#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r5g s PRO 12 N 0.00 1.42 -0.40 -0.24 0.04 -1.26 -5.01 135.00 129.54 2r5g s PRO 12 Ca 0.00 0.68 -0.25 0.00 0.04 0.00 0.00 61.00 61.46 2r5g s PRO 12 Cb 0.00 -1.84 0.02 0.00 0.04 0.00 0.00 34.50 32.72 2r5g s PRO 12 CO 0.00 -2.09 0.90 -1.21 0.04 0.00 0.00 177.00 174.64 2r5g s GLU 13 N -5.04 3.70 -0.11 4.56 2.02 -1.26 -4.83 118.70 117.74 2r5g s GLU 13 Ca 0.63 0.37 0.02 0.00 0.02 0.00 0.00 54.97 56.01 2r5g s GLU 13 Cb -0.17 -3.85 0.01 0.00 0.10 0.00 0.00 34.13 30.22 2r5g s GLU 13 CO 0.56 -1.04 -0.19 0.42 0.02 0.00 0.00 175.26 175.03 2r5g s ILE 14 N 3.53 1.76 -0.13 -1.63 1.01 -1.26 -0.42 121.20 124.05 2r5g s ILE 14 Ca 0.37 -0.81 0.00 0.00 0.00 0.00 0.00 60.65 60.21 2r5g s ILE 14 Cb -0.11 -1.57 0.02 0.00 0.01 0.00 0.00 42.46 40.81 2r5g s ILE 14 CO 0.21 0.49 -0.12 -0.70 0.00 0.00 0.00 174.94 174.82 2r5g s GLU 15 N 0.79 2.03 -0.21 2.79 2.12 -0.47 -1.25 118.70 124.51 2r5g s GLU 15 Ca -0.09 -0.46 -0.14 0.00 0.36 0.00 0.00 54.97 54.63 2r5g s GLU 15 Cb -0.16 -1.89 -0.04 0.00 0.26 0.00 0.00 34.13 32.30 2r5g s GLU 15 CO 0.01 -0.21 0.33 -1.17 -0.54 0.00 0.00 175.26 173.67 2r5g s LEU 16 N 1.45 4.15 -0.33 2.70 2.96 0.02 -1.00 118.68 128.63 2r5g s LEU 16 Ca 0.03 0.41 -0.12 0.00 -0.22 0.00 0.00 54.13 54.23 2r5g s LEU 16 Cb -0.13 -2.40 -0.01 0.00 0.50 0.00 0.00 46.19 44.15 2r5g s LEU 16 CO -0.08 -0.03 0.21 -0.36 -1.32 0.00 0.00 176.35 174.77 2r5g s PHE 17 N 1.18 3.21 0.37 5.38 0.40 0.79 -0.74 117.98 128.57 2r5g s PHE 17 Ca 0.16 -0.33 0.08 0.00 -0.60 0.00 0.00 56.93 56.24 2r5g s PHE 17 Cb -0.14 -2.43 -0.05 0.00 0.51 0.00 0.00 43.02 40.90 2r5g s PHE 17 CO 0.07 -0.39 0.08 0.14 0.70 0.00 0.00 175.22 175.82 2r5g s VAL 18 N 1.69 2.55 0.16 -0.44 -7.23 -0.04 -1.99 120.40 115.09 2r5g s VAL 18 Ca 0.06 -1.85 -0.30 0.00 -1.81 0.00 0.00 61.98 58.07 2r5g s VAL 18 Cb -0.17 -2.90 -0.08 0.00 0.56 0.00 0.00 36.38 33.79 2r5g s VAL 18 CO 0.09 -0.12 1.34 -0.54 -0.31 0.00 0.00 175.10 175.55 2r5g s LYS 19 N -3.79 4.36 0.47 4.82 1.02 -1.26 -0.14 119.74 125.22 2r5g s LYS 19 Ca 0.37 2.06 -0.19 0.00 0.02 0.00 0.00 55.97 58.23 2r5g s LYS 19 Cb 0.01 -3.22 -0.09 0.00 -0.52 0.00 0.00 37.83 34.01 2r5g s LYS 19 CO 0.21 -0.32 0.97 0.00 -0.92 0.00 0.00 175.35 175.28 2r5g s ALA 20 N 0.51 3.04 1.00 5.17 0.00 -0.16 -0.35 121.76 130.97 2r5g s ALA 20 Ca 0.60 0.32 0.00 0.00 0.00 0.00 0.00 51.96 52.87 2r5g s ALA 20 Cb -0.36 -3.14 0.00 0.00 0.00 0.00 0.00 23.12 19.61 2r5g s ALA 20 CO 0.35 -0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.46 2r5g n GLY 21 N -1.03 -1.10 0.30 0.00 0.00 0.97 -4.22 105.19 100.11 2r5g n GLY 21 Ca 0.07 -1.59 -0.03 0.00 0.00 0.00 0.00 46.02 44.47 2r5g n GLY 21 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2r5g h SER 22 N -0.03 0.75 0.16 1.61 4.64 -1.91 -1.43 113.55 117.34 2r5g h SER 22 Ca 0.00 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2r5g h SER 22 Cb 0.00 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 61.89 2r5g h SER 22 CO 0.00 0.76 0.00 -0.90 -0.87 0.00 0.00 176.83 175.82 2r5g n ASP 23 N -4.26 0.00 0.00 4.97 5.68 -1.26 -4.89 116.55 116.79 2r5g n ASP 23 Ca 0.03 -0.51 0.00 0.00 -0.50 0.00 0.00 54.79 53.81 2r5g n ASP 23 Cb 0.24 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.12 2r5g n ASP 23 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2r5g n GLY 24 N 0.61 0.59 0.82 6.12 0.00 -0.54 -4.77 105.19 108.02 2r5g n GLY 24 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2r5g n GLY 24 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2r5g n GLU 25 N -2.20 0.00 -0.90 1.61 1.02 -1.26 -4.35 120.64 114.55 2r5g n GLU 25 Ca 0.00 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.84 2r5g n GLU 25 Cb 0.05 -0.45 0.16 0.00 -0.02 0.00 0.00 31.44 31.18 2r5g n GLU 25 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2r5g s SER 26 N -4.24 2.95 0.10 1.62 0.01 -1.26 -4.68 113.70 108.20 2r5g s SER 26 Ca 0.00 1.81 -0.31 0.00 1.31 0.00 0.00 55.95 58.76 2r5g s SER 26 Cb 0.00 -2.40 -0.08 0.00 0.21 0.00 0.00 66.02 63.75 2r5g s SER 26 CO 0.00 -3.02 1.52 -0.63 0.41 0.00 0.00 173.24 171.52 2r5g s ILE 27 N -2.73 3.11 0.63 1.44 -1.09 -1.26 -0.02 121.20 121.27 2r5g s ILE 27 Ca 0.65 0.70 -0.01 0.00 -2.23 0.00 0.00 60.65 59.77 2r5g s ILE 27 Cb -0.21 -3.45 0.06 0.00 -1.58 0.00 0.00 42.46 37.29 2r5g s ILE 27 CO 0.59 0.03 0.88 -0.83 -1.23 0.00 0.00 174.94 174.37 2r5g s GLY 28 N 1.63 1.79 -0.48 6.18 0.00 0.53 -4.18 107.32 112.79 2r5g s GLY 28 Ca 0.69 -1.37 -0.28 0.00 0.00 0.00 0.00 44.72 43.75 2r5g s GLY 28 CO 0.30 -0.99 1.49 0.21 0.00 0.00 0.00 173.10 174.12 2r5g s ASN 29 N -4.53 6.12 -0.36 1.64 2.47 -1.26 -4.67 114.94 114.35 2r5g s ASN 29 Ca 0.60 0.63 0.06 0.00 0.42 0.00 0.00 52.86 54.58 2r5g s ASN 29 Cb -0.09 -2.54 0.18 0.00 -1.45 0.00 0.00 41.25 37.35 2r5g s ASN 29 CO 0.41 -1.64 0.54 0.00 -3.72 0.00 0.00 177.10 172.69 2r5g h PRO 31 N 7.42 0.00 -0.03 0.00 0.13 -1.92 -1.25 132.00 136.35 2r5g h PRO 31 Ca 0.01 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.99 2r5g h PRO 31 Cb 1.15 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 2r5g h PRO 31 CO 0.15 0.20 -0.68 0.35 -0.23 0.00 0.00 178.00 177.79 2r5g h PHE 32 N 0.00 0.22 -0.27 1.56 3.57 -1.95 -0.06 116.94 120.01 2r5g h PHE 32 Ca -0.00 -0.10 0.01 0.00 3.53 0.00 0.00 57.97 61.41 2r5g h PHE 32 Cb 0.36 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 2r5g h PHE 32 CO 0.00 0.80 0.17 0.00 -2.23 0.00 0.00 178.31 177.05 2r5g h GLN 34 N 0.36 1.01 -0.46 0.00 4.15 -1.08 -0.99 115.11 118.10 2r5g h GLN 34 Ca 0.10 -0.14 0.09 0.00 0.77 0.00 0.00 58.65 59.47 2r5g h GLN 34 Cb -0.03 -0.18 -0.10 0.00 0.21 0.00 0.00 27.48 27.38 2r5g h GLN 34 CO -0.03 0.79 -0.27 -0.09 -1.93 0.00 0.00 178.83 177.30 2r5g h ARG 35 N 0.98 -0.17 -0.33 1.69 2.43 -0.76 0.52 114.38 118.74 2r5g h ARG 35 Ca 0.24 0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 59.29 2r5g h ARG 35 Cb 0.11 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 2r5g h ARG 35 CO -0.03 -0.11 -0.32 -0.07 -1.51 0.00 0.00 179.97 177.92 2r5g h LEU 36 N -0.18 0.76 -0.18 3.80 3.38 -1.06 -1.44 115.31 120.39 2r5g h LEU 36 Ca 0.20 -0.31 0.04 0.00 0.09 0.00 0.00 57.88 57.90 2r5g h LEU 36 Cb 0.51 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2r5g h LEU 36 CO -0.56 1.02 -0.03 0.15 0.09 0.00 0.00 178.44 179.11 2r5g h PHE 37 N 0.62 -0.08 -0.67 1.13 -0.00 -0.74 -1.83 116.94 115.38 2r5g h PHE 37 Ca 0.07 0.02 -0.01 0.00 -0.00 0.00 0.00 57.97 58.04 2r5g h PHE 37 Cb 0.85 0.06 -0.03 0.00 -0.00 0.00 0.00 35.95 36.83 2r5g h PHE 37 CO 0.04 -0.07 0.37 0.52 -0.00 0.00 0.00 178.31 179.18 2r5g h MET 38 N 0.01 0.93 -0.19 1.11 2.86 -0.66 -1.88 114.93 117.11 2r5g h MET 38 Ca 0.09 -0.10 0.02 0.00 -2.06 0.00 0.00 59.70 57.64 2r5g h MET 38 Cb 0.13 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.58 2r5g h MET 38 CO -0.18 0.69 0.05 0.82 1.06 0.00 0.00 176.91 179.36 2r5g h ILE 39 N 0.91 0.94 -0.57 -1.22 2.04 -1.03 0.36 117.51 118.94 2r5g h ILE 39 Ca 0.24 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 66.04 2r5g h ILE 39 Cb 0.03 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 36.87 2r5g h ILE 39 CO -0.04 0.03 0.31 -0.07 0.00 0.00 0.00 178.15 178.38 2r5g h LEU 40 N 0.14 0.71 -0.27 1.44 3.38 -1.17 -0.83 115.31 118.70 2r5g h LEU 40 Ca 0.08 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 57.98 2r5g h LEU 40 Cb 0.06 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 2r5g h LEU 40 CO -0.10 0.60 0.13 -0.25 0.09 0.00 0.00 178.44 178.91 2r5g h TRP 41 N 0.77 0.24 0.00 1.13 2.91 -1.08 -2.86 115.95 117.06 2r5g h TRP 41 Ca 0.20 0.01 -0.05 0.00 1.13 0.00 0.00 58.89 60.18 2r5g h TRP 41 Cb 0.05 -0.07 -0.01 0.00 -0.51 0.00 0.00 29.16 28.62 2r5g h TRP 41 CO -0.01 0.13 -0.24 -0.07 -1.03 0.00 0.00 178.44 177.21 2r5g h LEU 42 N 0.28 0.00 -1.12 0.65 3.38 -0.58 -2.51 115.31 115.40 2r5g h LEU 42 Ca 0.11 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 2r5g h LEU 42 Cb 0.04 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2r5g h LEU 42 CO -0.08 0.24 -0.27 0.11 0.09 0.00 0.00 178.44 178.53 2r5g h LYS 43 N 0.00 0.00 0.00 1.13 1.79 -0.93 -3.45 116.57 115.11 2r5g h LYS 43 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2r5g h LYS 43 Cb 0.60 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.25 2r5g h LYS 43 CO 0.03 0.27 0.00 0.41 -1.08 0.00 0.00 179.45 179.08 2r5g n GLY 44 N 0.09 0.48 3.85 3.86 0.00 -0.95 -4.38 105.19 108.15 2r5g n GLY 44 Ca -0.00 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 2r5g n GLY 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r5g s VAL 45 N -2.00 4.65 0.23 1.61 0.11 -1.24 -5.04 120.40 118.72 2r5g s VAL 45 Ca 0.00 0.98 -0.30 0.00 -2.93 0.00 0.00 61.98 59.74 2r5g s VAL 45 Cb 0.00 -3.62 -0.09 0.00 -1.53 0.00 0.00 36.38 31.14 2r5g s VAL 45 CO 0.00 -0.25 1.27 -0.54 -3.33 0.00 0.00 175.10 172.25 2r5g s LYS 46 N -3.13 4.43 0.05 1.54 1.02 -1.26 -4.83 119.74 117.56 2r5g s LYS 46 Ca 0.55 2.03 -0.27 0.00 0.02 0.00 0.00 55.97 58.31 2r5g s LYS 46 Cb -0.10 -3.17 0.09 0.00 -0.52 0.00 0.00 37.83 34.12 2r5g s LYS 46 CO 0.19 -0.16 0.74 -0.59 -0.92 0.00 0.00 175.35 174.60 2r5g s PHE 47 N -0.31 -0.48 0.15 3.18 -0.12 -1.26 -4.39 117.98 114.74 2r5g s PHE 47 Ca 0.53 0.45 0.06 0.00 -0.05 0.00 0.00 56.93 57.92 2r5g s PHE 47 Cb -0.36 0.52 -0.04 0.00 -0.63 0.00 0.00 43.02 42.51 2r5g s PHE 47 CO 0.41 -0.67 0.02 -0.80 -0.05 0.00 0.00 175.22 174.13 2r5g s ASN 48 N -2.27 4.98 -0.13 1.98 -0.87 -0.38 -5.03 114.94 113.22 2r5g s ASN 48 Ca 0.00 -0.28 0.01 0.00 -1.57 0.00 0.00 52.86 51.02 2r5g s ASN 48 Cb -0.01 -1.15 0.02 0.00 -0.02 0.00 0.00 41.25 40.09 2r5g s ASN 48 CO -0.07 0.11 -0.17 -0.69 -2.57 0.00 0.00 177.10 173.72 2r5g s VAL 49 N -1.60 1.66 -0.05 1.60 1.01 -1.26 -0.80 120.40 120.96 2r5g s VAL 49 Ca 0.27 -0.72 0.05 0.00 0.00 0.00 0.00 61.98 61.59 2r5g s VAL 49 Cb -0.10 -1.51 -0.02 0.00 0.00 0.00 0.00 36.38 34.75 2r5g s VAL 49 CO 0.19 0.47 -0.21 -0.89 0.00 0.00 0.00 175.10 174.66 2r5g s THR 50 N 1.10 2.43 0.02 3.92 2.01 0.08 -4.97 115.64 120.22 2r5g s THR 50 Ca -0.03 -0.95 -0.09 0.00 0.31 0.00 0.00 61.69 60.94 2r5g s THR 50 Cb -0.14 -1.90 -0.05 0.00 0.01 0.00 0.00 72.50 70.41 2r5g s THR 50 CO -0.05 0.58 0.31 0.42 -0.69 0.00 0.00 174.62 175.19 2r5g s THR 51 N -0.42 5.22 -0.20 -0.82 -4.23 -1.26 -0.87 115.64 113.06 2r5g s THR 51 Ca 0.04 0.35 -0.01 0.00 -1.18 0.00 0.00 61.69 60.89 2r5g s THR 51 Cb -0.12 -3.60 0.00 0.00 1.34 0.00 0.00 72.50 70.13 2r5g s THR 51 CO 0.01 0.40 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.68 2r5g s VAL 52 N -1.27 2.75 -0.64 2.29 1.01 0.80 -4.80 120.40 120.54 2r5g s VAL 52 Ca 0.27 -0.71 -0.27 0.00 0.00 0.00 0.00 61.98 61.28 2r5g s VAL 52 Cb -0.14 -2.21 0.04 0.00 0.00 0.00 0.00 36.38 34.07 2r5g s VAL 52 CO 0.15 0.48 1.16 -0.62 0.00 0.00 0.00 175.10 176.27 2r5g s ASP 53 N 1.37 6.31 0.00 3.32 -1.08 -1.26 -0.99 116.67 124.34 2r5g s ASP 53 Ca 0.05 -0.24 0.27 0.00 -0.52 0.00 0.00 52.55 52.11 2r5g s ASP 53 Cb -0.14 -2.53 1.59 0.00 -1.46 0.00 0.00 42.92 40.39 2r5g s ASP 53 CO -0.08 -1.56 1.96 0.23 0.52 0.00 0.00 175.17 176.24 2r5g n MET 54 N 8.54 0.87 -0.00 4.34 2.81 -1.26 -1.62 117.12 130.80 2r5g n MET 54 Ca 0.05 0.00 0.14 0.00 -1.81 0.00 0.00 57.70 56.08 2r5g n MET 54 Cb 0.48 -1.48 0.53 0.00 -0.71 0.00 0.00 33.22 32.04 2r5g n MET 54 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2r5g n THR 55 N -0.98 0.01 -2.69 2.03 -2.24 -1.26 -4.25 114.28 104.89 2r5g n THR 55 Ca 0.20 -0.25 -0.16 0.00 -2.27 0.00 0.00 64.05 61.58 2r5g n THR 55 Cb 0.09 0.47 0.01 0.00 -2.10 0.00 0.00 70.33 68.81 2r5g n THR 55 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2r5g n ARG 56 N 0.15 1.83 -0.21 -0.78 1.74 -0.64 -4.97 116.66 113.77 2r5g n ARG 56 Ca 0.19 -3.68 -0.04 0.00 -0.77 0.00 0.00 57.85 53.55 2r5g n ARG 56 Cb 0.35 -1.61 0.07 0.00 -1.02 0.00 0.00 32.46 30.25 2r5g n ARG 56 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2r5g h LYS 57 N 2.89 0.71 -0.94 5.56 1.57 -1.74 0.15 116.57 124.77 2r5g h LYS 57 Ca 0.04 -0.04 0.12 0.00 -1.87 0.00 0.00 60.65 58.90 2r5g h LYS 57 Cb 1.05 -0.16 -0.08 0.00 0.08 0.00 0.00 32.23 33.12 2r5g h LYS 57 CO 0.61 0.47 0.56 -1.35 -0.57 0.00 0.00 179.45 179.17 2r5g h PRO 58 N 0.73 0.86 0.00 3.15 0.11 -1.93 0.28 132.00 135.20 2r5g h PRO 58 Ca 0.25 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.21 2r5g h PRO 58 Cb 0.05 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 30.95 2r5g h PRO 58 CO -0.12 0.57 -0.57 1.49 -0.21 0.00 0.00 178.00 179.17 2r5g h GLU 59 N 0.88 0.01 -0.26 1.05 4.57 -1.85 -3.40 114.58 115.58 2r5g h GLU 59 Ca 0.47 -0.02 -0.12 0.00 -1.18 0.00 0.00 59.36 58.52 2r5g h GLU 59 Cb 0.50 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.08 2r5g h GLU 59 CO -0.28 1.01 -0.33 0.93 -1.18 0.00 0.00 179.01 179.16 2r5g h GLU 60 N -0.98 0.57 -1.39 1.92 4.39 -0.57 -2.54 114.58 115.98 2r5g h GLU 60 Ca -0.15 -0.26 0.00 0.00 0.34 0.00 0.00 59.36 59.29 2r5g h GLU 60 Cb 1.15 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 2r5g h GLU 60 CO -0.08 0.83 0.00 1.28 -1.16 0.00 0.00 179.01 179.87 2r5g n LEU 61 N -4.07 3.78 0.00 1.33 7.99 0.99 -4.89 117.00 122.13 2r5g n LEU 61 Ca -0.01 -1.79 0.00 0.00 -0.01 0.00 0.00 56.01 54.20 2r5g n LEU 61 Cb 0.47 -0.72 0.00 0.00 -0.11 0.00 0.00 43.42 43.07 2r5g n LEU 61 CO 0.44 0.67 0.00 1.17 -1.51 0.00 0.00 177.39 178.16 2r5g n LYS 62 N 0.88 0.00 0.06 3.23 0.00 -0.96 -4.63 118.16 116.74 2r5g n LYS 62 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 2r5g n LYS 62 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.52 2r5g n LYS 62 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.40 177.00 2r5g n ASP 63 N 0.00 0.32 0.00 3.14 5.75 -1.26 -4.92 116.55 119.58 2r5g n ASP 63 Ca 0.00 0.19 0.00 0.00 -0.01 0.00 0.00 54.79 54.97 2r5g n ASP 63 Cb 0.00 0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.10 2r5g n ASP 63 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 2r5g n LEU 64 N -3.21 0.00 -1.62 -2.12 0.00 -1.26 -5.16 117.00 103.63 2r5g n LEU 64 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 56.01 56.01 2r5g n LEU 64 Cb 0.11 0.00 -0.00 0.00 0.00 0.00 0.00 43.42 43.52 2r5g n LEU 64 CO 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 177.39 177.33 2r5g n ALA 65 N -1.33 -3.06 -0.02 1.96 0.00 -1.26 -4.77 120.51 112.02 2r5g n ALA 65 Ca 0.00 0.17 0.24 0.00 0.00 0.00 0.00 53.44 53.85 2r5g n ALA 65 Cb 0.00 -0.33 0.71 0.00 0.00 0.00 0.00 19.45 19.83 2r5g n ALA 65 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2r5g h PRO 66 N 0.37 0.00 0.00 0.00 0.11 -2.01 0.12 132.00 130.59 2r5g h PRO 66 Ca -0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2r5g h PRO 66 Cb 0.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.19 2r5g h PRO 66 CO 0.00 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.20 2r5g n GLY 67 N -1.58 -0.71 3.61 -0.55 0.00 -1.26 -4.74 105.19 99.97 2r5g n GLY 67 Ca 0.12 -0.13 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2r5g n GLY 67 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2r5g s THR 68 N -2.00 4.40 -0.02 2.61 -1.32 0.43 -4.95 115.64 114.79 2r5g s THR 68 Ca 0.31 1.38 -0.08 0.00 -1.21 0.00 0.00 61.69 62.09 2r5g s THR 68 Cb 0.14 -4.48 0.01 0.00 -1.51 0.00 0.00 72.50 66.66 2r5g s THR 68 CO 0.24 -0.73 0.17 0.20 -2.21 0.00 0.00 174.62 172.29 2r5g s ASN 69 N 2.06 -0.05 0.43 8.08 -0.87 -1.26 -5.03 114.94 118.30 2r5g s ASN 69 Ca 0.45 -0.05 -0.26 0.00 -1.57 0.00 0.00 52.86 51.43 2r5g s ASN 69 Cb -0.10 0.26 -0.08 0.00 -0.02 0.00 0.00 41.25 41.30 2r5g s ASN 69 CO 0.23 -0.31 1.34 -2.16 -2.57 0.00 0.00 177.10 173.63 2r5g s PRO 70 N -1.05 3.84 0.22 -0.60 0.04 -1.26 -3.96 135.00 132.23 2r5g s PRO 70 Ca -0.11 2.24 -0.30 0.00 0.04 0.00 0.00 61.00 62.87 2r5g s PRO 70 Cb -0.06 -2.70 -0.08 0.00 0.04 0.00 0.00 34.50 31.70 2r5g s PRO 70 CO 0.02 -0.63 1.05 -1.25 0.04 0.00 0.00 177.00 176.23 2r5g s PRO 71 N -2.35 4.68 0.19 0.56 0.04 -1.26 -4.88 135.00 131.98 2r5g s PRO 71 Ca 0.59 1.68 -0.00 0.00 0.04 0.00 0.00 61.00 63.30 2r5g s PRO 71 Cb -0.40 -3.26 -0.04 0.00 0.04 0.00 0.00 34.50 30.84 2r5g s PRO 71 CO 0.51 0.23 0.09 -0.59 0.04 0.00 0.00 177.00 177.28 2r5g s PHE 72 N -0.75 1.15 -0.07 0.56 -0.12 -0.84 -4.44 117.98 113.47 2r5g s PHE 72 Ca 0.46 -1.26 -0.06 0.00 -0.05 0.00 0.00 56.93 56.01 2r5g s PHE 72 Cb -0.29 -0.61 0.02 0.00 -0.63 0.00 0.00 43.02 41.50 2r5g s PHE 72 CO 0.36 -0.50 0.18 -1.17 -0.05 0.00 0.00 175.22 174.04 2r5g s LEU 73 N -3.16 1.31 -0.22 -1.99 0.20 -0.66 -0.15 118.68 114.02 2r5g s LEU 73 Ca 0.33 0.34 -0.04 0.00 0.69 0.00 0.00 54.13 55.45 2r5g s LEU 73 Cb 0.07 0.63 -0.01 0.00 -0.43 0.00 0.00 46.19 46.44 2r5g s LEU 73 CO 0.08 -0.08 -0.02 -0.69 -0.29 0.00 0.00 176.35 175.36 2r5g s VAL 74 N 0.04 3.59 -0.25 1.68 1.01 -0.17 0.04 120.40 126.33 2r5g s VAL 74 Ca -0.01 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.57 2r5g s VAL 74 Cb -0.01 -2.63 0.05 0.00 0.00 0.00 0.00 36.38 33.79 2r5g s VAL 74 CO 0.00 0.42 -0.11 -0.47 0.00 0.00 0.00 175.10 174.94 2r5g s TYR 75 N 1.35 3.21 -1.33 5.22 5.04 -0.08 -1.37 117.35 129.40 2r5g s TYR 75 Ca 0.04 -2.21 -0.14 0.00 -2.44 0.00 0.00 57.07 52.32 2r5g s TYR 75 Cb -0.14 -1.94 0.01 0.00 0.35 0.00 0.00 41.96 40.23 2r5g s TYR 75 CO -0.01 -0.86 0.48 0.09 -1.34 0.00 0.00 175.55 173.90 2r5g n ASN 76 N 4.47 -2.16 0.00 4.32 3.02 0.44 -1.51 115.26 123.84 2r5g n ASN 76 Ca -0.15 -1.15 0.00 0.00 -0.03 0.00 0.00 54.58 53.25 2r5g n ASN 76 Cb 0.43 -2.42 0.00 0.00 -0.61 0.00 0.00 39.78 37.18 2r5g n ASN 76 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2r5g n LYS 77 N -4.58 0.00 -2.84 3.52 4.76 -1.26 -4.99 118.16 112.77 2r5g n LYS 77 Ca -0.21 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 54.82 2r5g n LYS 77 Cb 0.63 -2.18 -0.04 0.00 -1.84 0.00 0.00 35.03 31.61 2r5g n LYS 77 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2r5g s GLU 78 N 0.00 4.51 -0.02 1.97 2.02 -0.57 -5.03 118.70 121.59 2r5g s GLU 78 Ca 0.00 1.22 -0.27 0.00 0.02 0.00 0.00 54.97 55.94 2r5g s GLU 78 Cb 0.00 -3.45 -0.04 0.00 0.10 0.00 0.00 34.13 30.74 2r5g s GLU 78 CO 0.00 -0.01 0.84 -1.17 0.02 0.00 0.00 175.26 174.95 2r5g s LEU 79 N 0.93 4.36 -0.04 1.80 2.96 -1.26 -0.90 118.68 126.52 2r5g s LEU 79 Ca 0.46 1.46 0.04 0.00 -0.22 0.00 0.00 54.13 55.87 2r5g s LEU 79 Cb -0.20 -3.34 -0.00 0.00 0.50 0.00 0.00 46.19 43.15 2r5g s LEU 79 CO 0.24 -0.16 -0.16 -0.54 -1.32 0.00 0.00 176.35 174.41 2r5g s LYS 80 N 0.76 1.72 0.20 1.98 1.02 0.11 -5.00 119.74 120.53 2r5g s LYS 80 Ca 0.45 -0.58 0.00 0.00 0.02 0.00 0.00 55.97 55.86 2r5g s LYS 80 Cb -0.20 -1.50 -0.05 0.00 -0.52 0.00 0.00 37.83 35.57 2r5g s LYS 80 CO 0.24 0.22 0.07 0.99 -0.92 0.00 0.00 175.35 175.95 2r5g s THR 81 N 0.09 0.38 -0.20 2.17 2.01 -1.26 -1.66 115.64 117.17 2r5g s THR 81 Ca -0.04 -1.98 -0.01 0.00 0.31 0.00 0.00 61.69 59.97 2r5g s THR 81 Cb -0.12 -2.36 -0.01 0.00 0.01 0.00 0.00 72.50 70.03 2r5g s THR 81 CO 0.02 -0.21 0.18 -0.67 -0.69 0.00 0.00 174.62 173.25 2r5g n ASP 82 N -0.29 -3.12 0.00 3.53 2.03 -1.26 -4.13 116.55 113.31 2r5g n ASP 82 Ca -0.02 -0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.19 2r5g n ASP 82 Cb 0.65 -1.69 0.00 0.00 -0.72 0.00 0.00 41.12 39.35 2r5g n ASP 82 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2r5g n PHE 83 N -1.59 0.00 0.19 -0.67 3.72 -1.26 -1.60 117.46 116.25 2r5g n PHE 83 Ca -0.01 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.44 2r5g n PHE 83 Cb 0.52 0.00 0.51 0.00 -0.94 0.00 0.00 39.48 39.56 2r5g n PHE 83 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 2r5g h ILE 84 N 0.00 1.11 -0.43 4.37 6.09 -2.00 -0.07 117.51 126.57 2r5g h ILE 84 Ca 0.00 -0.47 0.02 0.00 -1.37 0.00 0.00 64.86 63.05 2r5g h ILE 84 Cb 0.00 1.16 -0.02 0.00 0.47 0.00 0.00 36.82 38.43 2r5g h ILE 84 CO 0.00 0.14 0.29 0.11 -3.07 0.00 0.00 178.15 175.62 2r5g h LYS 85 N 0.09 0.49 -0.19 2.19 1.57 -1.53 -0.43 116.57 118.75 2r5g h LYS 85 Ca 0.02 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.69 2r5g h LYS 85 Cb 0.22 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 2r5g h LYS 85 CO 0.01 0.33 -0.19 0.82 -0.57 0.00 0.00 179.45 179.85 2r5g h ILE 86 N 0.51 1.33 -0.37 1.86 2.04 -1.16 -1.89 117.51 119.83 2r5g h ILE 86 Ca 0.17 -1.34 0.01 0.00 1.00 0.00 0.00 64.86 64.70 2r5g h ILE 86 Cb 0.06 1.77 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 2r5g h ILE 86 CO -0.04 0.41 0.23 -0.08 0.00 0.00 0.00 178.15 178.67 2r5g h GLU 87 N 0.14 0.46 -0.51 2.37 4.81 -1.30 -1.39 114.58 119.16 2r5g h GLU 87 Ca 0.03 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 2r5g h GLU 87 Cb 0.73 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.97 2r5g h GLU 87 CO 0.05 0.31 0.33 0.93 -0.73 0.00 0.00 179.01 179.89 2r5g h GLU 88 N 0.48 0.65 -0.35 1.92 5.08 -1.08 -0.92 114.58 120.35 2r5g h GLU 88 Ca 0.14 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2r5g h GLU 88 Cb -0.03 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 2r5g h GLU 88 CO -0.05 0.43 0.23 0.35 -1.00 0.00 0.00 179.01 178.97 2r5g h PHE 89 N 0.67 0.45 -0.38 4.33 3.57 -1.08 -1.52 116.94 122.97 2r5g h PHE 89 Ca 0.19 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.67 2r5g h PHE 89 Cb -0.05 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.52 2r5g h PHE 89 CO -0.05 0.29 0.11 -0.07 -2.23 0.00 0.00 178.31 176.37 2r5g h LEU 90 N 0.47 0.56 -1.07 0.59 3.38 -0.97 0.27 115.31 118.54 2r5g h LEU 90 Ca 0.13 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 2r5g h LEU 90 Cb -0.04 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.53 2r5g h LEU 90 CO -0.03 0.63 0.27 -0.08 0.09 0.00 0.00 178.44 179.32 2r5g h GLU 91 N 0.47 0.93 0.03 1.13 4.57 -1.08 -1.22 114.58 119.41 2r5g h GLU 91 Ca 0.12 -0.14 -0.00 0.00 -1.18 0.00 0.00 59.36 58.16 2r5g h GLU 91 Cb 0.27 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 2r5g h GLU 91 CO -0.00 0.75 -0.02 0.37 -1.18 0.00 0.00 179.01 178.93 2r5g h GLN 92 N 0.92 -0.04 0.00 1.92 4.15 -1.08 -3.38 115.11 117.60 2r5g h GLN 92 Ca 0.22 0.00 -0.25 0.00 0.77 0.00 0.00 58.65 59.39 2r5g h GLN 92 Cb 0.16 0.01 0.02 0.00 0.21 0.00 0.00 27.48 27.88 2r5g h GLN 92 CO -0.02 0.50 -0.98 1.15 -1.93 0.00 0.00 178.83 177.55 2r5g h THR 93 N -0.61 1.30 -2.68 2.39 2.02 -0.91 -3.34 112.91 111.08 2r5g h THR 93 Ca -0.00 -2.22 -0.76 0.00 0.77 0.00 0.00 66.41 64.19 2r5g h THR 93 Cb 0.56 2.42 -0.22 0.00 -1.74 0.00 0.00 68.15 69.18 2r5g h THR 93 CO 0.01 0.68 1.03 0.18 0.37 0.00 0.00 175.52 177.79 2r5g n LEU 94 N -3.91 5.36 -4.53 2.58 4.77 -0.47 -4.99 117.00 115.81 2r5g n LEU 94 Ca -0.11 -4.68 -0.25 0.00 -0.03 0.00 0.00 56.01 50.93 2r5g n LEU 94 Cb 0.85 -1.56 -0.10 0.00 -2.33 0.00 0.00 43.42 40.27 2r5g n LEU 94 CO 0.55 0.97 -0.38 0.00 -1.33 0.00 0.00 177.39 177.20 2r5g s ALA 95 N 0.46 2.87 0.83 -1.18 0.00 -1.26 -4.65 121.76 118.83 2r5g s ALA 95 Ca 0.38 -2.07 -0.13 0.00 0.00 0.00 0.00 51.96 50.14 2r5g s ALA 95 Cb -0.05 0.01 0.09 0.00 0.00 0.00 0.00 23.12 23.17 2r5g s ALA 95 CO -0.03 0.04 1.17 -2.30 0.00 0.00 0.00 175.76 174.65 2r5g n PRO 96 N -0.77 0.04 0.24 0.00 -0.02 -0.45 -1.85 135.00 132.19 2r5g n PRO 96 Ca -0.05 0.09 0.13 0.00 -2.02 0.00 0.00 63.50 61.66 2r5g n PRO 96 Cb 0.64 -2.41 0.45 0.00 -0.02 0.00 0.00 33.50 32.16 2r5g n PRO 96 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2r5g h PRO 97 N -1.12 0.00 -0.14 0.52 0.13 -2.02 -3.45 132.00 125.93 2r5g h PRO 97 Ca -0.46 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.53 2r5g h PRO 97 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2r5g h PRO 97 CO 0.45 0.09 -0.48 0.00 -0.23 0.00 0.00 178.00 177.82 2r5g h ARG 98 N 0.00 0.57 -6.58 0.86 3.08 -1.97 -3.46 114.38 106.88 2r5g h ARG 98 Ca -0.00 -0.42 -0.65 0.00 0.07 0.00 0.00 59.98 58.97 2r5g h ARG 98 Cb 0.75 0.08 -0.17 0.00 0.08 0.00 0.00 29.97 30.71 2r5g h ARG 98 CO 0.01 1.05 -0.78 0.71 -1.07 0.00 0.00 179.97 179.89 2r5g s TYR 99 N -3.81 2.51 0.30 3.04 2.02 -0.77 -5.03 117.35 115.61 2r5g s TYR 99 Ca -0.13 -0.27 -0.29 0.00 -0.37 0.00 0.00 57.07 56.01 2r5g s TYR 99 Cb 0.06 -1.27 -0.10 0.00 -0.40 0.00 0.00 41.96 40.26 2r5g s TYR 99 CO 0.83 0.47 1.14 -1.25 -1.57 0.00 0.00 175.55 175.16 2r5g s PRO 100 N -2.56 4.55 -0.01 -1.71 0.04 -1.26 -1.34 135.00 132.70 2r5g s PRO 100 Ca 0.21 1.87 -0.30 0.00 0.04 0.00 0.00 61.00 62.82 2r5g s PRO 100 Cb -0.09 -3.12 -0.04 0.00 0.04 0.00 0.00 34.50 31.28 2r5g s PRO 100 CO 0.12 0.11 1.26 -1.58 0.04 0.00 0.00 177.00 176.94 2r5g s HIS 101 N -1.19 3.15 -0.46 0.56 5.65 -1.26 -4.79 115.29 116.95 2r5g s HIS 101 Ca 0.46 1.12 0.11 0.00 0.25 0.00 0.00 55.06 57.00 2r5g s HIS 101 Cb -0.33 -3.49 -0.12 0.00 -1.18 0.00 0.00 32.58 27.45 2r5g s HIS 101 CO 0.43 -1.64 0.44 1.28 -0.65 0.00 0.00 174.74 174.59 2r5g n LEU 102 N 4.95 0.46 -4.75 8.88 4.77 -1.26 -5.03 117.00 125.02 2r5g n LEU 102 Ca 0.11 -0.45 -0.41 0.00 -0.03 0.00 0.00 56.01 55.23 2r5g n LEU 102 Cb 0.45 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.53 2r5g n LEU 102 CO 0.56 0.11 1.19 -0.55 -1.33 0.00 0.00 177.39 177.37 2r5g s SER 103 N -2.15 6.47 0.65 -1.43 0.15 -1.26 -1.10 113.70 115.03 2r5g s SER 103 Ca 0.03 2.86 -0.14 0.00 0.70 0.00 0.00 55.95 59.41 2r5g s SER 103 Cb 0.08 -2.63 -0.01 0.00 -1.71 0.00 0.00 66.02 61.75 2r5g s SER 103 CO 0.45 -0.83 1.07 -2.16 1.20 0.00 0.00 173.24 172.96 2r5g s PRO 104 N -0.62 3.05 0.21 5.44 0.04 -1.26 -4.86 135.00 136.99 2r5g s PRO 104 Ca 0.61 1.15 0.02 0.00 0.04 0.00 0.00 61.00 62.81 2r5g s PRO 104 Cb -0.46 -2.00 0.16 0.00 0.04 0.00 0.00 34.50 32.24 2r5g s PRO 104 CO 0.48 -1.03 1.50 0.87 0.04 0.00 0.00 177.00 178.86 2r5g h LYS 105 N -0.10 0.32 -5.02 4.56 1.57 -1.93 -3.44 116.57 112.52 2r5g h LYS 105 Ca -0.46 -0.24 -0.66 0.00 -1.87 0.00 0.00 60.65 57.43 2r5g h LYS 105 Cb 1.22 0.04 -0.30 0.00 0.08 0.00 0.00 32.23 33.28 2r5g h LYS 105 CO 0.56 0.86 -0.76 0.71 -0.57 0.00 0.00 179.45 180.26 2r5g s TYR 106 N -3.69 2.91 0.45 -1.35 1.51 -1.26 -4.99 117.35 110.92 2r5g s TYR 106 Ca -0.05 -1.11 0.16 0.00 -1.01 0.00 0.00 57.07 55.06 2r5g s TYR 106 Cb 0.11 -2.05 1.08 0.00 -0.11 0.00 0.00 41.96 40.99 2r5g s TYR 106 CO 0.82 -0.61 1.98 -0.22 -1.11 0.00 0.00 175.55 176.41 2r5g h LYS 107 N 8.04 0.34 -0.34 -0.62 3.64 -2.03 -1.56 116.57 124.04 2r5g h LYS 107 Ca -0.42 -0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.03 2r5g h LYS 107 Cb 1.16 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.89 2r5g h LYS 107 CO 0.61 0.23 0.24 0.93 -2.27 0.00 0.00 179.45 179.19 2r5g h GLU 108 N 0.35 0.03 -0.01 1.90 3.07 -1.99 -0.31 114.58 117.62 2r5g h GLU 108 Ca 0.28 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.14 2r5g h GLU 108 Cb 0.63 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.54 2r5g h GLU 108 CO -0.07 0.02 0.01 0.77 -1.40 0.00 0.00 179.01 178.34 2r5g h SER 109 N 0.03 0.00 0.00 1.42 0.02 -1.62 -2.22 113.55 111.19 2r5g h SER 109 Ca 0.16 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 2r5g h SER 109 Cb 0.59 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.13 2r5g h SER 109 CO -0.01 0.00 -0.03 -0.26 -1.14 0.00 0.00 176.83 175.40 2r5g h PHE 110 N 0.00 0.03 -0.80 3.45 0.04 -1.22 -3.40 116.94 115.04 2r5g h PHE 110 Ca 0.01 -0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.77 2r5g h PHE 110 Cb 0.02 -0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.13 2r5g h PHE 110 CO -0.00 0.88 0.53 -0.44 -0.60 0.00 0.00 178.31 178.68 2r5g h ASP 111 N -0.84 0.91 -0.38 2.17 3.32 -1.03 -1.72 116.42 118.85 2r5g h ASP 111 Ca -0.00 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.03 2r5g h ASP 111 Cb 0.89 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.20 2r5g h ASP 111 CO 0.01 0.65 0.24 1.62 -1.72 0.00 0.00 179.24 180.04 2r5g h VAL 112 N 1.07 1.11 0.10 -1.35 3.04 -1.63 -3.05 116.25 115.53 2r5g h VAL 112 Ca 0.30 -0.22 -0.26 0.00 -1.01 0.00 0.00 66.70 65.51 2r5g h VAL 112 Cb -0.10 0.55 0.00 0.00 -2.01 0.00 0.00 31.29 29.74 2r5g h VAL 112 CO -0.07 0.11 -1.16 1.23 -1.01 0.00 0.00 177.57 176.67 2r5g h GLY 113 N 0.55 0.35 0.87 3.17 0.00 -1.52 -3.17 103.07 103.32 2r5g h GLY 113 Ca 0.14 -0.81 -0.08 0.00 0.00 0.00 0.00 47.33 46.59 2r5g h GLY 113 CO -0.03 0.71 -0.13 0.00 0.00 0.00 0.00 176.54 177.09 2r5g h ASN 115 N 0.28 1.09 -0.32 0.00 2.35 -1.67 -2.56 115.58 114.75 2r5g h ASN 115 Ca 0.06 -0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.60 2r5g h ASN 115 Cb 0.64 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 2r5g h ASN 115 CO 0.04 1.01 0.21 0.25 -1.65 0.00 0.00 177.43 177.29 2r5g h LEU 116 N 1.11 0.37 -1.12 1.61 5.85 -1.52 -2.12 115.31 119.49 2r5g h LEU 116 Ca 0.24 -0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.85 2r5g h LEU 116 Cb 0.32 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 2r5g h LEU 116 CO -0.01 0.27 -0.37 0.15 -0.34 0.00 0.00 178.44 178.15 2r5g h PHE 117 N 0.43 0.14 -0.32 1.25 3.57 -1.40 -1.95 116.94 118.66 2r5g h PHE 117 Ca 0.12 -0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.55 2r5g h PHE 117 Cb -0.04 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 2r5g h PHE 117 CO -0.05 0.48 0.06 0.00 -2.23 0.00 0.00 178.31 176.57 2r5g h ALA 118 N 1.52 0.43 -0.72 2.41 0.00 -1.14 -0.78 119.26 120.97 2r5g h ALA 118 Ca 0.01 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 2r5g h ALA 118 Cb 0.71 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 2r5g h ALA 118 CO 0.05 0.11 0.20 0.87 0.00 0.00 0.00 179.25 180.49 2r5g h LYS 119 N 0.36 1.14 -0.58 0.00 1.79 -1.18 -1.51 116.57 116.59 2r5g h LYS 119 Ca 0.10 -0.26 0.01 0.00 -2.18 0.00 0.00 60.65 58.32 2r5g h LYS 119 Cb 0.32 -0.16 -0.03 0.00 -1.58 0.00 0.00 32.23 30.79 2r5g h LYS 119 CO 0.00 0.99 0.38 0.35 -1.08 0.00 0.00 179.45 180.09 2r5g h PHE 120 N 1.08 0.73 -0.57 -1.35 3.57 -1.25 -1.85 116.94 117.29 2r5g h PHE 120 Ca 0.23 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 2r5g h PHE 120 Cb 0.34 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.80 2r5g h PHE 120 CO 0.03 0.46 0.31 0.77 -2.23 0.00 0.00 178.31 177.65 2r5g h SER 121 N 0.78 0.72 -0.74 0.41 0.02 -0.76 0.13 113.55 114.12 2r5g h SER 121 Ca 0.21 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2r5g h SER 121 Cb -0.09 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.23 2r5g h SER 121 CO -0.05 0.61 0.47 0.00 -1.14 0.00 0.00 176.83 176.72 2r5g h ALA 122 N 1.14 0.94 -0.19 3.77 0.00 -1.19 -2.02 119.26 121.71 2r5g h ALA 122 Ca 0.20 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2r5g h ALA 122 Cb 0.05 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2r5g h ALA 122 CO -0.03 0.39 0.06 -0.92 0.00 0.00 0.00 179.25 178.74 2r5g h TYR 123 N 1.00 0.31 0.00 0.00 3.20 -0.79 -1.46 116.97 119.24 2r5g h TYR 123 Ca 0.27 -0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.04 2r5g h TYR 123 Cb -0.07 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.10 2r5g h TYR 123 CO -0.02 0.40 -0.30 0.97 -1.64 0.00 0.00 178.16 177.57 2r5g h ILE 124 N 0.13 0.62 -0.00 1.81 6.09 -0.69 -3.03 117.51 122.44 2r5g h ILE 124 Ca 0.06 -1.49 0.00 0.00 -1.37 0.00 0.00 64.86 62.06 2r5g h ILE 124 Cb 0.24 2.01 0.00 0.00 0.47 0.00 0.00 36.82 39.54 2r5g h ILE 124 CO -0.00 0.30 -0.66 0.29 -3.07 0.00 0.00 178.15 175.01 2r5g n LYS 125 N -3.32 0.06 -1.68 2.19 5.02 -0.77 -3.89 118.16 115.76 2r5g n LYS 125 Ca 0.01 -0.04 -0.42 0.00 -2.02 0.00 0.00 58.31 55.84 2r5g n LYS 125 Cb 0.54 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 34.02 2r5g n LYS 125 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2r5g s ASN 126 N -2.97 6.08 0.00 4.39 3.04 -0.56 -4.88 114.94 120.05 2r5g s ASN 126 Ca 0.11 2.31 0.27 0.00 0.04 0.00 0.00 52.86 55.59 2r5g s ASN 126 Cb 0.17 -2.52 0.90 0.00 -1.54 0.00 0.00 41.25 38.26 2r5g s ASN 126 CO 0.75 -1.40 1.69 0.35 -3.04 0.00 0.00 177.10 175.45 2r5g n THR 127 N 6.41 0.00 -3.50 -5.21 -2.24 -1.26 -4.74 114.28 103.73 2r5g n THR 127 Ca 0.23 -0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.59 2r5g n THR 127 Cb 0.43 -0.12 -0.09 0.00 -2.10 0.00 0.00 70.33 68.45 2r5g n THR 127 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2r5g s GLN 128 N -2.95 2.76 0.49 -0.78 -1.52 -1.26 0.13 119.66 116.52 2r5g s GLN 128 Ca 0.14 -1.45 0.23 0.00 -1.95 0.00 0.00 55.36 52.33 2r5g s GLN 128 Cb 0.18 -3.95 1.28 0.00 -0.22 0.00 0.00 33.01 30.30 2r5g s GLN 128 CO 0.60 -1.01 1.95 -0.22 -0.25 0.00 0.00 175.29 176.36 2r5g h LYS 129 N 8.56 0.16 0.00 2.91 3.64 -1.44 0.14 116.57 130.55 2r5g h LYS 129 Ca -0.25 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.11 2r5g h LYS 129 Cb 1.09 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.88 2r5g h LYS 129 CO 0.82 0.10 -0.06 0.93 -2.27 0.00 0.00 179.45 178.97 2r5g h GLU 130 N 0.16 0.00 -0.01 1.90 5.08 -1.93 -1.96 114.58 117.83 2r5g h GLU 130 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 2r5g h GLU 130 Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.32 2r5g h GLU 130 CO -0.05 0.06 -0.08 0.00 -1.00 0.00 0.00 179.01 177.94 2r5g n ALA 131 N -2.17 2.74 -0.30 3.43 0.00 0.03 -4.49 120.51 119.76 2r5g n ALA 131 Ca -0.01 -0.39 0.04 0.00 0.00 0.00 0.00 53.44 53.07 2r5g n ALA 131 Cb 0.23 -1.21 0.18 0.00 0.00 0.00 0.00 19.45 18.66 2r5g n ALA 131 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2r5g h ASN 132 N 1.66 0.68 -0.53 0.00 -0.26 -1.37 -2.47 115.58 113.28 2r5g h ASN 132 Ca 0.00 0.06 0.06 0.00 -0.56 0.00 0.00 56.30 55.85 2r5g h ASN 132 Cb 0.44 -0.07 -0.05 0.00 -1.06 0.00 0.00 38.32 37.58 2r5g h ASN 132 CO 0.00 0.37 0.24 0.50 -1.06 0.00 0.00 177.43 177.48 2r5g h LYS 133 N 0.78 0.44 -0.25 0.81 1.63 -1.81 0.62 116.57 118.80 2r5g h LYS 133 Ca 0.42 -0.03 -0.07 0.00 -0.85 0.00 0.00 60.65 60.13 2r5g h LYS 133 Cb 0.43 -0.10 -0.01 0.00 -0.60 0.00 0.00 32.23 31.95 2r5g h LYS 133 CO -0.27 0.29 -0.10 -0.91 -3.45 0.00 0.00 179.45 175.02 2r5g h ASN 134 N 0.46 0.52 -0.71 4.20 2.35 -1.78 -0.50 115.58 120.12 2r5g h ASN 134 Ca 0.24 -0.39 -0.04 0.00 -0.55 0.00 0.00 56.30 55.57 2r5g h ASN 134 Cb 0.21 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.40 2r5g h ASN 134 CO -0.20 0.80 0.31 -0.26 -1.65 0.00 0.00 177.43 176.43 2r5g h PHE 135 N 0.25 1.07 -0.26 1.19 -1.00 -1.26 0.04 116.94 116.97 2r5g h PHE 135 Ca 0.06 -0.06 -0.04 0.00 2.81 0.00 0.00 57.97 60.74 2r5g h PHE 135 Cb 0.59 -0.33 -0.01 0.00 3.61 0.00 0.00 35.95 39.81 2r5g h PHE 135 CO 0.06 0.80 0.02 1.49 -1.61 0.00 0.00 178.31 179.07 2r5g h GLU 136 N 1.05 0.45 -0.84 1.51 4.81 -0.76 -1.14 114.58 119.66 2r5g h GLU 136 Ca 0.25 -0.13 0.04 0.00 -0.13 0.00 0.00 59.36 59.38 2r5g h GLU 136 Cb 0.16 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.44 2r5g h GLU 136 CO -0.03 0.59 0.54 0.87 -0.73 0.00 0.00 179.01 180.25 2r5g h LYS 137 N 0.24 1.00 -0.27 1.92 1.57 -0.89 0.17 116.57 120.31 2r5g h LYS 137 Ca 0.08 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2r5g h LYS 137 Cb 0.38 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 2r5g h LYS 137 CO 0.01 0.66 0.16 1.03 -0.57 0.00 0.00 179.45 180.74 2r5g h SER 138 N 1.03 0.25 -0.26 0.86 0.87 -0.75 0.19 113.55 115.74 2r5g h SER 138 Ca 0.34 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.90 2r5g h SER 138 Cb 0.04 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 2r5g h SER 138 CO -0.13 0.19 0.14 0.25 -0.53 0.00 0.00 176.83 176.75 2r5g h LEU 139 N 0.32 0.33 -0.98 2.23 5.85 -0.79 -2.32 115.31 119.96 2r5g h LEU 139 Ca 0.11 -0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.78 2r5g h LEU 139 Cb -0.00 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 40.88 2r5g h LEU 139 CO -0.05 0.34 0.64 -0.07 -0.34 0.00 0.00 178.44 178.95 2r5g h LEU 140 N 0.30 1.04 -0.63 2.25 3.38 -0.78 -0.55 115.31 120.31 2r5g h LEU 140 Ca 0.09 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 2r5g h LEU 140 Cb 0.08 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 2r5g h LEU 140 CO -0.01 0.69 0.23 0.50 0.09 0.00 0.00 178.44 179.93 2r5g h LYS 141 N 1.20 0.97 -0.28 1.13 1.63 -0.67 0.11 116.57 120.64 2r5g h LYS 141 Ca 0.41 -0.19 -0.14 0.00 -0.85 0.00 0.00 60.65 59.88 2r5g h LYS 141 Cb 0.08 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.56 2r5g h LYS 141 CO -0.15 0.83 -0.39 1.49 -3.45 0.00 0.00 179.45 177.79 2r5g h GLU 142 N 0.90 0.66 -0.85 1.90 4.57 -1.00 -1.40 114.58 119.36 2r5g h GLU 142 Ca 0.21 -0.33 0.00 0.00 -1.18 0.00 0.00 59.36 58.06 2r5g h GLU 142 Cb 0.25 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.80 2r5g h GLU 142 CO -0.01 0.94 0.53 0.74 -1.18 0.00 0.00 179.01 180.03 2r5g h PHE 143 N 0.55 1.09 -0.73 0.92 -1.00 -0.80 -1.38 116.94 115.58 2r5g h PHE 143 Ca 0.05 0.01 -0.04 0.00 2.81 0.00 0.00 57.97 60.80 2r5g h PHE 143 Cb 0.91 -0.36 -0.03 0.00 3.61 0.00 0.00 35.95 40.07 2r5g h PHE 143 CO 0.04 0.71 0.29 -0.22 -1.61 0.00 0.00 178.31 177.53 2r5g h LYS 144 N 1.16 1.09 -0.53 1.51 1.63 -0.59 0.22 116.57 121.06 2r5g h LYS 144 Ca 0.31 -0.19 0.02 0.00 -0.85 0.00 0.00 60.65 59.94 2r5g h LYS 144 Cb -0.09 -0.18 -0.03 0.00 -0.60 0.00 0.00 32.23 31.33 2r5g h LYS 144 CO -0.06 0.88 0.32 0.00 -3.45 0.00 0.00 179.45 177.14 2r5g h ARG 145 N 1.06 0.62 -0.30 1.90 3.08 -0.69 0.15 114.38 120.20 2r5g h ARG 145 Ca 0.25 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.22 2r5g h ARG 145 Cb 0.20 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 2r5g h ARG 145 CO -0.02 0.41 0.05 1.25 -1.07 0.00 0.00 179.97 180.59 2r5g h LEU 146 N 0.64 0.47 -0.40 3.04 5.85 -0.80 -0.41 115.31 123.70 2r5g h LEU 146 Ca 0.21 -0.26 0.08 0.00 0.84 0.00 0.00 57.88 58.75 2r5g h LEU 146 Cb 0.01 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 40.84 2r5g h LEU 146 CO -0.09 0.61 -0.07 -0.78 -0.34 0.00 0.00 178.44 177.77 2r5g h ASP 147 N 0.31 -0.31 -0.35 1.25 -0.00 -0.31 -0.11 116.42 116.91 2r5g h ASP 147 Ca 0.09 0.11 0.01 0.00 -0.00 0.00 0.00 57.03 57.24 2r5g h ASP 147 Cb 0.33 0.22 -0.02 0.00 -0.00 0.00 0.00 39.33 39.87 2r5g h ASP 147 CO 0.01 -0.11 0.22 0.44 -0.00 0.00 0.00 179.24 179.80 2r5g h ASP 148 N 0.03 0.38 -0.56 2.28 3.32 -0.49 -0.59 116.42 120.80 2r5g h ASP 148 Ca 0.19 -0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.30 2r5g h ASP 148 Cb 0.29 -0.09 -0.05 0.00 0.22 0.00 0.00 39.33 39.70 2r5g h ASP 148 CO -0.39 0.27 0.26 0.22 -1.72 0.00 0.00 179.24 177.89 2r5g h TYR 149 N 0.46 0.47 0.00 4.55 3.20 -0.51 -0.37 116.97 124.78 2r5g h TYR 149 Ca 0.13 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.95 2r5g h TYR 149 Cb -0.04 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 2r5g h TYR 149 CO -0.06 0.20 -0.38 -0.07 -1.64 0.00 0.00 178.16 176.21 2r5g h LEU 150 N 0.50 0.00 0.00 2.82 3.38 -0.73 -3.15 115.31 118.12 2r5g h LEU 150 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 2r5g h LEU 150 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2r5g h LEU 150 CO -0.20 0.38 -0.71 0.59 0.09 0.00 0.00 178.44 178.59 2r5g n ASN 151 N -3.54 0.62 -4.64 -0.43 3.02 -0.25 -4.62 115.26 105.42 2r5g n ASN 151 Ca -0.00 -0.09 -0.39 0.00 -0.03 0.00 0.00 54.58 54.07 2r5g n ASN 151 Cb 0.51 0.37 -0.08 0.00 -0.61 0.00 0.00 39.78 39.98 2r5g n ASN 151 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2r5g s THR 152 N -3.13 5.14 0.38 3.41 2.01 -0.18 -0.21 115.64 123.07 2r5g s THR 152 Ca 0.07 0.75 -0.28 0.00 0.31 0.00 0.00 61.69 62.54 2r5g s THR 152 Cb 0.15 -3.76 -0.10 0.00 0.01 0.00 0.00 72.50 68.79 2r5g s THR 152 CO 0.74 0.17 1.44 -2.84 -0.69 0.00 0.00 174.62 173.44 2r5g s PRO 153 N 1.84 4.07 0.85 4.92 0.02 -1.26 -4.74 135.00 140.69 2r5g s PRO 153 Ca 0.19 2.47 -0.11 0.00 0.02 0.00 0.00 61.00 63.56 2r5g s PRO 153 Cb -0.15 -2.92 0.10 0.00 0.02 0.00 0.00 34.50 31.55 2r5g s PRO 153 CO 0.09 -0.52 1.09 -0.51 -0.33 0.00 0.00 177.00 176.82 2r5g s LEU 154 N -2.17 2.49 0.43 -5.54 1.43 -1.26 -4.95 118.68 109.11 2r5g s LEU 154 Ca 0.54 1.50 0.13 0.00 -1.03 0.00 0.00 54.13 55.28 2r5g s LEU 154 Cb -0.44 -4.03 0.94 0.00 0.03 0.00 0.00 46.19 42.68 2r5g s LEU 154 CO 0.60 -2.35 1.96 0.25 0.23 0.00 0.00 176.35 177.04 2r5g h LEU 155 N -1.35 0.04 -3.44 1.79 5.85 -2.00 -2.55 115.31 113.66 2r5g h LEU 155 Ca -0.48 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.24 2r5g h LEU 155 Cb 1.27 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.29 2r5g h LEU 155 CO 0.55 0.23 0.00 -0.90 -0.34 0.00 0.00 178.44 177.99 2r5g n ASP 156 N -4.29 5.36 -4.69 1.25 5.75 -1.26 -5.00 116.55 113.67 2r5g n ASP 156 Ca -0.02 -2.81 -0.40 0.00 -0.01 0.00 0.00 54.79 51.54 2r5g n ASP 156 Cb 0.27 -0.65 -0.05 0.00 -1.03 0.00 0.00 41.12 39.66 2r5g n ASP 156 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 2r5g s GLU 157 N -2.53 4.36 -0.30 0.11 2.12 -0.96 -5.03 118.70 116.46 2r5g s GLU 157 Ca 0.53 0.89 -0.02 0.00 0.36 0.00 0.00 54.97 56.73 2r5g s GLU 157 Cb 0.39 -3.51 0.05 0.00 0.26 0.00 0.00 34.13 31.32 2r5g s GLU 157 CO 0.18 -0.12 0.01 0.42 -0.54 0.00 0.00 175.26 175.21 2r5g s ILE 158 N 1.43 3.01 0.32 -3.70 -1.09 -1.26 -3.85 121.20 116.06 2r5g s ILE 158 Ca 0.37 -1.40 -0.29 0.00 -2.23 0.00 0.00 60.65 57.10 2r5g s ILE 158 Cb -0.17 -2.74 -0.10 0.00 -1.58 0.00 0.00 42.46 37.86 2r5g s ILE 158 CO 0.15 -0.12 1.37 -0.62 -1.23 0.00 0.00 174.94 174.48 2r5g s ASP 159 N 1.27 6.68 0.48 3.58 -1.08 0.41 -4.85 116.67 123.16 2r5g s ASP 159 Ca -0.05 2.74 0.24 0.00 -0.52 0.00 0.00 52.55 54.97 2r5g s ASP 159 Cb -0.20 -2.65 1.21 0.00 -1.46 0.00 0.00 42.92 39.83 2r5g s ASP 159 CO -0.01 -0.63 1.97 1.55 0.52 0.00 0.00 175.17 178.58 2r5g h PRO 160 N 3.71 0.00 0.00 4.34 0.13 -1.98 0.11 132.00 138.31 2r5g h PRO 160 Ca -0.49 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.32 2r5g h PRO 160 Cb 1.23 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.30 2r5g h PRO 160 CO 0.68 0.18 -2.22 -0.25 -0.23 0.00 0.00 178.00 176.16 2r5g n ASP 161 N -3.64 1.15 -0.16 1.44 8.00 -1.26 -4.68 116.55 117.41 2r5g n ASP 161 Ca -0.01 -0.04 0.02 0.00 0.71 0.00 0.00 54.79 55.47 2r5g n ASP 161 Cb 0.31 0.55 0.03 0.00 -0.02 0.00 0.00 41.12 42.00 2r5g n ASP 161 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2r5g n SER 162 N -2.80 1.92 0.00 -2.24 3.41 -1.23 -5.11 113.62 107.58 2r5g n SER 162 Ca -0.32 -1.71 0.00 0.00 -0.26 0.00 0.00 58.87 56.58 2r5g n SER 162 Cb 1.03 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.93 2r5g n SER 162 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2r5g n ALA 163 N -0.09 0.00 -1.47 7.33 0.00 0.02 -4.83 120.51 121.47 2r5g n ALA 163 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.16 2r5g n ALA 163 Cb 0.22 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.76 2r5g n ALA 163 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2r5g s GLU 164 N 0.00 2.19 -1.30 0.00 1.03 -1.26 -0.44 118.70 118.91 2r5g s GLU 164 Ca 0.00 0.81 -0.11 0.00 0.03 0.00 0.00 54.97 55.70 2r5g s GLU 164 Cb 0.00 -1.92 0.00 0.00 -0.80 0.00 0.00 34.13 31.42 2r5g s GLU 164 CO 0.00 -1.59 0.55 0.39 -1.33 0.00 0.00 175.26 173.29 2r5g n GLU 165 N -3.44 -2.17 -1.65 -4.83 1.02 -1.25 -4.88 120.64 103.44 2r5g n GLU 165 Ca 0.07 0.37 -0.33 0.00 -0.02 0.00 0.00 57.16 57.26 2r5g n GLU 165 Cb 0.55 -4.14 0.06 0.00 -0.02 0.00 0.00 31.44 27.89 2r5g n GLU 165 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2r5g s PRO 166 N -6.49 2.70 0.15 3.49 0.04 -1.26 -4.97 135.00 128.67 2r5g s PRO 166 Ca 0.21 1.33 -0.08 0.00 0.04 0.00 0.00 61.00 62.50 2r5g s PRO 166 Cb -0.09 -1.94 -0.00 0.00 0.04 0.00 0.00 34.50 32.51 2r5g s PRO 166 CO 0.89 -1.32 1.44 -1.00 0.04 0.00 0.00 177.00 177.05 2r5g h PRO 167 N -0.24 0.72 -4.98 0.56 0.13 -1.97 -3.45 132.00 122.78 2r5g h PRO 167 Ca -0.46 -0.47 -0.34 0.00 -0.87 0.00 0.00 66.00 63.86 2r5g h PRO 167 Cb 1.24 0.06 -0.20 0.00 0.13 0.00 0.00 31.00 32.24 2r5g h PRO 167 CO 0.54 1.09 -0.75 0.54 -0.23 0.00 0.00 178.00 179.19 2r5g s VAL 168 N -4.03 0.90 0.04 1.56 0.11 -1.26 -4.79 120.40 112.94 2r5g s VAL 168 Ca -0.09 -1.42 -0.19 0.00 -2.93 0.00 0.00 61.98 57.35 2r5g s VAL 168 Cb 0.10 -1.11 -0.06 0.00 -1.53 0.00 0.00 36.38 33.78 2r5g s VAL 168 CO 0.87 -0.43 0.56 -0.55 -3.33 0.00 0.00 175.10 172.22 2r5g s SER 169 N -2.06 7.01 -0.12 3.54 0.15 0.70 -4.79 113.70 118.14 2r5g s SER 169 Ca -0.00 1.20 0.14 0.00 0.70 0.00 0.00 55.95 57.99 2r5g s SER 169 Cb -0.06 -2.35 0.30 0.00 -1.71 0.00 0.00 66.02 62.20 2r5g s SER 169 CO 0.01 0.24 1.15 0.54 1.20 0.00 0.00 173.24 176.37 2r5g n ARG 170 N 1.99 0.99 -0.92 5.44 1.74 -1.26 -4.68 116.66 119.95 2r5g n ARG 170 Ca -0.10 -2.46 -0.32 0.00 -0.77 0.00 0.00 57.85 54.20 2r5g n ARG 170 Cb 0.51 -1.16 0.14 0.00 -1.02 0.00 0.00 32.46 30.93 2r5g n ARG 170 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2r5g s ARG 171 N -2.11 1.38 -0.02 5.56 1.70 -1.26 -4.96 118.95 119.23 2r5g s ARG 171 Ca 0.29 1.59 -0.23 0.00 -0.47 0.00 0.00 55.73 56.91 2r5g s ARG 171 Cb 0.28 -1.76 -0.22 0.00 -0.57 0.00 0.00 34.95 32.67 2r5g s ARG 171 CO -0.03 -2.37 1.10 -0.07 -1.08 0.00 0.00 175.30 172.84 2r5g h LEU 172 N -1.42 0.32 0.00 -1.89 3.38 -1.88 -3.47 115.31 110.35 2r5g h LEU 172 Ca -0.44 -0.72 -0.37 0.00 0.09 0.00 0.00 57.88 56.43 2r5g h LEU 172 Cb 1.27 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.85 2r5g h LEU 172 CO 0.44 1.00 -0.31 0.49 0.09 0.00 0.00 178.44 180.15 2r5g n PHE 173 N -4.44 0.10 -0.26 1.13 3.72 0.16 -4.55 117.46 113.32 2r5g n PHE 173 Ca -0.09 -1.74 -0.02 0.00 -0.05 0.00 0.00 57.45 55.55 2r5g n PHE 173 Cb 0.52 -0.01 0.10 0.00 -0.94 0.00 0.00 39.48 39.16 2r5g n PHE 173 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2r5g h LEU 174 N 0.00 0.67 -1.32 4.37 3.38 -1.94 -3.16 115.31 117.32 2r5g h LEU 174 Ca -0.21 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.78 2r5g h LEU 174 Cb 0.81 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2r5g h LEU 174 CO 0.33 0.44 -0.09 -0.67 0.09 0.00 0.00 178.44 178.54 2r5g n ASP 175 N -4.71 1.96 0.00 -0.43 2.03 -1.26 -4.89 116.55 109.25 2r5g n ASP 175 Ca 0.09 -1.48 0.00 0.00 0.52 0.00 0.00 54.79 53.92 2r5g n ASP 175 Cb 0.15 0.16 0.00 0.00 -0.72 0.00 0.00 41.12 40.70 2r5g n ASP 175 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2r5g n GLY 176 N 0.89 -0.03 1.14 0.27 0.00 -1.19 -4.84 105.19 101.43 2r5g n GLY 176 Ca 0.08 -1.10 0.12 0.00 0.00 0.00 0.00 46.02 45.11 2r5g n GLY 176 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2r5g n ASP 177 N 0.00 3.44 -4.49 1.61 8.00 -1.26 -0.66 116.55 123.19 2r5g n ASP 177 Ca 0.00 -2.00 -0.31 0.00 0.71 0.00 0.00 54.79 53.19 2r5g n ASP 177 Cb 0.00 -0.22 -0.12 0.00 -0.02 0.00 0.00 41.12 40.76 2r5g n ASP 177 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2r5g s GLN 178 N -1.56 2.10 0.14 -1.24 1.11 -1.26 -4.82 119.66 114.13 2r5g s GLN 178 Ca 0.38 -0.98 -0.31 0.00 0.01 0.00 0.00 55.36 54.45 2r5g s GLN 178 Cb 0.23 -2.22 -0.09 0.00 -1.01 0.00 0.00 33.01 29.91 2r5g s GLN 178 CO 0.32 0.54 1.49 -0.51 0.01 0.00 0.00 175.29 177.13 2r5g s LEU 179 N -1.58 4.37 0.48 2.90 1.43 -1.26 -4.76 118.68 120.26 2r5g s LEU 179 Ca 0.16 2.49 0.02 0.00 -1.03 0.00 0.00 54.13 55.77 2r5g s LEU 179 Cb -0.11 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.51 2r5g s LEU 179 CO 0.07 -0.75 0.04 0.42 0.23 0.00 0.00 176.35 176.37 2r5g s THR 180 N 1.09 0.99 0.46 5.49 -4.23 -1.26 -4.92 115.64 113.27 2r5g s THR 180 Ca 0.67 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 59.36 2r5g s THR 180 Cb -0.41 -2.23 0.35 0.00 1.34 0.00 0.00 72.50 71.55 2r5g s THR 180 CO 0.31 0.00 1.98 -0.07 -0.54 0.00 0.00 174.62 176.30 2r5g h LEU 181 N 1.49 0.25 -1.00 4.79 3.38 -1.45 -0.98 115.31 121.80 2r5g h LEU 181 Ca -0.41 0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.59 2r5g h LEU 181 Cb 1.30 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 41.95 2r5g h LEU 181 CO 0.69 0.15 0.66 0.00 0.09 0.00 0.00 178.44 180.02 2r5g h ALA 182 N 1.72 1.30 -0.12 1.53 0.00 -1.89 -0.94 119.26 120.86 2r5g h ALA 182 Ca 0.27 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.92 2r5g h ALA 182 Cb 0.69 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2r5g h ALA 182 CO -0.06 0.61 -0.74 -0.44 0.00 0.00 0.00 179.25 178.62 2r5g h ASP 183 N 1.32 0.69 -0.08 0.00 3.32 -1.54 -1.63 116.42 118.49 2r5g h ASP 183 Ca 0.38 -0.45 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 2r5g h ASP 183 Cb -0.08 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 2r5g h ASP 183 CO -0.10 1.21 0.03 0.00 -1.72 0.00 0.00 179.24 178.65 2r5g h SER 185 N 0.18 -0.04 -0.01 0.00 0.87 -1.08 -3.37 113.55 110.11 2r5g h SER 185 Ca 0.05 -0.67 -0.20 0.00 -1.23 0.00 0.00 61.79 59.74 2r5g h SER 185 Cb 0.08 0.01 0.02 0.00 -0.44 0.00 0.00 62.40 62.07 2r5g h SER 185 CO -0.00 0.73 -0.76 0.25 -0.53 0.00 0.00 176.83 176.52 2r5g h LEU 186 N -0.89 0.68 -0.32 2.23 5.85 -1.15 -3.33 115.31 118.37 2r5g h LEU 186 Ca -0.00 -0.75 0.03 0.00 0.84 0.00 0.00 57.88 58.00 2r5g h LEU 186 Cb 0.70 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 2r5g h LEU 186 CO 0.01 1.33 0.13 -0.07 -0.34 0.00 0.00 178.44 179.50 2r5g h LEU 187 N 0.09 0.15 -1.08 2.25 3.38 -1.20 0.19 115.31 119.09 2r5g h LEU 187 Ca -0.09 0.03 0.08 0.00 0.09 0.00 0.00 57.88 57.98 2r5g h LEU 187 Cb 1.45 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 42.13 2r5g h LEU 187 CO 0.15 0.13 0.62 -0.65 0.09 0.00 0.00 178.44 178.78 2r5g h PRO 188 N 0.27 1.04 -0.58 1.13 0.11 -1.77 -0.93 132.00 131.27 2r5g h PRO 188 Ca 0.14 -0.06 -0.10 0.00 0.11 0.00 0.00 66.00 66.09 2r5g h PRO 188 Cb 0.10 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 30.95 2r5g h PRO 188 CO -0.13 0.69 -0.03 0.87 -0.21 0.00 0.00 178.00 179.18 2r5g h LYS 189 N 1.07 1.04 -0.59 1.05 1.57 -1.26 -2.02 116.57 117.43 2r5g h LYS 189 Ca 0.43 -0.35 -0.07 0.00 -1.87 0.00 0.00 60.65 58.78 2r5g h LYS 189 Cb 0.26 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 2r5g h LYS 189 CO -0.18 1.04 0.07 1.25 -0.57 0.00 0.00 179.45 181.06 2r5g h LEU 190 N 0.93 0.92 -0.45 2.94 5.85 -0.24 -0.57 115.31 124.69 2r5g h LEU 190 Ca 0.16 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 2r5g h LEU 190 Cb 0.59 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 2r5g h LEU 190 CO 0.04 0.94 0.26 -1.13 -0.34 0.00 0.00 178.44 178.20 2r5g h ASN 191 N 0.91 0.55 -0.06 1.25 -0.73 -1.08 -1.20 115.58 115.22 2r5g h ASN 191 Ca 0.18 -0.08 0.01 0.00 1.87 0.00 0.00 56.30 58.28 2r5g h ASN 191 Cb 0.43 -0.14 -0.01 0.00 0.27 0.00 0.00 38.32 38.87 2r5g h ASN 191 CO 0.01 0.47 0.00 0.40 -0.37 0.00 0.00 177.43 177.95 2r5g h ILE 192 N 0.59 0.96 -0.48 2.57 2.04 -1.03 -1.67 117.51 120.50 2r5g h ILE 192 Ca 0.16 -0.01 0.04 0.00 1.00 0.00 0.00 64.86 66.05 2r5g h ILE 192 Cb 0.03 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 37.01 2r5g h ILE 192 CO -0.03 0.00 0.24 0.40 0.00 0.00 0.00 178.15 178.77 2r5g h ILE 193 N 0.02 0.96 -0.35 -0.67 2.04 -0.99 0.49 117.51 119.02 2r5g h ILE 193 Ca 0.03 -0.16 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 2r5g h ILE 193 Cb 0.03 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 2r5g h ILE 193 CO -0.04 0.09 0.17 0.50 0.00 0.00 0.00 178.15 178.86 2r5g h LYS 194 N 0.47 0.49 0.17 2.37 3.64 -1.06 -0.64 116.57 122.02 2r5g h LYS 194 Ca 0.21 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 2r5g h LYS 194 Cb 0.12 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 2r5g h LYS 194 CO -0.15 0.44 -0.08 0.28 -2.27 0.00 0.00 179.45 177.67 2r5g h VAL 195 N 0.42 0.92 -0.29 2.00 2.07 -1.10 -3.09 116.25 117.18 2r5g h VAL 195 Ca 0.12 -0.97 -0.13 0.00 0.82 0.00 0.00 66.70 66.54 2r5g h VAL 195 Cb 0.11 1.46 -0.00 0.00 -1.52 0.00 0.00 31.29 31.33 2r5g h VAL 195 CO -0.02 0.20 -0.31 0.00 0.02 0.00 0.00 177.57 177.47 2r5g h ALA 196 N -0.09 0.43 -0.43 1.67 0.00 -0.93 -2.07 119.26 117.84 2r5g h ALA 196 Ca -0.02 -0.41 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 2r5g h ALA 196 Cb 0.51 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2r5g h ALA 196 CO 0.04 0.46 -0.07 0.00 0.00 0.00 0.00 179.25 179.68 2r5g h ALA 197 N 0.70 1.07 -0.14 0.00 0.00 -1.27 -1.18 119.26 118.44 2r5g h ALA 197 Ca 0.04 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 2r5g h ALA 197 Cb 0.89 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 2r5g h ALA 197 CO 0.08 0.57 -0.01 -0.22 0.00 0.00 0.00 179.25 179.67 2r5g h LYS 198 N 0.68 0.26 -0.15 0.00 1.63 -1.48 -0.29 116.57 117.21 2r5g h LYS 198 Ca 0.12 -0.09 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 2r5g h LYS 198 Cb 0.53 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.13 2r5g h LYS 198 CO 0.03 0.51 0.10 -0.22 -3.45 0.00 0.00 179.45 176.41 2r5g h LYS 199 N -0.02 0.21 0.00 1.90 1.63 -1.21 -2.06 116.57 117.02 2r5g h LYS 199 Ca 0.04 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 2r5g h LYS 199 Cb 0.40 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 31.98 2r5g h LYS 199 CO 0.01 0.16 -1.08 0.66 -3.45 0.00 0.00 179.45 175.75 2r5g n TYR 200 N -4.97 0.00 -0.62 1.91 4.01 -0.46 -4.53 117.16 112.50 2r5g n TYR 200 Ca -0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.70 2r5g n TYR 200 Cb 0.04 -0.11 0.00 0.00 -0.31 0.00 0.00 39.34 38.96 2r5g n TYR 200 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2r5g n ARG 201 N -1.60 0.75 -3.20 -0.72 5.12 -0.20 -5.01 116.66 111.80 2r5g n ARG 201 Ca 0.01 -0.70 -0.22 0.00 -1.93 0.00 0.00 57.85 55.02 2r5g n ARG 201 Cb 0.32 -0.69 0.00 0.00 -1.16 0.00 0.00 32.46 30.93 2r5g n ARG 201 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2r5g n ASP 202 N -0.14 -4.04 -4.72 0.55 2.03 -0.78 -4.93 116.55 104.52 2r5g n ASP 202 Ca 0.00 -0.30 -0.39 0.00 0.52 0.00 0.00 54.79 54.62 2r5g n ASP 202 Cb 0.34 -3.34 -0.05 0.00 -0.72 0.00 0.00 41.12 37.35 2r5g n ASP 202 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 2r5g s PHE 203 N -2.92 3.56 0.01 -0.67 5.36 -0.72 -4.92 117.98 117.68 2r5g s PHE 203 Ca 0.34 1.08 0.06 0.00 -0.96 0.00 0.00 56.93 57.45 2r5g s PHE 203 Cb -0.17 -2.67 -0.03 0.00 -0.34 0.00 0.00 43.02 39.80 2r5g s PHE 203 CO 0.41 0.15 -0.16 -0.51 -1.46 0.00 0.00 175.22 173.65 2r5g s ASP 204 N 0.64 3.89 -0.17 6.13 1.01 -1.26 -3.21 116.67 123.70 2r5g s ASP 204 Ca 0.32 -0.34 -0.29 0.00 0.71 0.00 0.00 52.55 52.95 2r5g s ASP 204 Cb -0.17 -0.70 -0.03 0.00 1.01 0.00 0.00 42.92 43.03 2r5g s ASP 204 CO 0.14 0.29 1.57 -0.63 0.21 0.00 0.00 175.17 176.75 2r5g s ILE 205 N -0.85 3.76 0.17 0.77 1.01 -1.26 -4.91 121.20 119.88 2r5g s ILE 205 Ca 0.14 0.88 -0.33 0.00 0.00 0.00 0.00 60.65 61.34 2r5g s ILE 205 Cb -0.11 -3.69 -0.16 0.00 0.01 0.00 0.00 42.46 38.52 2r5g s ILE 205 CO 0.04 -0.21 1.22 -2.65 0.00 0.00 0.00 174.94 173.34 2r5g n PRO 206 N 7.35 1.26 0.25 2.79 -0.02 -1.26 -4.86 135.00 140.52 2r5g n PRO 206 Ca 0.18 0.45 0.16 0.00 -2.02 0.00 0.00 63.50 62.27 2r5g n PRO 206 Cb 0.44 -1.99 0.87 0.00 -0.02 0.00 0.00 33.50 32.80 2r5g n PRO 206 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2r5g h ALA 207 N 3.68 1.67 0.00 3.55 0.00 -2.04 -2.14 119.26 123.98 2r5g h ALA 207 Ca -0.44 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.45 2r5g h ALA 207 Cb 1.33 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 2r5g h ALA 207 CO 0.72 -0.15 -0.07 0.93 0.00 0.00 0.00 179.25 180.68 2r5g h GLU 208 N 0.00 0.00 -5.05 0.00 3.07 -2.02 -3.32 114.58 107.26 2r5g h GLU 208 Ca 0.04 0.00 -0.70 0.00 -0.50 0.00 0.00 59.36 58.21 2r5g h GLU 208 Cb 0.25 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.09 2r5g h GLU 208 CO -0.00 0.07 2.52 1.19 -1.40 0.00 0.00 179.01 181.39 2r5g n PHE 209 N -3.31 4.21 0.01 4.33 3.72 -0.81 -4.77 117.46 120.83 2r5g n PHE 209 Ca -0.01 -2.91 0.02 0.00 -0.05 0.00 0.00 57.45 54.50 2r5g n PHE 209 Cb 0.25 -2.57 0.38 0.00 -0.94 0.00 0.00 39.48 36.60 2r5g n PHE 209 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 2r5g h SER 210 N 6.91 0.47 -0.14 4.37 0.02 -1.85 -1.75 113.55 121.58 2r5g h SER 210 Ca 0.49 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.36 2r5g h SER 210 Cb 0.78 -0.12 -0.00 0.00 0.14 0.00 0.00 62.40 63.19 2r5g h SER 210 CO 1.62 0.42 -0.06 1.23 -1.14 0.00 0.00 176.83 178.90 2r5g h GLY 211 N 0.66 0.31 0.92 -3.77 0.00 -1.86 0.24 103.07 99.57 2r5g h GLY 211 Ca 0.13 -0.27 0.02 0.00 0.00 0.00 0.00 47.33 47.21 2r5g h GLY 211 CO -0.01 0.25 0.28 -2.08 0.00 0.00 0.00 176.54 174.97 2r5g h VAL 212 N -0.05 1.06 -0.22 4.60 2.07 -1.78 -1.51 116.25 120.43 2r5g h VAL 212 Ca 0.03 -0.19 -0.12 0.00 0.82 0.00 0.00 66.70 67.24 2r5g h VAL 212 Cb 0.51 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 2r5g h VAL 212 CO 0.02 0.10 -0.39 -0.50 0.02 0.00 0.00 177.57 176.82 2r5g h TRP 213 N 0.56 0.59 -0.11 1.57 4.06 -1.27 0.05 115.95 121.40 2r5g h TRP 213 Ca 0.18 -0.16 0.01 0.00 2.06 0.00 0.00 58.89 60.98 2r5g h TRP 213 Cb -0.01 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 28.01 2r5g h TRP 213 CO -0.06 0.82 0.02 -0.09 -3.56 0.00 0.00 178.44 175.56 2r5g h ARG 214 N 0.42 0.07 -0.22 0.49 2.43 -0.79 -0.66 114.38 116.11 2r5g h ARG 214 Ca 0.04 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.24 2r5g h ARG 214 Cb 0.86 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.37 2r5g h ARG 214 CO 0.07 0.04 0.04 -0.92 -1.51 0.00 0.00 179.97 177.70 2r5g h TYR 215 N 0.07 0.07 -0.64 2.20 3.20 -0.98 -0.93 116.97 119.95 2r5g h TYR 215 Ca 0.05 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 2r5g h TYR 215 Cb 0.04 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.28 2r5g h TYR 215 CO -0.12 0.02 0.39 -0.07 -1.64 0.00 0.00 178.16 176.75 2r5g h LEU 216 N 0.13 0.76 -0.20 2.82 3.38 -0.84 0.20 115.31 121.56 2r5g h LEU 216 Ca 0.10 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2r5g h LEU 216 Cb 0.10 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2r5g h LEU 216 CO -0.14 0.59 0.09 0.45 0.09 0.00 0.00 178.44 179.53 2r5g h HIS 217 N 0.87 0.30 -0.77 1.13 3.86 -0.91 0.21 115.15 119.85 2r5g h HIS 217 Ca 0.23 -0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.46 2r5g h HIS 217 Cb -0.04 -0.09 -0.05 0.00 1.06 0.00 0.00 27.41 28.29 2r5g h HIS 217 CO -0.02 0.32 0.48 -0.91 0.86 0.00 0.00 177.93 178.66 2r5g h ASN 218 N 0.19 0.77 -0.15 2.45 2.35 -0.94 -2.67 115.58 117.58 2r5g h ASN 218 Ca 0.07 0.01 -0.11 0.00 -0.55 0.00 0.00 56.30 55.72 2r5g h ASN 218 Cb 0.14 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.35 2r5g h ASN 218 CO -0.01 0.52 -0.33 0.00 -1.65 0.00 0.00 177.43 175.96 2r5g h ALA 219 N 1.34 0.24 0.00 -0.83 0.00 -0.26 -3.05 119.26 116.71 2r5g h ALA 219 Ca 0.32 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2r5g h ALA 219 Cb 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2r5g h ALA 219 CO -0.13 0.29 0.00 0.66 0.00 0.00 0.00 179.25 180.07 2r5g n TYR 220 N -4.35 0.24 1.46 0.00 4.01 0.72 -1.44 117.16 117.81 2r5g n TYR 220 Ca -0.07 0.09 0.15 0.00 -0.16 0.00 0.00 57.90 57.91 2r5g n TYR 220 Cb 0.49 -0.65 0.72 0.00 -0.31 0.00 0.00 39.34 39.60 2r5g n TYR 220 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2r5g n ALA 221 N -1.58 2.60 -3.11 -0.72 0.00 -1.01 -4.79 120.51 111.91 2r5g n ALA 221 Ca 0.04 -0.19 -0.37 0.00 0.00 0.00 0.00 53.44 52.92 2r5g n ALA 221 Cb 0.21 -1.44 -0.13 0.00 0.00 0.00 0.00 19.45 18.10 2r5g n ALA 221 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2r5g s ARG 222 N -2.49 3.50 0.54 0.00 1.81 -0.52 -4.99 118.95 116.80 2r5g s ARG 222 Ca 0.30 -0.58 0.20 0.00 -1.72 0.00 0.00 55.73 53.94 2r5g s ARG 222 Cb 0.20 -3.32 1.43 0.00 -0.45 0.00 0.00 34.95 32.81 2r5g s ARG 222 CO 0.46 -0.25 2.17 0.93 -0.68 0.00 0.00 175.30 177.93 2r5g h GLU 223 N 8.23 0.00 -0.63 3.54 5.08 -1.86 -1.96 114.58 126.99 2r5g h GLU 223 Ca -0.37 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.04 2r5g h GLU 223 Cb 1.16 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.38 2r5g h GLU 223 CO 0.59 0.01 0.41 0.93 -1.00 0.00 0.00 179.01 179.95 2r5g h GLU 224 N 0.00 0.65 0.00 2.33 3.07 -1.94 0.45 114.58 119.13 2r5g h GLU 224 Ca -0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 2r5g h GLU 224 Cb 0.02 -0.15 0.00 0.00 -0.84 0.00 0.00 28.75 27.78 2r5g h GLU 224 CO 0.00 0.43 -0.07 0.35 -1.40 0.00 0.00 179.01 178.32 2r5g h PHE 225 N 0.67 0.00 -0.49 4.33 3.57 -1.66 -3.35 116.94 120.00 2r5g h PHE 225 Ca 0.26 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.72 2r5g h PHE 225 Cb 0.20 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 2r5g h PHE 225 CO -0.00 0.00 0.11 1.79 -2.23 0.00 0.00 178.31 177.98 2r5g h THR 226 N -0.94 1.21 -0.00 4.41 1.35 -1.30 -2.21 112.91 115.42 2r5g h THR 226 Ca 0.00 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 2r5g h THR 226 Cb 0.07 0.72 0.00 0.00 -1.73 0.00 0.00 68.15 67.20 2r5g h THR 226 CO 0.00 0.28 -0.06 1.41 -0.25 0.00 0.00 175.52 176.91 2r5g n HIS 227 N -4.29 0.00 0.89 4.73 8.25 0.14 -2.89 115.22 122.05 2r5g n HIS 227 Ca 0.03 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.59 2r5g n HIS 227 Cb 0.22 -0.16 0.01 0.00 1.12 0.00 0.00 29.99 31.18 2r5g n HIS 227 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2r5g n THR 228 N -0.96 0.00 -2.31 1.59 -2.24 -0.85 -4.98 114.28 104.53 2r5g n THR 228 Ca 0.17 -0.32 -0.38 0.00 -2.27 0.00 0.00 64.05 61.24 2r5g n THR 228 Cb 0.24 1.27 -0.02 0.00 -2.10 0.00 0.00 70.33 69.72 2r5g n THR 228 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2r5g s PRO 230 N -2.29 1.79 0.50 0.00 0.04 -1.26 -5.00 135.00 128.79 2r5g s PRO 230 Ca 0.57 0.42 -0.23 0.00 0.04 0.00 0.00 61.00 61.80 2r5g s PRO 230 Cb -0.30 -1.90 -0.06 0.00 0.04 0.00 0.00 34.50 32.27 2r5g s PRO 230 CO 0.38 -1.78 1.38 -1.21 0.04 0.00 0.00 177.00 175.82 2r5g s GLU 231 N -5.27 3.38 0.30 4.56 0.41 -1.26 -4.89 118.70 115.92 2r5g s GLU 231 Ca 0.62 2.30 0.05 0.00 -0.41 0.00 0.00 54.97 57.53 2r5g s GLU 231 Cb -0.14 -2.43 0.74 0.00 -1.78 0.00 0.00 34.13 30.53 2r5g s GLU 231 CO 0.53 -1.02 1.75 -0.44 -0.49 0.00 0.00 175.26 175.59 2r5g h ASP 232 N 1.83 0.65 0.11 -0.19 5.19 -2.00 -1.25 116.42 120.76 2r5g h ASP 232 Ca -0.51 0.12 -0.01 0.00 -0.62 0.00 0.00 57.03 56.01 2r5g h ASP 232 Cb 1.28 0.01 -0.00 0.00 0.18 0.00 0.00 39.33 40.80 2r5g h ASP 232 CO 0.59 0.18 -0.04 0.07 -3.12 0.00 0.00 179.24 176.92 2r5g h LYS 233 N 0.64 0.00 -0.27 3.56 5.09 -1.98 -0.75 116.57 122.86 2r5g h LYS 233 Ca 0.58 0.00 -0.04 0.00 0.09 0.00 0.00 60.65 61.27 2r5g h LYS 233 Cb 0.97 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 33.29 2r5g h LYS 233 CO -0.43 0.04 -0.00 0.93 -2.09 0.00 0.00 179.45 177.90 2r5g h GLU 234 N 0.00 0.49 -0.21 0.07 4.39 -1.58 0.71 114.58 118.45 2r5g h GLU 234 Ca -0.00 -0.16 -0.00 0.00 0.34 0.00 0.00 59.36 59.54 2r5g h GLU 234 Cb 0.11 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 2r5g h GLU 234 CO 0.01 0.65 0.13 0.82 -1.16 0.00 0.00 179.01 179.45 2r5g h ILE 235 N 0.27 1.09 -0.98 3.13 2.04 -1.43 -2.45 117.51 119.18 2r5g h ILE 235 Ca 0.08 -0.22 0.04 0.00 1.00 0.00 0.00 64.86 65.76 2r5g h ILE 235 Cb 0.43 0.85 -0.06 0.00 -0.74 0.00 0.00 36.82 37.31 2r5g h ILE 235 CO 0.01 0.08 0.64 -0.33 0.00 0.00 0.00 178.15 178.56 2r5g h GLU 236 N 0.25 1.19 -0.96 2.37 5.08 -1.04 -2.26 114.58 119.21 2r5g h GLU 236 Ca 0.08 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2r5g h GLU 236 Cb 0.03 -0.27 -0.05 0.00 0.50 0.00 0.00 28.75 28.96 2r5g h GLU 236 CO -0.01 0.79 0.63 -0.91 -1.00 0.00 0.00 179.01 178.50 2r5g h ASN 237 N 1.23 1.11 -0.96 1.42 2.35 -0.62 -2.64 115.58 117.47 2r5g h ASN 237 Ca 0.39 -0.03 0.13 0.00 -0.55 0.00 0.00 56.30 56.24 2r5g h ASN 237 Cb 0.02 -0.28 -0.09 0.00 0.05 0.00 0.00 38.32 38.02 2r5g h ASN 237 CO -0.13 0.81 0.58 0.74 -1.65 0.00 0.00 177.43 177.78 2r5g h THR 238 N 1.31 0.87 -0.46 2.81 2.02 -0.93 -2.82 112.91 115.71 2r5g h THR 238 Ca 0.35 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 67.23 2r5g h THR 238 Cb -0.14 -0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.17 2r5g h THR 238 CO -0.07 0.16 0.00 -1.22 0.37 0.00 0.00 175.52 174.76 2r5g n TYR 239 N -4.69 0.60 -0.37 3.16 4.01 -1.03 -4.64 117.16 114.20 2r5g n TYR 239 Ca 0.18 -0.32 0.02 0.00 -0.16 0.00 0.00 57.90 57.62 2r5g n TYR 239 Cb 0.38 -0.00 0.16 0.00 -0.31 0.00 0.00 39.34 39.57 2r5g n TYR 239 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2r5g h ALA 240 N 4.18 1.38 0.01 -0.72 0.00 -1.21 -1.32 119.26 121.59 2r5g h ALA 240 Ca 0.00 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.69 2r5g h ALA 240 Cb 0.95 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2r5g h ALA 240 CO 0.00 0.50 -0.97 -0.91 0.00 0.00 0.00 179.25 177.87 2r5g h ASN 241 N 1.22 0.05 0.62 0.00 2.35 -1.82 -3.40 115.58 114.60 2r5g h ASN 241 Ca 0.42 -0.68 -0.03 0.00 -0.55 0.00 0.00 56.30 55.46 2r5g h ASN 241 Cb 0.09 -0.02 -0.00 0.00 0.05 0.00 0.00 38.32 38.44 2r5g h ASN 241 CO -0.15 1.39 -0.14 -0.37 -1.65 0.00 0.00 177.43 176.51 2r5g h VAL 242 N -0.90 0.46 -0.00 2.81 -1.51 -1.82 -2.45 116.25 112.84 2r5g h VAL 242 Ca -0.26 -0.71 0.00 0.00 -1.23 0.00 0.00 66.70 64.50 2r5g h VAL 242 Cb 1.29 1.50 0.00 0.00 -2.13 0.00 0.00 31.29 31.95 2r5g h VAL 242 CO -0.12 0.13 -0.01 0.00 -1.23 0.00 0.00 177.57 176.34 2r5g n ALA 243 N -2.23 2.57 -1.89 5.19 0.00 -0.51 -4.54 120.51 119.10 2r5g n ALA 243 Ca -0.01 -0.17 -0.41 0.00 0.00 0.00 0.00 53.44 52.85 2r5g n ALA 243 Cb 0.30 -1.48 -0.03 0.00 0.00 0.00 0.00 19.45 18.25 2r5g n ALA 243 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2r5g s LYS 244 N -2.42 4.44 0.12 0.00 1.02 -0.92 -5.01 119.74 116.98 2r5g s LYS 244 Ca 0.33 2.03 0.10 0.00 0.02 0.00 0.00 55.97 58.45 2r5g s LYS 244 Cb 0.21 -3.16 -0.04 0.00 -0.52 0.00 0.00 37.83 34.31 2r5g s LYS 244 CO 0.44 -0.12 -0.24 -0.65 -0.92 0.00 0.00 175.35 173.86 2r5g s GLN 245 N -0.88 1.29 -0.11 1.68 -0.21 -1.26 -4.69 119.66 115.48 2r5g s GLN 245 Ca 0.51 -1.29 -0.21 0.00 0.02 0.00 0.00 55.36 54.39 2r5g s GLN 245 Cb -0.36 -1.67 -0.04 0.00 1.00 0.00 0.00 33.01 31.95 2r5g s GLN 245 CO 0.43 0.39 0.63 0.21 -2.12 0.00 0.00 175.29 174.82 2r5g s LYS 246 N -2.07 4.36 0.00 2.91 2.20 0.34 -4.91 119.74 122.57 2r5g s LYS 246 Ca 0.11 0.71 0.00 0.00 -0.36 0.00 0.00 55.97 56.43 2r5g s LYS 246 Cb -0.10 -3.47 0.00 0.00 -1.51 0.00 0.00 37.83 32.75 2r5g s LYS 246 CO 0.06 0.02 0.00 0.45 -0.36 0.00 0.00 175.35 175.52