#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nen s ARG 2 N 0.00 3.06 -0.11 0.03 3.52 -1.26 -1.38 118.95 122.81 1nen s ARG 2 Ca 0.00 -0.22 -0.04 0.00 -0.13 0.00 0.00 55.73 55.34 1nen s ARG 2 Cb 0.00 -2.43 0.05 0.00 -1.56 0.00 0.00 34.95 31.02 1nen s ARG 2 CO 0.00 -0.43 0.22 -0.51 -0.81 0.00 0.00 175.30 173.77 1nen s LEU 3 N -4.74 -0.04 -0.29 -0.88 1.43 -1.20 -4.85 118.68 108.11 1nen s LEU 3 Ca 0.50 0.48 -0.13 0.00 -1.03 0.00 0.00 54.13 53.95 1nen s LEU 3 Cb -0.10 0.54 -0.04 0.00 0.03 0.00 0.00 46.19 46.62 1nen s LEU 3 CO 0.41 -0.22 0.28 -1.61 0.23 0.00 0.00 176.35 175.44 1nen s GLU 4 N 2.11 3.88 0.11 1.70 0.41 -1.26 -2.03 118.70 123.61 1nen s GLU 4 Ca -0.01 -0.24 0.06 0.00 -0.41 0.00 0.00 54.97 54.36 1nen s GLU 4 Cb -0.12 -3.69 -0.04 0.00 -1.78 0.00 0.00 34.13 28.50 1nen s GLU 4 CO -0.07 -0.28 -0.01 -0.06 -0.49 0.00 0.00 175.26 174.34 1nen s PHE 5 N 1.90 2.94 -0.27 1.61 0.40 0.14 -0.95 117.98 123.74 1nen s PHE 5 Ca 0.10 -0.06 0.01 0.00 -0.60 0.00 0.00 56.93 56.38 1nen s PHE 5 Cb -0.16 -1.50 0.08 0.00 0.51 0.00 0.00 43.02 41.95 1nen s PHE 5 CO 0.11 0.48 0.01 0.45 0.70 0.00 0.00 175.22 176.97 1nen s SER 6 N -2.41 3.98 -0.07 1.36 0.15 0.11 -1.78 113.70 115.04 1nen s SER 6 Ca 0.25 -1.44 0.05 0.00 0.70 0.00 0.00 55.95 55.51 1nen s SER 6 Cb -0.11 -1.13 -0.01 0.00 -1.71 0.00 0.00 66.02 63.05 1nen s SER 6 CO 0.18 -0.31 -0.21 -0.63 1.20 0.00 0.00 173.24 173.47 1nen s ILE 7 N 1.40 2.43 0.18 6.45 1.01 -0.63 0.11 121.20 132.15 1nen s ILE 7 Ca 0.02 -0.93 -0.30 0.00 0.00 0.00 0.00 60.65 59.43 1nen s ILE 7 Cb -0.18 -1.92 -0.09 0.00 0.01 0.00 0.00 42.46 40.28 1nen s ILE 7 CO -0.12 0.57 1.36 -0.47 0.00 0.00 0.00 174.94 176.29 1nen s TYR 8 N -0.23 3.21 0.04 3.97 6.14 -0.80 -0.00 117.35 129.67 1nen s TYR 8 Ca -0.01 1.09 0.03 0.00 0.64 0.00 0.00 57.07 58.82 1nen s TYR 8 Cb -0.13 -3.67 -0.02 0.00 0.42 0.00 0.00 41.96 38.55 1nen s TYR 8 CO 0.03 -2.21 -0.10 1.03 0.64 0.00 0.00 175.55 174.94 1nen s ARG 9 N 0.22 0.67 -0.29 4.97 1.81 0.07 -4.44 118.95 121.96 1nen s ARG 9 Ca 0.60 -0.69 -0.17 0.00 -1.72 0.00 0.00 55.73 53.74 1nen s ARG 9 Cb -0.38 -0.58 0.18 0.00 -0.45 0.00 0.00 34.95 33.72 1nen s ARG 9 CO 0.37 0.13 1.14 -0.47 -0.68 0.00 0.00 175.30 175.79 1nen s TYR 10 N -1.00 -0.30 -0.23 -0.53 5.04 -1.26 -2.40 117.35 116.67 1nen s TYR 10 Ca -0.04 0.61 -0.03 0.00 -2.44 0.00 0.00 57.07 55.17 1nen s TYR 10 Cb -0.08 0.22 0.10 0.00 0.35 0.00 0.00 41.96 42.55 1nen s TYR 10 CO 0.01 -0.15 0.20 1.21 -1.34 0.00 0.00 175.55 175.48 1nen s ASN 11 N 1.04 1.94 0.42 4.32 3.84 -1.26 -1.28 114.94 123.96 1nen s ASN 11 Ca -0.07 -0.56 0.34 0.00 0.21 0.00 0.00 52.86 52.79 1nen s ASN 11 Cb -0.03 0.19 1.39 0.00 -0.55 0.00 0.00 41.25 42.24 1nen s ASN 11 CO -0.12 -0.36 1.37 -2.65 -2.79 0.00 0.00 177.10 172.55 1nen n PRO 12 N 5.30 -0.02 0.00 0.43 -0.02 -1.26 -0.61 135.00 138.82 1nen n PRO 12 Ca -0.05 1.04 0.11 0.00 -2.02 0.00 0.00 63.50 62.58 1nen n PRO 12 Cb 0.48 -2.18 0.05 0.00 -0.02 0.00 0.00 33.50 31.83 1nen n PRO 12 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1nen n ASP 13 N -4.16 0.92 -0.00 2.55 8.00 -1.26 -4.61 116.55 117.98 1nen n ASP 13 Ca 0.37 -0.78 -0.04 0.00 0.71 0.00 0.00 54.79 55.05 1nen n ASP 13 Cb 1.53 0.64 -0.01 0.00 -0.02 0.00 0.00 41.12 43.26 1nen n ASP 13 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1nen n VAL 14 N -1.32 1.09 -2.50 2.53 0.31 0.22 -5.04 118.33 113.63 1nen n VAL 14 Ca 0.05 0.22 -0.29 0.00 -0.01 0.00 0.00 64.34 64.32 1nen n VAL 14 Cb 0.35 -1.76 -0.01 0.00 -0.91 0.00 0.00 33.84 31.51 1nen n VAL 14 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1nen s ASP 15 N -5.91 6.32 0.00 4.52 1.01 -0.04 -4.99 116.67 117.57 1nen s ASP 15 Ca -0.09 1.10 0.00 0.00 0.71 0.00 0.00 52.55 54.27 1nen s ASP 15 Cb 0.02 -2.32 0.00 0.00 1.01 0.00 0.00 42.92 41.63 1nen s ASP 15 CO 0.13 -0.61 0.13 -0.90 0.21 0.00 0.00 175.17 174.12 1nen n ASP 16 N -2.17 0.26 -3.67 0.27 5.75 -1.26 -4.29 116.55 111.43 1nen n ASP 16 Ca 0.02 -0.60 -0.14 0.00 -0.01 0.00 0.00 54.79 54.05 1nen n ASP 16 Cb 0.55 0.62 -0.08 0.00 -1.03 0.00 0.00 41.12 41.17 1nen n ASP 16 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1nen s ALA 17 N -0.62 -1.27 0.96 2.12 0.00 -1.26 -5.11 121.76 116.58 1nen s ALA 17 Ca 0.00 1.15 -0.11 0.00 0.00 0.00 0.00 51.96 53.01 1nen s ALA 17 Cb 0.00 -0.43 0.17 0.00 0.00 0.00 0.00 23.12 22.86 1nen s ALA 17 CO 0.00 -0.28 1.12 -2.14 0.00 0.00 0.00 175.76 174.46 1nen s PRO 18 N -0.45 0.68 -0.01 0.00 0.02 -1.26 -4.95 135.00 129.03 1nen s PRO 18 Ca -0.06 1.37 -0.24 0.00 0.02 0.00 0.00 61.00 62.08 1nen s PRO 18 Cb -0.03 -1.70 0.05 0.00 0.02 0.00 0.00 34.50 32.84 1nen s PRO 18 CO 0.04 -2.80 0.54 -0.98 -0.33 0.00 0.00 177.00 173.47 1nen s ARG 19 N -4.63 0.96 -0.22 5.54 1.70 -1.01 -5.02 118.95 116.27 1nen s ARG 19 Ca 0.67 -0.01 -0.11 0.00 -0.47 0.00 0.00 55.73 55.81 1nen s ARG 19 Cb -0.23 0.44 -0.05 0.00 -0.57 0.00 0.00 34.95 34.55 1nen s ARG 19 CO 0.59 -0.31 0.16 -1.64 -1.08 0.00 0.00 175.30 173.02 1nen s MET 20 N -1.66 4.12 -0.10 3.89 -1.94 -1.26 -0.75 119.30 121.59 1nen s MET 20 Ca -0.10 -0.23 -0.02 0.00 -1.71 0.00 0.00 55.69 53.64 1nen s MET 20 Cb -0.01 -3.49 -0.03 0.00 2.01 0.00 0.00 34.83 33.30 1nen s MET 20 CO 0.05 0.15 -0.03 -1.14 -0.01 0.00 0.00 175.02 174.04 1nen s GLN 21 N 0.80 3.14 0.13 2.03 0.74 1.00 -4.90 119.66 122.60 1nen s GLN 21 Ca 0.08 -0.48 -0.30 0.00 0.05 0.00 0.00 55.36 54.72 1nen s GLN 21 Cb -0.13 -2.78 -0.06 0.00 1.10 0.00 0.00 33.01 31.14 1nen s GLN 21 CO 0.02 0.55 1.03 -0.51 -0.55 0.00 0.00 175.29 175.84 1nen s ASP 22 N -0.48 7.38 -0.00 6.67 1.01 -1.26 -1.60 116.67 128.38 1nen s ASP 22 Ca 0.08 1.92 0.01 0.00 0.71 0.00 0.00 52.55 55.27 1nen s ASP 22 Cb -0.12 -2.59 -0.00 0.00 1.01 0.00 0.00 42.92 41.21 1nen s ASP 22 CO 0.02 -0.15 -0.04 -0.31 0.21 0.00 0.00 175.17 174.90 1nen s TYR 23 N -0.03 0.36 -0.17 4.23 1.51 -0.74 -4.99 117.35 117.52 1nen s TYR 23 Ca 0.49 -0.08 -0.00 0.00 -1.01 0.00 0.00 57.07 56.47 1nen s TYR 23 Cb -0.26 -0.23 0.04 0.00 -0.11 0.00 0.00 41.96 41.40 1nen s TYR 23 CO 0.32 -0.01 -0.06 0.99 -1.11 0.00 0.00 175.55 175.68 1nen s THR 24 N -0.12 1.19 -0.37 -0.71 2.01 -1.26 0.24 115.64 116.63 1nen s THR 24 Ca 0.01 -0.70 0.01 0.00 0.31 0.00 0.00 61.69 61.32 1nen s THR 24 Cb -0.02 -1.36 0.10 0.00 0.01 0.00 0.00 72.50 71.24 1nen s THR 24 CO -0.00 0.13 0.12 -0.22 -0.69 0.00 0.00 174.62 173.95 1nen s LEU 25 N 1.60 4.96 -0.40 4.42 2.96 -0.86 -4.96 118.68 126.39 1nen s LEU 25 Ca 0.00 -2.08 -0.29 0.00 -0.22 0.00 0.00 54.13 51.54 1nen s LEU 25 Cb -0.15 -1.72 0.01 0.00 0.50 0.00 0.00 46.19 44.82 1nen s LEU 25 CO -0.08 -0.45 1.45 -1.61 -1.32 0.00 0.00 176.35 174.35 1nen s GLU 26 N 1.01 3.56 0.20 1.98 2.02 -1.26 -3.24 118.70 122.96 1nen s GLU 26 Ca 0.09 1.00 0.07 0.00 0.02 0.00 0.00 54.97 56.16 1nen s GLU 26 Cb -0.21 -4.04 -0.04 0.00 0.10 0.00 0.00 34.13 29.94 1nen s GLU 26 CO -0.06 -1.59 0.07 0.00 0.02 0.00 0.00 175.26 173.70 1nen s ALA 27 N 5.56 3.36 0.11 5.21 0.00 -0.48 -5.00 121.76 130.53 1nen s ALA 27 Ca 0.63 -1.38 -0.31 0.00 0.00 0.00 0.00 51.96 50.90 1nen s ALA 27 Cb -0.15 -1.11 -0.09 0.00 0.00 0.00 0.00 23.12 21.77 1nen s ALA 27 CO 0.33 0.42 1.55 -0.51 0.00 0.00 0.00 175.76 177.54 1nen s ASP 28 N -3.25 6.66 0.00 0.00 1.01 -1.26 -1.69 116.67 118.14 1nen s ASP 28 Ca 0.30 2.48 0.00 0.00 0.71 0.00 0.00 52.55 56.04 1nen s ASP 28 Cb -0.09 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.26 1nen s ASP 28 CO 0.21 -0.80 0.55 1.21 0.21 0.00 0.00 175.17 176.55 1nen n GLU 29 N 4.55 0.79 0.00 8.23 4.07 -1.26 -4.33 120.64 132.69 1nen n GLU 29 Ca 0.14 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.24 1nen n GLU 29 Cb 0.40 -1.24 0.00 0.00 -0.06 0.00 0.00 31.44 30.54 1nen n GLU 29 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1nen n GLY 30 N 0.18 -2.69 0.67 8.31 0.00 -1.26 -4.80 105.19 105.59 1nen n GLY 30 Ca 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 46.02 46.05 1nen n GLY 30 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nen n ARG 31 N -0.36 1.63 -3.62 1.61 1.74 -1.26 -5.14 116.66 111.26 1nen n ARG 31 Ca 0.00 -0.66 -0.33 0.00 -0.77 0.00 0.00 57.85 56.10 1nen n ARG 31 Cb 0.00 0.14 -0.05 0.00 -1.02 0.00 0.00 32.46 31.53 1nen n ARG 31 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1nen s ASP 32 N -1.53 6.55 0.21 0.55 1.11 -1.26 -5.00 116.67 117.29 1nen s ASP 32 Ca 0.02 0.69 0.04 0.00 0.18 0.00 0.00 52.55 53.48 1nen s ASP 32 Cb -0.00 -2.13 -0.05 0.00 1.07 0.00 0.00 42.92 41.81 1nen s ASP 32 CO 0.01 0.08 -0.04 0.00 1.18 0.00 0.00 175.17 176.40 1nen s MET 33 N -2.43 1.27 0.55 8.23 0.23 -1.26 -5.00 119.30 120.89 1nen s MET 33 Ca 0.39 -1.62 -0.10 0.00 -1.03 0.00 0.00 55.69 53.33 1nen s MET 33 Cb -0.13 -0.68 -0.05 0.00 -1.53 0.00 0.00 34.83 32.44 1nen s MET 33 CO 0.22 -0.02 0.94 -1.64 -2.03 0.00 0.00 175.02 172.48 1nen s MET 34 N -3.81 3.66 0.56 3.16 1.00 -1.26 -1.29 119.30 121.32 1nen s MET 34 Ca 0.25 0.62 0.26 0.00 0.00 0.00 0.00 55.69 56.81 1nen s MET 34 Cb 0.04 -2.19 1.64 0.00 0.00 0.00 0.00 34.83 34.32 1nen s MET 34 CO 0.07 -0.38 2.21 1.25 0.00 0.00 0.00 175.02 178.17 1nen h LEU 35 N 0.16 0.00 -0.45 -0.03 5.85 -0.76 -1.22 115.31 118.85 1nen h LEU 35 Ca -0.45 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.20 1nen h LEU 35 Cb 1.19 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 1nen h LEU 35 CO 0.62 0.01 0.01 0.25 -0.34 0.00 0.00 178.44 179.00 1nen h LEU 36 N 0.00 0.77 -0.18 2.25 5.85 -1.02 -2.01 115.31 120.98 1nen h LEU 36 Ca -0.00 -0.30 0.05 0.00 0.84 0.00 0.00 57.88 58.47 1nen h LEU 36 Cb 0.03 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 40.80 1nen h LEU 36 CO 0.00 0.88 -0.20 0.44 -0.34 0.00 0.00 178.44 179.23 1nen h ASP 37 N 0.64 -0.62 0.08 1.25 3.32 -1.49 0.12 116.42 119.72 1nen h ASP 37 Ca 0.13 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1nen h ASP 37 Cb 0.48 0.29 -0.02 0.00 0.22 0.00 0.00 39.33 40.30 1nen h ASP 37 CO 0.02 -0.24 -0.23 0.00 -1.72 0.00 0.00 179.24 177.07 1nen h ALA 38 N 0.84 -0.78 -0.87 3.45 0.00 -1.32 -2.09 119.26 118.48 1nen h ALA 38 Ca 0.12 -0.06 0.17 0.00 0.00 0.00 0.00 54.91 55.14 1nen h ALA 38 Cb 0.40 0.62 -0.16 0.00 0.00 0.00 0.00 17.79 18.64 1nen h ALA 38 CO -0.31 -0.83 -0.25 -0.07 0.00 0.00 0.00 179.25 177.78 1nen h LEU 39 N -0.35 -0.94 -1.05 0.00 3.38 -1.00 0.30 115.31 115.66 1nen h LEU 39 Ca -0.01 0.27 0.10 0.00 0.09 0.00 0.00 57.88 58.33 1nen h LEU 39 Cb 0.34 0.58 -0.07 0.00 0.09 0.00 0.00 40.66 41.60 1nen h LEU 39 CO -0.11 -0.29 0.63 0.40 0.09 0.00 0.00 178.44 179.15 1nen h ILE 40 N -0.01 0.99 0.54 1.22 2.04 -0.49 0.14 117.51 121.94 1nen h ILE 40 Ca 0.40 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.88 1nen h ILE 40 Cb 0.63 -0.14 0.01 0.00 -0.74 0.00 0.00 36.82 36.58 1nen h ILE 40 CO -0.90 0.19 -0.26 1.56 0.00 0.00 0.00 178.15 178.74 1nen h GLN 41 N 1.04 -0.70 -1.07 2.37 1.08 0.19 -3.05 115.11 114.98 1nen h GLN 41 Ca 0.46 0.05 0.29 0.00 -1.45 0.00 0.00 58.65 57.99 1nen h GLN 41 Cb 0.36 0.16 -0.08 0.00 -0.05 0.00 0.00 27.48 27.87 1nen h GLN 41 CO -0.21 -0.40 0.71 -0.07 -0.95 0.00 0.00 178.83 177.90 1nen h LEU 42 N -1.09 0.31 -0.66 1.46 3.38 -0.63 0.68 115.31 118.76 1nen h LEU 42 Ca -0.07 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1nen h LEU 42 Cb 0.62 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1nen h LEU 42 CO 0.12 0.06 0.00 0.50 0.09 0.00 0.00 178.44 179.21 1nen h LYS 43 N 0.27 0.00 0.10 1.13 3.64 -0.62 0.60 116.57 121.69 1nen h LYS 43 Ca 0.58 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.79 1nen h LYS 43 Cb 1.71 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 33.55 1nen h LYS 43 CO -0.21 0.00 -0.71 0.93 -2.27 0.00 0.00 179.45 177.19 1nen h GLU 44 N 0.00 0.30 -0.27 1.90 5.08 0.46 -2.62 114.58 119.43 1nen h GLU 44 Ca 0.00 -0.46 -0.02 0.00 -1.00 0.00 0.00 59.36 57.88 1nen h GLU 44 Cb 0.50 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 1nen h GLU 44 CO 0.00 1.19 0.10 -0.22 -1.00 0.00 0.00 179.01 179.09 1nen h LYS 45 N -0.36 0.41 -4.47 2.33 1.63 -1.06 -3.39 116.57 111.66 1nen h LYS 45 Ca -0.12 -0.08 -0.62 0.00 -0.85 0.00 0.00 60.65 58.98 1nen h LYS 45 Cb 1.53 -0.07 -0.38 0.00 -0.60 0.00 0.00 32.23 32.71 1nen h LYS 45 CO 0.13 0.45 -0.79 0.34 -3.45 0.00 0.00 179.45 176.14 1nen s ASP 46 N -5.72 4.02 0.11 4.20 2.15 0.21 -5.02 116.67 116.62 1nen s ASP 46 Ca -0.13 -1.26 -0.15 0.00 0.43 0.00 0.00 52.55 51.43 1nen s ASP 46 Cb 0.08 -1.27 -0.04 0.00 -0.30 0.00 0.00 42.92 41.39 1nen s ASP 46 CO 0.73 -0.23 1.52 -0.65 -0.17 0.00 0.00 175.17 176.37 1nen h PRO 47 N 7.90 0.67 -0.89 4.34 0.11 -1.68 -3.29 132.00 139.17 1nen h PRO 47 Ca -0.18 -0.25 0.26 0.00 0.11 0.00 0.00 66.00 65.94 1nen h PRO 47 Cb 1.06 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.09 1nen h PRO 47 CO 0.43 0.82 0.68 0.66 -0.21 0.00 0.00 178.00 180.38 1nen h SER 48 N 0.47 0.00 -2.40 -2.05 4.64 -1.96 -3.41 113.55 108.85 1nen h SER 48 Ca 0.09 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.83 1nen h SER 48 Cb 0.56 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.64 1nen h SER 48 CO 0.03 0.00 1.35 -0.22 -0.87 0.00 0.00 176.83 177.12 1nen s LEU 49 N -8.28 3.54 0.07 5.97 2.96 -1.24 -4.98 118.68 116.73 1nen s LEU 49 Ca -0.05 1.61 0.05 0.00 -0.22 0.00 0.00 54.13 55.52 1nen s LEU 49 Cb 0.21 -3.52 -0.04 0.00 0.50 0.00 0.00 46.19 43.34 1nen s LEU 49 CO 0.74 -1.75 -0.05 -0.94 -1.32 0.00 0.00 176.35 173.03 1nen s SER 50 N 6.75 4.71 -0.09 3.68 1.04 -1.26 -4.89 113.70 123.64 1nen s SER 50 Ca 0.88 -0.24 -0.31 0.00 0.48 0.00 0.00 55.95 56.76 1nen s SER 50 Cb -0.27 -1.04 0.12 0.00 0.10 0.00 0.00 66.02 64.92 1nen s SER 50 CO 0.34 0.20 1.00 0.72 0.98 0.00 0.00 173.24 176.49 1nen s PHE 51 N -1.20 -0.29 0.26 5.02 -0.71 -1.26 -3.10 117.98 116.70 1nen s PHE 51 Ca 0.22 0.28 -0.11 0.00 -1.04 0.00 0.00 56.93 56.28 1nen s PHE 51 Cb -0.11 0.51 -0.08 0.00 -1.21 0.00 0.00 43.02 42.13 1nen s PHE 51 CO 0.14 -0.40 0.61 1.03 -1.34 0.00 0.00 175.22 175.26 1nen s ARG 52 N -2.41 3.86 -0.12 1.99 0.52 -1.26 -5.05 118.95 116.47 1nen s ARG 52 Ca 0.04 0.39 -0.30 0.00 -0.52 0.00 0.00 55.73 55.34 1nen s ARG 52 Cb -0.01 -2.57 0.12 0.00 0.52 0.00 0.00 34.95 33.01 1nen s ARG 52 CO -0.05 0.26 0.98 -0.98 0.02 0.00 0.00 175.30 175.52 1nen s ARG 53 N -2.91 0.64 0.00 3.54 1.04 -1.26 -3.70 118.95 116.29 1nen s ARG 53 Ca 0.49 0.02 0.00 0.00 -1.04 0.00 0.00 55.73 55.21 1nen s ARG 53 Cb -0.11 0.30 0.00 0.00 -2.04 0.00 0.00 34.95 33.10 1nen s ARG 53 CO 0.21 -0.22 0.00 0.45 -0.04 0.00 0.00 175.30 175.69 1nen n SER 54 N 0.45 0.00 -0.51 -2.89 2.88 -1.26 -4.96 113.62 107.33 1nen n SER 54 Ca -0.09 0.00 0.43 0.00 -1.33 0.00 0.00 58.87 57.87 1nen n SER 54 Cb 0.59 0.00 0.66 0.00 -0.75 0.00 0.00 64.21 64.70 1nen n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nen n ARG 56 N -3.61 0.00 -0.19 0.00 0.63 -1.26 -4.78 116.66 107.46 1nen n ARG 56 Ca 0.36 0.00 0.09 0.00 -0.92 0.00 0.00 57.85 57.38 1nen n ARG 56 Cb 1.79 -3.91 0.16 0.00 0.45 0.00 0.00 32.46 30.95 1nen n ARG 56 CO 0.00 0.00 0.00 -0.85 -2.51 0.00 0.00 177.63 174.27 1nen n GLU 57 N -2.00 1.41 -2.47 -0.14 0.28 -1.26 -4.83 120.64 111.64 1nen n GLU 57 Ca 0.00 -2.72 -0.05 0.00 -0.16 0.00 0.00 57.16 54.22 1nen n GLU 57 Cb 0.00 -1.54 0.01 0.00 1.43 0.00 0.00 31.44 31.34 1nen n GLU 57 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1nen n GLY 58 N -1.34 0.40 0.00 -1.84 0.00 -1.26 -4.96 105.19 96.19 1nen n GLY 58 Ca 0.17 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1nen n GLY 58 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1nen n VAL 59 N -3.51 0.00 -0.10 1.61 0.31 -1.26 -4.87 118.33 110.51 1nen n VAL 59 Ca -0.03 -0.08 -0.13 0.00 -0.01 0.00 0.00 64.34 64.10 1nen n VAL 59 Cb 0.53 1.21 -0.14 0.00 -0.91 0.00 0.00 33.84 34.52 1nen n VAL 59 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1nen n GLY 61 N 1.91 0.73 0.18 0.00 0.00 -1.26 -4.83 105.19 101.92 1nen n GLY 61 Ca -0.36 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.53 1nen n GLY 61 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1nen h SER 62 N 0.00 -0.35 -0.05 1.61 0.02 -1.91 -3.35 113.55 109.52 1nen h SER 62 Ca 0.00 0.03 -0.27 0.00 -0.84 0.00 0.00 61.79 60.71 1nen h SER 62 Cb 0.00 0.11 -0.06 0.00 0.14 0.00 0.00 62.40 62.59 1nen h SER 62 CO 0.00 -0.22 0.22 -0.90 -1.14 0.00 0.00 176.83 174.79 1nen n ASP 63 N -5.26 5.78 -4.70 3.07 5.75 -1.24 -4.67 116.55 115.28 1nen n ASP 63 Ca -0.08 -2.53 -0.42 0.00 -0.01 0.00 0.00 54.79 51.75 1nen n ASP 63 Cb 0.18 -1.43 -0.03 0.00 -1.03 0.00 0.00 41.12 38.81 1nen n ASP 63 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1nen s GLY 64 N 1.94 2.67 0.01 6.12 0.00 -1.26 -1.52 107.32 115.29 1nen s GLY 64 Ca 0.67 0.48 -0.16 0.00 0.00 0.00 0.00 44.72 45.71 1nen s GLY 64 CO -0.02 1.79 0.34 1.08 0.00 0.00 0.00 173.10 176.29 1nen s LEU 65 N 1.42 0.74 -0.48 0.66 1.43 -0.29 -4.60 118.68 117.57 1nen s LEU 65 Ca 0.51 0.03 -0.21 0.00 -1.03 0.00 0.00 54.13 53.43 1nen s LEU 65 Cb -0.20 1.40 0.04 0.00 0.03 0.00 0.00 46.19 47.46 1nen s LEU 65 CO 0.24 -0.53 0.68 0.21 0.23 0.00 0.00 176.35 177.19 1nen s ASN 66 N -1.60 6.30 -0.37 2.29 3.84 0.36 -1.46 114.94 124.30 1nen s ASN 66 Ca -0.10 -0.52 -0.12 0.00 0.21 0.00 0.00 52.86 52.33 1nen s ASN 66 Cb -0.03 -2.33 0.02 0.00 -0.55 0.00 0.00 41.25 38.36 1nen s ASN 66 CO 0.02 -0.88 0.22 -0.04 -2.79 0.00 0.00 177.10 173.62 1nen s MET 67 N 2.93 2.97 -1.37 0.43 -1.94 0.11 -0.87 119.30 121.56 1nen s MET 67 Ca 0.21 -0.99 -0.05 0.00 -1.71 0.00 0.00 55.69 53.16 1nen s MET 67 Cb -0.15 -3.76 0.03 0.00 2.01 0.00 0.00 34.83 32.96 1nen s MET 67 CO 0.17 -0.65 0.87 0.09 -0.01 0.00 0.00 175.02 175.49 1nen n ASN 68 N 5.03 -2.91 0.00 3.03 3.02 0.13 -2.22 115.26 121.34 1nen n ASN 68 Ca -0.12 -0.76 0.00 0.00 -0.03 0.00 0.00 54.58 53.67 1nen n ASN 68 Cb 0.47 -4.22 0.00 0.00 -0.61 0.00 0.00 39.78 35.42 1nen n ASN 68 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1nen n GLY 69 N -1.61 0.91 3.04 7.41 0.00 -1.26 -5.02 105.19 108.65 1nen n GLY 69 Ca -0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.65 1nen n GLY 69 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1nen s LYS 70 N -0.07 1.04 0.27 1.61 2.20 -0.94 -5.10 119.74 118.75 1nen s LYS 70 Ca 0.00 -0.37 -0.27 0.00 -0.36 0.00 0.00 55.97 54.97 1nen s LYS 70 Cb 0.00 -0.97 -0.09 0.00 -1.51 0.00 0.00 37.83 35.26 1nen s LYS 70 CO 0.00 0.17 0.92 -0.80 -0.36 0.00 0.00 175.35 175.28 1nen s ASN 71 N 0.02 7.45 -0.03 1.43 0.01 -1.26 0.10 114.94 122.66 1nen s ASN 71 Ca -0.01 1.84 -0.30 0.00 -0.71 0.00 0.00 52.86 53.69 1nen s ASN 71 Cb -0.07 -2.58 0.11 0.00 0.41 0.00 0.00 41.25 39.12 1nen s ASN 71 CO 0.00 0.05 1.31 -0.83 -1.51 0.00 0.00 177.10 176.12 1nen s GLY 72 N -1.41 -0.25 -0.19 0.66 0.00 -0.53 -4.80 107.32 100.79 1nen s GLY 72 Ca 0.45 0.33 -0.20 0.00 0.00 0.00 0.00 44.72 45.29 1nen s GLY 72 CO 0.27 3.57 0.61 1.08 0.00 0.00 0.00 173.10 178.64 1nen s LEU 73 N -3.50 4.16 0.55 0.66 1.43 -1.26 -1.14 118.68 119.58 1nen s LEU 73 Ca 0.24 0.82 0.26 0.00 -1.03 0.00 0.00 54.13 54.42 1nen s LEU 73 Cb 0.02 -2.87 1.59 0.00 0.03 0.00 0.00 46.19 44.97 1nen s LEU 73 CO -0.02 -0.25 2.18 0.00 0.23 0.00 0.00 176.35 178.49 1nen h ALA 74 N 7.43 1.57 0.00 4.21 0.00 -1.62 -1.85 119.26 129.00 1nen h ALA 74 Ca -0.32 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1nen h ALA 74 Cb 1.15 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1nen h ALA 74 CO 0.77 0.05 0.00 0.00 0.00 0.00 0.00 179.25 180.07 1nen n ILE 76 N -2.25 0.23 -3.25 0.00 -5.35 -0.77 -4.72 119.36 103.25 1nen n ILE 76 Ca 0.03 -0.26 -0.45 0.00 -0.27 0.00 0.00 62.75 61.80 1nen n ILE 76 Cb 0.29 0.73 -0.05 0.00 -1.74 0.00 0.00 39.64 38.88 1nen n ILE 76 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 1nen s THR 77 N -0.29 5.07 0.38 7.28 2.01 -0.79 -5.00 115.64 124.30 1nen s THR 77 Ca 0.02 -1.27 -0.28 0.00 0.31 0.00 0.00 61.69 60.47 1nen s THR 77 Cb 0.02 -4.37 -0.11 0.00 0.01 0.00 0.00 72.50 68.05 1nen s THR 77 CO 0.00 -0.93 1.46 -2.84 -0.69 0.00 0.00 174.62 171.62 1nen s PRO 78 N 1.99 4.10 0.35 4.92 0.02 -1.26 -1.54 135.00 143.58 1nen s PRO 78 Ca 0.06 2.52 0.24 0.00 0.02 0.00 0.00 61.00 63.84 1nen s PRO 78 Cb -0.27 -2.95 1.27 0.00 0.02 0.00 0.00 34.50 32.56 1nen s PRO 78 CO 0.05 -0.52 1.73 0.82 -0.33 0.00 0.00 177.00 178.74 1nen h ILE 79 N 2.92 0.00 0.65 2.83 1.08 -1.50 -1.29 117.51 122.20 1nen h ILE 79 Ca -0.51 -0.02 -0.03 0.00 -0.39 0.00 0.00 64.86 63.91 1nen h ILE 79 Cb 1.24 0.56 0.01 0.00 -3.07 0.00 0.00 36.82 35.56 1nen h ILE 79 CO 0.64 0.00 -0.31 0.28 -0.69 0.00 0.00 178.15 178.07 1nen h SER 80 N 0.00 -0.74 -0.46 1.72 0.02 -1.90 -1.96 113.55 110.24 1nen h SER 80 Ca 0.00 -0.01 0.13 0.00 -0.84 0.00 0.00 61.79 61.07 1nen h SER 80 Cb 0.03 0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 1nen h SER 80 CO 0.00 -0.42 0.48 0.00 -1.14 0.00 0.00 176.83 175.75 1nen h ALA 81 N -0.80 2.19 -0.15 3.77 0.00 -1.60 -2.23 119.26 120.43 1nen h ALA 81 Ca -0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1nen h ALA 81 Cb 0.71 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1nen h ALA 81 CO 0.15 -0.72 0.00 1.28 0.00 0.00 0.00 179.25 179.96 1nen n LEU 82 N -3.73 3.15 -4.24 0.00 4.32 -1.08 -4.99 117.00 110.44 1nen n LEU 82 Ca 0.08 -2.94 -0.34 0.00 -0.02 0.00 0.00 56.01 52.79 1nen n LEU 82 Cb 0.67 -0.46 -0.15 0.00 -1.62 0.00 0.00 43.42 41.86 1nen n LEU 82 CO 0.28 0.68 -0.44 0.21 -1.22 0.00 0.00 177.39 176.90 1nen s ASN 83 N -2.20 3.85 -0.19 -1.43 2.47 -0.76 -4.73 114.94 111.95 1nen s ASN 83 Ca 0.35 -0.49 -0.04 0.00 0.42 0.00 0.00 52.86 53.10 1nen s ASN 83 Cb 0.29 -1.64 0.06 0.00 -1.45 0.00 0.00 41.25 38.51 1nen s ASN 83 CO 0.07 -0.01 0.06 -1.58 -3.72 0.00 0.00 177.10 171.91 1nen s GLN 84 N 1.41 0.43 0.04 0.43 0.74 -1.26 -4.99 119.66 116.45 1nen s GLN 84 Ca 0.05 -0.31 -0.37 0.00 0.05 0.00 0.00 55.36 54.79 1nen s GLN 84 Cb -0.14 -2.00 -0.19 0.00 1.10 0.00 0.00 33.01 31.79 1nen s GLN 84 CO -0.07 -0.66 0.94 -2.30 -0.55 0.00 0.00 175.29 172.64 1nen n PRO 85 N 5.13 0.00 0.00 1.67 -0.02 -1.26 -1.37 135.00 139.15 1nen n PRO 85 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.40 1nen n PRO 85 Cb 0.48 -1.37 0.00 0.00 -0.02 0.00 0.00 33.50 32.59 1nen n PRO 85 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nen n GLY 86 N 1.56 2.59 3.93 -1.23 0.00 -1.26 -4.99 105.19 105.79 1nen n GLY 86 Ca 0.19 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.89 1nen n GLY 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nen s LYS 87 N 0.00 3.47 0.53 1.61 1.02 -0.47 -5.12 119.74 120.79 1nen s LYS 87 Ca 0.00 -0.47 -0.02 0.00 0.02 0.00 0.00 55.97 55.50 1nen s LYS 87 Cb 0.00 -2.93 0.01 0.00 -0.52 0.00 0.00 37.83 34.39 1nen s LYS 87 CO 0.00 0.50 0.79 0.15 -0.92 0.00 0.00 175.35 175.87 1nen s LYS 88 N -3.11 2.85 -0.53 1.68 1.02 -1.26 -4.61 119.74 115.77 1nen s LYS 88 Ca 0.36 -0.37 -0.17 0.00 0.02 0.00 0.00 55.97 55.82 1nen s LYS 88 Cb -0.11 -2.42 0.11 0.00 -0.52 0.00 0.00 37.83 34.88 1nen s LYS 88 CO 0.28 -0.57 0.53 0.42 -0.92 0.00 0.00 175.35 175.09 1nen s ILE 89 N -2.79 5.12 -0.24 2.17 1.01 -0.12 -4.87 121.20 121.47 1nen s ILE 89 Ca 0.53 -1.25 -0.28 0.00 0.00 0.00 0.00 60.65 59.65 1nen s ILE 89 Cb -0.10 -4.32 0.01 0.00 0.01 0.00 0.00 42.46 38.05 1nen s ILE 89 CO 0.41 -0.86 0.97 -0.69 0.00 0.00 0.00 174.94 174.77 1nen s VAL 90 N 1.89 4.71 -0.14 2.92 1.01 -1.26 0.08 120.40 129.61 1nen s VAL 90 Ca 0.06 1.84 0.03 0.00 0.00 0.00 0.00 61.98 63.90 1nen s VAL 90 Cb -0.27 -4.26 0.01 0.00 0.00 0.00 0.00 36.38 31.86 1nen s VAL 90 CO 0.05 -0.18 -0.22 -0.63 0.00 0.00 0.00 175.10 174.12 1nen s ILE 91 N 3.13 2.06 0.21 2.22 1.01 0.12 0.17 121.20 130.10 1nen s ILE 91 Ca 0.41 -0.98 0.00 0.00 0.00 0.00 0.00 60.65 60.08 1nen s ILE 91 Cb -0.15 -1.81 -0.05 0.00 0.01 0.00 0.00 42.46 40.46 1nen s ILE 91 CO 0.07 0.55 0.08 -0.13 0.00 0.00 0.00 174.94 175.51 1nen s ARG 92 N 0.78 1.22 1.03 2.79 0.52 -0.05 -1.91 118.95 123.32 1nen s ARG 92 Ca -0.08 -1.63 -0.13 0.00 -0.52 0.00 0.00 55.73 53.37 1nen s ARG 92 Cb -0.16 -0.06 0.21 0.00 0.52 0.00 0.00 34.95 35.46 1nen s ARG 92 CO -0.01 -0.28 1.09 -2.14 0.02 0.00 0.00 175.30 173.99 1nen s PRO 93 N -4.04 0.17 0.19 3.54 0.02 -1.26 -0.49 135.00 133.14 1nen s PRO 93 Ca 0.33 0.44 -0.30 0.00 0.02 0.00 0.00 61.00 61.49 1nen s PRO 93 Cb 0.07 -1.71 -0.08 0.00 0.02 0.00 0.00 34.50 32.79 1nen s PRO 93 CO 0.09 -2.89 1.24 -0.51 -0.33 0.00 0.00 177.00 174.61 1nen s LEU 94 N -6.54 4.44 0.86 -5.54 1.43 -1.26 -4.06 118.68 108.01 1nen s LEU 94 Ca 0.66 2.31 -0.13 0.00 -1.03 0.00 0.00 54.13 55.95 1nen s LEU 94 Cb -0.18 -3.61 0.07 0.00 0.03 0.00 0.00 46.19 42.51 1nen s LEU 94 CO 0.58 -0.44 0.93 -2.65 0.23 0.00 0.00 176.35 175.00 1nen n PRO 95 N 2.51 -0.08 0.00 1.29 -0.02 -1.26 -3.93 135.00 133.51 1nen n PRO 95 Ca 0.05 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 1nen n PRO 95 Cb 0.44 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 1nen n PRO 95 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1nen n GLY 96 N 0.82 1.11 3.77 -1.23 0.00 -1.26 -4.77 105.19 103.64 1nen n GLY 96 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 1nen n GLY 96 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nen s LEU 97 N 0.00 3.65 0.42 0.99 1.43 -1.25 -4.99 118.68 118.92 1nen s LEU 97 Ca 0.00 2.16 -0.25 0.00 -1.03 0.00 0.00 54.13 55.01 1nen s LEU 97 Cb 0.00 -4.58 -0.08 0.00 0.03 0.00 0.00 46.19 41.56 1nen s LEU 97 CO 0.00 -1.37 1.29 -2.84 0.23 0.00 0.00 176.35 173.66 1nen s PRO 98 N -3.49 3.90 -0.35 1.29 0.02 -1.26 -4.83 135.00 130.28 1nen s PRO 98 Ca 0.72 2.12 -0.18 0.00 0.02 0.00 0.00 61.00 63.68 1nen s PRO 98 Cb -0.24 -2.70 -0.00 0.00 0.02 0.00 0.00 34.50 31.58 1nen s PRO 98 CO 0.31 -0.54 0.50 0.08 -0.33 0.00 0.00 177.00 177.02 1nen s VAL 99 N -1.29 5.03 0.04 3.83 1.01 -1.26 -0.10 120.40 127.65 1nen s VAL 99 Ca 0.58 0.30 -0.17 0.00 0.00 0.00 0.00 61.98 62.69 1nen s VAL 99 Cb -0.37 -3.95 -0.23 0.00 0.00 0.00 0.00 36.38 31.82 1nen s VAL 99 CO 0.47 -0.21 1.14 0.40 0.00 0.00 0.00 175.10 176.91 1nen h ILE 100 N 5.61 1.36 -1.04 2.22 2.04 -0.78 -3.47 117.51 123.45 1nen h ILE 100 Ca -0.28 -2.15 0.20 0.00 1.00 0.00 0.00 64.86 63.63 1nen h ILE 100 Cb 1.13 2.49 -0.33 0.00 -0.74 0.00 0.00 36.82 39.36 1nen h ILE 100 CO 0.77 0.65 0.91 -0.60 0.00 0.00 0.00 178.15 179.87 1nen s ARG 101 N -3.27 0.03 1.85 2.37 3.52 -0.91 -4.74 118.95 117.81 1nen s ARG 101 Ca -0.12 0.04 0.00 0.00 -0.13 0.00 0.00 55.73 55.52 1nen s ARG 101 Cb 0.05 0.02 0.00 0.00 -1.56 0.00 0.00 34.95 33.46 1nen s ARG 101 CO 0.87 -0.00 0.00 -0.25 -0.81 0.00 0.00 175.30 175.10 1nen n ASP 102 N 1.51 0.00 -1.28 -2.12 8.00 -0.41 0.46 116.55 122.71 1nen n ASP 102 Ca -0.10 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.46 1nen n ASP 102 Cb 0.57 0.00 0.26 0.00 -0.02 0.00 0.00 41.12 41.93 1nen n ASP 102 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1nen n LEU 103 N 0.00 3.72 -4.46 0.64 4.77 -1.18 -4.66 117.00 115.84 1nen n LEU 103 Ca 0.00 -1.88 -0.40 0.00 -0.03 0.00 0.00 56.01 53.70 1nen n LEU 103 Cb 0.00 -0.54 -0.11 0.00 -2.33 0.00 0.00 43.42 40.44 1nen n LEU 103 CO 0.00 0.55 -0.15 -0.69 -1.33 0.00 0.00 177.39 175.77 1nen s VAL 104 N -1.93 4.89 0.05 4.08 1.01 0.17 -4.71 120.40 123.97 1nen s VAL 104 Ca 0.35 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.85 1nen s VAL 104 Cb 0.25 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 1nen s VAL 104 CO 0.14 -0.07 0.19 0.68 0.00 0.00 0.00 175.10 176.04 1nen s VAL 105 N 1.64 5.28 -0.21 2.92 -7.23 -1.26 -0.06 120.40 121.48 1nen s VAL 105 Ca 0.05 -0.41 -0.29 0.00 -1.81 0.00 0.00 61.98 59.51 1nen s VAL 105 Cb -0.18 -3.56 -0.01 0.00 0.56 0.00 0.00 36.38 33.19 1nen s VAL 105 CO 0.08 0.16 1.33 -0.62 -0.31 0.00 0.00 175.10 175.74 1nen s ASP 106 N -2.43 6.78 0.00 4.85 -1.08 0.85 -4.80 116.67 120.84 1nen s ASP 106 Ca 0.33 1.54 0.23 0.00 -0.52 0.00 0.00 52.55 54.13 1nen s ASP 106 Cb -0.13 -2.54 0.94 0.00 -1.46 0.00 0.00 42.92 39.73 1nen s ASP 106 CO 0.26 -0.93 1.66 0.23 0.52 0.00 0.00 175.17 176.91 1nen n MET 107 N 6.99 1.57 -0.07 4.34 2.81 -1.26 -4.30 117.12 127.20 1nen n MET 107 Ca 0.15 -0.84 -0.02 0.00 -1.81 0.00 0.00 57.70 55.18 1nen n MET 107 Cb 0.45 -1.40 -0.02 0.00 -0.71 0.00 0.00 33.22 31.54 1nen n MET 107 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1nen n GLY 108 N 1.08 -2.69 0.44 3.03 0.00 -1.26 -0.65 105.19 105.14 1nen n GLY 108 Ca 0.17 0.62 0.26 0.00 0.00 0.00 0.00 46.02 47.06 1nen n GLY 108 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1nen h GLN 109 N 0.00 0.00 0.47 1.61 4.20 -1.96 -1.30 115.11 118.12 1nen h GLN 109 Ca 0.03 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 1nen h GLN 109 Cb 0.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.85 1nen h GLN 109 CO -0.15 0.00 -0.23 0.35 -0.67 0.00 0.00 178.83 178.13 1nen h PHE 110 N 0.00 -0.58 -0.73 2.96 3.57 -1.22 -3.01 116.94 117.93 1nen h PHE 110 Ca 0.35 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.87 1nen h PHE 110 Cb 1.49 0.19 -0.04 0.00 2.79 0.00 0.00 35.95 40.39 1nen h PHE 110 CO 0.00 -0.26 0.48 1.88 -2.23 0.00 0.00 178.31 178.18 1nen h TYR 111 N -0.96 0.87 0.01 0.41 0.05 -0.88 -2.98 116.97 113.50 1nen h TYR 111 Ca -0.06 0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.74 1nen h TYR 111 Cb 0.59 -0.29 -0.02 0.00 1.01 0.00 0.00 36.73 38.02 1nen h TYR 111 CO 0.01 0.51 -0.17 0.00 -1.05 0.00 0.00 178.16 177.47 1nen h ALA 112 N 1.57 -0.66 -1.05 3.88 0.00 -1.22 -1.09 119.26 120.69 1nen h ALA 112 Ca 0.29 -0.03 0.28 0.00 0.00 0.00 0.00 54.91 55.45 1nen h ALA 112 Cb 0.03 0.62 -0.11 0.00 0.00 0.00 0.00 17.79 18.33 1nen h ALA 112 CO -0.08 -0.71 0.65 1.96 0.00 0.00 0.00 179.25 181.08 1nen h GLN 113 N -0.22 0.41 -0.31 0.00 1.08 -1.46 0.33 115.11 114.95 1nen h GLN 113 Ca 0.00 -0.02 0.04 0.00 -1.45 0.00 0.00 58.65 57.22 1nen h GLN 113 Cb 0.23 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.53 1nen h GLN 113 CO -0.10 0.27 0.08 -0.92 -0.95 0.00 0.00 178.83 177.21 1nen h TYR 114 N 0.42 0.13 -0.61 2.96 3.20 -1.09 -2.27 116.97 119.72 1nen h TYR 114 Ca 0.64 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 62.47 1nen h TYR 114 Cb 1.52 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 39.75 1nen h TYR 114 CO -0.00 0.04 0.16 0.93 -1.64 0.00 0.00 178.16 177.65 1nen h GLU 115 N 0.20 0.97 -0.95 1.82 5.08 0.73 -2.96 114.58 119.47 1nen h GLU 115 Ca 0.14 -0.23 0.28 0.00 -1.00 0.00 0.00 59.36 58.55 1nen h GLU 115 Cb 0.14 -0.13 -0.14 0.00 0.50 0.00 0.00 28.75 29.12 1nen h GLU 115 CO -0.17 0.88 0.43 0.87 -1.00 0.00 0.00 179.01 180.02 1nen h LYS 116 N 0.89 0.30 -0.03 2.33 1.57 -0.63 0.25 116.57 121.25 1nen h LYS 116 Ca 0.19 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1nen h LYS 116 Cb 0.33 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1nen h LYS 116 CO -0.00 0.20 0.00 0.44 -0.57 0.00 0.00 179.45 179.52 1nen n ILE 117 N -5.10 0.04 -3.16 1.86 -6.64 -1.12 -4.94 119.36 100.30 1nen n ILE 117 Ca 0.27 -0.05 -0.11 0.00 -1.77 0.00 0.00 62.75 61.09 1nen n ILE 117 Cb 0.83 -0.04 0.05 0.00 -1.44 0.00 0.00 39.64 39.04 1nen n ILE 117 CO 0.00 0.00 0.00 0.29 -1.77 0.00 0.00 176.55 175.07 1nen n LYS 118 N -0.46 -1.97 0.00 6.28 4.76 0.89 -4.84 118.16 122.81 1nen n LYS 118 Ca 0.05 1.00 0.00 0.00 -2.87 0.00 0.00 58.31 56.49 1nen n LYS 118 Cb 0.05 -5.72 0.00 0.00 -1.84 0.00 0.00 35.03 27.52 1nen n LYS 118 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1nen n PRO 119 N -2.84 0.00 -4.04 1.97 -0.02 -1.26 -4.74 135.00 124.07 1nen n PRO 119 Ca -0.05 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.35 1nen n PRO 119 Cb 0.59 -1.13 -0.10 0.00 -0.02 0.00 0.00 33.50 32.84 1nen n PRO 119 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1nen s TYR 120 N 0.09 0.41 0.62 6.00 -0.85 -1.26 -5.11 117.35 117.24 1nen s TYR 120 Ca 0.00 -0.84 -0.18 0.00 -0.52 0.00 0.00 57.07 55.53 1nen s TYR 120 Cb 0.00 -0.30 -0.03 0.00 0.38 0.00 0.00 41.96 42.01 1nen s TYR 120 CO 0.00 -0.31 1.12 -0.11 -1.52 0.00 0.00 175.55 174.73 1nen n LEU 121 N 0.67 4.79 -3.62 -3.49 7.94 -1.26 -5.00 117.00 117.03 1nen n LEU 121 Ca -0.18 0.82 -0.28 0.00 -1.11 0.00 0.00 56.01 55.27 1nen n LEU 121 Cb 0.59 -1.47 -0.16 0.00 0.53 0.00 0.00 43.42 42.91 1nen n LEU 121 CO 0.25 -1.44 -0.34 -0.76 -1.11 0.00 0.00 177.39 173.99 1nen s LEU 122 N -3.09 0.72 -0.25 -1.96 1.43 -1.26 -5.09 118.68 109.17 1nen s LEU 122 Ca 0.79 -0.93 0.01 0.00 -1.03 0.00 0.00 54.13 52.97 1nen s LEU 122 Cb -0.40 -0.39 0.07 0.00 0.03 0.00 0.00 46.19 45.49 1nen s LEU 122 CO 0.44 -0.37 -0.04 0.21 0.23 0.00 0.00 176.35 176.82 1nen s ASN 123 N 2.03 4.02 0.19 2.29 2.47 -1.26 -0.38 114.94 124.30 1nen s ASN 123 Ca 0.04 -1.32 0.04 0.00 0.42 0.00 0.00 52.86 52.04 1nen s ASN 123 Cb -0.16 -1.24 0.22 0.00 -1.45 0.00 0.00 41.25 38.61 1nen s ASN 123 CO -0.18 -0.25 0.88 -0.46 -3.72 0.00 0.00 177.10 173.36 1nen n ASN 124 N 4.62 0.11 0.00 -4.21 0.23 -1.26 -4.69 115.26 110.05 1nen n ASN 124 Ca -0.10 0.31 0.00 0.00 -0.53 0.00 0.00 54.58 54.25 1nen n ASN 124 Cb 0.43 -0.22 0.00 0.00 -2.08 0.00 0.00 39.78 37.91 1nen n ASN 124 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1nen n GLY 125 N -1.22 2.21 3.72 4.83 0.00 -1.26 -5.00 105.19 108.48 1nen n GLY 125 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1nen n GLY 125 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1nen s GLN 126 N -0.29 4.16 -0.48 1.61 0.74 -1.26 -3.49 119.66 120.65 1nen s GLN 126 Ca 0.00 2.50 -0.02 0.00 0.05 0.00 0.00 55.36 57.89 1nen s GLN 126 Cb 0.00 -3.10 -0.03 0.00 1.10 0.00 0.00 33.01 30.99 1nen s GLN 126 CO 0.00 -0.67 0.43 0.09 -0.55 0.00 0.00 175.29 174.58 1nen n ASN 127 N 3.71 -4.40 -4.73 6.67 3.02 -1.26 -4.97 115.26 113.30 1nen n ASN 127 Ca 0.14 -0.28 -0.42 0.00 -0.03 0.00 0.00 54.58 53.99 1nen n ASN 127 Cb 0.37 -2.87 -0.03 0.00 -0.61 0.00 0.00 39.78 36.64 1nen n ASN 127 CO 0.00 0.00 0.00 -2.84 -2.62 0.00 0.00 177.26 171.80 1nen s PRO 128 N -3.53 4.20 0.55 3.52 0.02 -1.23 -4.99 135.00 133.55 1nen s PRO 128 Ca 0.17 2.41 -0.19 0.00 0.02 0.00 0.00 61.00 63.42 1nen s PRO 128 Cb -0.02 -3.11 -0.05 0.00 0.02 0.00 0.00 34.50 31.33 1nen s PRO 128 CO 0.36 -0.58 1.10 -2.14 -0.33 0.00 0.00 177.00 175.41 1nen s PRO 129 N 0.43 3.38 0.08 5.54 0.02 -1.26 -4.97 135.00 138.22 1nen s PRO 129 Ca 0.66 1.48 -0.31 0.00 0.02 0.00 0.00 61.00 62.86 1nen s PRO 129 Cb -0.45 -2.02 -0.17 0.00 0.02 0.00 0.00 34.50 31.88 1nen s PRO 129 CO 0.38 -0.80 1.64 0.00 -0.33 0.00 0.00 177.00 177.89 1nen h ALA 130 N 1.05 -0.72 -3.00 -1.55 0.00 -2.02 -3.45 119.26 109.57 1nen h ALA 130 Ca -0.49 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1nen h ALA 130 Cb 1.25 0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.36 1nen h ALA 130 CO 0.57 -0.92 0.00 0.54 0.00 0.00 0.00 179.25 179.44 1nen n ARG 131 N -5.42 0.00 -2.27 0.00 1.74 -1.26 -5.11 116.66 104.34 1nen n ARG 131 Ca -0.12 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.71 1nen n ARG 131 Cb 0.31 0.00 0.08 0.00 -1.02 0.00 0.00 32.46 31.84 1nen n ARG 131 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 1nen s GLU 132 N 1.21 1.98 0.43 5.56 1.03 -1.26 -5.06 118.70 122.59 1nen s GLU 132 Ca 0.00 -0.45 -0.21 0.00 0.03 0.00 0.00 54.97 54.33 1nen s GLU 132 Cb 0.00 -2.19 -0.11 0.00 -0.80 0.00 0.00 34.13 31.03 1nen s GLU 132 CO 0.00 -1.35 0.96 -1.01 -1.33 0.00 0.00 175.26 172.53 1nen s HIS 133 N -3.25 3.30 -0.38 4.83 3.76 -1.26 -4.78 115.29 117.50 1nen s HIS 133 Ca 0.62 1.61 -0.29 0.00 -0.15 0.00 0.00 55.06 56.86 1nen s HIS 133 Cb -0.09 -2.87 -0.00 0.00 1.11 0.00 0.00 32.58 30.73 1nen s HIS 133 CO 0.45 -0.14 1.58 -1.17 -0.85 0.00 0.00 174.74 174.61 1nen s LEU 134 N -3.16 3.54 -0.19 0.89 2.96 -1.26 -4.96 118.68 116.50 1nen s LEU 134 Ca 0.62 1.01 -0.05 0.00 -0.22 0.00 0.00 54.13 55.49 1nen s LEU 134 Cb -0.10 -3.50 0.07 0.00 0.50 0.00 0.00 46.19 43.15 1nen s LEU 134 CO 0.14 -1.57 0.09 -1.58 -1.32 0.00 0.00 176.35 172.11 1nen s GLN 135 N 5.29 0.14 0.30 1.98 2.00 -1.26 -4.89 119.66 123.22 1nen s GLN 135 Ca 0.69 -0.18 -0.28 0.00 -2.00 0.00 0.00 55.36 53.59 1nen s GLN 135 Cb -0.17 -1.78 -0.09 0.00 0.80 0.00 0.00 33.01 31.76 1nen s GLN 135 CO 0.33 -0.71 0.99 -1.64 -0.50 0.00 0.00 175.29 173.75 1nen s MET 136 N 2.10 4.63 0.39 1.67 -1.94 -1.26 -4.80 119.30 120.10 1nen s MET 136 Ca 0.03 1.50 0.23 0.00 -1.71 0.00 0.00 55.69 55.73 1nen s MET 136 Cb -0.16 -3.00 1.31 0.00 2.01 0.00 0.00 34.83 34.98 1nen s MET 136 CO -0.12 0.29 1.63 -1.35 -0.01 0.00 0.00 175.02 175.45 1nen h PRO 137 N 3.53 0.13 -0.16 2.03 0.11 -2.00 1.20 132.00 136.84 1nen h PRO 137 Ca -0.46 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.55 1nen h PRO 137 Cb 1.20 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1nen h PRO 137 CO 0.66 0.09 -0.28 1.49 -0.21 0.00 0.00 178.00 179.75 1nen h GLU 138 N 0.13 0.30 0.23 1.05 4.81 -1.99 0.58 114.58 119.70 1nen h GLU 138 Ca 0.80 -0.11 -0.33 0.00 -0.13 0.00 0.00 59.36 59.59 1nen h GLU 138 Cb 2.22 -0.02 0.04 0.00 0.63 0.00 0.00 28.75 31.62 1nen h GLU 138 CO -0.56 0.56 -1.44 1.96 -0.73 0.00 0.00 179.01 178.80 1nen h GLN 139 N 0.27 0.56 0.00 1.92 4.20 0.93 -3.27 115.11 119.72 1nen h GLN 139 Ca 0.04 -0.92 -0.12 0.00 0.06 0.00 0.00 58.65 57.72 1nen h GLN 139 Cb 0.64 0.34 -0.02 0.00 0.30 0.00 0.00 27.48 28.74 1nen h GLN 139 CO 0.05 1.44 -0.56 -0.09 -0.67 0.00 0.00 178.83 178.99 1nen h ARG 140 N 0.17 0.00 -0.50 1.46 1.12 -0.40 -2.96 114.38 113.27 1nen h ARG 140 Ca -0.25 0.00 0.10 0.00 -1.11 0.00 0.00 59.98 58.72 1nen h ARG 140 Cb 2.13 0.00 -0.03 0.00 -0.01 0.00 0.00 29.97 32.06 1nen h ARG 140 CO 0.27 0.56 0.34 0.93 -3.11 0.00 0.00 179.97 178.97 1nen h GLU 141 N 0.00 0.24 0.00 0.20 5.08 0.11 -1.69 114.58 118.53 1nen h GLU 141 Ca -0.01 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1nen h GLU 141 Cb 1.03 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.22 1nen h GLU 141 CO 0.07 0.16 0.01 0.87 -1.00 0.00 0.00 179.01 179.12 1nen h LYS 142 N 0.25 0.00 0.00 2.33 1.57 -1.62 -1.68 116.57 117.41 1nen h LYS 142 Ca 0.23 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.91 1nen h LYS 142 Cb 0.59 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 1nen h LYS 142 CO -0.05 0.00 -0.63 -0.07 -0.57 0.00 0.00 179.45 178.14 1nen h LEU 143 N 0.00 0.00 -9.40 2.94 4.07 -1.50 -3.46 115.31 107.97 1nen h LEU 143 Ca 0.00 0.00 -0.62 0.00 0.08 0.00 0.00 57.88 57.34 1nen h LEU 143 Cb 0.02 0.00 0.10 0.00 1.08 0.00 0.00 40.66 41.86 1nen h LEU 143 CO 0.00 0.47 0.09 0.47 -1.08 0.00 0.00 178.44 178.40 1nen n ASP 144 N -3.15 1.06 0.00 -0.43 8.00 -0.64 -0.18 116.55 121.21 1nen n ASP 144 Ca 0.00 1.17 0.00 0.00 0.71 0.00 0.00 54.79 56.67 1nen n ASP 144 Cb 0.73 -1.24 0.00 0.00 -0.02 0.00 0.00 41.12 40.59 1nen n ASP 144 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nen n GLY 145 N 1.48 0.49 0.00 0.44 0.00 -1.26 -4.79 105.19 101.54 1nen n GLY 145 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1nen n GLY 145 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1nen n LEU 146 N 0.00 0.20 0.00 0.99 4.77 0.75 -4.61 117.00 119.10 1nen n LEU 146 Ca 0.00 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.68 1nen n LEU 146 Cb 0.08 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1nen n LEU 146 CO 0.00 0.05 0.25 0.00 -1.33 0.00 0.00 177.39 176.36 1nen n TYR 147 N -0.21 0.00 0.21 -1.77 4.11 -1.17 -4.65 117.16 113.68 1nen n TYR 147 Ca 0.00 -0.05 0.11 0.00 -0.00 0.00 0.00 57.90 57.96 1nen n TYR 147 Cb 0.07 -0.00 0.27 0.00 -0.00 0.00 0.00 39.34 39.68 1nen n TYR 147 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.86 177.25 1nen n GLU 148 N -0.05 2.39 -1.99 -3.48 4.71 -1.26 -4.94 120.64 116.03 1nen n GLU 148 Ca 0.00 -2.14 -0.41 0.00 -0.01 0.00 0.00 57.16 54.60 1nen n GLU 148 Cb 0.06 -1.48 -0.02 0.00 -1.01 0.00 0.00 31.44 28.99 1nen n GLU 148 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1nen n ILE 150 N 2.01 0.76 -3.68 0.00 -5.35 -1.26 -4.99 119.36 106.86 1nen n ILE 150 Ca 0.06 -0.88 -0.25 0.00 -0.27 0.00 0.00 62.75 61.40 1nen n ILE 150 Cb 0.40 0.69 0.07 0.00 -1.74 0.00 0.00 39.64 39.06 1nen n ILE 150 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1nen n LEU 151 N 0.82 -3.20 0.14 7.28 4.77 -1.26 -4.41 117.00 121.14 1nen n LEU 151 Ca 0.14 -0.60 0.02 0.00 -0.03 0.00 0.00 56.01 55.54 1nen n LEU 151 Cb 0.45 -2.92 0.09 0.00 -2.33 0.00 0.00 43.42 38.71 1nen n LEU 151 CO 0.10 0.61 0.49 0.00 -1.33 0.00 0.00 177.39 177.26 1nen n ALA 153 N -2.26 -0.12 -0.11 0.00 0.00 -1.26 -4.71 120.51 112.06 1nen n ALA 153 Ca 0.01 0.09 -0.13 0.00 0.00 0.00 0.00 53.44 53.41 1nen n ALA 153 Cb 0.70 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.12 1nen n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nen h SER 156 N -0.54 0.56 0.69 0.00 0.02 -1.96 0.23 113.55 112.56 1nen h SER 156 Ca -0.05 0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1nen h SER 156 Cb 0.41 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.88 1nen h SER 156 CO 0.09 0.28 0.00 0.74 -1.14 0.00 0.00 176.83 176.80 1nen h THR 157 N 0.59 0.00 -0.16 -2.27 2.02 -1.43 -2.58 112.91 109.09 1nen h THR 157 Ca 0.43 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 67.34 1nen h THR 157 Cb 0.80 1.05 0.00 0.00 -1.74 0.00 0.00 68.15 68.26 1nen h THR 157 CO -0.18 0.00 0.00 -1.20 0.37 0.00 0.00 175.52 174.51 1nen n SER 158 N -2.50 3.15 -4.40 4.18 7.64 0.81 -4.32 113.62 118.18 1nen n SER 158 Ca 0.01 -1.99 -0.39 0.00 1.01 0.00 0.00 58.87 57.51 1nen n SER 158 Cb 0.22 -0.09 -0.12 0.00 -1.01 0.00 0.00 64.21 63.22 1nen n SER 158 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nen h PRO 160 N 8.35 0.52 -0.46 0.00 0.11 -1.91 0.81 132.00 139.41 1nen h PRO 160 Ca -0.30 -0.03 0.08 0.00 0.11 0.00 0.00 66.00 65.86 1nen h PRO 160 Cb 1.13 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.10 1nen h PRO 160 CO 0.62 0.34 0.32 0.77 -0.21 0.00 0.00 178.00 179.84 1nen h SER 161 N 0.53 0.23 1.35 -2.05 0.02 -1.94 0.20 113.55 111.89 1nen h SER 161 Ca 0.46 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 61.29 1nen h SER 161 Cb 0.70 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.18 1nen h SER 161 CO -0.40 0.15 -0.60 0.15 -1.14 0.00 0.00 176.83 174.99 1nen h PHE 162 N 0.26 0.00 -0.35 3.45 3.57 -1.17 -2.15 116.94 120.55 1nen h PHE 162 Ca 0.21 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.61 1nen h PHE 162 Cb 0.49 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 1nen h PHE 162 CO -0.00 0.60 -0.17 -1.49 -2.23 0.00 0.00 178.31 175.02 1nen h TRP 163 N 0.00 0.84 -0.02 0.41 6.55 0.18 -2.36 115.95 121.55 1nen h TRP 163 Ca -0.01 -0.21 -0.20 0.00 0.95 0.00 0.00 58.89 59.43 1nen h TRP 163 Cb 1.44 -0.19 -0.01 0.00 -0.86 0.00 0.00 29.16 29.54 1nen h TRP 163 CO 0.00 0.93 -0.84 -1.49 -1.05 0.00 0.00 178.44 175.99 1nen h TRP 164 N 0.51 0.41 -2.03 0.49 -0.00 -1.37 -3.37 115.95 110.60 1nen h TRP 164 Ca 0.08 -0.21 -0.52 0.00 -0.00 0.00 0.00 58.89 58.24 1nen h TRP 164 Cb 0.71 -0.05 -0.41 0.00 -0.00 0.00 0.00 29.16 29.41 1nen h TRP 164 CO 0.06 1.00 -0.99 0.09 -0.00 0.00 0.00 178.44 178.60 1nen n ASN 165 N -3.73 2.27 -0.34 -3.49 3.02 -0.81 -4.92 115.26 107.26 1nen n ASN 165 Ca -0.04 -3.25 0.23 0.00 -0.03 0.00 0.00 54.58 51.48 1nen n ASN 165 Cb 0.78 -0.59 0.46 0.00 -0.61 0.00 0.00 39.78 39.82 1nen n ASN 165 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1nen h PRO 166 N 2.98 0.35 -0.01 3.52 0.11 -1.59 -1.03 132.00 136.33 1nen h PRO 166 Ca 0.11 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1nen h PRO 166 Cb 0.82 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.85 1nen h PRO 166 CO 0.62 0.23 -0.66 -0.40 -0.21 0.00 0.00 178.00 177.58 1nen n ASP 167 N -5.03 1.20 -0.13 -2.05 5.75 -1.26 -4.62 116.55 110.41 1nen n ASP 167 Ca 0.31 -1.10 -0.26 0.00 -0.01 0.00 0.00 54.79 53.73 1nen n ASP 167 Cb 0.95 0.80 -0.09 0.00 -1.03 0.00 0.00 41.12 41.74 1nen n ASP 167 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1nen n LYS 168 N -0.90 0.58 -2.85 0.11 5.02 -0.63 -4.90 118.16 114.59 1nen n LYS 168 Ca 0.05 0.30 -0.41 0.00 -2.02 0.00 0.00 58.31 56.23 1nen n LYS 168 Cb 0.32 -1.52 -0.04 0.00 -0.02 0.00 0.00 35.03 33.77 1nen n LYS 168 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1nen s PHE 169 N -2.53 3.54 0.19 2.13 5.36 -0.49 -3.09 117.98 123.09 1nen s PHE 169 Ca -0.36 1.43 -0.12 0.00 -0.96 0.00 0.00 56.93 56.91 1nen s PHE 169 Cb 0.12 -3.02 0.10 0.00 -0.34 0.00 0.00 43.02 39.89 1nen s PHE 169 CO 0.49 -0.09 1.85 0.82 -1.46 0.00 0.00 175.22 176.83 1nen h ILE 170 N 4.96 1.17 0.00 3.12 1.08 -1.66 -3.43 117.51 122.74 1nen h ILE 170 Ca -0.36 -0.34 0.00 0.00 -0.39 0.00 0.00 64.86 63.78 1nen h ILE 170 Cb 1.17 0.26 0.00 0.00 -3.07 0.00 0.00 36.82 35.19 1nen h ILE 170 CO 0.80 0.17 0.00 0.61 -0.69 0.00 0.00 178.15 179.04 1nen n GLY 171 N -1.23 1.70 0.19 5.37 0.00 -1.26 -4.44 105.19 105.52 1nen n GLY 171 Ca 0.05 -1.84 -0.06 0.00 0.00 0.00 0.00 46.02 44.17 1nen n GLY 171 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1nen h PRO 172 N 0.00 -0.13 -0.58 1.61 0.11 -1.94 -1.43 132.00 129.64 1nen h PRO 172 Ca 0.00 0.01 0.11 0.00 0.11 0.00 0.00 66.00 66.23 1nen h PRO 172 Cb 0.00 0.03 -0.11 0.00 0.11 0.00 0.00 31.00 31.03 1nen h PRO 172 CO 0.00 -0.09 -0.28 0.00 -0.21 0.00 0.00 178.00 177.42 1nen h ALA 173 N -0.67 0.09 -0.59 -0.75 0.00 -1.95 0.16 119.26 115.55 1nen h ALA 173 Ca 0.04 0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.11 1nen h ALA 173 Cb 0.24 0.68 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 1nen h ALA 173 CO -0.29 -0.60 0.29 0.78 0.00 0.00 0.00 179.25 179.43 1nen h GLY 174 N -0.13 0.88 1.06 0.00 0.00 -1.70 -1.44 103.07 101.73 1nen h GLY 174 Ca 0.25 -0.40 -0.21 0.00 0.00 0.00 0.00 47.33 46.97 1nen h GLY 174 CO -0.65 0.38 -0.78 1.41 0.00 0.00 0.00 176.54 176.90 1nen h LEU 175 N 0.82 0.81 -0.89 3.11 3.38 -0.15 -0.07 115.31 122.33 1nen h LEU 175 Ca 0.21 -0.69 0.10 0.00 0.09 0.00 0.00 57.88 57.59 1nen h LEU 175 Cb 0.07 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.50 1nen h LEU 175 CO -0.03 1.38 0.53 0.25 0.09 0.00 0.00 178.44 180.66 1nen h LEU 176 N 0.31 0.78 -0.61 1.67 5.85 -0.44 0.16 115.31 123.02 1nen h LEU 176 Ca -0.08 0.04 -0.14 0.00 0.84 0.00 0.00 57.88 58.54 1nen h LEU 176 Cb 1.43 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.34 1nen h LEU 176 CO 0.16 0.44 -0.44 0.00 -0.34 0.00 0.00 178.44 178.26 1nen h ALA 177 N 1.47 0.79 -0.26 1.25 0.00 -1.17 -1.81 119.26 119.53 1nen h ALA 177 Ca 0.43 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1nen h ALA 177 Cb 0.37 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1nen h ALA 177 CO -0.24 0.66 0.10 0.00 0.00 0.00 0.00 179.25 179.77 1nen h ALA 178 N 1.04 0.34 -0.67 0.00 0.00 0.70 -2.26 119.26 118.42 1nen h ALA 178 Ca 0.03 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.85 1nen h ALA 178 Cb 0.96 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 1nen h ALA 178 CO 0.09 -0.06 0.44 -0.92 0.00 0.00 0.00 179.25 178.79 1nen h TYR 179 N 0.27 0.79 -0.64 0.00 3.20 -0.65 -0.72 116.97 119.23 1nen h TYR 179 Ca 0.09 0.02 0.16 0.00 3.14 0.00 0.00 58.73 62.14 1nen h TYR 179 Cb 0.18 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.15 1nen h TYR 179 CO -0.01 0.47 0.45 -0.09 -1.64 0.00 0.00 178.16 177.34 1nen h ARG 180 N 0.83 0.15 0.00 1.82 2.43 -0.71 -1.41 114.38 117.49 1nen h ARG 180 Ca 0.26 -0.01 -0.27 0.00 -0.81 0.00 0.00 59.98 59.15 1nen h ARG 180 Cb 0.02 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.48 1nen h ARG 180 CO -0.07 0.10 -2.00 1.19 -1.51 0.00 0.00 179.97 177.68 1nen n PHE 181 N -4.41 0.42 -0.09 2.20 3.72 -0.48 -3.66 117.46 115.17 1nen n PHE 181 Ca 0.12 0.15 -0.00 0.00 -0.05 0.00 0.00 57.45 57.66 1nen n PHE 181 Cb 0.60 -1.00 0.27 0.00 -0.94 0.00 0.00 39.48 38.41 1nen n PHE 181 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 1nen h LEU 182 N 0.00 0.67 -3.50 4.37 3.38 -0.43 -2.85 115.31 116.95 1nen h LEU 182 Ca -0.35 -0.08 -0.18 0.00 0.09 0.00 0.00 57.88 57.36 1nen h LEU 182 Cb 1.92 -0.17 -0.11 0.00 0.09 0.00 0.00 40.66 42.40 1nen h LEU 182 CO 0.04 0.62 0.12 2.30 0.09 0.00 0.00 178.44 181.61 1nen n ILE 183 N -4.33 2.65 -3.34 1.22 -5.35 -0.60 -4.89 119.36 104.71 1nen n ILE 183 Ca 0.04 -2.12 -0.40 0.00 -0.27 0.00 0.00 62.75 60.00 1nen n ILE 183 Cb 0.17 -0.33 -0.09 0.00 -1.74 0.00 0.00 39.64 37.65 1nen n ILE 183 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1nen s ASP 184 N -1.84 6.27 0.55 7.28 -1.08 -1.08 -4.82 116.67 121.94 1nen s ASP 184 Ca 0.48 0.11 0.29 0.00 -0.52 0.00 0.00 52.55 52.90 1nen s ASP 184 Cb 0.41 -2.23 1.45 0.00 -1.46 0.00 0.00 42.92 41.09 1nen s ASP 184 CO 0.07 -0.30 1.93 0.28 0.52 0.00 0.00 175.17 177.67 1nen h SER 185 N 8.30 0.00 1.52 -0.34 0.02 -1.89 0.62 113.55 121.78 1nen h SER 185 Ca -0.30 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.64 1nen h SER 185 Cb 1.15 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.69 1nen h SER 185 CO 0.69 0.00 -0.04 0.03 -1.14 0.00 0.00 176.83 176.37 1nen h ARG 186 N 0.00 0.00 -5.79 3.45 3.08 -1.91 -3.44 114.38 109.76 1nen h ARG 186 Ca 0.32 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.79 1nen h ARG 186 Cb 1.34 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 31.31 1nen h ARG 186 CO -0.00 0.04 0.09 0.34 -1.07 0.00 0.00 179.97 179.37 1nen s ASP 187 N -6.03 6.79 -0.10 7.04 2.15 0.21 -4.60 116.67 122.12 1nen s ASP 187 Ca 0.04 0.95 0.17 0.00 0.43 0.00 0.00 52.55 54.14 1nen s ASP 187 Cb 0.07 -2.36 0.60 0.00 -0.30 0.00 0.00 42.92 40.93 1nen s ASP 187 CO 0.62 -0.20 1.52 0.35 -0.17 0.00 0.00 175.17 177.29 1nen n THR 188 N 4.30 1.76 -1.46 1.71 -2.24 0.49 -4.48 114.28 114.36 1nen n THR 188 Ca -0.02 -1.29 0.07 0.00 -2.27 0.00 0.00 64.05 60.54 1nen n THR 188 Cb 0.50 0.13 0.19 0.00 -2.10 0.00 0.00 70.33 69.05 1nen n THR 188 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1nen n GLU 189 N 0.70 1.49 -0.28 -0.78 -0.58 -1.25 -4.81 120.64 115.13 1nen n GLU 189 Ca 0.22 -3.10 0.08 0.00 -0.42 0.00 0.00 57.16 53.94 1nen n GLU 189 Cb 0.80 -1.57 0.31 0.00 -0.57 0.00 0.00 31.44 30.40 1nen n GLU 189 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 1nen h THR 190 N 0.79 0.96 -0.01 2.62 2.02 -1.90 0.22 112.91 117.61 1nen h THR 190 Ca -0.00 -0.29 -0.16 0.00 0.77 0.00 0.00 66.41 66.73 1nen h THR 190 Cb 1.01 0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 1nen h THR 190 CO 0.00 0.16 -0.73 0.44 0.37 0.00 0.00 175.52 175.76 1nen h ASP 191 N 0.86 0.05 -0.24 4.18 3.32 -1.97 -1.93 116.42 120.69 1nen h ASP 191 Ca 0.41 -0.04 -0.17 0.00 0.02 0.00 0.00 57.03 57.25 1nen h ASP 191 Cb 0.43 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.96 1nen h ASP 191 CO -0.17 0.76 -0.49 -1.28 -1.72 0.00 0.00 179.24 176.33 1nen h SER 192 N 0.03 0.90 -0.35 6.45 0.87 -1.66 -2.77 113.55 117.02 1nen h SER 192 Ca -0.01 -0.46 -0.02 0.00 -1.23 0.00 0.00 61.79 60.07 1nen h SER 192 Cb 1.28 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.97 1nen h SER 192 CO 0.10 1.24 0.13 0.03 -0.53 0.00 0.00 176.83 177.79 1nen h ARG 193 N 0.65 0.53 -0.33 2.24 3.08 -0.48 -2.78 114.38 117.29 1nen h ARG 193 Ca 0.03 -0.10 -0.05 0.00 0.07 0.00 0.00 59.98 59.93 1nen h ARG 193 Cb 1.08 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 31.03 1nen h ARG 193 CO 0.11 0.53 0.01 -0.07 -1.07 0.00 0.00 179.97 179.48 1nen h LEU 194 N 0.41 0.47 -1.08 3.04 3.38 -1.31 -1.91 115.31 118.31 1nen h LEU 194 Ca 0.11 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 57.91 1nen h LEU 194 Cb 0.21 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1nen h LEU 194 CO -0.01 0.53 -0.32 0.44 0.09 0.00 0.00 178.44 179.17 1nen h ASP 195 N 0.48 0.25 0.93 -0.43 3.32 -1.35 -2.01 116.42 117.61 1nen h ASP 195 Ca 0.11 -0.09 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 1nen h ASP 195 Cb 0.30 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 1nen h ASP 195 CO 0.01 0.57 -0.08 1.23 -1.72 0.00 0.00 179.24 179.24 1nen h GLY 196 N 1.08 0.00 -2.17 2.75 0.00 -1.07 -3.12 103.07 100.53 1nen h GLY 196 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1nen h GLY 196 CO 0.05 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.63 1nen n LEU 197 N -3.23 3.43 0.00 3.11 4.77 -0.77 -4.58 117.00 119.74 1nen n LEU 197 Ca 0.00 -1.70 0.14 0.00 -0.03 0.00 0.00 56.01 54.43 1nen n LEU 197 Cb 0.34 -0.30 0.80 0.00 -2.33 0.00 0.00 43.42 41.92 1nen n LEU 197 CO 0.29 0.79 0.99 -1.20 -1.33 0.00 0.00 177.39 176.94 1nen n SER 198 N 1.33 0.00 -2.96 -1.43 7.64 -1.13 -4.23 113.62 112.84 1nen n SER 198 Ca 0.19 -0.68 -0.08 0.00 1.01 0.00 0.00 58.87 59.31 1nen n SER 198 Cb 0.56 -0.07 0.07 0.00 -1.01 0.00 0.00 64.21 63.76 1nen n SER 198 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1nen n ASP 199 N -1.07 -2.12 0.16 6.43 5.75 -1.26 -4.94 116.55 119.49 1nen n ASP 199 Ca 0.19 -0.38 0.08 0.00 -0.01 0.00 0.00 54.79 54.67 1nen n ASP 199 Cb 0.13 -0.26 0.07 0.00 -1.03 0.00 0.00 41.12 40.03 1nen n ASP 199 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1nen h ALA 200 N -2.35 0.78 0.00 2.12 0.00 -2.00 -3.42 119.26 114.40 1nen h ALA 200 Ca -0.10 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.51 1nen h ALA 200 Cb 0.34 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1nen h ALA 200 CO 0.06 0.25 -1.14 1.19 0.00 0.00 0.00 179.25 179.61 1nen n PHE 201 N -3.03 0.00 -0.09 0.00 3.01 -1.26 -4.12 117.46 111.97 1nen n PHE 201 Ca 0.01 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.45 1nen n PHE 201 Cb 0.62 -0.48 -0.02 0.00 -0.01 0.00 0.00 39.48 39.59 1nen n PHE 201 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1nen n SER 202 N -4.16 -0.22 -0.04 4.37 7.64 -1.18 -3.52 113.62 116.51 1nen n SER 202 Ca -0.19 0.39 -0.07 0.00 1.01 0.00 0.00 58.87 60.00 1nen n SER 202 Cb 0.50 -0.05 -0.03 0.00 -1.01 0.00 0.00 64.21 63.61 1nen n SER 202 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1nen n VAL 203 N -4.28 0.47 0.70 0.44 0.31 -1.26 -2.28 118.33 112.43 1nen n VAL 203 Ca 0.01 -0.15 0.03 0.00 -0.01 0.00 0.00 64.34 64.21 1nen n VAL 203 Cb 0.06 -1.16 0.16 0.00 -0.91 0.00 0.00 33.84 31.99 1nen n VAL 203 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1nen n PHE 204 N -3.03 0.00 0.83 3.52 3.72 -1.23 -2.83 117.46 118.44 1nen n PHE 204 Ca -0.16 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.37 1nen n PHE 204 Cb 0.64 0.00 0.44 0.00 -0.94 0.00 0.00 39.48 39.62 1nen n PHE 204 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1nen n ARG 205 N -0.74 0.12 -2.20 -1.08 5.12 -1.23 -4.77 116.66 111.88 1nen n ARG 205 Ca 0.04 0.08 -0.43 0.00 -1.93 0.00 0.00 57.85 55.61 1nen n ARG 205 Cb 0.02 -1.62 -0.02 0.00 -1.16 0.00 0.00 32.46 29.68 1nen n ARG 205 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1nen n HIS 207 N 7.34 1.73 -3.71 0.00 8.25 -1.26 -4.96 115.22 122.60 1nen n HIS 207 Ca 0.16 -0.71 -0.22 0.00 -0.26 0.00 0.00 57.72 56.70 1nen n HIS 207 Cb 0.44 -0.40 0.03 0.00 1.12 0.00 0.00 29.99 31.18 1nen n HIS 207 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1nen n SER 208 N 0.61 -1.27 0.13 0.41 7.64 -1.26 -4.90 113.62 114.98 1nen n SER 208 Ca 0.26 -0.82 0.00 0.00 1.01 0.00 0.00 58.87 59.32 1nen n SER 208 Cb 1.06 -4.04 0.08 0.00 -1.01 0.00 0.00 64.21 60.30 1nen n SER 208 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1nen h ILE 209 N -1.88 1.17 -2.69 0.44 2.04 -1.99 -3.48 117.51 111.13 1nen h ILE 209 Ca -0.61 -2.38 -0.38 0.00 1.00 0.00 0.00 64.86 62.49 1nen h ILE 209 Cb 1.36 2.39 -0.02 0.00 -0.74 0.00 0.00 36.82 39.81 1nen h ILE 209 CO 0.57 0.61 -0.48 0.23 0.00 0.00 0.00 178.15 179.08 1nen n MET 210 N -3.40 -1.51 0.09 2.37 2.81 -1.26 -4.89 117.12 111.33 1nen n MET 210 Ca 0.01 0.91 -0.02 0.00 -1.81 0.00 0.00 57.70 56.79 1nen n MET 210 Cb 0.72 -5.46 -0.05 0.00 -0.71 0.00 0.00 33.22 27.72 1nen n MET 210 CO 0.00 0.00 0.00 -0.91 1.51 0.00 0.00 175.97 176.57 1nen h ASN 211 N -0.00 0.00 0.37 7.83 -0.26 -1.93 -2.98 115.58 118.60 1nen h ASN 211 Ca -0.45 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.27 1nen h ASN 211 Cb 1.33 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.59 1nen h ASN 211 CO 0.53 0.74 -0.18 0.00 -1.06 0.00 0.00 177.43 177.46 1nen h VAL 213 N -0.61 1.08 -0.99 0.00 2.07 -1.80 -2.21 116.25 113.79 1nen h VAL 213 Ca -0.05 -0.38 0.16 0.00 0.82 0.00 0.00 66.70 67.26 1nen h VAL 213 Cb 0.45 -0.12 -0.10 0.00 -1.52 0.00 0.00 31.29 29.99 1nen h VAL 213 CO 0.08 0.20 0.60 -1.28 0.02 0.00 0.00 177.57 177.20 1nen h SER 214 N 1.10 0.81 -0.02 0.57 0.87 -1.30 -3.13 113.55 112.46 1nen h SER 214 Ca 0.41 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 61.05 1nen h SER 214 Cb 0.15 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 1nen h SER 214 CO -0.17 0.34 -0.00 1.33 -0.53 0.00 0.00 176.83 177.80 1nen n VAL 215 N -4.73 0.00 -2.04 2.23 0.24 -0.87 -5.00 118.33 108.16 1nen n VAL 215 Ca 0.21 -0.50 -0.43 0.00 -2.04 0.00 0.00 64.34 61.59 1nen n VAL 215 Cb 0.49 1.32 -0.03 0.00 -1.47 0.00 0.00 33.84 34.16 1nen n VAL 215 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1nen h PRO 217 N 12.10 0.47 -0.42 0.00 0.11 -1.92 0.62 132.00 142.96 1nen h PRO 217 Ca -0.34 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1nen h PRO 217 Cb 1.16 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1nen h PRO 217 CO 1.02 0.31 0.00 1.63 -0.21 0.00 0.00 178.00 180.76 1nen n LYS 218 N -4.94 1.99 -3.08 1.05 4.76 -1.26 -4.91 118.16 111.78 1nen n LYS 218 Ca 0.29 -1.38 -0.22 0.00 -2.87 0.00 0.00 58.31 54.12 1nen n LYS 218 Cb 0.83 -1.36 0.03 0.00 -1.84 0.00 0.00 35.03 32.70 1nen n LYS 218 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1nen n GLY 219 N 1.01 -0.52 3.89 0.72 0.00 0.22 -4.97 105.19 105.54 1nen n GLY 219 Ca 0.13 0.12 -0.29 0.00 0.00 0.00 0.00 46.02 45.97 1nen n GLY 219 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nen s LEU 220 N -6.63 3.30 -0.59 0.99 1.43 -1.26 -5.06 118.68 110.87 1nen s LEU 220 Ca 0.32 1.18 0.05 0.00 -1.03 0.00 0.00 54.13 54.64 1nen s LEU 220 Cb -0.15 -4.15 0.17 0.00 0.03 0.00 0.00 46.19 42.10 1nen s LEU 220 CO 0.39 -0.86 0.43 0.21 0.23 0.00 0.00 176.35 176.75 1nen s ASN 221 N -4.19 3.50 0.34 2.29 3.84 -1.26 -4.56 114.94 114.90 1nen s ASN 221 Ca 0.53 -3.54 0.02 0.00 0.21 0.00 0.00 52.86 50.08 1nen s ASN 221 Cb -0.11 -1.17 0.60 0.00 -0.55 0.00 0.00 41.25 40.03 1nen s ASN 221 CO 0.50 -0.12 1.99 -0.65 -2.79 0.00 0.00 177.10 176.03 1nen h PRO 222 N 5.51 0.89 -0.24 0.43 0.11 -1.92 -2.59 132.00 134.19 1nen h PRO 222 Ca 0.19 -0.05 0.06 0.00 0.11 0.00 0.00 66.00 66.31 1nen h PRO 222 Cb 0.82 -0.20 -0.06 0.00 0.11 0.00 0.00 31.00 31.66 1nen h PRO 222 CO 0.58 0.59 -0.18 1.79 -0.21 0.00 0.00 178.00 180.57 1nen h THR 223 N 0.91 0.51 -0.85 -1.15 1.35 -1.94 0.26 112.91 112.00 1nen h THR 223 Ca 0.27 0.00 0.03 0.00 -0.55 0.00 0.00 66.41 66.16 1nen h THR 223 Cb -0.02 0.51 -0.05 0.00 -1.73 0.00 0.00 68.15 66.86 1nen h THR 223 CO -0.07 0.00 0.56 -0.09 -0.25 0.00 0.00 175.52 175.67 1nen h ARG 224 N -0.17 1.05 -0.15 4.72 2.43 -1.90 0.01 114.38 120.37 1nen h ARG 224 Ca 0.13 -0.06 -0.19 0.00 -0.81 0.00 0.00 59.98 59.05 1nen h ARG 224 Cb 0.37 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1nen h ARG 224 CO -0.34 0.69 -0.69 0.00 -1.51 0.00 0.00 179.97 178.13 1nen h ALA 225 N 1.50 0.51 -0.32 2.80 0.00 -1.26 -2.56 119.26 119.91 1nen h ALA 225 Ca 0.33 -0.57 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 1nen h ALA 225 Cb -0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1nen h ALA 225 CO -0.09 0.71 -0.12 0.82 0.00 0.00 0.00 179.25 180.57 1nen h ILE 226 N 0.44 1.24 -0.06 0.00 2.04 0.23 -1.95 117.51 119.45 1nen h ILE 226 Ca -0.02 -1.05 -0.06 0.00 1.00 0.00 0.00 64.86 64.73 1nen h ILE 226 Cb 1.28 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 38.47 1nen h ILE 226 CO 0.13 0.35 -0.23 1.23 0.00 0.00 0.00 178.15 179.63 1nen h GLY 227 N 0.94 0.12 1.61 5.37 0.00 -0.73 -0.50 103.07 109.88 1nen h GLY 227 Ca 0.09 -0.08 -0.23 0.00 0.00 0.00 0.00 47.33 47.11 1nen h GLY 227 CO 0.03 0.07 -1.00 0.45 0.00 0.00 0.00 176.54 176.09 1nen h HIS 228 N 0.10 0.52 -0.05 5.60 3.86 -1.04 -2.53 115.15 121.61 1nen h HIS 228 Ca 0.02 -0.31 -0.00 0.00 -1.16 0.00 0.00 60.37 58.92 1nen h HIS 228 Cb 0.46 -0.05 -0.00 0.00 1.06 0.00 0.00 27.41 28.88 1nen h HIS 228 CO 0.00 1.15 0.02 0.82 0.86 0.00 0.00 177.93 180.78 1nen h ILE 229 N 0.17 1.17 -0.94 2.45 2.04 -0.78 -0.66 117.51 120.96 1nen h ILE 229 Ca -0.09 -0.50 0.14 0.00 1.00 0.00 0.00 64.86 65.41 1nen h ILE 229 Cb 1.66 1.41 -0.09 0.00 -0.74 0.00 0.00 36.82 39.07 1nen h ILE 229 CO 0.17 0.14 0.55 0.11 0.00 0.00 0.00 178.15 179.12 1nen h LYS 230 N -0.11 0.80 -0.40 2.37 1.57 -1.12 0.66 116.57 120.33 1nen h LYS 230 Ca 0.02 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 1nen h LYS 230 Cb 0.21 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1nen h LYS 230 CO -0.00 0.53 0.02 0.77 -0.57 0.00 0.00 179.45 180.20 1nen h SER 231 N 0.82 0.68 -0.54 0.86 0.02 -0.97 -1.80 113.55 112.62 1nen h SER 231 Ca 0.49 -0.29 0.04 0.00 -0.84 0.00 0.00 61.79 61.19 1nen h SER 231 Cb 0.60 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.91 1nen h SER 231 CO -0.31 0.80 0.30 0.24 -1.14 0.00 0.00 176.83 176.72 1nen h MET 232 N 0.53 0.56 -0.72 3.45 2.86 0.22 -0.42 114.93 121.41 1nen h MET 232 Ca 0.12 -0.03 0.10 0.00 -2.06 0.00 0.00 59.70 57.83 1nen h MET 232 Cb 0.44 -0.13 -0.08 0.00 0.06 0.00 0.00 31.60 31.90 1nen h MET 232 CO 0.02 0.37 0.35 -0.07 1.06 0.00 0.00 176.91 178.64 1nen h LEU 233 N 0.58 0.44 -0.77 1.22 3.38 -0.47 0.76 115.31 120.45 1nen h LEU 233 Ca 0.23 0.07 -0.11 0.00 0.09 0.00 0.00 57.88 58.16 1nen h LEU 233 Cb 0.09 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1nen h LEU 233 CO -0.13 0.24 -0.21 -0.07 0.09 0.00 0.00 178.44 178.35 1nen h LEU 234 N 0.58 0.71 -0.52 1.67 3.38 -0.47 0.62 115.31 121.29 1nen h LEU 234 Ca 0.36 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 58.02 1nen h LEU 234 Cb 0.42 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1nen h LEU 234 CO -0.29 0.91 0.05 -0.61 0.09 0.00 0.00 178.44 178.59 1nen h GLN 235 N 0.62 0.88 0.00 1.13 5.75 0.14 -3.15 115.11 120.48 1nen h GLN 235 Ca 0.09 -0.25 -0.06 0.00 -0.15 0.00 0.00 58.65 58.28 1nen h GLN 235 Cb 0.70 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 29.15 1nen h GLN 235 CO 0.05 0.88 -0.52 -0.09 -2.65 0.00 0.00 178.83 176.50 1nen h ARG 236 N 0.75 0.00 -1.75 1.69 2.43 -0.60 -3.39 114.38 113.51 1nen h ARG 236 Ca 0.15 0.00 -0.54 0.00 -0.81 0.00 0.00 59.98 58.78 1nen h ARG 236 Cb 0.45 0.00 -0.41 0.00 -0.42 0.00 0.00 29.97 29.58 1nen h ARG 236 CO 0.02 0.21 -0.84 0.09 -1.51 0.00 0.00 179.97 177.94 1nen n ASN 237 N -3.05 3.61 0.00 -3.80 5.03 0.21 -5.08 115.26 112.19 1nen n ASN 237 Ca 0.01 -3.46 0.00 0.00 0.87 0.00 0.00 54.58 52.00 1nen n ASN 237 Cb 0.64 -0.52 0.00 0.00 -1.02 0.00 0.00 39.78 38.88 1nen n ASN 237 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43