -1.95 -2.93 119.26 117.36 3cno h ALA 36 Ca -0.38 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.34 3cno h ALA 36 Cb 1.70 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.34 3cno h ALA 36 CO -0.04 0.42 0.00 0.25 0.00 0.00 0.00 179.25 179.88 3cno n THR 37 N -4.29 1.25 -1.75 0.00 -2.24 -0.74 -4.95 114.28 101.56 3cno n THR 37 Ca 0.01 -1.02 -0.32 0.00 -2.27 0.00 0.00 64.05 60.45 3cno n THR 37 Cb 0.24 0.34 0.04 0.00 -2.10 0.00 0.00 70.33 68.85 3cno n THR 37 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3cno s SER 38 N -0.95 5.32 -1.14 3.42 1.04 -1.08 -4.48 113.70 115.83 3cno s SER 38 Ca 0.49 1.82 -0.05 0.00 0.48 0.00 0.00 55.95 58.69 3cno s SER 38 Cb 0.27 -2.53 0.12 0.00 0.10 0.00 0.00 66.02 63.99 3cno s SER 38 CO 0.29 -1.48 2.42 0.00 0.98 0.00 0.00 173.24 175.46 3cno n ALA 39 N -2.59 6.70 -1.76 5.32 0.00 -1.26 -4.89 120.51 122.02 3cno n ALA 39 Ca 0.09 -3.92 -0.39 0.00 0.00 0.00 0.00 53.44 49.22 3cno n ALA 39 Cb 0.53 -2.61 0.00 0.00 0.00 0.00 0.00 19.45 17.37 3cno n ALA 39 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3cno s TYR 40 N -1.49 2.72 0.00 0.00 5.04 -1.26 -3.36 117.35 119.00 3cno s TYR 40 Ca 0.54 1.43 0.00 0.00 -2.44 0.00 0.00 57.07 56.60 3cno s TYR 40 Cb 0.23 -3.62 0.00 0.00 0.35 0.00 0.00 41.96 38.91 3cno s TYR 40 CO -0.12 -2.11 0.00 0.41 -1.34 0.00 0.00 175.55 172.39 3cno n GLY 41 N 0.62 2.52 3.77 8.97 0.00 -1.26 -5.03 105.19 114.78 3cno n GLY 41 Ca 0.06 -0.65 -0.38 0.00 0.00 0.00 0.00 46.02 45.05 3cno n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cno s VAL 42 N 0.00 3.54 -0.33 1.61 0.11 -1.21 -5.01 120.40 119.10 3cno s VAL 42 Ca 0.00 1.32 -0.11 0.00 -2.93 0.00 0.00 61.98 60.26 3cno s VAL 42 Cb 0.00 -3.75 -0.01 0.00 -1.53 0.00 0.00 36.38 31.09 3cno s VAL 42 CO 0.00 0.15 0.20 -0.62 -3.33 0.00 0.00 175.10 171.50 3cno s ASP 43 N -1.25 5.82 -0.11 3.54 2.15 -1.26 -4.93 116.67 120.63 3cno s ASP 43 Ca 0.53 -0.54 0.15 0.00 0.43 0.00 0.00 52.55 53.12 3cno s ASP 43 Cb -0.27 -2.07 0.32 0.00 -0.30 0.00 0.00 42.92 40.60 3cno s ASP 43 CO 0.34 -0.24 1.22 0.49 -0.17 0.00 0.00 175.17 176.81 3cno n PHE 44 N 5.05 0.32 0.10 -5.34 3.72 -1.26 -4.79 117.46 115.26 3cno n PHE 44 Ca -0.13 -0.85 0.14 0.00 -0.05 0.00 0.00 57.45 56.56 3cno n PHE 44 Cb 0.49 -0.17 0.64 0.00 -0.94 0.00 0.00 39.48 39.50 3cno n PHE 44 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3cno h SER 45 N 0.72 0.05 -0.94 4.37 4.64 -2.02 -1.87 113.55 118.50 3cno h SER 45 Ca 0.00 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.71 3cno h SER 45 Cb 1.04 -0.01 -0.37 0.00 -0.31 0.00 0.00 62.40 62.75 3cno h SER 45 CO 0.07 0.03 -0.06 0.54 -0.87 0.00 0.00 176.83 176.54 3cno n ARG 46 N -4.46 3.20 -4.07 4.77 5.12 -1.26 -4.96 116.66 115.00 3cno n ARG 46 Ca 0.04 -3.81 -0.12 0.00 -1.93 0.00 0.00 57.85 52.03 3cno n ARG 46 Cb 0.34 -2.28 -0.11 0.00 -1.16 0.00 0.00 32.46 29.25 3cno n ARG 46 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 3cno s LYS 47 N -3.71 0.56 -0.18 5.56 -0.14 -0.70 -5.01 119.74 116.12 3cno s LYS 47 Ca 0.56 -0.87 -0.29 0.00 -1.36 0.00 0.00 55.97 54.02 3cno s LYS 47 Cb 0.45 -0.20 -0.02 0.00 -1.68 0.00 0.00 37.83 36.38 3cno s LYS 47 CO -0.01 0.02 1.38 -2.00 -0.76 0.00 0.00 175.35 173.97 3cno s GLU 48 N -2.09 4.12 -0.14 1.68 2.56 0.14 -4.90 118.70 120.07 3cno s GLU 48 Ca -0.06 1.68 0.01 0.00 0.00 0.00 0.00 54.97 56.60 3cno s GLU 48 Cb -0.06 -3.85 0.00 0.00 2.00 0.00 0.00 34.13 32.21 3cno s GLU 48 CO -0.01 -0.87 -0.17 0.99 -0.56 0.00 0.00 175.26 174.64 3cno s THR 49 N 3.93 2.49 -0.20 -1.70 2.01 -1.26 -0.17 115.64 120.74 3cno s THR 49 Ca 0.60 -0.84 -0.05 0.00 0.31 0.00 0.00 61.69 61.72 3cno s THR 49 Cb -0.23 -2.03 -0.02 0.00 0.01 0.00 0.00 72.50 70.22 3cno s THR 49 CO 0.20 0.53 -0.01 -0.63 -0.69 0.00 0.00 174.62 174.02 3cno s ILE 50 N 0.75 3.87 -0.32 1.82 1.01 -0.48 -4.47 121.20 123.37 3cno s ILE 50 Ca -0.07 -0.34 -0.22 0.00 0.00 0.00 0.00 60.65 60.02 3cno s ILE 50 Cb -0.16 -2.75 -0.00 0.00 0.01 0.00 0.00 42.46 39.56 3cno s ILE 50 CO 0.01 0.43 0.74 -0.63 0.00 0.00 0.00 174.94 175.48 3cno s ILE 51 N 1.05 4.82 -0.37 2.92 1.01 -0.32 -0.98 121.20 129.33 3cno s ILE 51 Ca 0.02 1.00 -0.11 0.00 0.00 0.00 0.00 60.65 61.57 3cno s ILE 51 Cb -0.14 -4.12 0.03 0.00 0.01 0.00 0.00 42.46 38.23 3cno s ILE 51 CO 0.01 -0.26 0.20 -0.22 0.00 0.00 0.00 174.94 174.67 3cno s LEU 52 N 2.88 4.66 -0.54 2.97 0.20 -0.13 -0.06 118.68 128.66 3cno s LEU 52 Ca 0.30 -0.97 -0.22 0.00 0.69 0.00 0.00 54.13 53.92 3cno s LEU 52 Cb -0.14 -2.01 0.05 0.00 -0.43 0.00 0.00 46.19 43.66 3cno s LEU 52 CO 0.13 -0.37 0.84 -0.76 -0.29 0.00 0.00 176.35 175.90 3cno s LEU 53 N 1.55 4.41 0.39 -0.68 1.43 0.17 -0.90 118.68 125.05 3cno s LEU 53 Ca 0.02 -0.59 0.04 0.00 -1.03 0.00 0.00 54.13 52.57 3cno s LEU 53 Cb -0.19 -2.67 -0.00 0.00 0.03 0.00 0.00 46.19 43.35 3cno s LEU 53 CO 0.06 -1.13 0.56 0.21 0.23 0.00 0.00 176.35 176.29 3cno s ASN 54 N 2.86 5.87 -1.10 2.29 2.47 -0.20 -1.81 114.94 125.32 3cno s ASN 54 Ca 0.25 -0.02 -0.04 0.00 0.42 0.00 0.00 52.86 53.47 3cno s ASN 54 Cb -0.15 -1.30 0.00 0.00 -1.45 0.00 0.00 41.25 38.36 3cno s ASN 54 CO 0.16 -0.58 0.56 0.29 -3.72 0.00 0.00 177.10 173.81 3cno n LYS 55 N -1.85 -4.21 0.30 0.43 5.02 -0.92 -1.13 118.16 115.81 3cno n LYS 55 Ca 0.01 0.65 0.18 0.00 -2.02 0.00 0.00 58.31 57.13 3cno n LYS 55 Cb 0.58 -5.00 0.97 0.00 -0.02 0.00 0.00 35.03 31.56 3cno n LYS 55 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 3cno h VAL 56 N -1.28 0.21 0.00 -0.18 -1.51 -1.77 -2.16 116.25 109.56 3cno h VAL 56 Ca -0.40 -0.22 -0.02 0.00 -1.23 0.00 0.00 66.70 64.83 3cno h VAL 56 Cb 1.27 1.17 -0.00 0.00 -2.13 0.00 0.00 31.29 31.60 3cno h VAL 56 CO 0.41 0.03 -0.11 -2.24 -1.23 0.00 0.00 177.57 174.43 3cno h ASP 57 N 0.00 0.00 -0.17 4.19 2.03 -1.90 -3.03 116.42 117.54 3cno h ASP 57 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3cno h ASP 57 Cb 0.17 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.67 3cno h ASP 57 CO 0.00 0.11 0.00 2.30 -1.03 0.00 0.00 179.24 180.63 3cno n ILE 58 N -3.75 0.99 -3.76 4.15 -5.35 -0.82 -4.93 119.36 105.87 3cno n ILE 58 Ca -0.02 -0.99 -0.20 0.00 -0.27 0.00 0.00 62.75 61.26 3cno n ILE 58 Cb 0.22 0.51 -0.02 0.00 -1.74 0.00 0.00 39.64 38.61 3cno n ILE 58 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3cno s ALA 59 N -0.99 3.98 -0.29 -1.28 0.00 -1.15 -2.95 121.76 119.09 3cno s ALA 59 Ca 0.11 -1.44 -0.29 0.00 0.00 0.00 0.00 51.96 50.35 3cno s ALA 59 Cb 0.06 -1.53 -0.01 0.00 0.00 0.00 0.00 23.12 21.64 3cno s ALA 59 CO 0.08 0.09 1.47 0.34 0.00 0.00 0.00 175.76 177.74 3cno s ASP 60 N -4.04 6.45 0.22 0.00 -1.08 -1.26 -4.52 116.67 112.44 3cno s ASP 60 Ca 0.40 1.32 -0.07 0.00 -0.52 0.00 0.00 52.55 53.67 3cno s ASP 60 Cb -0.08 -2.54 0.33 0.00 -1.46 0.00 0.00 42.92 39.17 3cno s ASP 60 CO 0.29 -1.25 1.77 -0.33 0.52 0.00 0.00 175.17 176.17 3cno h GLU 61 N 10.31 0.54 -0.21 4.34 5.08 -1.91 -0.21 114.58 132.51 3cno h GLU 61 Ca -0.30 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.01 3cno h GLU 61 Cb 1.13 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 3cno h GLU 61 CO 1.03 0.36 0.07 -0.22 -1.00 0.00 0.00 179.01 179.24 3cno h LYS 62 N 0.55 0.33 -0.56 2.33 3.11 -1.99 -0.37 116.57 119.97 3cno h LYS 62 Ca 0.34 -0.07 0.06 0.00 -2.81 0.00 0.00 60.65 58.17 3cno h LYS 62 Cb 0.38 -0.05 -0.05 0.00 -1.00 0.00 0.00 32.23 31.52 3cno h LYS 62 CO -0.28 0.42 0.28 1.15 -2.81 0.00 0.00 179.45 178.20 3cno h THR 63 N 0.17 0.93 -0.78 1.00 2.02 -1.79 -1.82 112.91 112.63 3cno h THR 63 Ca 0.07 -0.18 -0.00 0.00 0.77 0.00 0.00 66.41 67.06 3cno h THR 63 Cb 0.23 0.35 -0.04 0.00 -1.74 0.00 0.00 68.15 66.95 3cno h THR 63 CO -0.00 0.10 0.48 0.74 0.37 0.00 0.00 175.52 177.20 3cno h THR 64 N 0.53 1.21 -0.72 3.16 2.02 -0.71 -0.63 112.91 117.78 3cno h THR 64 Ca 0.26 -0.46 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 3cno h THR 64 Cb 0.19 0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 66.67 3cno h THR 64 CO -0.19 0.22 0.39 0.50 0.37 0.00 0.00 175.52 176.81 3cno h LYS 65 N 1.07 1.01 -0.71 6.66 3.11 -0.60 -1.52 116.57 125.59 3cno h LYS 65 Ca 0.28 -0.12 -0.05 0.00 -2.81 0.00 0.00 60.65 57.95 3cno h LYS 65 Cb -0.06 -0.19 -0.03 0.00 -1.00 0.00 0.00 32.23 30.95 3cno h LYS 65 CO -0.05 0.76 0.26 0.87 -2.81 0.00 0.00 179.45 178.48 3cno h LYS 66 N 0.99 1.06 -0.46 1.90 1.57 -0.55 -2.82 116.57 118.27 3cno h LYS 66 Ca 0.25 -0.19 -0.07 0.00 -1.87 0.00 0.00 60.65 58.77 3cno h LYS 66 Cb 0.05 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 3cno h LYS 66 CO -0.04 0.88 0.01 -1.49 -0.57 0.00 0.00 179.45 178.24 3cno h TRP 67 N 1.04 0.87 0.41 -1.35 4.06 -0.66 -0.91 115.95 119.41 3cno h TRP 67 Ca 0.24 -0.15 -0.01 0.00 2.06 0.00 0.00 58.89 61.03 3cno h TRP 67 Cb 0.23 -0.23 -0.02 0.00 -1.00 0.00 0.00 29.16 28.14 3cno h TRP 67 CO 0.02 0.84 -0.43 0.28 -3.56 0.00 0.00 178.44 175.59 3cno h VAL 68 N 0.65 0.14 -0.34 1.49 2.07 -1.22 -1.65 116.25 117.39 3cno h VAL 68 Ca 0.13 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.62 3cno h VAL 68 Cb 0.48 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 3cno h VAL 68 CO 0.02 0.00 0.09 1.05 0.02 0.00 0.00 177.57 178.75 3cno h GLU 69 N -0.86 0.49 -0.84 1.57 4.11 -1.51 0.70 114.58 118.23 3cno h GLU 69 Ca -0.04 -0.08 0.07 0.00 0.07 0.00 0.00 59.36 59.39 3cno h GLU 69 Cb 0.77 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.87 3cno h GLU 69 CO -0.07 0.46 0.51 0.35 0.07 0.00 0.00 179.01 180.33 3cno h PHE 70 N 0.49 0.94 0.12 2.06 3.57 -0.88 0.99 116.94 124.23 3cno h PHE 70 Ca 0.12 0.03 -0.30 0.00 3.53 0.00 0.00 57.97 61.35 3cno h PHE 70 Cb 0.19 -0.30 0.03 0.00 2.79 0.00 0.00 35.95 38.65 3cno h PHE 70 CO 0.01 0.45 -1.24 0.74 -2.23 0.00 0.00 178.31 176.04 3cno h PHE 71 N 0.92 0.97 -0.52 0.41 0.04 -0.29 -3.14 116.94 115.31 3cno h PHE 71 Ca 0.38 -0.61 -0.03 0.00 2.80 0.00 0.00 57.97 60.51 3cno h PHE 71 Cb 0.23 -0.08 -0.02 0.00 2.20 0.00 0.00 35.95 38.28 3cno h PHE 71 CO -0.04 1.45 0.21 0.87 -0.60 0.00 0.00 178.31 180.20 3cno h LYS 72 N 0.26 0.78 -0.00 1.51 1.57 -0.76 -1.54 116.57 118.39 3cno h LYS 72 Ca -0.18 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 3cno h LYS 72 Cb 1.92 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 34.10 3cno h LYS 72 CO 0.24 0.69 0.00 0.87 -0.57 0.00 0.00 179.45 180.67 3cno h LYS 73 N 0.70 0.00 -0.01 3.15 1.57 -0.91 0.09 116.57 121.17 3cno h LYS 73 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3cno h LYS 73 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 3cno h LYS 73 CO -0.01 0.00 -0.08 1.04 -0.57 0.00 0.00 179.45 179.83 3cno n GLN 74 N -3.73 0.92 -0.67 3.15 6.02 -0.76 -4.90 117.38 117.41 3cno n GLN 74 Ca -0.03 -0.33 0.00 0.00 -0.01 0.00 0.00 57.00 56.63 3cno n GLN 74 Cb 0.08 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.85 3cno n GLN 74 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3cno n GLY 75 N 1.21 0.78 3.87 1.08 0.00 0.02 -5.04 105.19 107.12 3cno n GLY 75 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 3cno n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cno s LYS 76 N -0.33 3.67 -0.25 1.61 1.02 -0.65 -4.99 119.74 119.82 3cno s LYS 76 Ca 0.00 0.69 -0.14 0.00 0.02 0.00 0.00 55.97 56.53 3cno s LYS 76 Cb 0.00 -2.15 -0.04 0.00 -0.52 0.00 0.00 37.83 35.12 3cno s LYS 76 CO 0.00 -0.43 0.35 0.50 -0.92 0.00 0.00 175.35 174.85 3cno s ARG 77 N -4.83 4.07 -0.01 1.68 3.52 -1.26 -4.30 118.95 117.81 3cno s ARG 77 Ca 0.54 0.03 -0.01 0.00 -0.13 0.00 0.00 55.73 56.17 3cno s ARG 77 Cb -0.11 -3.60 0.01 0.00 -1.56 0.00 0.00 34.95 29.69 3cno s ARG 77 CO 0.47 -0.16 0.04 0.54 -0.81 0.00 0.00 175.30 175.38 3cno s VAL 78 N 1.70 -0.01 0.20 7.11 0.11 -1.26 -1.17 120.40 127.08 3cno s VAL 78 Ca 0.15 0.02 0.03 0.00 -2.93 0.00 0.00 61.98 59.25 3cno s VAL 78 Cb -0.15 -0.06 -0.05 0.00 -1.53 0.00 0.00 36.38 34.59 3cno s VAL 78 CO 0.09 0.01 -0.00 0.27 -3.33 0.00 0.00 175.10 172.14 3cno s ILE 79 N 0.14 0.87 0.06 7.04 -4.36 0.92 -4.94 121.20 120.93 3cno s ILE 79 Ca -0.01 -2.01 0.05 0.00 -0.26 0.00 0.00 60.65 58.42 3cno s ILE 79 Cb -0.02 -2.24 -0.03 0.00 1.25 0.00 0.00 42.46 41.43 3cno s ILE 79 CO -0.00 -0.39 -0.14 0.42 0.24 0.00 0.00 174.94 175.06 3cno s THR 80 N -3.53 1.11 0.22 8.37 -4.23 -1.26 -0.66 115.64 115.66 3cno s THR 80 Ca 0.26 -1.15 -0.21 0.00 -1.18 0.00 0.00 61.69 59.41 3cno s THR 80 Cb 0.06 -1.04 0.07 0.00 1.34 0.00 0.00 72.50 72.93 3cno s THR 80 CO 0.07 -0.11 0.96 0.28 -0.54 0.00 0.00 174.62 175.28 3cno s THR 81 N -1.06 0.00 0.27 3.99 -1.32 -0.75 -4.94 115.64 111.83 3cno s THR 81 Ca -0.00 -0.70 -0.19 0.00 -1.21 0.00 0.00 61.69 59.59 3cno s THR 81 Cb -0.09 -2.68 0.01 0.00 -1.51 0.00 0.00 72.50 68.23 3cno s THR 81 CO 0.02 0.00 0.66 -1.38 -2.21 0.00 0.00 174.62 171.71 3cno s HIS 82 N -2.47 -0.05 0.23 9.09 -3.43 -1.26 -2.16 115.29 115.24 3cno s HIS 82 Ca 0.18 -0.38 -0.12 0.00 -0.80 0.00 0.00 55.06 53.94 3cno s HIS 82 Cb -0.03 0.59 0.31 0.00 -1.43 0.00 0.00 32.58 32.02 3cno s HIS 82 CO 0.06 -1.19 1.60 -0.22 -2.00 0.00 0.00 174.74 172.99 3cno h LYS 83 N 2.06 -0.01 -0.00 -0.38 3.64 -1.98 -2.07 116.57 117.83 3cno h LYS 83 Ca -0.21 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 3cno h LYS 83 Cb 1.25 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 3cno h LYS 83 CO 0.26 -0.00 -0.01 0.41 -2.27 0.00 0.00 179.45 177.84 3cno n GLY 84 N -1.50 -0.90 3.73 5.01 0.00 -1.26 -4.83 105.19 105.44 3cno n GLY 84 Ca 0.11 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 3cno n GLY 84 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3cno s GLU 85 N -2.10 4.50 0.56 1.61 2.12 -0.78 -4.98 118.70 119.62 3cno s GLU 85 Ca 0.43 1.77 -0.21 0.00 0.36 0.00 0.00 54.97 57.31 3cno s GLU 85 Cb 0.22 -3.31 -0.04 0.00 0.26 0.00 0.00 34.13 31.26 3cno s GLU 85 CO 0.38 -0.11 1.35 -2.14 -0.54 0.00 0.00 175.26 174.21 3cno s PRO 86 N 0.33 3.06 0.27 4.30 0.02 -1.26 -4.83 135.00 136.90 3cno s PRO 86 Ca 0.54 2.22 0.01 0.00 0.02 0.00 0.00 61.00 63.79 3cno s PRO 86 Cb -0.30 -2.20 0.63 0.00 0.02 0.00 0.00 34.50 32.65 3cno s PRO 86 CO 0.33 -1.25 1.71 -0.09 -0.33 0.00 0.00 177.00 177.36 3cno h ARG 87 N 1.33 0.40 -0.58 5.54 2.43 -1.94 -1.70 114.38 119.87 3cno h ARG 87 Ca -0.51 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 58.69 3cno h ARG 87 Cb 1.31 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 30.72 3cno h ARG 87 CO 0.57 0.26 0.31 0.87 -1.51 0.00 0.00 179.97 180.47 3cno h LYS 88 N 0.41 0.58 -0.55 0.20 1.57 -1.97 -1.31 116.57 115.49 3cno h LYS 88 Ca 0.51 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 59.18 3cno h LYS 88 Cb 0.90 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.06 3cno h LYS 88 CO -0.49 0.38 0.07 0.28 -0.57 0.00 0.00 179.45 179.12 3cno h VAL 89 N 0.59 1.26 -0.33 0.50 2.07 -1.69 -1.96 116.25 116.68 3cno h VAL 89 Ca 0.26 -0.99 -0.04 0.00 0.82 0.00 0.00 66.70 66.75 3cno h VAL 89 Cb 0.15 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 3cno h VAL 89 CO -0.16 0.36 0.07 0.25 0.02 0.00 0.00 177.57 178.10 3cno h LEU 90 N 0.81 0.52 -1.05 2.57 6.46 -1.15 -1.38 115.31 122.09 3cno h LEU 90 Ca 0.17 -0.25 0.00 0.00 -0.12 0.00 0.00 57.88 57.68 3cno h LEU 90 Cb 0.43 -0.14 -0.04 0.00 -0.73 0.00 0.00 40.66 40.18 3cno h LEU 90 CO 0.01 0.64 0.56 -0.07 -0.62 0.00 0.00 178.44 178.96 3cno h LEU 91 N 0.39 1.06 -0.21 2.25 3.38 -1.16 0.84 115.31 121.86 3cno h LEU 91 Ca 0.10 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 3cno h LEU 91 Cb 0.33 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3cno h LEU 91 CO 0.00 0.80 -0.10 0.50 0.09 0.00 0.00 178.44 179.73 3cno h LYS 92 N 1.23 0.44 -0.72 1.13 3.64 -1.17 0.08 116.57 121.21 3cno h LYS 92 Ca 0.33 -0.19 0.04 0.00 -1.27 0.00 0.00 60.65 59.56 3cno h LYS 92 Cb -0.09 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.67 3cno h LYS 92 CO -0.06 0.73 0.43 0.87 -2.27 0.00 0.00 179.45 179.15 3cno h LYS 93 N 0.14 0.80 -0.24 1.90 1.57 -1.03 -2.93 116.57 116.78 3cno h LYS 93 Ca 0.05 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 3cno h LYS 93 Cb 0.60 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 3cno h LYS 93 CO 0.03 0.53 0.03 -0.07 -0.57 0.00 0.00 179.45 179.40 3cno h LEU 94 N 0.82 0.39 -3.74 2.94 3.38 -0.68 -3.48 115.31 114.95 3cno h LEU 94 Ca 0.30 -0.27 -0.50 0.00 0.09 0.00 0.00 57.88 57.50 3cno h LEU 94 Cb 0.10 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 3cno h LEU 94 CO -0.14 0.56 -1.03 -1.20 0.09 0.00 0.00 178.44 176.72 3cno n SER 95 N -4.68 -4.77 -4.74 -0.43 7.64 0.00 -4.91 113.62 101.73 3cno n SER 95 Ca -0.03 -1.03 -0.41 0.00 1.01 0.00 0.00 58.87 58.40 3cno n SER 95 Cb 0.21 -1.85 -0.04 0.00 -1.01 0.00 0.00 64.21 61.52 3cno n SER 95 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3cno s PHE 96 N -3.15 3.54 0.63 1.43 0.08 -1.26 -5.02 117.98 114.22 3cno s PHE 96 Ca 0.15 1.56 -0.18 0.00 0.12 0.00 0.00 56.93 58.58 3cno s PHE 96 Cb -0.08 -3.32 -0.04 0.00 -0.57 0.00 0.00 43.02 39.01 3cno s PHE 96 CO 0.91 -0.77 0.98 -3.47 -0.10 0.00 0.00 175.22 172.76 3cno n ASP 97 N 2.33 0.76 0.31 1.36 2.03 -1.26 -4.88 116.55 117.20 3cno n ASP 97 Ca 0.03 0.77 0.20 0.00 0.52 0.00 0.00 54.79 56.32 3cno n ASP 97 Cb 0.46 -1.40 1.02 0.00 -0.72 0.00 0.00 41.12 40.47 3cno n ASP 97 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 3cno h ARG 98 N 0.32 0.00 -0.55 -0.67 0.11 -1.95 -1.90 114.38 109.75 3cno h ARG 98 Ca -0.49 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.59 3cno h ARG 98 Cb 1.36 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.44 3cno h ARG 98 CO 0.50 0.01 0.00 1.28 0.10 0.00 0.00 179.97 181.86 3cno n LEU 99 N -3.15 3.52 -4.76 0.08 4.77 -1.26 -4.18 117.00 112.02 3cno n LEU 99 Ca -0.02 -2.03 -0.41 0.00 -0.03 0.00 0.00 56.01 53.52 3cno n LEU 99 Cb 0.15 -0.38 -0.02 0.00 -2.33 0.00 0.00 43.42 40.85 3cno n LEU 99 CO 0.23 0.86 1.11 0.00 -1.33 0.00 0.00 177.39 178.27 3cno s ALA 100 N -1.06 3.61 -0.11 -1.18 0.00 -0.72 -4.96 121.76 117.34 3cno s ALA 100 Ca 0.37 1.43 0.03 0.00 0.00 0.00 0.00 51.96 53.78 3cno s ALA 100 Cb 0.20 -3.57 0.01 0.00 0.00 0.00 0.00 23.12 19.76 3cno s ALA 100 CO 0.25 -0.85 -0.19 1.03 0.00 0.00 0.00 175.76 176.00 3cno s ARG 101 N -1.14 2.57 -0.11 0.00 0.52 -1.26 -2.66 118.95 116.88 3cno s ARG 101 Ca 0.56 -0.70 0.02 0.00 -0.52 0.00 0.00 55.73 55.09 3cno s ARG 101 Cb -0.44 -2.07 -0.01 0.00 0.52 0.00 0.00 34.95 32.96 3cno s ARG 101 CO 0.51 0.03 -0.19 0.08 0.02 0.00 0.00 175.30 175.75 3cno s VAL 102 N 0.72 2.54 -0.18 3.52 1.01 0.36 -1.27 120.40 127.10 3cno s VAL 102 Ca -0.11 -0.85 -0.06 0.00 0.00 0.00 0.00 61.98 60.95 3cno s VAL 102 Cb -0.16 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 3cno s VAL 102 CO 0.02 0.55 0.04 -0.22 0.00 0.00 0.00 175.10 175.48 3cno s LEU 103 N 0.25 3.60 -0.30 3.92 2.96 -0.63 -1.30 118.68 127.17 3cno s LEU 103 Ca -0.13 -0.02 -0.19 0.00 -0.22 0.00 0.00 54.13 53.58 3cno s LEU 103 Cb -0.16 -1.91 -0.01 0.00 0.50 0.00 0.00 46.19 44.60 3cno s LEU 103 CO 0.07 0.14 0.55 -0.63 -1.32 0.00 0.00 176.35 175.16 3cno s ILE 104 N 0.56 5.01 0.16 6.68 -1.09 -1.26 0.31 121.20 131.56 3cno s ILE 104 Ca 0.01 0.73 0.07 0.00 -2.23 0.00 0.00 60.65 59.24 3cno s ILE 104 Cb -0.13 -3.92 -0.04 0.00 -1.58 0.00 0.00 42.46 36.78 3cno s ILE 104 CO 0.02 -0.07 -0.16 0.54 -1.23 0.00 0.00 174.94 174.04 3cno s VAL 105 N 2.44 1.60 0.00 2.92 0.11 0.14 -1.15 120.40 126.46 3cno s VAL 105 Ca 0.22 -1.92 0.00 0.00 -2.93 0.00 0.00 61.98 57.35 3cno s VAL 105 Cb -0.15 -1.78 0.00 0.00 -1.53 0.00 0.00 36.38 32.91 3cno s VAL 105 CO 0.11 -0.43 0.00 0.61 -3.33 0.00 0.00 175.10 172.06 3cno n GLY 106 N 0.20 0.27 3.78 6.54 0.00 -0.98 -0.29 105.19 114.70 3cno n GLY 106 Ca -0.13 -1.15 -0.31 0.00 0.00 0.00 0.00 46.02 44.44 3cno n GLY 106 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3cno s VAL 107 N -2.00 3.47 0.48 1.61 -7.23 -1.26 -0.34 120.40 115.13 3cno s VAL 107 Ca 0.00 0.49 -0.22 0.00 -1.81 0.00 0.00 61.98 60.44 3cno s VAL 107 Cb 0.00 -3.02 -0.09 0.00 0.56 0.00 0.00 36.38 33.83 3cno s VAL 107 CO 0.00 -0.61 0.96 -2.65 -0.31 0.00 0.00 175.10 172.49 3cno n PRO 108 N -3.38 1.17 -1.90 4.82 -0.02 -1.26 -3.74 135.00 130.69 3cno n PRO 108 Ca 0.09 0.43 -0.14 0.00 -2.02 0.00 0.00 63.50 61.86 3cno n PRO 108 Cb 0.53 -2.06 -0.03 0.00 -0.02 0.00 0.00 33.50 31.93 3cno n PRO 108 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3cno n ASN 109 N 0.16 -4.44 -0.13 2.55 3.02 -1.26 -4.09 115.26 111.06 3cno n ASN 109 Ca 0.11 0.14 0.11 0.00 -0.03 0.00 0.00 54.58 54.90 3cno n ASN 109 Cb 0.42 -3.41 -0.00 0.00 -0.61 0.00 0.00 39.78 36.17 3cno n ASN 109 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 3cno n THR 110 N -3.41 0.00 0.00 3.41 5.66 -1.25 -4.81 114.28 113.88 3cno n THR 110 Ca -0.15 -0.07 0.00 0.00 -3.05 0.00 0.00 64.05 60.78 3cno n THR 110 Cb 0.55 0.90 0.00 0.00 -1.55 0.00 0.00 70.33 70.24 3cno n THR 110 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3cno n GLY 111 N 1.47 1.69 0.17 1.09 0.00 -1.26 -4.71 105.19 103.63 3cno n GLY 111 Ca 0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.95 3cno n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3cno h LYS 112 N 0.00 0.50 -0.17 1.61 1.57 -1.92 -1.89 116.57 116.26 3cno h LYS 112 Ca 0.00 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.52 3cno h LYS 112 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3cno h LYS 112 CO 0.00 0.82 0.08 0.77 -0.57 0.00 0.00 179.45 180.56 3cno h SER 113 N 0.19 0.22 -0.78 0.86 0.02 -1.98 -0.64 113.55 111.42 3cno h SER 113 Ca 0.04 -0.11 0.13 0.00 -0.84 0.00 0.00 61.79 61.01 3cno h SER 113 Cb 0.71 -0.06 -0.09 0.00 0.14 0.00 0.00 62.40 63.11 3cno h SER 113 CO 0.05 0.26 0.38 0.74 -1.14 0.00 0.00 176.83 177.12 3cno h THR 114 N 0.15 0.75 0.27 -2.27 2.02 -1.99 0.17 112.91 112.03 3cno h THR 114 Ca 0.06 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 3cno h THR 114 Cb 0.10 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 66.64 3cno h THR 114 CO -0.01 0.11 -0.13 0.40 0.37 0.00 0.00 175.52 176.26 3cno h ILE 115 N 0.58 0.77 -0.61 3.11 2.04 -1.08 -2.37 117.51 119.95 3cno h ILE 115 Ca 0.41 -0.41 0.12 0.00 1.00 0.00 0.00 64.86 65.99 3cno h ILE 115 Cb 0.55 1.00 -0.10 0.00 -0.74 0.00 0.00 36.82 37.53 3cno h ILE 115 CO -0.34 0.09 0.07 0.40 0.00 0.00 0.00 178.15 178.36 3cno h ILE 116 N -0.58 0.56 -0.84 -0.67 5.03 -0.63 -1.77 117.51 118.61 3cno h ILE 116 Ca -0.04 -0.06 0.03 0.00 -0.12 0.00 0.00 64.86 64.67 3cno h ILE 116 Cb 0.42 0.36 -0.05 0.00 -3.03 0.00 0.00 36.82 34.52 3cno h ILE 116 CO 0.06 0.03 0.55 0.78 -0.68 0.00 0.00 178.15 178.90 3cno h ASN 117 N 0.18 0.90 -0.24 1.72 2.35 -0.56 -1.28 115.58 118.66 3cno h ASN 117 Ca 0.32 -0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 55.94 3cno h ASN 117 Cb 0.51 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.67 3cno h ASN 117 CO -0.47 0.62 -0.34 0.50 -1.65 0.00 0.00 177.43 176.09 3cno h LYS 118 N 1.05 0.65 0.00 0.81 3.64 -0.83 -3.02 116.57 118.86 3cno h LYS 118 Ca 0.33 -0.38 -0.06 0.00 -1.27 0.00 0.00 60.65 59.27 3cno h LYS 118 Cb 0.02 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 3cno h LYS 118 CO -0.10 0.99 -0.28 -0.07 -2.27 0.00 0.00 179.45 177.73 3cno h LEU 119 N 0.35 0.00 0.70 5.20 3.38 -1.09 -3.42 115.31 120.43 3cno h LEU 119 Ca 0.02 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 3cno h LEU 119 Cb 0.92 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.68 3cno h LEU 119 CO 0.08 0.28 -0.34 0.50 0.09 0.00 0.00 178.44 179.05 3cno h LYS 120 N 0.00 -0.90 0.00 1.13 3.64 -1.10 -3.48 116.57 115.86 3cno h LYS 120 Ca -0.00 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 3cno h LYS 120 Cb 0.52 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.55 3cno h LYS 120 CO 0.04 -0.60 0.00 0.41 -2.27 0.00 0.00 179.45 177.03 3cno n GLY 121 N -0.61 0.07 3.47 5.01 0.00 -1.26 -2.91 105.19 108.97 3cno n GLY 121 Ca -0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 3cno n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cno s LYS 122 N 0.00 2.24 0.26 1.61 1.02 -1.26 -4.65 119.74 118.96 3cno s LYS 122 Ca 0.00 -0.87 0.02 0.00 0.02 0.00 0.00 55.97 55.14 3cno s LYS 122 Cb 0.00 -2.26 -0.04 0.00 -0.52 0.00 0.00 37.83 35.01 3cno s LYS 122 CO 0.00 0.57 0.17 -0.98 -0.92 0.00 0.00 175.35 174.19 3cno s ARG 123 N -1.19 1.43 0.59 1.68 1.70 -1.14 -5.23 118.95 116.79 3cno s ARG 123 Ca 0.14 -1.79 -0.17 0.00 -0.47 0.00 0.00 55.73 53.44 3cno s ARG 123 Cb -0.11 0.18 -0.03 0.00 -0.57 0.00 0.00 34.95 34.42 3cno s ARG 123 CO 0.04 -0.46 1.09 0.00 -1.08 0.00 0.00 175.30 174.88 3cno s ALA 124 N -3.84 2.66 0.00 7.88 0.00 -1.26 -4.99 121.76 122.20 3cno s ALA 124 Ca 0.39 0.56 0.00 0.00 0.00 0.00 0.00 51.96 52.90 3cno s ALA 124 Cb 0.05 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.89 3cno s ALA 124 CO 0.17 -0.90 0.00 0.41 0.00 0.00 0.00 175.76 175.44 3cno n GLY 136 N -0.51 0.00 3.71 0.00 0.00 -1.26 -4.55 105.19 102.58 3cno n GLY 136 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3cno n GLY 136 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3cno s ILE 137 N -3.67 2.79 0.08 -0.61 -5.25 -1.26 -5.00 121.20 108.28 3cno s ILE 137 Ca 0.00 0.54 0.02 0.00 -0.99 0.00 0.00 60.65 60.22 3cno s ILE 137 Cb 0.00 -3.34 -0.04 0.00 2.95 0.00 0.00 42.46 42.03 3cno s ILE 137 CO 0.00 0.04 0.13 -1.10 -1.79 0.00 0.00 174.94 172.21 3cno s GLN 138 N 1.30 3.05 0.40 0.37 -1.52 -1.26 -5.07 119.66 116.94 3cno s GLN 138 Ca 0.69 -0.63 0.04 0.00 -1.95 0.00 0.00 55.36 53.51 3cno s GLN 138 Cb -0.42 -2.81 -0.04 0.00 -0.22 0.00 0.00 33.01 29.52 3cno s GLN 138 CO 0.31 0.57 0.07 -1.58 -0.25 0.00 0.00 175.29 174.41 3cno s TRP 139 N -1.46 1.93 0.12 0.91 0.52 -1.26 -1.72 118.94 117.98 3cno s TRP 139 Ca 0.31 -1.06 -0.05 0.00 0.02 0.00 0.00 56.10 55.32 3cno s TRP 139 Cb -0.12 -1.34 -0.02 0.00 -1.15 0.00 0.00 33.47 30.83 3cno s TRP 139 CO 0.24 -0.03 0.14 -0.59 0.02 0.00 0.00 176.95 176.73 3cno s PHE 140 N -3.13 0.53 0.08 -1.98 -0.71 -0.34 -4.74 117.98 107.70 3cno s PHE 140 Ca 0.26 -0.94 0.10 0.00 -1.04 0.00 0.00 56.93 55.30 3cno s PHE 140 Cb 0.05 -0.25 -0.03 0.00 -1.21 0.00 0.00 43.02 41.58 3cno s PHE 140 CO 0.13 -0.57 -0.25 -1.12 -1.34 0.00 0.00 175.22 172.07 3cno s SER 141 N -2.97 3.33 0.59 1.98 0.01 -1.26 -1.13 113.70 114.25 3cno s SER 141 Ca 0.16 -0.63 -0.04 0.00 1.31 0.00 0.00 55.95 56.75 3cno s SER 141 Cb 0.06 -0.31 0.02 0.00 0.21 0.00 0.00 66.02 66.00 3cno s SER 141 CO -0.03 0.23 0.87 -0.76 0.41 0.00 0.00 173.24 173.96 3cno s LEU 142 N -1.60 3.21 0.55 2.44 1.43 -0.76 -4.92 118.68 119.03 3cno s LEU 142 Ca 0.13 0.47 0.27 0.00 -1.03 0.00 0.00 54.13 53.97 3cno s LEU 142 Cb -0.10 -3.27 1.46 0.00 0.03 0.00 0.00 46.19 44.31 3cno s LEU 142 CO 0.04 -1.14 1.98 -0.33 0.23 0.00 0.00 176.35 177.13 3cno h GLU 143 N -0.14 0.00 -0.31 1.70 3.07 -1.97 0.48 114.58 117.41 3cno h GLU 143 Ca -0.45 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.41 3cno h GLU 143 Cb 1.28 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.19 3cno h GLU 143 CO 0.59 0.00 0.00 0.27 -1.40 0.00 0.00 179.01 178.47 3cno n ASN 144 N -4.12 2.69 0.00 1.42 2.04 -1.26 -4.98 115.26 111.06 3cno n ASN 144 Ca 0.09 -1.89 0.00 0.00 -0.44 0.00 0.00 54.58 52.34 3cno n ASN 144 Cb 0.62 -0.20 0.00 0.00 -2.53 0.00 0.00 39.78 37.67 3cno n ASN 144 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3cno n GLY 145 N 1.34 0.89 3.70 4.83 0.00 0.17 -4.97 105.19 111.14 3cno n GLY 145 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3cno n GLY 145 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3cno n VAL 146 N -2.00 2.38 -4.31 1.61 0.24 -1.26 -4.65 118.33 110.33 3cno n VAL 146 Ca 0.00 -0.50 -0.34 0.00 -2.04 0.00 0.00 64.34 61.46 3cno n VAL 146 Cb 0.00 -1.56 -0.11 0.00 -1.47 0.00 0.00 33.84 30.70 3cno n VAL 146 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 3cno s LYS 147 N -2.10 3.69 -0.09 7.34 -0.14 -1.09 -1.82 119.74 125.53 3cno s LYS 147 Ca 0.59 -0.47 0.04 0.00 -1.36 0.00 0.00 55.97 54.77 3cno s LYS 147 Cb -0.53 -2.97 0.00 0.00 -1.68 0.00 0.00 37.83 32.66 3cno s LYS 147 CO 0.59 0.29 -0.21 0.42 -0.76 0.00 0.00 175.35 175.68 3cno s ILE 148 N 0.26 1.80 0.11 2.17 1.01 -0.28 -0.48 121.20 125.79 3cno s ILE 148 Ca -0.01 -0.87 -0.31 0.00 0.00 0.00 0.00 60.65 59.46 3cno s ILE 148 Cb -0.14 -1.57 -0.10 0.00 0.01 0.00 0.00 42.46 40.67 3cno s ILE 148 CO 0.02 0.50 1.73 -0.76 0.00 0.00 0.00 174.94 176.44 3cno s LEU 149 N 0.41 4.38 0.50 2.97 1.43 -0.42 -1.20 118.68 126.75 3cno s LEU 149 Ca -0.17 2.65 0.19 0.00 -1.03 0.00 0.00 54.13 55.77 3cno s LEU 149 Cb -0.17 -3.57 1.25 0.00 0.03 0.00 0.00 46.19 43.72 3cno s LEU 149 CO 0.07 -0.94 2.08 -0.78 0.23 0.00 0.00 176.35 177.01 3cno h ASP 150 N 8.20 0.00 -3.55 2.29 3.58 -1.62 -3.42 116.42 121.90 3cno h ASP 150 Ca -0.44 0.00 -0.67 0.00 0.42 0.00 0.00 57.03 56.33 3cno h ASP 150 Cb 1.21 0.00 -0.29 0.00 1.72 0.00 0.00 39.33 41.97 3cno h ASP 150 CO 0.94 0.10 -0.82 -0.89 -2.88 0.00 0.00 179.24 175.69 3cno s THR 151 N -4.68 2.55 0.37 2.25 2.01 -1.26 -5.01 115.64 111.87 3cno s THR 151 Ca -0.04 -0.86 -0.25 0.00 0.31 0.00 0.00 61.69 60.85 3cno s THR 151 Cb 0.16 -2.01 -0.09 0.00 0.01 0.00 0.00 72.50 70.56 3cno s THR 151 CO 0.65 0.55 1.03 -2.84 -0.69 0.00 0.00 174.62 173.33 3cno s PRO 152 N 0.12 4.29 -0.05 4.92 0.02 -1.26 -4.80 135.00 138.23 3cno s PRO 152 Ca -0.09 1.50 -0.30 0.00 0.02 0.00 0.00 61.00 62.13 3cno s PRO 152 Cb -0.15 -2.65 -0.04 0.00 0.02 0.00 0.00 34.50 31.68 3cno s PRO 152 CO 0.06 -0.02 1.34 0.20 -0.33 0.00 0.00 177.00 178.25 3cno s GLY 153 N -1.52 1.85 -0.21 0.52 0.00 -0.30 -5.00 107.32 102.66 3cno s GLY 153 Ca 0.55 0.73 -0.13 0.00 0.00 0.00 0.00 44.72 45.87 3cno s GLY 153 CO 0.28 2.48 0.26 -0.42 0.00 0.00 0.00 173.10 175.70 3cno s ILE 154 N 2.73 5.30 -0.21 0.90 1.01 -1.26 -2.33 121.20 127.35 3cno s ILE 154 Ca 0.61 0.42 -0.06 0.00 0.00 0.00 0.00 60.65 61.62 3cno s ILE 154 Cb -0.28 -3.60 -0.03 0.00 0.01 0.00 0.00 42.46 38.57 3cno s ILE 154 CO 0.23 0.33 0.03 -0.22 0.00 0.00 0.00 174.94 175.31 3cno s LEU 155 N 0.97 3.39 -0.18 2.97 1.98 0.53 -4.94 118.68 123.40 3cno s LEU 155 Ca 0.13 -0.16 -0.04 0.00 -2.89 0.00 0.00 54.13 51.17 3cno s LEU 155 Cb -0.14 -1.87 -0.02 0.00 0.66 0.00 0.00 46.19 44.82 3cno s LEU 155 CO 0.05 0.06 -0.02 -0.31 -1.89 0.00 0.00 176.35 174.24 3cno s TYR 156 N 1.04 3.03 0.03 5.38 2.02 -1.26 -4.12 117.35 123.46 3cno s TYR 156 Ca 0.03 -0.40 -0.00 0.00 -0.37 0.00 0.00 57.07 56.32 3cno s TYR 156 Cb -0.14 -2.02 -0.04 0.00 -0.40 0.00 0.00 41.96 39.36 3cno s TYR 156 CO 0.02 -0.15 0.16 0.15 -1.57 0.00 0.00 175.55 174.16 3cno s LYS 157 N 0.70 3.29 -0.25 -0.62 1.02 -1.26 -5.04 119.74 117.58 3cno s LYS 157 Ca -0.01 -0.45 -0.29 0.00 0.02 0.00 0.00 55.97 55.24 3cno s LYS 157 Cb -0.14 -2.98 -0.03 0.00 -0.52 0.00 0.00 37.83 34.16 3cno s LYS 157 CO 0.02 0.63 1.72 1.21 -0.92 0.00 0.00 175.35 178.01 3cno s ASN 158 N -2.19 6.17 -0.98 2.83 2.47 -1.26 -4.94 114.94 117.04 3cno s ASN 158 Ca 0.30 1.57 -0.21 0.00 0.42 0.00 0.00 52.86 54.94 3cno s ASN 158 Cb -0.13 -2.53 0.09 0.00 -1.45 0.00 0.00 41.25 37.24 3cno s ASN 158 CO 0.22 -1.44 1.28 -0.63 -3.72 0.00 0.00 177.10 172.81 3cno s ILE 159 N 5.91 4.36 0.05 -5.21 1.01 -1.26 -4.80 121.20 121.25 3cno s ILE 159 Ca 0.77 -1.22 0.08 0.00 0.00 0.00 0.00 60.65 60.27 3cno s ILE 159 Cb -0.25 -4.91 -0.22 0.00 0.01 0.00 0.00 42.46 37.08 3cno s ILE 159 CO 0.32 -1.71 1.02 2.19 0.00 0.00 0.00 174.94 176.76 3cno h PHE 160 N 9.24 0.05 -3.66 3.97 -0.00 -2.00 -3.46 116.94 121.08 3cno h PHE 160 Ca 0.18 -0.04 -0.67 0.00 -0.00 0.00 0.00 57.97 57.44 3cno h PHE 160 Cb 1.01 -0.00 -0.17 0.00 -0.00 0.00 0.00 35.95 36.79 3cno h PHE 160 CO 1.22 1.04 -0.76 -1.54 -0.00 0.00 0.00 178.31 178.27 3cno s SER 161 N -6.53 4.18 0.53 -0.68 1.04 -1.26 -5.01 113.70 105.97 3cno s SER 161 Ca -0.02 -0.44 0.32 0.00 0.48 0.00 0.00 55.95 56.29 3cno s SER 161 Cb 0.09 -0.73 1.26 0.00 0.10 0.00 0.00 66.02 66.74 3cno s SER 161 CO 0.83 0.19 1.95 1.05 0.98 0.00 0.00 173.24 178.24 3cno h GLU 162 N 3.80 0.00 -0.43 4.02 4.11 -2.00 -2.75 114.58 121.33 3cno h GLU 162 Ca -0.49 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 58.87 3cno h GLU 162 Cb 1.17 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.40 3cno h GLU 162 CO 0.50 0.03 0.01 0.22 0.07 0.00 0.00 179.01 179.84 3cno h ASP 163 N 0.00 0.73 -0.25 3.06 3.58 -1.97 -1.31 116.42 120.26 3cno h ASP 163 Ca -0.00 -0.30 -0.04 0.00 0.42 0.00 0.00 57.03 57.11 3cno h ASP 163 Cb 0.56 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.41 3cno h ASP 163 CO 0.00 0.85 0.00 0.25 -2.88 0.00 0.00 179.24 177.47 3cno h LEU 164 N 0.58 0.43 -0.82 2.28 5.85 -1.92 -1.22 115.31 120.49 3cno h LEU 164 Ca 0.12 -0.30 0.08 0.00 0.84 0.00 0.00 57.88 58.62 3cno h LEU 164 Cb 0.47 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.31 3cno h LEU 164 CO 0.02 0.63 0.49 0.00 -0.34 0.00 0.00 178.44 179.24 3cno h ALA 165 N 0.82 1.16 -0.50 1.25 0.00 -1.48 0.10 119.26 120.61 3cno h ALA 165 Ca 0.07 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3cno h ALA 165 Cb 0.41 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3cno h ALA 165 CO 0.01 0.16 0.15 0.00 0.00 0.00 0.00 179.25 179.57 3cno h ALA 166 N 1.43 0.65 -0.08 0.00 0.00 -1.08 -0.42 119.26 119.75 3cno h ALA 166 Ca 0.38 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.97 3cno h ALA 166 Cb 0.28 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3cno h ALA 166 CO -0.22 0.31 -0.56 0.87 0.00 0.00 0.00 179.25 179.65 3cno h LYS 167 N 0.67 0.25 0.00 0.00 1.57 -0.83 -0.71 116.57 117.53 3cno h LYS 167 Ca 0.16 -0.16 -0.15 0.00 -1.87 0.00 0.00 60.65 58.63 3cno h LYS 167 Cb 0.28 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 3cno h LYS 167 CO -0.00 0.75 -0.70 -0.07 -0.57 0.00 0.00 179.45 178.86 3cno h LEU 168 N 0.19 0.00 -0.15 2.94 3.38 -0.66 -2.91 115.31 118.12 3cno h LEU 168 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3cno h LEU 168 Cb 1.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 3cno h LEU 168 CO 0.09 0.70 0.03 0.25 0.09 0.00 0.00 178.44 179.60 3cno h LEU 169 N 0.00 0.22 -1.76 1.67 5.85 -0.77 0.12 115.31 120.64 3cno h LEU 169 Ca -0.01 -0.23 0.01 0.00 0.84 0.00 0.00 57.88 58.49 3cno h LEU 169 Cb 1.24 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 3cno h LEU 169 CO 0.09 0.40 0.17 -0.07 -0.34 0.00 0.00 178.44 178.68 3cno h LEU 170 N 0.04 0.28 -2.04 2.25 3.38 -1.08 -1.96 115.31 116.17 3cno h LEU 170 Ca 0.05 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3cno h LEU 170 Cb 0.26 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3cno h LEU 170 CO 0.00 0.20 0.00 1.33 0.09 0.00 0.00 178.44 180.06 3cno n VAL 171 N -4.50 0.14 -0.88 1.22 0.24 -1.10 -2.73 118.33 110.72 3cno n VAL 171 Ca 0.01 -0.57 0.00 0.00 -2.04 0.00 0.00 64.34 61.74 3cno n VAL 171 Cb 0.08 1.35 0.00 0.00 -1.47 0.00 0.00 33.84 33.80 3cno n VAL 171 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3cno n GLY 172 N 1.40 0.54 0.22 7.63 0.00 -0.74 -4.88 105.19 109.36 3cno n GLY 172 Ca 0.16 -0.16 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 3cno n GLY 172 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3cno h SER 173 N 0.00 0.87 -3.57 1.61 0.87 -1.17 -3.40 113.55 108.75 3cno h SER 173 Ca 0.00 -0.54 -0.71 0.00 -1.23 0.00 0.00 61.79 59.31 3cno h SER 173 Cb 0.00 -0.25 -0.26 0.00 -0.44 0.00 0.00 62.40 61.44 3cno h SER 173 CO 0.00 1.33 -0.52 -0.22 -0.53 0.00 0.00 176.83 176.89 3cno s LEU 174 N -8.40 4.75 0.58 2.23 2.96 -0.50 -4.73 118.68 115.57 3cno s LEU 174 Ca -0.09 -1.14 -0.18 0.00 -0.22 0.00 0.00 54.13 52.49 3cno s LEU 174 Cb 0.09 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 3cno s LEU 174 CO 0.89 -0.41 1.13 -2.16 -1.32 0.00 0.00 176.35 174.47 3cno s PRO 175 N 1.50 3.16 0.54 0.98 0.04 -1.26 -4.17 135.00 135.79 3cno s PRO 175 Ca 0.01 1.55 0.26 0.00 0.04 0.00 0.00 61.00 62.86 3cno s PRO 175 Cb -0.20 -1.98 1.56 0.00 0.04 0.00 0.00 34.50 33.91 3cno s PRO 175 CO 0.05 -0.99 2.15 -0.39 0.04 0.00 0.00 177.00 177.86 3cno h VAL 176 N 0.81 0.64 0.00 -0.36 -1.51 -1.93 -2.13 116.25 111.77 3cno h VAL 176 Ca -0.49 -0.27 -0.04 0.00 -1.23 0.00 0.00 66.70 64.67 3cno h VAL 176 Cb 1.26 1.17 -0.01 0.00 -2.13 0.00 0.00 31.29 31.58 3cno h VAL 176 CO 0.56 0.07 -0.18 -0.33 -1.23 0.00 0.00 177.57 176.45 3cno h GLU 177 N 0.00 0.00 0.00 5.19 3.07 -1.98 -2.87 114.58 117.99 3cno h GLU 177 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3cno h GLU 177 Cb 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 3cno h GLU 177 CO 0.01 0.18 -0.09 0.54 -1.40 0.00 0.00 179.01 178.25 3cno n ARG 178 N -3.87 0.08 -2.85 2.33 1.74 -0.80 -4.83 116.66 108.46 3cno n ARG 178 Ca -0.02 0.06 -0.42 0.00 -0.77 0.00 0.00 57.85 56.70 3cno n ARG 178 Cb 0.28 -1.59 -0.04 0.00 -1.02 0.00 0.00 32.46 30.09 3cno n ARG 178 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3cno s ILE 179 N -3.04 4.70 -0.09 0.55 -1.09 -1.09 -4.88 121.20 116.27 3cno s ILE 179 Ca 0.12 1.34 0.14 0.00 -2.23 0.00 0.00 60.65 60.02 3cno s ILE 179 Cb 0.17 -4.23 -0.21 0.00 -1.58 0.00 0.00 42.46 36.61 3cno s ILE 179 CO 0.58 -0.33 0.17 -0.62 -1.23 0.00 0.00 174.94 173.51 3cno n GLU 180 N 6.42 1.16 -3.63 2.79 -0.58 -1.26 -4.96 120.64 120.57 3cno n GLU 180 Ca 0.06 -0.06 -0.37 0.00 -0.42 0.00 0.00 57.16 56.37 3cno n GLU 180 Cb 0.48 -1.37 -0.10 0.00 -0.57 0.00 0.00 31.44 29.87 3cno n GLU 180 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3cno s ASP 181 N -4.40 6.02 0.48 1.62 -1.08 -1.26 -4.98 116.67 113.07 3cno s ASP 181 Ca -0.07 0.03 0.31 0.00 -0.52 0.00 0.00 52.55 52.31 3cno s ASP 181 Cb 0.07 -2.10 1.21 0.00 -1.46 0.00 0.00 42.92 40.64 3cno s ASP 181 CO 0.62 0.00 1.90 0.06 0.52 0.00 0.00 175.17 178.27 3cno h GLN 182 N 7.97 0.00 -0.11 4.34 3.07 -2.01 -2.79 115.11 125.58 3cno h GLN 182 Ca -0.36 0.00 -0.05 0.00 0.09 0.00 0.00 58.65 58.32 3cno h GLN 182 Cb 1.18 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.73 3cno h GLN 182 CO 0.60 0.00 -0.17 0.00 0.09 0.00 0.00 178.83 179.35 3cno h ARG 183 N 0.00 0.17 -0.41 0.06 3.08 -1.99 -2.24 114.38 113.05 3cno h ARG 183 Ca 0.00 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 59.90 3cno h ARG 183 Cb 0.52 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 3cno h ARG 183 CO 0.00 0.35 -0.15 0.82 -1.07 0.00 0.00 179.97 179.92 3cno h ILE 184 N 0.16 1.28 -0.88 2.04 2.04 -1.82 -0.64 117.51 119.68 3cno h ILE 184 Ca 0.03 -1.27 0.07 0.00 1.00 0.00 0.00 64.86 64.69 3cno h ILE 184 Cb 0.40 1.24 -0.06 0.00 -0.74 0.00 0.00 36.82 37.67 3cno h ILE 184 CO 0.03 0.43 0.57 -0.26 0.00 0.00 0.00 178.15 178.92 3cno h PHE 185 N 0.64 0.99 -0.20 1.37 0.04 -1.61 -0.67 116.94 117.50 3cno h PHE 185 Ca 0.10 0.03 -0.15 0.00 2.80 0.00 0.00 57.97 60.75 3cno h PHE 185 Cb 0.70 -0.32 0.00 0.00 2.20 0.00 0.00 35.95 38.53 3cno h PHE 185 CO 0.05 0.50 -0.45 0.93 -0.60 0.00 0.00 178.31 178.74 3cno h GLU 186 N 0.96 0.65 -0.54 1.51 5.08 -1.02 -1.45 114.58 119.77 3cno h GLU 186 Ca 0.39 -0.44 -0.06 0.00 -1.00 0.00 0.00 59.36 58.25 3cno h GLU 186 Cb 0.27 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 3cno h GLU 186 CO -0.15 1.06 0.10 -0.09 -1.00 0.00 0.00 179.01 178.92 3cno h ARG 187 N 0.34 0.89 -0.50 2.33 1.12 -1.02 -0.28 114.38 117.25 3cno h ARG 187 Ca -0.00 -0.23 -0.01 0.00 -1.11 0.00 0.00 59.98 58.63 3cno h ARG 187 Cb 1.06 -0.11 -0.02 0.00 -0.01 0.00 0.00 29.97 30.89 3cno h ARG 187 CO 0.10 0.86 0.28 0.00 -3.11 0.00 0.00 179.97 178.10 3cno h ALA 188 N 0.99 0.64 -0.33 2.80 0.00 -1.05 -0.53 119.26 121.78 3cno h ALA 188 Ca 0.16 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3cno h ALA 188 Cb 0.39 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3cno h ALA 188 CO 0.01 0.16 0.10 0.35 0.00 0.00 0.00 179.25 179.86 3cno h PHE 189 N 0.67 0.54 -0.88 0.00 3.57 -1.12 -0.67 116.94 119.04 3cno h PHE 189 Ca 0.18 -0.06 0.06 0.00 3.53 0.00 0.00 57.97 61.68 3cno h PHE 189 Cb 0.04 -0.16 -0.06 0.00 2.79 0.00 0.00 35.95 38.56 3cno h PHE 189 CO -0.02 0.55 0.55 1.49 -2.23 0.00 0.00 178.31 178.65 3cno h GLU 190 N 0.38 0.98 0.00 1.11 4.81 -0.76 0.81 114.58 121.93 3cno h GLU 190 Ca 0.11 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.28 3cno h GLU 190 Cb 0.26 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.42 3cno h GLU 190 CO -0.00 0.65 -0.00 0.82 -0.73 0.00 0.00 179.01 179.75 3cno h ILE 191 N 1.01 1.19 0.00 2.32 2.04 -1.01 -1.89 117.51 121.18 3cno h ILE 191 Ca 0.38 -0.56 0.03 0.00 1.00 0.00 0.00 64.86 65.71 3cno h ILE 191 Cb 0.15 1.57 -0.05 0.00 -0.74 0.00 0.00 36.82 37.76 3cno h ILE 191 CO -0.17 0.15 -0.30 0.15 0.00 0.00 0.00 178.15 177.98 3cno h PHE 192 N -0.24 -0.81 -0.79 1.37 3.57 -0.42 -1.75 116.94 117.87 3cno h PHE 192 Ca -0.00 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.61 3cno h PHE 192 Cb 0.24 0.36 -0.07 0.00 2.79 0.00 0.00 35.95 39.27 3cno h PHE 192 CO 0.01 -0.39 0.45 0.00 -2.23 0.00 0.00 178.31 176.15 3cno h ALA 193 N 0.31 1.11 -0.52 2.41 0.00 0.62 -0.96 119.26 122.23 3cno h ALA 193 Ca 0.06 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3cno h ALA 193 Cb 0.53 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3cno h ALA 193 CO -0.25 0.11 -0.00 -0.09 0.00 0.00 0.00 179.25 179.02 3cno h ARG 194 N 0.79 0.93 -0.76 0.00 2.43 -1.16 0.21 114.38 116.82 3cno h ARG 194 Ca 0.37 -0.30 -0.05 0.00 -0.81 0.00 0.00 59.98 59.19 3cno h ARG 194 Cb 0.29 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.73 3cno h ARG 194 CO -0.22 0.95 0.28 0.77 -1.51 0.00 0.00 179.97 180.23 3cno h SER 195 N 0.80 1.06 0.37 -3.80 0.02 -0.61 -3.23 113.55 108.15 3cno h SER 195 Ca 0.15 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 3cno h SER 195 Cb 0.53 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.80 3cno h SER 195 CO 0.03 0.95 -1.53 0.00 -1.14 0.00 0.00 176.83 175.14 3cno n ILE 196 N -4.27 0.22 0.00 3.27 3.06 -0.43 -4.91 119.36 116.29 3cno n ILE 196 Ca 0.07 -0.47 0.00 0.00 -2.50 0.00 0.00 62.75 59.85 3cno n ILE 196 Cb 0.20 -0.04 0.00 0.00 0.54 0.00 0.00 39.64 40.34 3cno n ILE 196 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3cno n GLY 197 N 1.26 1.17 3.71 4.50 0.00 0.45 -5.08 105.19 111.20 3cno n GLY 197 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 3cno n GLY 197 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cno s ILE 198 N -2.00 4.47 -1.14 -0.61 1.01 0.43 -4.93 121.20 118.44 3cno s ILE 198 Ca 0.00 1.82 0.10 0.00 0.00 0.00 0.00 60.65 62.56 3cno s ILE 198 Cb 0.00 -4.16 0.06 0.00 0.01 0.00 0.00 42.46 38.36 3cno s ILE 198 CO 0.00 0.16 0.76 -0.62 0.00 0.00 0.00 174.94 175.24 3cno n GLU 199 N 3.72 0.87 -2.07 2.79 1.02 -1.26 -4.51 120.64 121.18 3cno n GLU 199 Ca 0.07 -0.95 -0.32 0.00 -0.02 0.00 0.00 57.16 55.94 3cno n GLU 199 Cb 0.49 -1.15 -0.01 0.00 -0.02 0.00 0.00 31.44 30.75 3cno n GLU 199 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3cno s SER 200 N -0.96 6.30 0.73 1.62 1.04 -1.26 -5.04 113.70 116.13 3cno s SER 200 Ca 0.11 1.52 -0.11 0.00 0.48 0.00 0.00 55.95 57.94 3cno s SER 200 Cb 0.08 -2.49 0.03 0.00 0.10 0.00 0.00 66.02 63.74 3cno s SER 200 CO 0.16 -0.81 1.09 -0.94 0.98 0.00 0.00 173.24 173.71 3cno s SER 201 N -3.61 5.19 0.17 7.02 1.04 -1.26 -4.85 113.70 117.40 3cno s SER 201 Ca 0.57 1.26 -0.17 0.00 0.48 0.00 0.00 55.95 58.10 3cno s SER 201 Cb -0.11 -2.07 0.11 0.00 0.10 0.00 0.00 66.02 64.06 3cno s SER 201 CO 0.44 -1.52 1.66 0.15 0.98 0.00 0.00 173.24 174.95 3cno h PHE 202 N -0.78 -0.25 0.30 5.02 3.57 -1.98 -1.49 116.94 121.34 3cno h PHE 202 Ca -0.45 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.07 3cno h PHE 202 Cb 1.25 0.18 0.00 0.00 2.79 0.00 0.00 35.95 40.17 3cno h PHE 202 CO 0.51 -0.19 -0.14 0.77 -2.23 0.00 0.00 178.31 177.03 3cno h SER 203 N -0.01 -0.34 -0.28 0.41 0.02 -1.99 -1.82 113.55 109.53 3cno h SER 203 Ca 0.21 -0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.19 3cno h SER 203 Cb 0.32 0.09 -0.05 0.00 0.14 0.00 0.00 62.40 62.90 3cno h SER 203 CO -0.45 -0.21 -0.02 -0.33 -1.14 0.00 0.00 176.83 174.68 3cno h GLU 204 N -0.44 0.05 -0.13 3.45 5.08 -1.91 -0.84 114.58 119.84 3cno h GLU 204 Ca -0.04 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3cno h GLU 204 Cb 0.33 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 3cno h GLU 204 CO 0.07 0.03 0.07 0.35 -1.00 0.00 0.00 179.01 178.53 3cno h PHE 205 N 0.05 0.18 -0.00 4.33 3.57 -1.22 -1.90 116.94 121.95 3cno h PHE 205 Ca 0.14 -0.01 -0.19 0.00 3.53 0.00 0.00 57.97 61.44 3cno h PHE 205 Cb 0.19 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 3cno h PHE 205 CO -0.24 0.21 -0.85 0.74 -2.23 0.00 0.00 178.31 175.94 3cno h PHE 206 N 0.11 0.21 -0.33 0.41 0.04 -1.18 -0.69 116.94 115.51 3cno h PHE 206 Ca 0.05 -0.12 0.02 0.00 2.80 0.00 0.00 57.97 60.72 3cno h PHE 206 Cb 0.09 -0.02 -0.03 0.00 2.20 0.00 0.00 35.95 38.18 3cno h PHE 206 CO -0.04 0.92 0.17 1.49 -0.60 0.00 0.00 178.31 180.25 3cno h GLU 207 N 0.08 0.34 -0.36 1.51 4.81 -1.15 -0.81 114.58 118.99 3cno h GLU 207 Ca -0.03 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 3cno h GLU 207 Cb 1.47 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.75 3cno h GLU 207 CO 0.12 0.23 0.23 0.22 -0.73 0.00 0.00 179.01 179.08 3cno h ASP 208 N 0.35 0.43 -0.48 1.04 3.58 -1.15 -0.84 116.42 119.35 3cno h ASP 208 Ca 0.14 -0.03 0.01 0.00 0.42 0.00 0.00 57.03 57.56 3cno h ASP 208 Cb 0.04 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 40.96 3cno h ASP 208 CO -0.09 0.33 0.31 0.15 -2.88 0.00 0.00 179.24 177.07 3cno h PHE 209 N 0.48 0.59 -0.67 0.28 3.57 -0.94 0.22 116.94 120.48 3cno h PHE 209 Ca 0.13 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.66 3cno h PHE 209 Cb -0.03 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.48 3cno h PHE 209 CO -0.04 0.37 0.44 0.00 -2.23 0.00 0.00 178.31 176.84 3cno h ALA 210 N 1.19 0.86 0.82 2.41 0.00 -1.00 -2.08 119.26 121.46 3cno h ALA 210 Ca 0.18 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 3cno h ALA 210 Cb -0.05 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.48 3cno h ALA 210 CO -0.05 0.26 -0.40 0.00 0.00 0.00 0.00 179.25 179.07 3cno h ARG 211 N 0.90 -1.07 -1.02 0.00 3.08 -0.64 0.47 114.38 116.10 3cno h ARG 211 Ca 0.25 0.07 0.26 0.00 0.07 0.00 0.00 59.98 60.64 3cno h ARG 211 Cb -0.09 0.24 -0.08 0.00 0.08 0.00 0.00 29.97 30.13 3cno h ARG 211 CO -0.06 -0.70 0.68 0.87 -1.07 0.00 0.00 179.97 179.69 3cno h LYS 212 N -1.23 0.30 -0.61 0.04 1.57 -0.52 0.79 116.57 116.92 3cno h LYS 212 Ca -0.11 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 3cno h LYS 212 Cb 0.86 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.10 3cno h LYS 212 CO 0.19 0.20 0.00 0.54 -0.57 0.00 0.00 179.45 179.80 3cno n ARG 213 N -4.51 3.61 -2.77 3.15 5.12 -0.79 -4.94 116.66 115.54 3cno n ARG 213 Ca 0.23 -2.83 -0.19 0.00 -1.93 0.00 0.00 57.85 53.13 3cno n ARG 213 Cb 0.90 -1.84 0.00 0.00 -1.16 0.00 0.00 32.46 30.36 3cno n ARG 213 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3cno n GLY 214 N 0.99 -0.50 3.45 -0.13 0.00 0.27 -4.91 105.19 104.35 3cno n GLY 214 Ca 0.25 0.05 -0.44 0.00 0.00 0.00 0.00 46.02 45.88 3cno n GLY 214 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cno s LEU 215 N -6.18 5.13 0.10 0.99 1.43 0.16 -4.97 118.68 115.34 3cno s LEU 215 Ca 0.16 -2.34 0.08 0.00 -1.03 0.00 0.00 54.13 51.00 3cno s LEU 215 Cb -0.08 -2.39 -0.04 0.00 0.03 0.00 0.00 46.19 43.72 3cno s LEU 215 CO 0.20 -0.95 -0.21 -0.76 0.23 0.00 0.00 176.35 174.85 3cno s LEU 216 N 2.25 2.30 0.53 1.79 1.43 -1.26 -0.19 118.68 125.53 3cno s LEU 216 Ca 0.35 -0.69 0.06 0.00 -1.03 0.00 0.00 54.13 52.82 3cno s LEU 216 Cb -0.04 -0.90 0.04 0.00 0.03 0.00 0.00 46.19 45.31 3cno s LEU 216 CO -0.07 0.06 0.46 -1.59 0.23 0.00 0.00 176.35 175.44 3cno s LYS 217 N -1.91 2.29 0.17 1.70 -2.85 0.04 -4.81 119.74 114.37 3cno s LYS 217 Ca 0.07 -1.91 -0.32 0.00 -1.00 0.00 0.00 55.97 52.81 3cno s LYS 217 Cb -0.10 -2.21 -0.16 0.00 -2.06 0.00 0.00 37.83 33.30 3cno s LYS 217 CO 0.04 -0.61 1.05 1.63 0.10 0.00 0.00 175.35 177.57 3cno n LYS 218 N -1.81 0.92 -0.70 1.78 5.02 -1.26 -1.75 118.16 120.35 3cno n LYS 218 Ca 0.02 0.33 0.00 0.00 -2.02 0.00 0.00 58.31 56.63 3cno n LYS 218 Cb 0.64 -1.75 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 3cno n LYS 218 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3cno n GLY 219 N 1.88 0.63 2.81 0.72 0.00 -1.26 -3.97 105.19 106.00 3cno n GLY 219 Ca 0.15 -0.17 -0.21 0.00 0.00 0.00 0.00 46.02 45.79 3cno n GLY 219 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cno n GLY 220 N -2.70 -0.44 3.68 -0.02 0.00 -0.72 -4.98 105.19 100.01 3cno n GLY 220 Ca 0.00 0.04 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 3cno n GLY 220 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cno s VAL 221 N -3.10 5.06 0.03 1.61 0.11 -1.10 -4.88 120.40 118.13 3cno s VAL 221 Ca 0.22 1.14 -0.36 0.00 -2.93 0.00 0.00 61.98 60.06 3cno s VAL 221 Cb -0.10 -3.92 -0.15 0.00 -1.53 0.00 0.00 36.38 30.68 3cno s VAL 221 CO 0.27 0.17 1.55 -2.65 -3.33 0.00 0.00 175.10 171.11 3cno n PRO 222 N 4.62 1.59 -2.76 1.54 -0.02 -1.26 -0.78 135.00 137.93 3cno n PRO 222 Ca -0.03 0.58 -0.43 0.00 -2.02 0.00 0.00 63.50 61.60 3cno n PRO 222 Cb 0.50 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.66 3cno n PRO 222 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3cno s ASP 223 N 1.56 6.47 0.29 2.55 -1.08 0.73 -4.80 116.67 122.38 3cno s ASP 223 Ca 0.86 -1.53 0.05 0.00 -0.52 0.00 0.00 52.55 51.41 3cno s ASP 223 Cb -0.85 -2.47 0.43 0.00 -1.46 0.00 0.00 42.92 38.56 3cno s ASP 223 CO 0.48 -1.34 1.70 0.40 0.52 0.00 0.00 175.17 176.92 3cno h ILE 224 N 6.19 1.30 -0.02 4.11 1.08 -1.90 -2.04 117.51 126.23 3cno h ILE 224 Ca 0.06 -1.47 -0.01 0.00 -0.39 0.00 0.00 64.86 63.05 3cno h ILE 224 Cb 1.03 1.61 -0.00 0.00 -3.07 0.00 0.00 36.82 36.39 3cno h ILE 224 CO 1.24 0.45 -0.01 -0.08 -0.69 0.00 0.00 178.15 179.06 3cno h GLU 225 N 0.27 0.05 -0.52 2.37 4.81 -1.98 -1.31 114.58 118.26 3cno h GLU 225 Ca 0.03 -0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.32 3cno h GLU 225 Cb 0.79 -0.00 -0.07 0.00 0.63 0.00 0.00 28.75 30.10 3cno h GLU 225 CO 0.06 0.45 0.14 0.00 -0.73 0.00 0.00 179.01 178.93 3cno h ARG 226 N -0.36 0.28 -0.36 1.92 3.08 -1.97 -1.98 114.38 115.00 3cno h ARG 226 Ca 0.00 -0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.11 3cno h ARG 226 Cb 0.43 -0.06 -0.09 0.00 0.08 0.00 0.00 29.97 30.33 3cno h ARG 226 CO 0.00 0.19 -0.40 0.00 -1.07 0.00 0.00 179.97 178.69 3cno h ALA 227 N 1.39 -0.38 -0.63 0.04 0.00 -1.23 0.15 119.26 118.60 3cno h ALA 227 Ca 0.26 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.25 3cno h ALA 227 Cb 0.33 0.82 -0.04 0.00 0.00 0.00 0.00 17.79 18.91 3cno h ALA 227 CO -0.31 -0.83 0.40 -0.07 0.00 0.00 0.00 179.25 178.44 3cno h LEU 228 N -0.33 0.67 -0.26 0.00 3.38 -1.01 0.14 115.31 117.91 3cno h LEU 228 Ca 0.14 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 3cno h LEU 228 Cb 0.58 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3cno h LEU 228 CO -0.54 0.48 0.13 -0.03 0.09 0.00 0.00 178.44 178.57 3cno h MET 229 N 0.80 0.37 0.02 1.13 4.05 -0.75 -1.93 114.93 118.62 3cno h MET 229 Ca 0.24 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.61 3cno h MET 229 Cb -0.03 -0.07 0.00 0.00 -0.80 0.00 0.00 31.60 30.70 3cno h MET 229 CO -0.08 0.35 -0.01 1.25 0.23 0.00 0.00 176.91 178.65 3cno h LEU 230 N 0.30 -0.02 -0.48 3.39 5.85 -0.41 -2.83 115.31 121.12 3cno h LEU 230 Ca 0.09 -0.48 0.09 0.00 0.84 0.00 0.00 57.88 58.42 3cno h LEU 230 Cb 0.10 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.05 3cno h LEU 230 CO -0.01 0.47 -0.03 0.15 -0.34 0.00 0.00 178.44 178.68 3cno h PHE 231 N -0.52 -0.09 -0.11 1.25 3.57 -0.72 -0.16 116.94 120.17 3cno h PHE 231 Ca -0.00 0.04 -0.20 0.00 3.53 0.00 0.00 57.97 61.33 3cno h PHE 231 Cb 0.50 0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.35 3cno h PHE 231 CO 0.10 -0.13 -0.76 0.74 -2.23 0.00 0.00 178.31 176.02 3cno h PHE 232 N 0.08 0.77 -0.38 0.41 0.04 -1.42 0.78 116.94 117.22 3cno h PHE 232 Ca 0.24 -0.34 0.08 0.00 2.80 0.00 0.00 57.97 60.74 3cno h PHE 232 Cb 0.36 -0.12 -0.08 0.00 2.20 0.00 0.00 35.95 38.31 3cno h PHE 232 CO -0.33 1.13 -0.16 1.15 -0.60 0.00 0.00 178.31 179.50 3cno h THR 233 N 0.38 0.48 -0.63 -1.55 2.02 -1.33 -1.82 112.91 110.48 3cno h THR 233 Ca -0.04 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.06 3cno h THR 233 Cb 1.36 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 68.23 3cno h THR 233 CO 0.14 0.00 0.10 -0.33 0.37 0.00 0.00 175.52 175.80 3cno h GLU 234 N -0.09 1.04 0.36 6.66 5.08 -0.54 -2.51 114.58 124.57 3cno h GLU 234 Ca 0.19 -0.28 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3cno h GLU 234 Cb 0.38 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 3cno h GLU 234 CO -0.44 0.97 -0.31 0.28 -1.00 0.00 0.00 179.01 178.51 3cno h VAL 235 N 0.95 0.36 -0.69 3.13 2.07 -0.71 0.14 116.25 121.49 3cno h VAL 235 Ca 0.19 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.88 3cno h VAL 235 Cb 0.43 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 3cno h VAL 235 CO 0.01 0.00 0.48 0.00 0.02 0.00 0.00 177.57 178.08 3cno h ALA 236 N -0.15 2.37 -0.00 1.67 0.00 -1.13 0.15 119.26 122.16 3cno h ALA 236 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3cno h ALA 236 Cb 0.60 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 3cno h ALA 236 CO -0.03 -0.56 -0.10 1.04 0.00 0.00 0.00 179.25 179.60 3cno n GLN 237 N -4.42 0.74 -1.07 0.00 6.02 -0.95 -4.74 117.38 112.97 3cno n GLN 237 Ca 0.13 -0.25 -0.02 0.00 -0.01 0.00 0.00 57.00 56.85 3cno n GLN 237 Cb 0.63 -1.49 -0.01 0.00 1.02 0.00 0.00 30.24 30.38 3cno n GLN 237 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3cno n GLY 238 N 1.26 0.57 0.02 1.08 0.00 0.53 -4.93 105.19 103.72 3cno n GLY 238 Ca 0.15 -0.70 0.14 0.00 0.00 0.00 0.00 46.02 45.61 3cno n GLY 238 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3cno n LYS 239 N -2.78 0.15 -0.34 1.61 5.02 0.43 -3.51 118.16 118.74 3cno n LYS 239 Ca -0.02 -0.04 0.11 0.00 -2.02 0.00 0.00 58.31 56.34 3cno n LYS 239 Cb 0.09 -1.50 0.30 0.00 -0.02 0.00 0.00 35.03 33.91 3cno n LYS 239 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3cno n ALA 240 N -1.39 2.39 0.00 7.82 0.00 -1.22 -4.94 120.51 123.16 3cno n ALA 240 Ca 0.09 -1.21 0.00 0.00 0.00 0.00 0.00 53.44 52.32 3cno n ALA 240 Cb 0.32 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.83 3cno n ALA 240 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cno n GLY 241 N 1.61 2.34 3.56 0.00 0.00 -1.23 -4.93 105.19 106.53 3cno n GLY 241 Ca 0.23 -2.05 -0.40 0.00 0.00 0.00 0.00 46.02 43.80 3cno n GLY 241 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3cno s ARG 242 N -2.31 2.90 -0.02 1.61 0.52 -1.26 -4.82 118.95 115.58 3cno s ARG 242 Ca 0.00 0.46 0.00 0.00 -0.52 0.00 0.00 55.73 55.68 3cno s ARG 242 Cb 0.00 -4.29 0.01 0.00 0.52 0.00 0.00 34.95 31.20 3cno s ARG 242 CO 0.00 -2.42 -0.01 0.08 0.02 0.00 0.00 175.30 172.97 3cno s VAL 243 N 7.75 0.14 0.16 3.52 1.01 -1.15 -4.24 120.40 127.59 3cno s VAL 243 Ca 0.59 0.02 0.07 0.00 0.00 0.00 0.00 61.98 62.67 3cno s VAL 243 Cb -0.12 -0.19 -0.04 0.00 0.00 0.00 0.00 36.38 36.03 3cno s VAL 243 CO 0.21 0.09 -0.02 -0.44 0.00 0.00 0.00 175.10 174.94 3cno s SER 244 N 0.55 4.69 -0.01 3.32 0.01 -1.26 -4.25 113.70 116.76 3cno s SER 244 Ca -0.05 -0.39 0.07 0.00 1.31 0.00 0.00 55.95 56.89 3cno s SER 244 Cb -0.08 -0.98 -0.10 0.00 0.21 0.00 0.00 66.02 65.07 3cno s SER 244 CO -0.01 0.11 0.20 0.49 0.41 0.00 0.00 173.24 174.44 3cno n PHE 245 N 0.07 0.00 -4.42 2.43 3.72 0.78 -4.74 117.46 115.30 3cno n PHE 245 Ca -0.10 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.08 3cno n PHE 245 Cb 0.54 -0.11 -0.13 0.00 -0.94 0.00 0.00 39.48 38.84 3cno n PHE 245 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 3cno s GLU 246 N -2.20 1.06 0.03 -1.08 2.02 -0.88 -5.00 118.70 112.66 3cno s GLU 246 Ca -0.01 -0.83 0.06 0.00 0.02 0.00 0.00 54.97 54.22 3cno s GLU 246 Cb 0.05 -1.11 -0.02 0.00 0.10 0.00 0.00 34.13 33.15 3cno s GLU 246 CO 0.29 0.28 -0.19 1.03 0.02 0.00 0.00 175.26 176.69 3cno s ARG 247 N -1.19 1.30 0.55 1.61 0.52 -1.26 -4.82 118.95 115.65 3cno s ARG 247 Ca 0.03 -0.84 0.33 0.00 -0.52 0.00 0.00 55.73 54.73 3cno s ARG 247 Cb -0.08 -1.36 1.33 0.00 0.52 0.00 0.00 34.95 35.36 3cno s ARG 247 CO 0.02 0.35 1.97 -1.00 0.02 0.00 0.00 175.30 176.66 3cno h PRO 248 N 5.04 0.00 -0.67 3.54 0.13 -1.91 -3.39 132.00 134.73 3cno h PRO 248 Ca -0.41 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 64.82 3cno h PRO 248 Cb 1.16 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.25 3cno h PRO 248 CO 0.45 0.00 0.44 1.05 -0.23 0.00 0.00 178.00 179.71 3cno h GLU 249 N 0.00 0.54 0.00 0.86 9.09 -1.98 -3.54 114.58 119.56 3cno h GLU 249 Ca -0.00 -0.03 0.00 0.00 0.05 0.00 0.00 59.36 59.38 3cno h GLU 249 Cb 0.53 -0.12 0.00 0.00 -1.65 0.00 0.00 28.75 27.51 3cno h GLU 249 CO 0.00 0.36 0.00 -0.40 0.05 0.00 0.00 179.01 179.02