#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1niu s ASP 3 N 0.00 0.91 -0.01 1.20 1.01 -1.26 -4.69 116.67 113.82 1niu s ASP 3 Ca 0.00 -1.09 -0.06 0.00 0.71 0.00 0.00 52.55 52.12 1niu s ASP 3 Cb 0.00 0.15 0.00 0.00 1.01 0.00 0.00 42.92 44.09 1niu s ASP 3 CO 0.00 -0.56 0.12 0.72 0.21 0.00 0.00 175.17 175.66 1niu s PHE 4 N -3.75 0.00 -0.25 4.23 -0.71 -1.26 -4.74 117.98 111.50 1niu s PHE 4 Ca 0.17 -0.01 0.10 0.00 -1.04 0.00 0.00 56.93 56.15 1niu s PHE 4 Cb 0.06 -0.03 0.46 0.00 -1.21 0.00 0.00 43.02 42.30 1niu s PHE 4 CO -0.02 -0.20 1.34 0.72 -1.34 0.00 0.00 175.22 175.71 1niu n HIS 5 N 2.00 0.52 -4.17 3.49 8.25 -1.26 -4.97 115.22 119.08 1niu n HIS 5 Ca -0.19 -1.54 -0.16 0.00 -0.26 0.00 0.00 57.72 55.57 1niu n HIS 5 Cb 0.57 -0.36 -0.14 0.00 1.12 0.00 0.00 29.99 31.18 1niu n HIS 5 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 1niu s ARG 6 N -3.24 0.52 -1.37 -0.41 3.52 -1.26 -5.06 118.95 111.64 1niu s ARG 6 Ca 0.41 -0.40 -0.09 0.00 -0.13 0.00 0.00 55.73 55.52 1niu s ARG 6 Cb 0.39 -0.44 0.09 0.00 -1.56 0.00 0.00 34.95 33.43 1niu s ARG 6 CO -0.04 0.11 2.26 -0.25 -0.81 0.00 0.00 175.30 176.58 1niu n ASP 7 N 2.45 6.45 -3.69 -2.12 8.00 -1.26 -4.76 116.55 121.62 1niu n ASP 7 Ca -0.16 -3.00 -0.12 0.00 0.71 0.00 0.00 54.79 52.23 1niu n ASP 7 Cb 0.57 -1.48 -0.12 0.00 -0.02 0.00 0.00 41.12 40.07 1niu n ASP 7 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1niu s THR 8 N 0.56 -0.20 0.16 -3.53 2.01 -1.26 -2.43 115.64 110.95 1niu s THR 8 Ca 0.50 0.16 -0.20 0.00 0.31 0.00 0.00 61.69 62.47 1niu s THR 8 Cb 0.14 -0.50 0.05 0.00 0.01 0.00 0.00 72.50 72.21 1niu s THR 8 CO -0.05 0.07 0.53 -1.66 -0.69 0.00 0.00 174.62 172.82 1niu s TRP 9 N 1.74 -0.35 0.06 4.92 -2.14 -0.58 -4.40 118.94 118.19 1niu s TRP 9 Ca -0.06 0.07 0.07 0.00 2.66 0.00 0.00 56.10 58.85 1niu s TRP 9 Cb -0.10 0.44 -0.03 0.00 -3.10 0.00 0.00 33.47 30.68 1niu s TRP 9 CO -0.10 -0.83 -0.17 0.00 -2.66 0.00 0.00 176.95 173.18 1niu s ALA 10 N -3.79 2.65 -0.02 2.67 0.00 -0.29 -0.48 121.76 122.50 1niu s ALA 10 Ca 0.03 -1.23 0.06 0.00 0.00 0.00 0.00 51.96 50.82 1niu s ALA 10 Cb -0.00 -0.74 -0.02 0.00 0.00 0.00 0.00 23.12 22.36 1niu s ALA 10 CO -0.10 0.58 -0.20 -1.21 0.00 0.00 0.00 175.76 174.83 1niu s GLU 11 N -1.67 2.26 -0.18 0.00 2.02 0.14 -1.01 118.70 120.26 1niu s GLU 11 Ca 0.16 -0.84 0.01 0.00 0.02 0.00 0.00 54.97 54.31 1niu s GLU 11 Cb -0.11 -2.19 0.03 0.00 0.10 0.00 0.00 34.13 31.96 1niu s GLU 11 CO 0.07 0.58 -0.14 0.08 0.02 0.00 0.00 175.26 175.88 1niu s VAL 12 N -0.69 1.69 -0.59 2.63 1.01 -0.35 -1.75 120.40 122.34 1niu s VAL 12 Ca 0.11 -0.85 -0.23 0.00 0.00 0.00 0.00 61.98 61.01 1niu s VAL 12 Cb -0.10 -1.65 0.06 0.00 0.00 0.00 0.00 36.38 34.69 1niu s VAL 12 CO 0.00 0.35 0.90 -0.62 0.00 0.00 0.00 175.10 175.74 1niu s ASP 13 N 1.41 6.25 0.32 3.32 -1.08 0.26 -1.69 116.67 125.45 1niu s ASP 13 Ca 0.02 -0.72 0.26 0.00 -0.52 0.00 0.00 52.55 51.59 1niu s ASP 13 Cb -0.14 -2.41 0.99 0.00 -1.46 0.00 0.00 42.92 39.90 1niu s ASP 13 CO -0.10 -1.27 1.77 -0.07 0.52 0.00 0.00 175.17 176.02 1niu h LEU 14 N 10.95 0.00 -0.50 -1.34 3.38 -1.23 -2.81 115.31 123.77 1niu h LEU 14 Ca -0.28 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.54 1niu h LEU 14 Cb 1.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1niu h LEU 14 CO 1.11 0.00 -0.49 0.44 0.09 0.00 0.00 178.44 179.59 1niu h ASP 15 N 0.00 0.73 -0.68 -0.43 3.32 -1.91 -1.60 116.42 115.86 1niu h ASP 15 Ca 0.00 -0.37 -0.02 0.00 0.02 0.00 0.00 57.03 56.66 1niu h ASP 15 Cb 0.51 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.82 1niu h ASP 15 CO 0.00 1.10 0.33 0.00 -1.72 0.00 0.00 179.24 178.95 1niu h ALA 16 N 0.92 0.87 -0.48 3.45 0.00 -1.83 -1.15 119.26 121.05 1niu h ALA 16 Ca 0.02 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1niu h ALA 16 Cb 1.05 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1niu h ALA 16 CO 0.10 0.44 -0.03 0.82 0.00 0.00 0.00 179.25 180.57 1niu h ILE 17 N 0.94 1.25 -0.08 0.00 2.04 -1.49 -0.48 117.51 119.68 1niu h ILE 17 Ca 0.23 -1.06 -0.00 0.00 1.00 0.00 0.00 64.86 65.02 1niu h ILE 17 Cb 0.12 0.92 -0.00 0.00 -0.74 0.00 0.00 36.82 37.11 1niu h ILE 17 CO -0.03 0.37 0.03 0.22 0.00 0.00 0.00 178.15 178.75 1niu h TYR 18 N 0.75 0.12 -0.25 1.37 3.20 -0.82 -2.55 116.97 118.80 1niu h TYR 18 Ca 0.14 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.02 1niu h TYR 18 Cb 0.50 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.71 1niu h TYR 18 CO 0.03 0.23 0.11 -0.44 -1.64 0.00 0.00 178.16 176.45 1niu h ASP 19 N -0.03 0.16 -0.91 -2.11 5.19 -0.90 0.06 116.42 117.89 1niu h ASP 19 Ca 0.03 0.01 0.04 0.00 -0.62 0.00 0.00 57.03 56.49 1niu h ASP 19 Cb 0.16 -0.01 -0.05 0.00 0.18 0.00 0.00 39.33 39.61 1niu h ASP 19 CO -0.00 0.12 0.60 0.78 -3.12 0.00 0.00 179.24 177.62 1niu h ASN 20 N 0.24 0.98 0.08 6.45 2.35 -1.05 -1.22 115.58 123.42 1niu h ASN 20 Ca 0.10 -0.01 -0.26 0.00 -0.55 0.00 0.00 56.30 55.58 1niu h ASN 20 Cb 0.04 -0.23 0.03 0.00 0.05 0.00 0.00 38.32 38.21 1niu h ASN 20 CO -0.08 0.67 -1.08 0.58 -1.65 0.00 0.00 177.43 175.87 1niu h VAL 21 N 1.14 1.32 -0.63 2.81 2.07 -1.16 -3.22 116.25 118.58 1niu h VAL 21 Ca 0.36 -2.36 -0.06 0.00 0.82 0.00 0.00 66.70 65.46 1niu h VAL 21 Cb 0.02 2.65 -0.03 0.00 -1.52 0.00 0.00 31.29 32.42 1niu h VAL 21 CO -0.11 0.71 0.16 -0.08 0.02 0.00 0.00 177.57 178.28 1niu h GLU 22 N 0.20 0.99 0.00 1.57 4.81 -0.84 -1.78 114.58 119.53 1niu h GLU 22 Ca -0.16 -0.21 -0.03 0.00 -0.13 0.00 0.00 59.36 58.82 1niu h GLU 22 Cb 1.77 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 31.00 1niu h GLU 22 CO 0.21 0.87 -0.16 -0.91 -0.73 0.00 0.00 179.01 178.29 1niu h ASN 23 N 0.94 0.00 0.09 1.04 2.35 -1.31 -1.50 115.58 117.19 1niu h ASN 23 Ca 0.20 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.69 1niu h ASN 23 Cb 0.32 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.71 1niu h ASN 23 CO -0.00 0.16 -1.03 0.25 -1.65 0.00 0.00 177.43 175.16 1niu h LEU 24 N 0.00 0.82 -1.69 1.61 5.85 -1.39 -1.95 115.31 118.57 1niu h LEU 24 Ca -0.00 -0.66 -0.01 0.00 0.84 0.00 0.00 57.88 58.05 1niu h LEU 24 Cb 0.32 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1niu h LEU 24 CO 0.02 1.47 0.11 -0.09 -0.34 0.00 0.00 178.44 179.61 1niu h ARG 25 N 0.35 0.32 0.01 1.25 9.65 -0.72 -0.39 114.38 124.85 1niu h ARG 25 Ca -0.12 -0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.73 1niu h ARG 25 Cb 1.68 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 30.19 1niu h ARG 25 CO 0.20 0.25 -0.00 0.00 2.80 0.00 0.00 179.97 183.21 1niu h ARG 26 N 0.32 -0.01 -0.58 0.20 3.08 -1.17 -3.35 114.38 112.88 1niu h ARG 26 Ca 0.08 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.14 1niu h ARG 26 Cb 0.03 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.06 1niu h ARG 26 CO -0.01 0.57 0.38 1.25 -1.07 0.00 0.00 179.97 181.09 1niu h LEU 27 N -0.60 0.65-10.30 3.04 5.85 -0.69 -3.45 115.31 109.81 1niu h LEU 27 Ca -0.00 -0.01 -0.50 0.00 0.84 0.00 0.00 57.88 58.21 1niu h LEU 27 Cb 0.59 -0.16 0.05 0.00 0.37 0.00 0.00 40.66 41.51 1niu h LEU 27 CO 0.00 0.47 0.40 -0.76 -0.34 0.00 0.00 178.44 178.21 1niu s LEU 28 N -10.16 3.36 0.49 2.25 1.43 -0.22 -5.01 118.68 110.83 1niu s LEU 28 Ca -0.13 1.51 -0.22 0.00 -1.03 0.00 0.00 54.13 54.25 1niu s LEU 28 Cb 0.13 -4.49 -0.06 0.00 0.03 0.00 0.00 46.19 41.80 1niu s LEU 28 CO 0.75 -0.84 1.23 -2.84 0.23 0.00 0.00 176.35 174.87 1niu s PRO 29 N -4.76 3.55 0.55 1.29 0.02 -1.26 -4.90 135.00 129.50 1niu s PRO 29 Ca 0.57 1.92 0.25 0.00 0.02 0.00 0.00 61.00 63.76 1niu s PRO 29 Cb -0.11 -2.35 1.48 0.00 0.02 0.00 0.00 34.50 33.53 1niu s PRO 29 CO 0.46 -0.77 2.05 0.22 -0.33 0.00 0.00 177.00 178.64 1niu h ASP 30 N 1.84 0.00 0.66 2.53 1.82 -1.94 -1.10 116.42 120.23 1niu h ASP 30 Ca -0.50 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.14 1niu h ASP 30 Cb 1.26 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.27 1niu h ASP 30 CO 0.59 0.00 0.00 -0.90 -1.61 0.00 0.00 179.24 177.32 1niu n ASP 31 N -4.16 0.00 -4.55 2.28 5.75 -1.26 -4.69 116.55 109.92 1niu n ASP 31 Ca 0.05 0.09 -0.40 0.00 -0.01 0.00 0.00 54.79 54.52 1niu n ASP 31 Cb 0.42 -0.36 -0.10 0.00 -1.03 0.00 0.00 41.12 40.05 1niu n ASP 31 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1niu s THR 32 N -2.71 5.26 0.63 2.12 2.01 -0.42 -4.86 115.64 117.66 1niu s THR 32 Ca 0.22 -0.01 -0.11 0.00 0.31 0.00 0.00 61.69 62.09 1niu s THR 32 Cb 0.18 -3.70 -0.03 0.00 0.01 0.00 0.00 72.50 68.96 1niu s THR 32 CO 0.45 0.04 1.03 -1.00 -0.69 0.00 0.00 174.62 174.45 1niu s HIS 33 N 1.83 3.56 -0.21 4.92 3.76 0.15 -4.80 115.29 124.50 1niu s HIS 33 Ca 0.08 1.31 -0.03 0.00 -0.15 0.00 0.00 55.06 56.28 1niu s HIS 33 Cb -0.17 -2.74 0.00 0.00 1.11 0.00 0.00 32.58 30.78 1niu s HIS 33 CO 0.11 -0.76 -0.08 0.42 -0.85 0.00 0.00 174.74 173.58 1niu s ILE 34 N -3.15 3.04 -0.40 0.60 1.01 -1.26 -1.51 121.20 119.52 1niu s ILE 34 Ca 0.55 -0.63 -0.13 0.00 0.00 0.00 0.00 60.65 60.44 1niu s ILE 34 Cb -0.11 -2.37 0.02 0.00 0.01 0.00 0.00 42.46 40.01 1niu s ILE 34 CO 0.54 0.44 0.26 -0.32 0.00 0.00 0.00 174.94 175.86 1niu s MET 35 N 1.43 2.91 -0.10 2.79 -2.45 0.14 -1.85 119.30 122.16 1niu s MET 35 Ca 0.05 -1.05 -0.27 0.00 -1.25 0.00 0.00 55.69 53.17 1niu s MET 35 Cb -0.14 -3.89 -0.02 0.00 1.25 0.00 0.00 34.83 32.04 1niu s MET 35 CO -0.06 -0.73 0.90 0.00 1.05 0.00 0.00 175.02 176.18 1niu s ALA 36 N 1.63 3.39 -0.33 4.11 0.00 -0.66 -0.79 121.76 129.12 1niu s ALA 36 Ca 0.04 0.25 -0.12 0.00 0.00 0.00 0.00 51.96 52.12 1niu s ALA 36 Cb -0.19 -3.28 -0.02 0.00 0.00 0.00 0.00 23.12 19.63 1niu s ALA 36 CO 0.09 -0.48 0.23 0.54 0.00 0.00 0.00 175.76 176.13 1niu s VAL 37 N 1.72 5.26 -0.35 0.00 0.11 -0.54 -1.43 120.40 125.17 1niu s VAL 37 Ca 0.44 -0.17 0.07 0.00 -2.93 0.00 0.00 61.98 59.38 1niu s VAL 37 Cb -0.18 -3.68 0.48 0.00 -1.53 0.00 0.00 36.38 31.47 1niu s VAL 37 CO 0.18 0.03 1.44 1.33 -3.33 0.00 0.00 175.10 174.75 1niu n VAL 38 N 5.10 2.70 -1.11 2.04 0.24 -0.58 -4.68 118.33 122.03 1niu n VAL 38 Ca -0.13 -3.33 -0.29 0.00 -2.04 0.00 0.00 64.34 58.55 1niu n VAL 38 Cb 0.50 -0.73 0.17 0.00 -1.47 0.00 0.00 33.84 32.31 1niu n VAL 38 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1niu s LYS 39 N -3.47 0.63 -1.40 7.34 -2.85 -1.23 -1.11 119.74 117.65 1niu s LYS 39 Ca 0.50 0.70 -0.08 0.00 -1.00 0.00 0.00 55.97 56.09 1niu s LYS 39 Cb 0.42 -1.75 0.04 0.00 -2.06 0.00 0.00 37.83 34.48 1niu s LYS 39 CO 0.01 -2.64 0.95 0.00 0.10 0.00 0.00 175.35 173.76 1niu n ALA 40 N -4.14 -1.57 -3.64 0.59 0.00 -1.26 -0.62 120.51 109.87 1niu n ALA 40 Ca 0.06 0.11 -0.23 0.00 0.00 0.00 0.00 53.44 53.38 1niu n ALA 40 Cb 0.56 -3.78 0.06 0.00 0.00 0.00 0.00 19.45 16.29 1niu n ALA 40 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1niu n ASN 41 N -2.96 -3.58 -3.30 0.00 5.15 -1.25 -1.05 115.26 108.27 1niu n ASN 41 Ca -0.09 -0.68 -0.16 0.00 -0.60 0.00 0.00 54.58 53.05 1niu n ASN 41 Cb 0.59 -4.60 0.08 0.00 -0.53 0.00 0.00 39.78 35.32 1niu n ASN 41 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1niu n ALA 42 N -4.52 -2.33 -4.05 5.20 0.00 -0.26 -0.31 120.51 114.24 1niu n ALA 42 Ca -0.14 0.07 -0.32 0.00 0.00 0.00 0.00 53.44 53.05 1niu n ALA 42 Cb 0.61 -4.68 -0.01 0.00 0.00 0.00 0.00 19.45 15.37 1niu n ALA 42 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1niu n TYR 43 N -3.52 -1.91 -0.99 0.00 4.02 0.21 -0.43 117.16 114.55 1niu n TYR 43 Ca -0.14 0.82 0.00 0.00 -0.01 0.00 0.00 57.90 58.57 1niu n TYR 43 Cb 0.64 -3.50 0.00 0.00 -0.02 0.00 0.00 39.34 36.46 1niu n TYR 43 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1niu n GLY 44 N -1.61 0.46 0.02 2.72 0.00 -0.21 -4.00 105.19 102.57 1niu n GLY 44 Ca -0.03 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.10 1niu n GLY 44 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1niu n HIS 45 N -2.69 0.12 0.00 1.61 8.25 0.43 -4.86 115.22 118.09 1niu n HIS 45 Ca 0.00 0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.50 1niu n HIS 45 Cb 0.08 -0.35 0.00 0.00 1.12 0.00 0.00 29.99 30.84 1niu n HIS 45 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1niu n GLY 46 N 1.36 1.60 0.43 -1.41 0.00 0.58 -4.82 105.19 102.93 1niu n GLY 46 Ca 0.00 -0.72 -0.12 0.00 0.00 0.00 0.00 46.02 45.18 1niu n GLY 46 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1niu h ASP 47 N 0.00 -1.70 0.22 1.61 2.03 -1.85 -1.99 116.42 114.73 1niu h ASP 47 Ca 0.00 0.23 -0.16 0.00 -0.73 0.00 0.00 57.03 56.38 1niu h ASP 47 Cb 0.00 0.71 -0.01 0.00 -0.83 0.00 0.00 39.33 39.20 1niu h ASP 47 CO 0.00 -0.40 -0.60 1.62 -1.03 0.00 0.00 179.24 178.84 1niu h VAL 48 N -0.39 1.36 -0.33 4.15 3.04 -1.95 -1.33 116.25 120.81 1niu h VAL 48 Ca 0.10 -1.92 -0.03 0.00 -1.01 0.00 0.00 66.70 63.84 1niu h VAL 48 Cb 0.60 1.92 -0.01 0.00 -2.01 0.00 0.00 31.29 31.79 1niu h VAL 48 CO -0.58 0.58 0.08 1.56 -1.01 0.00 0.00 177.57 178.20 1niu h GLN 49 N 0.29 0.53 -0.40 4.17 7.50 -1.90 -0.03 115.11 125.26 1niu h GLN 49 Ca -0.00 -0.13 -0.14 0.00 0.50 0.00 0.00 58.65 58.88 1niu h GLN 49 Cb 1.12 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 28.57 1niu h GLN 49 CO 0.10 0.59 -0.30 0.28 -1.50 0.00 0.00 178.83 177.99 1niu h VAL 50 N 0.37 1.27 -0.16 -0.54 2.07 -1.36 -2.59 116.25 115.31 1niu h VAL 50 Ca 0.10 -1.47 0.02 0.00 0.82 0.00 0.00 66.70 66.17 1niu h VAL 50 Cb 0.30 1.33 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 1niu h VAL 50 CO 0.00 0.49 0.03 0.00 0.02 0.00 0.00 177.57 178.12 1niu h ALA 51 N 0.79 0.16 -0.46 1.67 0.00 -1.07 0.15 119.26 120.50 1niu h ALA 51 Ca 0.08 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.06 1niu h ALA 51 Cb 0.89 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 1niu h ALA 51 CO 0.08 -0.41 0.21 0.00 0.00 0.00 0.00 179.25 179.14 1niu h ARG 52 N 0.10 0.42 -0.26 0.00 3.08 -0.97 -1.81 114.38 114.92 1niu h ARG 52 Ca 0.07 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.07 1niu h ARG 52 Cb 0.06 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1niu h ARG 52 CO -0.09 0.27 0.07 1.15 -1.07 0.00 0.00 179.97 180.30 1niu h THR 53 N 0.43 1.21 -0.68 2.04 2.02 -1.07 -2.68 112.91 114.18 1niu h THR 53 Ca 0.21 -0.69 0.00 0.00 0.77 0.00 0.00 66.41 66.70 1niu h THR 53 Cb 0.14 1.17 -0.03 0.00 -1.74 0.00 0.00 68.15 67.69 1niu h THR 53 CO -0.16 0.22 0.44 0.00 0.37 0.00 0.00 175.52 176.39 1niu h ALA 54 N 0.89 0.87 0.00 6.16 0.00 -0.53 -1.84 119.26 124.80 1niu h ALA 54 Ca 0.08 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1niu h ALA 54 Cb 0.28 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1niu h ALA 54 CO 0.00 0.31 -0.11 -0.07 0.00 0.00 0.00 179.25 179.38 1niu h LEU 55 N 0.93 0.00 -0.25 0.00 3.38 -1.27 -1.64 115.31 116.45 1niu h LEU 55 Ca 0.25 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.09 1niu h LEU 55 Cb -0.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1niu h LEU 55 CO -0.05 0.11 -0.33 -0.33 0.09 0.00 0.00 178.44 177.93 1niu h GLU 56 N 0.00 0.67 0.00 1.13 5.08 -1.00 -3.23 114.58 117.23 1niu h GLU 56 Ca -0.00 -0.39 0.00 0.00 -1.00 0.00 0.00 59.36 57.97 1niu h GLU 56 Cb 0.21 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1niu h GLU 56 CO 0.01 1.00 0.00 0.00 -1.00 0.00 0.00 179.01 179.03 1niu n ALA 57 N -2.50 2.01 0.00 3.43 0.00 -0.88 -4.87 120.51 117.70 1niu n ALA 57 Ca -0.05 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1niu n ALA 57 Cb 0.50 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.58 1niu n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1niu n GLY 58 N 0.78 0.19 3.80 0.00 0.00 -1.05 -4.08 105.19 104.83 1niu n GLY 58 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 1niu n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1niu s ALA 59 N -0.21 2.79 0.00 4.61 0.00 -0.66 -4.58 121.76 123.71 1niu s ALA 59 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1niu s ALA 59 Cb 0.00 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.87 1niu s ALA 59 CO 0.00 -0.60 0.00 -1.13 0.00 0.00 0.00 175.76 174.03 1niu n SER 60 N -1.55 3.97 -4.33 0.00 3.41 -0.77 -4.43 113.62 109.92 1niu n SER 60 Ca 0.09 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.53 1niu n SER 60 Cb 0.53 0.78 -0.10 0.00 -0.26 0.00 0.00 64.21 65.15 1niu n SER 60 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1niu s ARG 61 N -1.60 1.35 0.08 4.33 0.52 -1.19 -4.22 118.95 118.22 1niu s ARG 61 Ca 0.00 -1.70 0.05 0.00 -0.52 0.00 0.00 55.73 53.57 1niu s ARG 61 Cb 0.00 -0.53 -0.03 0.00 0.52 0.00 0.00 34.95 34.91 1niu s ARG 61 CO 0.00 -0.15 -0.14 -0.51 0.02 0.00 0.00 175.30 174.52 1niu s LEU 62 N -3.31 2.29 0.05 2.53 1.43 0.17 -1.65 118.68 120.19 1niu s LEU 62 Ca 0.30 -0.64 0.06 0.00 -1.03 0.00 0.00 54.13 52.83 1niu s LEU 62 Cb 0.06 -0.53 -0.02 0.00 0.03 0.00 0.00 46.19 45.73 1niu s LEU 62 CO 0.10 -0.08 -0.17 0.00 0.23 0.00 0.00 176.35 176.43 1niu s ALA 63 N -1.35 1.41 0.11 4.21 0.00 -0.51 -0.44 121.76 125.19 1niu s ALA 63 Ca -0.01 -0.94 -0.01 0.00 0.00 0.00 0.00 51.96 51.00 1niu s ALA 63 Cb -0.10 -0.24 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 1niu s ALA 63 CO 0.02 0.29 0.04 0.54 0.00 0.00 0.00 175.76 176.65 1niu s VAL 64 N -0.87 0.13 -0.06 0.00 0.11 0.00 -1.52 120.40 118.20 1niu s VAL 64 Ca 0.04 -1.87 -0.22 0.00 -2.93 0.00 0.00 61.98 57.00 1niu s VAL 64 Cb -0.08 -1.89 -0.31 0.00 -1.53 0.00 0.00 36.38 32.57 1niu s VAL 64 CO 0.02 -0.61 0.85 0.00 -3.33 0.00 0.00 175.10 172.03 1niu h ALA 65 N 2.94 -0.06 -2.47 1.54 0.00 -1.92 0.15 119.26 119.43 1niu h ALA 65 Ca -0.35 -0.71 -0.19 0.00 0.00 0.00 0.00 54.91 53.66 1niu h ALA 65 Cb 1.18 0.12 -0.15 0.00 0.00 0.00 0.00 17.79 18.95 1niu h ALA 65 CO 0.61 0.37 -0.63 -0.59 0.00 0.00 0.00 179.25 179.01 1niu s PHE 66 N -2.41 0.89 0.22 0.00 -0.71 -1.26 -1.72 117.98 112.99 1niu s PHE 66 Ca -0.15 -1.24 -0.10 0.00 -1.04 0.00 0.00 56.93 54.40 1niu s PHE 66 Cb 0.01 -0.47 0.32 0.00 -1.21 0.00 0.00 43.02 41.67 1niu s PHE 66 CO 0.81 -0.55 1.65 1.25 -1.34 0.00 0.00 175.22 177.04 1niu h LEU 67 N 2.81 -0.32 -0.96 -1.99 5.85 -1.94 -1.94 115.31 116.82 1niu h LEU 67 Ca -0.35 0.17 0.19 0.00 0.84 0.00 0.00 57.88 58.73 1niu h LEU 67 Cb 1.21 0.30 -0.11 0.00 0.37 0.00 0.00 40.66 42.43 1niu h LEU 67 CO 0.57 -0.14 0.55 0.44 -0.34 0.00 0.00 178.44 179.52 1niu h ASP 68 N 0.10 0.67 -0.42 1.25 5.19 -1.99 0.05 116.42 121.28 1niu h ASP 68 Ca 0.34 0.11 -0.06 0.00 -0.62 0.00 0.00 57.03 56.81 1niu h ASP 68 Cb 0.56 -0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.05 1niu h ASP 68 CO -0.57 0.21 0.08 -0.33 -3.12 0.00 0.00 179.24 175.50 1niu h GLU 69 N 0.67 0.76 -0.22 3.56 5.08 -1.78 -0.74 114.58 121.91 1niu h GLU 69 Ca 0.56 -0.17 -0.13 0.00 -1.00 0.00 0.00 59.36 58.63 1niu h GLU 69 Cb 0.91 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.05 1niu h GLU 69 CO -0.41 0.72 -0.35 0.00 -1.00 0.00 0.00 179.01 177.97 1niu h ALA 70 N 1.35 0.34 -0.54 3.43 0.00 -1.03 -2.93 119.26 119.89 1niu h ALA 70 Ca 0.16 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 1niu h ALA 70 Cb 0.34 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1niu h ALA 70 CO 0.01 0.41 0.13 -0.07 0.00 0.00 0.00 179.25 179.72 1niu h LEU 71 N 0.33 0.77 -1.22 0.00 3.38 -0.86 -2.36 115.31 115.36 1niu h LEU 71 Ca 0.02 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 1niu h LEU 71 Cb 0.94 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 1niu h LEU 71 CO 0.08 0.76 0.00 0.00 0.09 0.00 0.00 178.44 179.37 1niu h ALA 72 N 1.34 1.37 -0.21 1.53 0.00 -1.11 -1.60 119.26 120.57 1niu h ALA 72 Ca 0.18 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 1niu h ALA 72 Cb 0.29 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1niu h ALA 72 CO -0.00 0.44 -0.41 -0.07 0.00 0.00 0.00 179.25 179.21 1niu h LEU 73 N 0.51 0.53 -0.39 0.00 3.38 -1.24 -2.87 115.31 115.23 1niu h LEU 73 Ca 0.11 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 1niu h LEU 73 Cb 0.33 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1niu h LEU 73 CO 0.01 0.88 -0.01 0.03 0.09 0.00 0.00 178.44 179.44 1niu h ARG 74 N 0.41 0.69 0.00 1.13 2.47 -0.97 -1.89 114.38 116.23 1niu h ARG 74 Ca 0.04 -0.23 -0.00 0.00 -1.26 0.00 0.00 59.98 58.53 1niu h ARG 74 Cb 0.89 -0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 29.15 1niu h ARG 74 CO 0.08 0.79 -0.01 0.93 0.56 0.00 0.00 179.97 182.32 1niu h GLU 75 N 0.51 0.00 -0.61 0.04 5.08 -1.19 -1.47 114.58 116.94 1niu h GLU 75 Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1niu h GLU 75 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1niu h GLU 75 CO 0.02 0.01 0.00 1.63 -1.00 0.00 0.00 179.01 179.67 1niu n LYS 76 N -3.15 4.52 -0.72 2.33 5.02 -1.05 -4.94 118.16 120.16 1niu n LYS 76 Ca -0.01 -2.97 0.00 0.00 -2.02 0.00 0.00 58.31 53.31 1niu n LYS 76 Cb 0.18 -2.16 0.00 0.00 -0.02 0.00 0.00 35.03 33.02 1niu n LYS 76 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1niu n GLY 77 N 0.71 0.60 3.68 0.72 0.00 -0.55 -5.05 105.19 105.30 1niu n GLY 77 Ca 0.26 -0.32 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 1niu n GLY 77 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1niu s ILE 78 N -2.00 4.90 -1.64 -0.61 -1.09 -0.74 -4.93 121.20 115.09 1niu s ILE 78 Ca 0.00 1.68 0.13 0.00 -2.23 0.00 0.00 60.65 60.23 1niu s ILE 78 Cb 0.00 -4.15 0.11 0.00 -1.58 0.00 0.00 42.46 36.84 1niu s ILE 78 CO 0.00 0.07 0.93 -1.84 -1.23 0.00 0.00 174.94 172.88 1niu n GLU 79 N 4.84 0.91 -1.23 2.79 0.28 -1.26 -4.43 120.64 122.54 1niu n GLU 79 Ca 0.04 -1.32 -0.31 0.00 -0.16 0.00 0.00 57.16 55.41 1niu n GLU 79 Cb 0.49 -1.26 0.11 0.00 1.43 0.00 0.00 31.44 32.21 1niu n GLU 79 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1niu s ALA 80 N -1.10 2.04 0.44 -1.84 0.00 -1.26 -4.98 121.76 115.06 1niu s ALA 80 Ca 0.16 0.19 -0.24 0.00 0.00 0.00 0.00 51.96 52.07 1niu s ALA 80 Cb 0.11 -3.26 -0.08 0.00 0.00 0.00 0.00 23.12 19.90 1niu s ALA 80 CO 0.17 -1.95 1.22 -2.14 0.00 0.00 0.00 175.76 173.06 1niu s PRO 81 N -4.90 3.83 -0.01 0.00 0.02 -1.26 -4.87 135.00 127.80 1niu s PRO 81 Ca 0.62 1.94 0.04 0.00 0.02 0.00 0.00 61.00 63.62 1niu s PRO 81 Cb -0.17 -2.56 -0.01 0.00 0.02 0.00 0.00 34.50 31.78 1niu s PRO 81 CO 0.56 -0.54 -0.12 0.42 -0.33 0.00 0.00 177.00 176.99 1niu s ILE 82 N -1.41 0.99 -0.09 2.83 1.01 -1.26 -0.66 121.20 122.62 1niu s ILE 82 Ca 0.61 -0.53 0.03 0.00 0.00 0.00 0.00 60.65 60.76 1niu s ILE 82 Cb -0.33 -0.84 -0.02 0.00 0.01 0.00 0.00 42.46 41.29 1niu s ILE 82 CO 0.41 0.28 -0.17 -0.22 0.00 0.00 0.00 174.94 175.24 1niu s LEU 83 N -0.22 2.53 -0.45 2.97 2.96 0.41 -0.87 118.68 126.00 1niu s LEU 83 Ca 0.03 -0.35 -0.20 0.00 -0.22 0.00 0.00 54.13 53.39 1niu s LEU 83 Cb -0.06 -1.53 0.03 0.00 0.50 0.00 0.00 46.19 45.14 1niu s LEU 83 CO -0.00 0.23 0.63 -0.69 -1.32 0.00 0.00 176.35 175.19 1niu s VAL 84 N -0.05 4.85 0.32 1.68 1.01 -0.27 -0.82 120.40 127.13 1niu s VAL 84 Ca -0.04 -0.04 0.19 0.00 0.00 0.00 0.00 61.98 62.09 1niu s VAL 84 Cb -0.14 -4.22 0.17 0.00 0.00 0.00 0.00 36.38 32.19 1niu s VAL 84 CO 0.04 -0.64 1.88 -0.07 0.00 0.00 0.00 175.10 176.31 1niu h LEU 85 N 9.67 0.00 0.00 3.92 3.38 -0.85 -2.89 115.31 128.53 1niu h LEU 85 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1niu h LEU 85 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1niu h LEU 85 CO 0.90 0.29 0.00 0.61 0.09 0.00 0.00 178.44 180.33 1niu n GLY 86 N -0.33 2.17 3.85 0.83 0.00 -0.70 -4.82 105.19 106.18 1niu n GLY 86 Ca -0.01 -2.06 -0.32 0.00 0.00 0.00 0.00 46.02 43.63 1niu n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1niu s ALA 87 N -2.00 3.02 0.22 4.61 0.00 -1.26 -4.42 121.76 121.93 1niu s ALA 87 Ca 0.00 0.09 -0.06 0.00 0.00 0.00 0.00 51.96 51.99 1niu s ALA 87 Cb 0.00 -3.12 -0.03 0.00 0.00 0.00 0.00 23.12 19.98 1niu s ALA 87 CO 0.00 -0.55 0.27 -1.54 0.00 0.00 0.00 175.76 173.94 1niu s SER 88 N -3.54 0.05 0.06 0.00 1.04 -1.26 -4.67 113.70 105.38 1niu s SER 88 Ca 0.58 -1.20 -0.20 0.00 0.48 0.00 0.00 55.95 55.61 1niu s SER 88 Cb -0.11 0.47 -0.06 0.00 0.10 0.00 0.00 66.02 66.41 1niu s SER 88 CO 0.43 -0.97 0.58 -0.13 0.98 0.00 0.00 173.24 174.13 1niu s ARG 89 N -4.10 4.23 0.42 4.02 0.52 -1.26 -4.96 118.95 117.82 1niu s ARG 89 Ca 0.32 0.74 0.08 0.00 -0.52 0.00 0.00 55.73 56.36 1niu s ARG 89 Cb 0.04 -3.26 0.91 0.00 0.52 0.00 0.00 34.95 33.16 1niu s ARG 89 CO 0.11 0.59 2.06 -1.00 0.02 0.00 0.00 175.30 177.08 1niu h PRO 90 N 4.73 0.45 0.00 3.54 0.13 -1.95 -1.25 132.00 137.65 1niu h PRO 90 Ca -0.49 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 64.61 1niu h PRO 90 Cb 1.21 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 1niu h PRO 90 CO 0.65 0.31 -0.02 0.00 -0.23 0.00 0.00 178.00 178.70 1niu h ALA 91 N 1.77 1.55 -0.21 -0.56 0.00 -1.93 -2.22 119.26 117.67 1niu h ALA 91 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1niu h ALA 91 Cb -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1niu h ALA 91 CO -0.02 0.03 0.00 -0.25 0.00 0.00 0.00 179.25 179.00 1niu n ASP 92 N -3.91 1.23 -0.07 0.00 8.00 -0.47 -4.27 116.55 117.06 1niu n ASP 92 Ca -0.03 -1.90 0.01 0.00 0.71 0.00 0.00 54.79 53.58 1niu n ASP 92 Cb 0.11 -0.14 0.30 0.00 -0.02 0.00 0.00 41.12 41.37 1niu n ASP 92 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1niu h ALA 93 N 3.56 1.45 -0.28 2.24 0.00 -1.49 -2.33 119.26 122.41 1niu h ALA 93 Ca 0.00 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1niu h ALA 93 Cb 0.32 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1niu h ALA 93 CO 0.00 0.43 -0.28 0.00 0.00 0.00 0.00 179.25 179.40 1niu h ALA 94 N 1.54 1.01 -0.15 0.00 0.00 -1.83 -1.29 119.26 118.54 1niu h ALA 94 Ca 0.17 -0.37 -0.21 0.00 0.00 0.00 0.00 54.91 54.50 1niu h ALA 94 Cb 0.11 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.78 1niu h ALA 94 CO -0.02 0.59 -0.75 1.25 0.00 0.00 0.00 179.25 180.32 1niu h LEU 95 N 0.48 0.85 -0.39 0.00 5.85 -1.81 -1.91 115.31 118.38 1niu h LEU 95 Ca 0.06 -0.55 -0.04 0.00 0.84 0.00 0.00 57.88 58.19 1niu h LEU 95 Cb 0.73 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1niu h LEU 95 CO 0.06 1.34 0.08 0.00 -0.34 0.00 0.00 178.44 179.57 1niu h ALA 96 N 0.65 0.52 -0.28 1.25 0.00 -1.25 -1.27 119.26 118.88 1niu h ALA 96 Ca -0.04 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 1niu h ALA 96 Cb 1.36 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 1niu h ALA 96 CO 0.15 0.21 -0.17 0.00 0.00 0.00 0.00 179.25 179.44 1niu h ALA 97 N 0.93 1.19 -0.25 0.00 0.00 -1.22 0.02 119.26 119.92 1niu h ALA 97 Ca 0.12 -0.30 -0.18 0.00 0.00 0.00 0.00 54.91 54.55 1niu h ALA 97 Cb 0.34 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1niu h ALA 97 CO 0.00 0.52 -0.56 0.37 0.00 0.00 0.00 179.25 179.58 1niu h GLN 98 N 0.45 0.78 -0.28 0.00 4.15 -1.14 -3.03 115.11 116.05 1niu h GLN 98 Ca 0.08 -0.50 0.00 0.00 0.77 0.00 0.00 58.65 59.00 1niu h GLN 98 Cb 0.56 0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.31 1niu h GLN 98 CO 0.04 1.13 0.00 1.04 -1.93 0.00 0.00 178.83 179.10 1niu n GLN 99 N -3.99 1.71 -3.70 1.69 1.13 -0.50 -4.94 117.38 108.79 1niu n GLN 99 Ca -0.04 -1.10 -0.24 0.00 -1.94 0.00 0.00 57.00 53.68 1niu n GLN 99 Cb 0.63 -1.28 0.05 0.00 0.11 0.00 0.00 30.24 29.75 1niu n GLN 99 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1niu n ARG 100 N 0.37 -5.93 -3.86 -1.09 1.74 -0.32 -4.99 116.66 102.59 1niu n ARG 100 Ca 0.12 0.69 -0.36 0.00 -0.77 0.00 0.00 57.85 57.53 1niu n ARG 100 Cb 0.27 -5.51 -0.13 0.00 -1.02 0.00 0.00 32.46 26.07 1niu n ARG 100 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1niu s ILE 101 N -3.45 3.96 0.35 0.55 1.01 -0.16 -4.31 121.20 119.15 1niu s ILE 101 Ca 0.29 -0.29 -0.25 0.00 0.00 0.00 0.00 60.65 60.39 1niu s ILE 101 Cb -0.14 -2.83 -0.09 0.00 0.01 0.00 0.00 42.46 39.41 1niu s ILE 101 CO 0.79 0.38 1.00 0.00 0.00 0.00 0.00 174.94 177.11 1niu s ALA 102 N 1.46 3.17 0.16 9.38 0.00 -0.05 -4.51 121.76 131.37 1niu s ALA 102 Ca 0.05 0.63 0.08 0.00 0.00 0.00 0.00 51.96 52.72 1niu s ALA 102 Cb -0.15 -3.23 -0.04 0.00 0.00 0.00 0.00 23.12 19.70 1niu s ALA 102 CO 0.01 -0.01 -0.10 -0.51 0.00 0.00 0.00 175.76 175.15 1niu s LEU 103 N -2.26 2.98 -0.03 0.00 1.43 0.15 -1.11 118.68 119.86 1niu s LEU 103 Ca 0.53 -0.52 -0.16 0.00 -1.03 0.00 0.00 54.13 52.95 1niu s LEU 103 Cb -0.21 -1.71 -0.05 0.00 0.03 0.00 0.00 46.19 44.25 1niu s LEU 103 CO 0.27 0.13 0.43 -0.89 0.23 0.00 0.00 176.35 176.51 1niu s THR 104 N -1.54 5.05 -0.01 5.49 2.01 -1.09 -0.79 115.64 124.77 1niu s THR 104 Ca 0.24 0.87 0.03 0.00 0.31 0.00 0.00 61.69 63.14 1niu s THR 104 Cb -0.10 -3.74 -0.01 0.00 0.01 0.00 0.00 72.50 68.67 1niu s THR 104 CO 0.15 0.52 -0.10 0.54 -0.69 0.00 0.00 174.62 175.04 1niu s VAL 105 N -0.66 0.77 0.00 3.82 0.11 -0.59 -4.80 120.40 119.04 1niu s VAL 105 Ca 0.24 -0.41 0.00 0.00 -2.93 0.00 0.00 61.98 58.88 1niu s VAL 105 Cb -0.16 -0.64 0.00 0.00 -1.53 0.00 0.00 36.38 34.04 1niu s VAL 105 CO 0.13 0.22 0.00 2.22 -3.33 0.00 0.00 175.10 174.33 1niu n PHE 106 N 2.88 0.00 -3.92 1.54 1.16 -1.26 -4.32 117.46 113.54 1niu n PHE 106 Ca -0.14 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.34 1niu n PHE 106 Cb 0.56 0.00 -0.12 0.00 -1.61 0.00 0.00 39.48 38.32 1niu n PHE 106 CO 0.00 0.00 0.00 -0.98 -1.87 0.00 0.00 176.76 173.91 1niu s ARG 107 N 0.00 0.20 0.19 3.97 1.70 -1.26 -4.06 118.95 119.69 1niu s ARG 107 Ca 0.00 -0.30 0.01 0.00 -0.47 0.00 0.00 55.73 54.97 1niu s ARG 107 Cb 0.00 0.07 0.11 0.00 -0.57 0.00 0.00 34.95 34.56 1niu s ARG 107 CO 0.00 -0.03 1.46 0.66 -1.08 0.00 0.00 175.30 176.31 1niu h SER 108 N 5.28 0.37 0.30 -2.89 4.64 -1.96 -3.07 113.55 116.22 1niu h SER 108 Ca -0.28 -0.24 -0.00 0.00 -0.47 0.00 0.00 61.79 60.79 1niu h SER 108 Cb 1.21 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1niu h SER 108 CO 0.45 0.97 -0.02 -2.24 -0.87 0.00 0.00 176.83 175.12 1niu h ASP 109 N 0.21 0.00 -0.08 4.97 3.04 -1.99 0.11 116.42 122.69 1niu h ASP 109 Ca -0.02 0.00 -0.05 0.00 -3.24 0.00 0.00 57.03 53.71 1niu h ASP 109 Cb 1.28 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.57 1niu h ASP 109 CO 0.12 0.02 -0.16 -0.25 -2.04 0.00 0.00 179.24 176.92 1niu h TRP 110 N 0.00 0.31 -0.23 4.15 7.01 -1.97 -2.69 115.95 122.54 1niu h TRP 110 Ca -0.00 -0.12 -0.09 0.00 2.11 0.00 0.00 58.89 60.79 1niu h TRP 110 Cb 0.17 -0.06 -0.01 0.00 -2.10 0.00 0.00 29.16 27.16 1niu h TRP 110 CO 0.00 0.77 -0.26 -0.07 -2.79 0.00 0.00 178.44 176.09 1niu h LEU 111 N -0.23 0.44 0.07 0.65 3.38 -1.34 -0.73 115.31 117.56 1niu h LEU 111 Ca 0.00 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 57.84 1niu h LEU 111 Cb 0.75 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 1niu h LEU 111 CO 0.04 0.69 -0.13 -0.33 0.09 0.00 0.00 178.44 178.80 1niu h GLU 112 N 0.39 -0.25 -0.20 1.13 5.08 -0.82 -1.45 114.58 118.46 1niu h GLU 112 Ca 0.06 0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.40 1niu h GLU 112 Cb 0.66 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 1niu h GLU 112 CO 0.05 -0.17 -0.04 1.49 -1.00 0.00 0.00 179.01 179.34 1niu h GLU 113 N -0.26 0.30 0.00 2.33 4.81 -1.16 -3.19 114.58 117.41 1niu h GLU 113 Ca 0.02 -0.05 -0.21 0.00 -0.13 0.00 0.00 59.36 58.99 1niu h GLU 113 Cb 0.28 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 1niu h GLU 113 CO -0.08 0.36 -1.19 0.00 -0.73 0.00 0.00 179.01 177.37 1niu h ALA 114 N 1.67 0.57 -0.23 2.92 0.00 -0.80 -3.28 119.26 120.11 1niu h ALA 114 Ca 0.07 -0.99 -0.06 0.00 0.00 0.00 0.00 54.91 53.93 1niu h ALA 114 Cb 0.27 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1niu h ALA 114 CO 0.01 1.20 -0.12 0.77 0.00 0.00 0.00 179.25 181.10 1niu h SER 115 N 0.00 0.37 1.30 0.00 0.02 -1.26 -2.13 113.55 111.85 1niu h SER 115 Ca -0.11 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.75 1niu h SER 115 Cb 1.75 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 64.19 1niu h SER 115 CO 0.09 0.53 0.00 0.00 -1.14 0.00 0.00 176.83 176.31 1niu h ALA 116 N 1.52 1.00 -0.01 3.77 0.00 -1.62 -3.24 119.26 120.68 1niu h ALA 116 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1niu h ALA 116 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1niu h ALA 116 CO 0.03 0.00 -0.29 1.28 0.00 0.00 0.00 179.25 180.27 1niu n LEU 117 N -2.70 1.03 -4.07 0.00 4.77 -0.98 -5.00 117.00 110.06 1niu n LEU 117 Ca 0.03 -0.69 -0.18 0.00 -0.03 0.00 0.00 56.01 55.13 1niu n LEU 117 Cb 0.37 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.32 1niu n LEU 117 CO 0.28 0.21 -0.44 -0.47 -1.33 0.00 0.00 177.39 175.64 1niu s TYR 118 N -1.55 0.94 -0.47 -1.77 5.04 -0.84 -4.96 117.35 113.74 1niu s TYR 118 Ca 0.07 -0.26 0.06 0.00 -2.44 0.00 0.00 57.07 54.51 1niu s TYR 118 Cb 0.08 -0.58 0.25 0.00 0.35 0.00 0.00 41.96 42.06 1niu s TYR 118 CO 0.30 -0.01 0.84 0.43 -1.34 0.00 0.00 175.55 175.78 1niu n SER 119 N 2.39 -2.31 -0.71 4.32 7.64 -1.26 -4.76 113.62 118.92 1niu n SER 119 Ca -0.16 -3.22 0.10 0.00 1.01 0.00 0.00 58.87 56.59 1niu n SER 119 Cb 0.56 1.39 -0.03 0.00 -1.01 0.00 0.00 64.21 65.13 1niu n SER 119 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1niu n GLY 120 N 1.52 -1.64 0.05 0.23 0.00 -1.26 -4.99 105.19 99.11 1niu n GLY 120 Ca 0.11 -1.35 0.12 0.00 0.00 0.00 0.00 46.02 44.90 1niu n GLY 120 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1niu n PRO 121 N -2.67 0.30 -2.49 1.61 -0.04 -1.26 -5.08 135.00 125.36 1niu n PRO 121 Ca 0.00 0.05 -0.39 0.00 -0.04 0.00 0.00 63.50 63.12 1niu n PRO 121 Cb 0.33 -1.65 -0.04 0.00 -0.04 0.00 0.00 33.50 32.10 1niu n PRO 121 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1niu s PHE 122 N -3.18 3.44 0.33 0.54 0.08 -1.26 -5.02 117.98 112.90 1niu s PHE 122 Ca 0.05 1.67 -0.20 0.00 0.12 0.00 0.00 56.93 58.58 1niu s PHE 122 Cb 0.14 -3.23 -0.10 0.00 -0.57 0.00 0.00 43.02 39.26 1niu s PHE 122 CO 0.76 -0.61 0.83 -1.25 -0.10 0.00 0.00 175.22 174.85 1niu s PRO 123 N -1.89 4.23 -0.18 0.24 0.04 -1.26 -4.91 135.00 131.27 1niu s PRO 123 Ca 0.50 0.96 -0.04 0.00 0.04 0.00 0.00 61.00 62.46 1niu s PRO 123 Cb -0.28 -2.53 -0.02 0.00 0.04 0.00 0.00 34.50 31.71 1niu s PRO 123 CO 0.36 0.18 -0.04 0.42 0.04 0.00 0.00 177.00 177.96 1niu s ILE 124 N -1.87 3.66 -0.18 0.56 1.01 0.02 -4.72 121.20 119.69 1niu s ILE 124 Ca 0.53 -0.42 -0.17 0.00 0.00 0.00 0.00 60.65 60.59 1niu s ILE 124 Cb -0.13 -2.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.67 1niu s ILE 124 CO 0.18 0.46 0.45 -1.00 0.00 0.00 0.00 174.94 175.03 1niu s HIS 125 N 0.87 3.41 0.08 3.97 3.76 -1.26 -1.43 115.29 124.69 1niu s HIS 125 Ca -0.01 0.73 0.05 0.00 -0.15 0.00 0.00 55.06 55.68 1niu s HIS 125 Cb -0.15 -2.57 -0.04 0.00 1.11 0.00 0.00 32.58 30.94 1niu s HIS 125 CO 0.01 0.02 -0.03 -0.06 -0.85 0.00 0.00 174.74 173.83 1niu s PHE 126 N 1.20 2.91 -0.18 1.40 0.08 0.13 -0.67 117.98 122.85 1niu s PHE 126 Ca 0.22 -0.06 0.00 0.00 0.12 0.00 0.00 56.93 57.21 1niu s PHE 126 Cb -0.15 -1.52 0.04 0.00 -0.57 0.00 0.00 43.02 40.82 1niu s PHE 126 CO 0.09 0.45 -0.08 -1.01 -0.10 0.00 0.00 175.22 174.57 1niu s HIS 127 N -1.25 2.04 0.00 0.36 3.76 0.03 -0.62 115.29 119.62 1niu s HIS 127 Ca 0.23 -1.31 0.00 0.00 -0.15 0.00 0.00 55.06 53.84 1niu s HIS 127 Cb -0.11 -1.48 0.00 0.00 1.11 0.00 0.00 32.58 32.10 1niu s HIS 127 CO 0.16 -0.67 0.00 -0.11 -0.85 0.00 0.00 174.74 173.26 1niu n LEU 128 N 4.79 0.00 -3.79 0.89 7.94 -0.30 -1.54 117.00 124.99 1niu n LEU 128 Ca -0.13 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.64 1niu n LEU 128 Cb 0.47 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.34 1niu n LEU 128 CO 0.18 0.00 -0.02 -0.04 -1.11 0.00 0.00 177.39 176.40 1niu s MET 130 N 0.00 0.69 -0.50 1.96 -1.94 1.47 -0.62 119.30 120.36 1niu s MET 130 Ca 0.00 -0.38 -0.22 0.00 -1.71 0.00 0.00 55.69 53.38 1niu s MET 130 Cb 0.00 0.30 0.04 0.00 2.01 0.00 0.00 34.83 37.18 1niu s MET 130 CO 0.00 -0.20 0.79 0.34 -0.01 0.00 0.00 175.02 175.94 1niu s ASP 131 N -1.67 6.33 0.00 3.03 -1.08 -0.14 -4.36 116.67 118.78 1niu s ASP 131 Ca -0.10 -0.41 0.17 0.00 -0.52 0.00 0.00 52.55 51.69 1niu s ASP 131 Cb -0.04 -2.37 0.41 0.00 -1.46 0.00 0.00 42.92 39.46 1niu s ASP 131 CO 0.01 -1.00 1.33 0.35 0.52 0.00 0.00 175.17 176.37 1niu n THR 132 N 6.00 0.77 0.00 1.71 -2.24 -1.26 -4.69 114.28 114.57 1niu n THR 132 Ca -0.00 -0.88 0.00 0.00 -2.27 0.00 0.00 64.05 60.89 1niu n THR 132 Cb 0.47 0.70 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 1niu n THR 132 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1niu n GLY 133 N 1.09 -0.62 0.08 3.38 0.00 -1.26 -4.46 105.19 103.39 1niu n GLY 133 Ca 0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.09 1niu n GLY 133 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1niu h MET 134 N 0.00 0.04 -0.26 1.61 1.85 -1.90 -3.46 114.93 112.82 1niu h MET 134 Ca 0.00 -0.07 -0.11 0.00 -0.61 0.00 0.00 59.70 58.91 1niu h MET 134 Cb 0.00 0.03 -0.04 0.00 0.43 0.00 0.00 31.60 32.01 1niu h MET 134 CO 0.00 0.84 -0.10 0.41 -0.40 0.00 0.00 176.91 177.66 1niu n GLY 135 N 1.47 0.77 0.00 1.39 0.00 -1.26 -4.96 105.19 102.60 1niu n GLY 135 Ca -0.08 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.47 1niu n GLY 135 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1niu n ARG 136 N -2.35 0.00 -4.38 1.61 0.63 -1.26 -5.06 116.66 105.85 1niu n ARG 136 Ca -0.05 0.00 -0.21 0.00 -0.92 0.00 0.00 57.85 56.67 1niu n ARG 136 Cb 0.24 -0.11 -0.10 0.00 0.45 0.00 0.00 32.46 32.94 1niu n ARG 136 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1niu s LEU 137 N -1.49 2.54 0.00 6.15 1.43 -1.26 -5.13 118.68 120.92 1niu s LEU 137 Ca 0.00 -0.99 0.00 0.00 -1.03 0.00 0.00 54.13 52.11 1niu s LEU 137 Cb 0.00 -0.83 0.00 0.00 0.03 0.00 0.00 46.19 45.39 1niu s LEU 137 CO 0.00 -0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.11 1niu n GLY 138 N -0.30 3.61 3.81 -3.19 0.00 -1.26 -4.21 105.19 103.65 1niu n GLY 138 Ca -0.08 -1.76 -0.33 0.00 0.00 0.00 0.00 46.02 43.85 1niu n GLY 138 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1niu s VAL 139 N -2.45 3.88 0.00 1.61 -7.23 -1.26 -4.32 120.40 110.64 1niu s VAL 139 Ca 0.00 0.95 0.00 0.00 -1.81 0.00 0.00 61.98 61.12 1niu s VAL 139 Cb 0.00 -3.43 0.00 0.00 0.56 0.00 0.00 36.38 33.51 1niu s VAL 139 CO 0.00 -0.47 0.03 0.29 -0.31 0.00 0.00 175.10 174.64 1niu n LYS 140 N -1.76 1.92 -4.54 4.82 5.02 -1.26 -0.97 118.16 121.39 1niu n LYS 140 Ca 0.09 -0.03 -0.26 0.00 -2.02 0.00 0.00 58.31 56.09 1niu n LYS 140 Cb 0.53 -0.26 -0.11 0.00 -0.02 0.00 0.00 35.03 35.18 1niu n LYS 140 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1niu s ASP 141 N -0.28 3.65 0.04 4.39 1.01 -1.26 -5.06 116.67 119.16 1niu s ASP 141 Ca 0.00 -1.23 -0.04 0.00 0.71 0.00 0.00 52.55 51.99 1niu s ASP 141 Cb 0.00 -0.34 -0.28 0.00 1.01 0.00 0.00 42.92 43.31 1niu s ASP 141 CO 0.00 -0.26 1.02 -0.08 0.21 0.00 0.00 175.17 176.06 1niu h GLU 142 N 2.01 0.27 -0.50 8.23 4.81 -1.99 -2.73 114.58 124.68 1niu h GLU 142 Ca -0.42 -0.47 -0.04 0.00 -0.13 0.00 0.00 59.36 58.30 1niu h GLU 142 Cb 1.25 0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.78 1niu h GLU 142 CO 0.72 1.18 0.15 1.05 -0.73 0.00 0.00 179.01 181.39 1niu h GLU 143 N 0.07 0.78 -0.55 1.92 4.11 -1.99 -2.36 114.58 116.56 1niu h GLU 143 Ca -0.18 -0.17 -0.07 0.00 0.07 0.00 0.00 59.36 59.01 1niu h GLU 143 Cb 2.00 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 31.12 1niu h GLU 143 CO 0.19 0.73 0.07 1.49 0.07 0.00 0.00 179.01 181.56 1niu h GLU 144 N 0.68 0.92 -0.68 1.06 4.57 -2.00 -1.86 114.58 117.27 1niu h GLU 144 Ca 0.16 -0.26 0.04 0.00 -1.18 0.00 0.00 59.36 58.12 1niu h GLU 144 Cb 0.28 -0.10 -0.05 0.00 -0.16 0.00 0.00 28.75 28.72 1niu h GLU 144 CO -0.00 0.90 0.42 1.15 -1.18 0.00 0.00 179.01 180.30 1niu h THR 145 N 0.81 1.07 0.00 0.32 2.02 -1.32 -1.79 112.91 114.02 1niu h THR 145 Ca 0.16 -0.28 -0.12 0.00 0.77 0.00 0.00 66.41 66.94 1niu h THR 145 Cb 0.44 0.19 -0.02 0.00 -1.74 0.00 0.00 68.15 67.02 1niu h THR 145 CO 0.02 0.15 -0.59 0.11 0.37 0.00 0.00 175.52 175.58 1niu h LYS 146 N 0.81 0.00 -0.08 6.66 1.57 -1.32 -2.56 116.57 121.65 1niu h LYS 146 Ca 0.28 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.04 1niu h LYS 146 Cb 0.05 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.36 1niu h LYS 146 CO -0.12 0.59 -0.01 -0.09 -0.57 0.00 0.00 179.45 179.24 1niu h ARG 147 N 0.00 0.15 -0.50 3.15 2.43 -0.85 -0.91 114.38 117.86 1niu h ARG 147 Ca -0.01 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.13 1niu h ARG 147 Cb 1.11 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.61 1niu h ARG 147 CO 0.08 0.46 0.29 0.82 -1.51 0.00 0.00 179.97 180.11 1niu h ILE 148 N -0.17 1.04 -0.53 1.20 2.04 -1.32 -0.39 117.51 119.38 1niu h ILE 148 Ca 0.02 -0.20 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 1niu h ILE 148 Cb 0.40 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 1niu h ILE 148 CO 0.01 0.11 0.10 0.58 0.00 0.00 0.00 178.15 178.94 1niu h VAL 149 N 0.58 1.23 0.07 1.67 2.07 -1.41 -0.85 116.25 119.61 1niu h VAL 149 Ca 0.20 -0.86 -0.00 0.00 0.82 0.00 0.00 66.70 66.85 1niu h VAL 149 Cb 0.03 0.72 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1niu h VAL 149 CO -0.09 0.32 -0.03 0.00 0.02 0.00 0.00 177.57 177.78 1niu h ALA 150 N 1.31 -0.09 -0.73 1.67 0.00 -0.63 -0.20 119.26 120.58 1niu h ALA 150 Ca 0.17 -0.21 0.12 0.00 0.00 0.00 0.00 54.91 54.99 1niu h ALA 150 Cb 0.33 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1niu h ALA 150 CO 0.00 -0.33 0.49 -0.07 0.00 0.00 0.00 179.25 179.34 1niu h LEU 151 N -0.53 0.48 -0.20 0.00 3.38 -0.96 0.33 115.31 117.81 1niu h LEU 151 Ca -0.01 0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.78 1niu h LEU 151 Cb 0.46 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.13 1niu h LEU 151 CO 0.02 0.27 -0.64 0.40 0.09 0.00 0.00 178.44 178.58 1niu h ILE 152 N 0.53 1.29 -0.57 1.22 2.04 -1.02 -3.11 117.51 117.87 1niu h ILE 152 Ca 0.35 -1.84 -0.10 0.00 1.00 0.00 0.00 64.86 64.27 1niu h ILE 152 Cb 0.64 1.87 -0.02 0.00 -0.74 0.00 0.00 36.82 38.57 1niu h ILE 152 CO -0.12 0.59 -0.03 -0.08 0.00 0.00 0.00 178.15 178.51 1niu h GLU 153 N 0.52 1.02 -0.16 2.37 4.57 0.92 -3.21 114.58 120.61 1niu h GLU 153 Ca -0.02 -0.33 -0.09 0.00 -1.18 0.00 0.00 59.36 57.73 1niu h GLU 153 Cb 1.26 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.75 1niu h GLU 153 CO 0.14 1.02 -0.29 0.00 -1.18 0.00 0.00 179.01 178.69 1niu h ARG 154 N 0.93 0.31 -6.29 1.92 3.08 -0.43 -3.42 114.38 110.48 1niu h ARG 154 Ca 0.16 -0.12 -0.54 0.00 0.07 0.00 0.00 59.98 59.55 1niu h ARG 154 Cb 0.58 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.58 1niu h ARG 154 CO 0.03 0.59 0.20 -1.58 -1.07 0.00 0.00 179.97 178.14 1niu s HIS 155 N -4.39 3.70 -0.43 3.04 2.46 -1.18 -4.95 115.29 113.54 1niu s HIS 155 Ca -0.05 1.49 0.26 0.00 0.47 0.00 0.00 55.06 57.23 1niu s HIS 155 Cb 0.14 -2.88 0.98 0.00 -0.13 0.00 0.00 32.58 30.68 1niu s HIS 155 CO 0.77 0.19 1.77 -1.00 -2.47 0.00 0.00 174.74 173.99 1niu h PRO 156 N 6.05 0.00 -0.02 2.88 0.13 -1.85 -3.19 132.00 136.00 1niu h PRO 156 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1niu h PRO 156 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1niu h PRO 156 CO 0.73 0.00 -0.05 0.72 -0.23 0.00 0.00 178.00 179.17 1niu n HIS 157 N -2.45 0.00 -3.46 1.56 8.25 -1.26 -4.91 115.22 112.95 1niu n HIS 157 Ca 0.03 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.12 1niu n HIS 157 Cb 0.30 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.35 1niu n HIS 157 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1niu s PHE 158 N -1.53 3.45 -0.05 4.41 0.40 -1.21 -0.80 117.98 122.66 1niu s PHE 158 Ca 0.20 0.66 0.03 0.00 -0.60 0.00 0.00 56.93 57.21 1niu s PHE 158 Cb 0.14 -2.42 0.01 0.00 0.51 0.00 0.00 43.02 41.26 1niu s PHE 158 CO 0.25 0.17 -0.13 0.08 0.70 0.00 0.00 175.22 176.29 1niu s VAL 159 N 0.68 1.17 -0.69 -0.44 1.01 -0.52 -4.74 120.40 116.86 1niu s VAL 159 Ca 0.19 -0.53 -0.20 0.00 0.00 0.00 0.00 61.98 61.44 1niu s VAL 159 Cb -0.14 -1.04 0.11 0.00 0.00 0.00 0.00 36.38 35.31 1niu s VAL 159 CO 0.06 0.35 0.87 -0.22 0.00 0.00 0.00 175.10 176.16 1niu s LEU 160 N 0.41 5.12 0.02 3.92 2.96 -1.26 0.17 118.68 130.01 1niu s LEU 160 Ca -0.10 -1.51 0.15 0.00 -0.22 0.00 0.00 54.13 52.45 1niu s LEU 160 Cb -0.13 -2.35 -0.18 0.00 0.50 0.00 0.00 46.19 44.03 1niu s LEU 160 CO 0.03 -1.17 0.76 1.21 -1.32 0.00 0.00 176.35 175.86 1niu n GLU 161 N 6.63 0.62 -4.15 1.98 2.13 0.21 -4.63 120.64 123.43 1niu n GLU 161 Ca 0.00 0.26 -0.14 0.00 0.66 0.00 0.00 57.16 57.95 1niu n GLU 161 Cb 0.45 -1.80 -0.07 0.00 0.27 0.00 0.00 31.44 30.28 1niu n GLU 161 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 1niu s GLY 162 N -4.93 1.48 -0.23 8.31 0.00 -0.49 -1.91 107.32 109.55 1niu s GLY 162 Ca -0.04 -1.58 -0.11 0.00 0.00 0.00 0.00 44.72 42.99 1niu s GLY 162 CO 0.82 -1.17 0.55 -2.27 0.00 0.00 0.00 173.10 171.02 1niu s LEU 163 N -3.20 -0.66 0.24 0.66 2.96 -0.29 -1.15 118.68 117.24 1niu s LEU 163 Ca 0.34 1.24 -0.14 0.00 -0.22 0.00 0.00 54.13 55.35 1niu s LEU 163 Cb 0.03 1.87 0.00 0.00 0.50 0.00 0.00 46.19 48.59 1niu s LEU 163 CO 0.17 -0.22 0.50 -0.72 -1.32 0.00 0.00 176.35 174.76 1niu s TYR 164 N 1.94 0.25 0.27 5.38 1.13 0.20 -1.91 117.35 124.62 1niu s TYR 164 Ca -0.08 -0.62 0.01 0.00 -1.41 0.00 0.00 57.07 54.98 1niu s TYR 164 Cb -0.08 0.26 -0.03 0.00 -1.10 0.00 0.00 41.96 41.01 1niu s TYR 164 CO -0.16 -1.00 0.26 -0.08 -2.51 0.00 0.00 175.55 172.06 1niu s THR 165 N -3.99 0.00 -0.03 -3.49 -1.32 -1.11 0.43 115.64 106.13 1niu s THR 165 Ca 0.19 -1.90 -0.02 0.00 -1.21 0.00 0.00 61.69 58.75 1niu s THR 165 Cb -0.01 -2.50 0.01 0.00 -1.51 0.00 0.00 72.50 68.49 1niu s THR 165 CO 0.07 0.00 0.06 -2.28 -2.21 0.00 0.00 174.62 170.26 1niu s HIS 166 N -3.71 -0.07 0.11 9.09 2.46 -1.26 -4.32 115.29 117.59 1niu s HIS 166 Ca 0.37 0.18 -0.16 0.00 0.47 0.00 0.00 55.06 55.92 1niu s HIS 166 Cb 0.04 0.01 -0.07 0.00 -0.13 0.00 0.00 32.58 32.43 1niu s HIS 166 CO 0.19 -0.04 0.55 -0.06 -2.47 0.00 0.00 174.74 172.91 1niu s PHE 167 N 0.13 3.69 -0.13 3.88 0.08 -1.26 -4.46 117.98 119.90 1niu s PHE 167 Ca -0.01 1.14 0.20 0.00 0.12 0.00 0.00 56.93 58.38 1niu s PHE 167 Cb -0.01 -2.42 -0.18 0.00 -0.57 0.00 0.00 43.02 39.84 1niu s PHE 167 CO -0.00 0.50 0.67 0.00 -0.10 0.00 0.00 175.22 176.28 1niu n ALA 168 N 1.20 2.25 -2.00 5.36 0.00 -1.26 -4.54 120.51 121.52 1niu n ALA 168 Ca -0.08 -0.58 0.05 0.00 0.00 0.00 0.00 53.44 52.83 1niu n ALA 168 Cb 0.51 -0.82 0.09 0.00 0.00 0.00 0.00 19.45 19.23 1niu n ALA 168 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1niu n THR 169 N -2.64 0.91 0.26 0.00 -2.24 -1.26 -4.82 114.28 104.48 1niu n THR 169 Ca -0.09 -1.73 0.13 0.00 -2.27 0.00 0.00 64.05 60.09 1niu n THR 169 Cb 0.74 0.41 0.66 0.00 -2.10 0.00 0.00 70.33 70.04 1niu n THR 169 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1niu h ALA 170 N 0.77 1.00 -0.61 6.98 0.00 -1.96 -1.93 119.26 123.51 1niu h ALA 170 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1niu h ALA 170 Cb 1.45 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1niu h ALA 170 CO 0.04 0.00 0.00 -0.40 0.00 0.00 0.00 179.25 178.89 1niu n ASP 171 N -2.43 3.83 -4.81 0.00 5.75 -1.26 -4.39 116.55 113.23 1niu n ASP 171 Ca -0.01 -2.18 -0.36 0.00 -0.01 0.00 0.00 54.79 52.23 1niu n ASP 171 Cb 0.11 -0.48 -0.07 0.00 -1.03 0.00 0.00 41.12 39.65 1niu n ASP 171 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1niu s GLU 172 N -1.46 3.78 0.30 0.11 8.01 -0.73 -4.32 118.70 124.40 1niu s GLU 172 Ca 0.44 -0.17 0.03 0.00 0.01 0.00 0.00 54.97 55.27 1niu s GLU 172 Cb 0.26 -3.29 0.60 0.00 -4.31 0.00 0.00 34.13 27.38 1niu s GLU 172 CO 0.26 0.56 1.86 -0.39 0.01 0.00 0.00 175.26 177.56 1niu h VAL 173 N 4.30 0.94 -3.21 2.63 -1.51 -1.88 -3.37 116.25 114.14 1niu h VAL 173 Ca -0.49 -0.33 -0.58 0.00 -1.23 0.00 0.00 66.70 64.08 1niu h VAL 173 Cb 1.19 -0.09 -0.06 0.00 -2.13 0.00 0.00 31.29 30.20 1niu h VAL 173 CO 0.66 0.17 0.83 0.21 -1.23 0.00 0.00 177.57 178.21 1niu s ASN 174 N -5.79 7.00 -0.10 4.19 3.84 -1.26 -4.94 114.94 117.87 1niu s ASN 174 Ca -0.11 1.19 0.10 0.00 0.21 0.00 0.00 52.86 54.24 1niu s ASN 174 Cb 0.22 -2.54 0.45 0.00 -0.55 0.00 0.00 41.25 38.83 1niu s ASN 174 CO 0.80 -0.80 1.26 0.35 -2.79 0.00 0.00 177.10 175.93 1niu n THR 175 N 5.65 1.32 0.01 -5.21 -2.24 -1.26 -4.59 114.28 107.95 1niu n THR 175 Ca 0.12 -0.75 -0.10 0.00 -2.27 0.00 0.00 64.05 61.05 1niu n THR 175 Cb 0.47 -0.18 -0.04 0.00 -2.10 0.00 0.00 70.33 68.48 1niu n THR 175 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1niu h ASP 176 N 2.40 -0.20 0.36 3.42 3.32 -1.94 -0.24 116.42 123.54 1niu h ASP 176 Ca 0.00 0.05 -0.15 0.00 0.02 0.00 0.00 57.03 56.94 1niu h ASP 176 Cb 1.14 0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.79 1niu h ASP 176 CO 0.21 -0.09 -0.64 0.22 -1.72 0.00 0.00 179.24 177.22 1niu h TYR 177 N -0.07 0.34 -0.32 4.55 3.20 -1.95 -2.67 116.97 120.05 1niu h TYR 177 Ca 0.06 -0.14 0.03 0.00 3.14 0.00 0.00 58.73 61.82 1niu h TYR 177 Cb 0.16 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.34 1niu h TYR 177 CO -0.18 0.83 0.14 0.35 -1.64 0.00 0.00 178.16 177.66 1niu h PHE 178 N 0.19 0.25 -0.73 -3.82 3.57 -1.79 -1.59 116.94 113.02 1niu h PHE 178 Ca -0.01 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1niu h PHE 178 Cb 1.16 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.80 1niu h PHE 178 CO 0.02 0.13 0.43 0.77 -2.23 0.00 0.00 178.31 177.43 1niu h SER 179 N 0.30 0.89 -0.20 0.41 0.02 -0.92 -0.04 113.55 114.01 1niu h SER 179 Ca 0.14 -0.07 0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1niu h SER 179 Cb 0.08 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 1niu h SER 179 CO -0.12 0.70 0.12 0.22 -1.14 0.00 0.00 176.83 176.61 1niu h TYR 180 N 1.00 0.23 -0.26 3.45 3.20 -1.13 -1.50 116.97 121.95 1niu h TYR 180 Ca 0.26 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.13 1niu h TYR 180 Cb -0.01 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 1niu h TYR 180 CO -0.01 0.14 0.15 1.96 -1.64 0.00 0.00 178.16 178.76 1niu h GLN 181 N 0.25 0.36 -0.61 1.82 4.20 -0.82 0.18 115.11 120.48 1niu h GLN 181 Ca 0.07 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 1niu h GLN 181 Cb -0.02 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 27.66 1niu h GLN 181 CO -0.03 0.30 0.37 -0.92 -0.67 0.00 0.00 178.83 177.88 1niu h TYR 182 N 0.32 0.81 -0.49 2.96 3.20 -0.92 0.28 116.97 123.13 1niu h TYR 182 Ca 0.09 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.87 1niu h TYR 182 Cb 0.04 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.02 1niu h TYR 182 CO -0.04 0.55 -0.06 1.15 -1.64 0.00 0.00 178.16 178.13 1niu h THR 183 N 0.83 1.26 -0.27 1.81 2.02 -1.13 -1.31 112.91 116.12 1niu h THR 183 Ca 0.22 -1.13 -0.13 0.00 0.77 0.00 0.00 66.41 66.14 1niu h THR 183 Cb -0.02 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 1niu h THR 183 CO -0.04 0.39 -0.39 -0.09 0.37 0.00 0.00 175.52 175.77 1niu h ARG 184 N 0.78 0.62 -0.26 6.66 1.12 -0.41 -0.68 114.38 122.22 1niu h ARG 184 Ca 0.14 -0.31 -0.02 0.00 -1.11 0.00 0.00 59.98 58.68 1niu h ARG 184 Cb 0.55 0.00 -0.01 0.00 -0.01 0.00 0.00 29.97 30.50 1niu h ARG 184 CO 0.03 0.90 0.09 0.35 -3.11 0.00 0.00 179.97 178.24 1niu h PHE 185 N 0.51 0.40 -0.95 2.20 3.57 -0.69 0.18 116.94 122.16 1niu h PHE 185 Ca 0.05 -0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.56 1niu h PHE 185 Cb 0.90 -0.12 -0.06 0.00 2.79 0.00 0.00 35.95 39.46 1niu h PHE 185 CO 0.04 0.42 0.62 -0.07 -2.23 0.00 0.00 178.31 177.09 1niu h LEU 186 N 0.26 1.00 -0.44 0.59 3.38 -0.89 0.13 115.31 119.34 1niu h LEU 186 Ca 0.08 -0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 1niu h LEU 186 Cb 0.20 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1niu h LEU 186 CO -0.01 0.66 -0.30 -0.74 0.09 0.00 0.00 178.44 178.15 1niu h HIS 187 N 1.14 1.14 -0.01 1.13 2.76 -0.54 -3.18 115.15 117.60 1niu h HIS 187 Ca 0.39 -0.31 -0.11 0.00 -2.20 0.00 0.00 60.37 58.14 1niu h HIS 187 Cb 0.09 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 28.78 1niu h HIS 187 CO -0.00 1.14 -0.50 0.52 -1.30 0.00 0.00 177.93 177.80 1niu h MET 188 N 0.81 0.02 0.00 5.26 2.86 0.57 -2.89 114.93 121.56 1niu h MET 188 Ca 0.09 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.69 1niu h MET 188 Cb 0.89 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.55 1niu h MET 188 CO 0.08 0.51 -0.11 -0.07 1.06 0.00 0.00 176.91 178.38 1niu h LEU 189 N 0.01 0.00 -0.25 1.22 3.38 -0.77 -2.06 115.31 116.84 1niu h LEU 189 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1niu h LEU 189 Cb 0.88 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.63 1niu h LEU 189 CO 0.07 0.11 0.00 -0.62 0.09 0.00 0.00 178.44 178.09 1niu n GLU 190 N -4.22 0.08 0.00 1.13 -0.58 -1.09 -2.48 120.64 113.47 1niu n GLU 190 Ca -0.03 0.30 0.15 0.00 -0.42 0.00 0.00 57.16 57.17 1niu n GLU 190 Cb 0.19 -1.64 0.87 0.00 -0.57 0.00 0.00 31.44 30.28 1niu n GLU 190 CO 0.00 0.00 0.00 0.91 -0.48 0.00 0.00 177.13 177.56 1niu n TRP 191 N -1.79 0.00 -3.88 -0.32 8.01 -0.77 -4.79 117.44 113.90 1niu n TRP 191 Ca 0.03 0.00 -0.36 0.00 -1.31 0.00 0.00 57.50 55.86 1niu n TRP 191 Cb 0.21 -0.09 -0.07 0.00 -2.01 0.00 0.00 31.31 29.34 1niu n TRP 191 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 1niu s LEU 192 N -2.19 4.20 0.39 -0.99 1.43 -1.03 -4.73 118.68 115.76 1niu s LEU 192 Ca 0.41 0.32 0.10 0.00 -1.03 0.00 0.00 54.13 53.92 1niu s LEU 192 Cb 0.21 -2.04 0.88 0.00 0.03 0.00 0.00 46.19 45.26 1niu s LEU 192 CO 0.39 0.30 1.93 1.55 0.23 0.00 0.00 176.35 180.75 1niu h PRO 193 N 5.78 0.59 -2.85 1.29 0.13 -1.89 -3.43 132.00 131.61 1niu h PRO 193 Ca -0.48 -0.04 -0.10 0.00 -0.87 0.00 0.00 66.00 64.52 1niu h PRO 193 Cb 1.19 -0.13 -0.19 0.00 0.13 0.00 0.00 31.00 32.00 1niu h PRO 193 CO 0.65 0.39 -0.15 -1.54 -0.23 0.00 0.00 178.00 177.12 1niu s SER 194 N -6.04 -0.29 0.03 1.44 1.04 -1.26 -5.14 113.70 103.47 1niu s SER 194 Ca -0.09 0.17 -0.30 0.00 0.48 0.00 0.00 55.95 56.21 1niu s SER 194 Cb 0.20 0.38 -0.06 0.00 0.10 0.00 0.00 66.02 66.64 1niu s SER 194 CO 0.77 -0.53 1.39 -0.13 0.98 0.00 0.00 173.24 175.72 1niu s ARG 195 N -1.59 4.30 0.81 4.02 1.81 -1.26 -5.03 118.95 122.01 1niu s ARG 195 Ca -0.11 1.98 -0.11 0.00 -1.72 0.00 0.00 55.73 55.77 1niu s ARG 195 Cb -0.03 -3.49 0.09 0.00 -0.45 0.00 0.00 34.95 31.07 1niu s ARG 195 CO 0.04 -0.53 1.17 -1.25 -0.68 0.00 0.00 175.30 174.05 1niu s PRO 196 N 2.03 1.84 0.48 3.54 0.04 -1.26 -4.95 135.00 136.72 1niu s PRO 196 Ca 0.64 -0.03 0.14 0.00 0.04 0.00 0.00 61.00 61.78 1niu s PRO 196 Cb -0.33 -1.98 1.13 0.00 0.04 0.00 0.00 34.50 33.36 1niu s PRO 196 CO 0.28 -1.63 2.09 -1.00 0.04 0.00 0.00 177.00 176.77 1niu h PRO 197 N -1.04 0.10 -4.87 0.56 0.13 -1.82 -3.40 132.00 121.65 1niu h PRO 197 Ca -0.45 -0.01 -0.67 0.00 -0.87 0.00 0.00 66.00 63.99 1niu h PRO 197 Cb 1.32 -0.02 -0.31 0.00 0.13 0.00 0.00 31.00 32.11 1niu h PRO 197 CO 0.61 0.11 -0.72 -0.51 -0.23 0.00 0.00 178.00 177.26 1niu s LEU 198 N -9.05 3.40 -0.15 1.56 1.43 -0.80 -4.95 118.68 110.12 1niu s LEU 198 Ca -0.05 -0.91 0.01 0.00 -1.03 0.00 0.00 54.13 52.15 1niu s LEU 198 Cb 0.17 -1.70 0.00 0.00 0.03 0.00 0.00 46.19 44.69 1niu s LEU 198 CO 0.69 -0.16 -0.18 -0.69 0.23 0.00 0.00 176.35 176.24 1niu s VAL 199 N 1.34 2.45 0.04 -1.59 1.01 -1.26 -1.14 120.40 121.24 1niu s VAL 199 Ca -0.00 -0.85 -0.06 0.00 0.00 0.00 0.00 61.98 61.07 1niu s VAL 199 Cb -0.17 -2.01 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 1niu s VAL 199 CO -0.03 0.53 0.12 -1.38 0.00 0.00 0.00 175.10 174.34 1niu s HIS 200 N 0.80 0.16 0.00 5.22 -3.43 -0.80 -2.66 115.29 114.58 1niu s HIS 200 Ca -0.06 -0.45 0.00 0.00 -0.80 0.00 0.00 55.06 53.75 1niu s HIS 200 Cb -0.15 -0.11 0.00 0.00 -1.43 0.00 0.00 32.58 30.88 1niu s HIS 200 CO -0.00 -0.38 0.00 0.00 -2.00 0.00 0.00 174.74 172.35 1niu s ALA 202 N -1.00 3.36 0.00 0.00 0.00 -1.26 -4.39 121.76 118.46 1niu s ALA 202 Ca 0.00 0.96 0.00 0.00 0.00 0.00 0.00 51.96 52.92 1niu s ALA 202 Cb 0.00 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.76 1niu s ALA 202 CO 0.00 -0.30 0.00 0.27 0.00 0.00 0.00 175.76 175.73 1niu n ASN 203 N 0.85 0.74 0.21 0.00 0.23 -1.26 -1.31 115.26 114.71 1niu n ASN 203 Ca 0.00 -0.34 -0.15 0.00 -0.53 0.00 0.00 54.58 53.56 1niu n ASN 203 Cb 0.45 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.07 1niu n ASN 203 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1niu h SER 204 N 0.00 -0.41 0.03 0.53 0.02 -1.94 -2.47 113.55 109.31 1niu h SER 204 Ca 0.00 0.02 0.03 0.00 -0.84 0.00 0.00 61.79 60.99 1niu h SER 204 Cb 0.00 0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.61 1niu h SER 204 CO 0.00 -0.29 -0.23 0.00 -1.14 0.00 0.00 176.83 175.17 1niu h ALA 205 N 0.19 -0.32 -0.61 3.77 0.00 -1.95 -0.70 119.26 119.64 1niu h ALA 205 Ca -0.04 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.89 1niu h ALA 205 Cb 0.37 0.39 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 1niu h ALA 205 CO 0.07 -0.74 0.37 0.00 0.00 0.00 0.00 179.25 178.95 1niu h ALA 206 N 0.46 0.79 0.00 0.00 0.00 -1.76 -1.38 119.26 117.36 1niu h ALA 206 Ca 0.05 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1niu h ALA 206 Cb 0.44 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1niu h ALA 206 CO -0.19 0.10 -0.40 0.66 0.00 0.00 0.00 179.25 179.42 1niu h SER 207 N 0.72 0.00 1.00 0.00 4.64 -1.23 0.14 113.55 118.82 1niu h SER 207 Ca 0.25 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.39 1niu h SER 207 Cb 0.04 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.10 1niu h SER 207 CO -0.11 0.40 -1.06 -0.07 -0.87 0.00 0.00 176.83 175.12 1niu h LEU 208 N 0.00 0.00 0.06 5.97 3.38 -0.90 -3.22 115.31 120.60 1niu h LEU 208 Ca -0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 1niu h LEU 208 Cb 1.00 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.72 1niu h LEU 208 CO 0.05 0.72 -1.93 0.54 0.09 0.00 0.00 178.44 177.91 1niu n ARG 209 N -3.13 0.70 -3.25 1.13 1.74 -0.54 -4.56 116.66 108.75 1niu n ARG 209 Ca -0.05 0.26 -0.25 0.00 -0.77 0.00 0.00 57.85 57.04 1niu n ARG 209 Cb 0.86 -1.72 -0.07 0.00 -1.02 0.00 0.00 32.46 30.51 1niu n ARG 209 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1niu n PHE 210 N -3.26 0.91 0.07 -1.55 3.72 0.50 -4.97 117.46 112.88 1niu n PHE 210 Ca -0.27 -3.75 0.19 0.00 -0.05 0.00 0.00 57.45 53.56 1niu n PHE 210 Cb 1.05 -0.42 0.71 0.00 -0.94 0.00 0.00 39.48 39.89 1niu n PHE 210 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1niu h PRO 211 N 3.98 0.00 0.00 -1.08 0.11 -1.73 -1.50 132.00 131.79 1niu h PRO 211 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1niu h PRO 211 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 1niu h PRO 211 CO 0.58 0.00 -0.18 -0.40 -0.21 0.00 0.00 178.00 177.79 1niu n ASP 212 N -4.25 0.53 -1.68 -2.05 5.75 -1.26 -3.82 116.55 109.76 1niu n ASP 212 Ca 0.07 0.37 -0.10 0.00 -0.01 0.00 0.00 54.79 55.12 1niu n ASP 212 Cb 0.51 -0.41 0.22 0.00 -1.03 0.00 0.00 41.12 40.42 1niu n ASP 212 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1niu n ARG 213 N -1.93 2.50 0.00 0.11 5.12 -0.56 -4.63 116.66 117.27 1niu n ARG 213 Ca 0.05 -3.07 0.10 0.00 -1.93 0.00 0.00 57.85 53.00 1niu n ARG 213 Cb 0.40 -2.03 -0.00 0.00 -1.16 0.00 0.00 32.46 29.66 1niu n ARG 213 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1niu n THR 214 N -0.86 0.00 -1.57 0.55 -2.24 -1.25 -4.89 114.28 104.01 1niu n THR 214 Ca 0.43 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 1niu n THR 214 Cb 1.32 1.25 0.00 0.00 -2.10 0.00 0.00 70.33 70.80 1niu n THR 214 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1niu n PHE 215 N 0.02 0.00 0.10 4.78 3.01 -1.26 -3.78 117.46 120.33 1niu n PHE 215 Ca 0.09 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.61 1niu n PHE 215 Cb 0.44 0.01 0.13 0.00 -0.01 0.00 0.00 39.48 40.06 1niu n PHE 215 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 1niu n ASN 216 N 4.26 2.70 -3.67 4.37 6.94 -1.09 -4.74 115.26 124.02 1niu n ASN 216 Ca 0.00 -1.82 -0.11 0.00 -0.02 0.00 0.00 54.58 52.63 1niu n ASN 216 Cb 0.00 -0.16 -0.09 0.00 -2.36 0.00 0.00 39.78 37.17 1niu n ASN 216 CO 0.00 0.00 0.00 -0.32 -1.03 0.00 0.00 177.26 175.91 1niu s MET 217 N -1.04 0.62 0.05 -3.83 0.00 -1.22 -0.67 119.30 113.21 1niu s MET 217 Ca 0.23 0.93 0.06 0.00 0.00 0.00 0.00 55.69 56.90 1niu s MET 217 Cb 0.13 0.19 -0.04 0.00 0.00 0.00 0.00 34.83 35.12 1niu s MET 217 CO 0.18 -0.12 -0.11 0.14 0.00 0.00 0.00 175.02 175.11 1niu s VAL 218 N 0.95 3.32 -0.64 10.11 -7.23 -0.57 -4.20 120.40 122.14 1niu s VAL 218 Ca -0.05 -1.06 -0.08 0.00 -1.81 0.00 0.00 61.98 58.97 1niu s VAL 218 Cb -0.05 -2.47 0.17 0.00 0.56 0.00 0.00 36.38 34.58 1niu s VAL 218 CO -0.08 0.28 0.51 -0.13 -0.31 0.00 0.00 175.10 175.36 1niu s ARG 219 N -1.71 2.86 -0.39 4.82 0.52 -0.43 0.28 118.95 124.89 1niu s ARG 219 Ca 0.18 -2.28 -0.23 0.00 -0.52 0.00 0.00 55.73 52.88 1niu s ARG 219 Cb -0.11 -4.01 0.01 0.00 0.52 0.00 0.00 34.95 31.37 1niu s ARG 219 CO 0.09 -1.22 0.77 0.12 0.02 0.00 0.00 175.30 175.09 1niu s PHE 220 N 0.44 3.07 0.00 -0.53 5.36 0.03 -3.69 117.98 122.67 1niu s PHE 220 Ca 0.14 0.40 0.00 0.00 -0.96 0.00 0.00 56.93 56.51 1niu s PHE 220 Cb -0.19 -3.47 0.00 0.00 -0.34 0.00 0.00 43.02 39.02 1niu s PHE 220 CO -0.04 -0.81 0.00 0.41 -1.46 0.00 0.00 175.22 173.32 1niu n GLY 221 N 4.70 0.79 0.32 13.12 0.00 -1.26 -1.47 105.19 121.39 1niu n GLY 221 Ca 0.02 0.00 0.29 0.00 0.00 0.00 0.00 46.02 46.33 1niu n GLY 221 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1niu h ILE 222 N 0.00 0.08 0.00 -0.61 6.09 -1.89 0.26 117.51 121.44 1niu h ILE 222 Ca 0.00 -0.03 -0.04 0.00 -1.37 0.00 0.00 64.86 63.43 1niu h ILE 222 Cb 0.00 -0.01 -0.01 0.00 0.47 0.00 0.00 36.82 37.27 1niu h ILE 222 CO 0.00 0.02 -0.17 0.00 -3.07 0.00 0.00 178.15 174.93 1niu h ALA 223 N 1.96 1.11 -0.38 0.18 0.00 -1.91 -2.62 119.26 117.60 1niu h ALA 223 Ca 0.80 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.54 1niu h ALA 223 Cb 2.04 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.78 1niu h ALA 223 CO -0.74 0.21 0.15 1.98 0.00 0.00 0.00 179.25 180.85 1niu h MET 224 N 0.00 0.53 -0.05 0.00 1.85 -0.77 -1.16 114.93 115.32 1niu h MET 224 Ca -0.00 -0.07 0.00 0.00 -0.61 0.00 0.00 59.70 59.02 1niu h MET 224 Cb 0.56 -0.10 0.00 0.00 0.43 0.00 0.00 31.60 32.49 1niu h MET 224 CO 0.02 0.44 0.00 0.66 -0.40 0.00 0.00 176.91 177.64 1niu n TYR 225 N -4.39 0.06 -0.84 1.39 4.01 -1.00 -4.46 117.16 111.93 1niu n TYR 225 Ca 0.02 -0.03 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1niu n TYR 225 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 1niu n TYR 225 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1niu n GLY 226 N 1.03 0.50 3.52 2.72 0.00 -0.44 -2.21 105.19 110.31 1niu n GLY 226 Ca 0.18 -0.70 -0.34 0.00 0.00 0.00 0.00 46.02 45.16 1niu n GLY 226 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1niu s LEU 227 N 0.00 3.25 0.32 0.99 1.43 -1.15 -3.73 118.68 119.79 1niu s LEU 227 Ca 0.00 -0.10 -0.28 0.00 -1.03 0.00 0.00 54.13 52.72 1niu s LEU 227 Cb 0.00 -1.77 -0.10 0.00 0.03 0.00 0.00 46.19 44.36 1niu s LEU 227 CO 0.00 0.21 1.22 0.00 0.23 0.00 0.00 176.35 178.01 1niu s ALA 228 N 0.10 3.42 0.55 4.21 0.00 -1.26 -3.47 121.76 125.30 1niu s ALA 228 Ca -0.01 1.10 0.28 0.00 0.00 0.00 0.00 51.96 53.33 1niu s ALA 228 Cb -0.14 -3.41 1.45 0.00 0.00 0.00 0.00 23.12 21.02 1niu s ALA 228 CO 0.03 -0.46 1.96 -1.35 0.00 0.00 0.00 175.76 175.93 1niu h PRO 229 N 3.42 0.00 -2.08 0.00 0.11 -1.96 -3.45 132.00 128.04 1niu h PRO 229 Ca -0.48 0.00 0.15 0.00 0.11 0.00 0.00 66.00 65.78 1niu h PRO 229 Cb 1.22 0.00 -0.16 0.00 0.11 0.00 0.00 31.00 32.17 1niu h PRO 229 CO 0.65 0.00 0.57 -1.54 -0.21 0.00 0.00 178.00 177.48 1niu s SER 230 N -5.87 -0.30 0.56 -2.05 1.04 -1.26 -5.00 113.70 100.82 1niu s SER 230 Ca -0.05 -0.01 0.32 0.00 0.48 0.00 0.00 55.95 56.69 1niu s SER 230 Cb 0.19 0.33 1.61 0.00 0.10 0.00 0.00 66.02 68.24 1niu s SER 230 CO 0.69 -0.53 2.10 -0.65 0.98 0.00 0.00 173.24 175.84 1niu h PRO 231 N 2.00 0.00 -0.27 4.02 0.11 -1.91 -3.18 132.00 132.77 1niu h PRO 231 Ca -0.19 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.93 1niu h PRO 231 Cb 1.22 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 1niu h PRO 231 CO 0.29 0.07 0.14 0.78 -0.21 0.00 0.00 178.00 179.07 1niu h GLY 232 N 1.02 0.36 -2.08 -0.55 0.00 -1.95 -3.25 103.07 96.62 1niu h GLY 232 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1niu h GLY 232 CO 0.01 0.09 0.00 0.29 0.00 0.00 0.00 176.54 176.93 1niu n ILE 233 N -4.96 0.78 -0.22 2.60 -5.35 -1.20 -4.66 119.36 106.35 1niu n ILE 233 Ca -0.02 -0.75 0.02 0.00 -0.27 0.00 0.00 62.75 61.73 1niu n ILE 233 Cb 0.06 0.36 0.12 0.00 -1.74 0.00 0.00 39.64 38.43 1niu n ILE 233 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 1niu h LYS 234 N 3.26 0.12 0.00 6.28 1.57 -1.67 -0.18 116.57 125.95 1niu h LYS 234 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1niu h LYS 234 Cb 0.77 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.05 1niu h LYS 234 CO 0.01 0.08 0.00 -1.00 -0.57 0.00 0.00 179.45 177.97 1niu h PRO 235 N 0.12 0.00 -0.00 3.15 0.13 -1.87 -2.88 132.00 130.65 1niu h PRO 235 Ca 0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.48 1niu h PRO 235 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.71 1niu h PRO 235 CO -0.56 0.00 -0.08 1.28 -0.23 0.00 0.00 178.00 178.41 1niu n LEU 236 N -2.90 0.26 -4.70 1.56 4.77 -0.09 -4.88 117.00 111.02 1niu n LEU 236 Ca 0.01 0.15 -0.42 0.00 -0.03 0.00 0.00 56.01 55.72 1niu n LEU 236 Cb 0.29 -0.25 -0.03 0.00 -2.33 0.00 0.00 43.42 41.10 1niu n LEU 236 CO 0.26 0.05 0.93 -0.76 -1.33 0.00 0.00 177.39 176.53 1niu s LEU 237 N -2.58 4.34 0.30 2.23 1.43 -1.09 -4.84 118.68 118.47 1niu s LEU 237 Ca 0.27 1.98 -0.02 0.00 -1.03 0.00 0.00 54.13 55.33 1niu s LEU 237 Cb 0.20 -3.57 0.46 0.00 0.03 0.00 0.00 46.19 43.30 1niu s LEU 237 CO 0.49 -0.53 1.95 1.55 0.23 0.00 0.00 176.35 180.04 1niu h PRO 238 N 7.07 1.03 -4.80 1.29 0.13 -1.90 -3.44 132.00 131.38 1niu h PRO 238 Ca -0.39 -0.08 -0.30 0.00 -0.87 0.00 0.00 66.00 64.36 1niu h PRO 238 Cb 1.20 -0.22 -0.20 0.00 0.13 0.00 0.00 31.00 31.91 1niu h PRO 238 CO 0.84 0.71 -0.74 1.52 -0.23 0.00 0.00 178.00 180.10 1niu s TYR 239 N -5.81 0.88 0.36 1.56 -0.85 -1.26 -5.13 117.35 107.10 1niu s TYR 239 Ca -0.11 -0.59 -0.28 0.00 -0.52 0.00 0.00 57.07 55.57 1niu s TYR 239 Cb 0.17 -0.51 -0.10 0.00 0.38 0.00 0.00 41.96 41.91 1niu s TYR 239 CO 0.79 -0.05 1.35 -1.25 -1.52 0.00 0.00 175.55 174.87 1niu s PRO 240 N -2.20 4.22 -0.03 -3.49 0.04 -1.26 -5.00 135.00 127.28 1niu s PRO 240 Ca -0.02 2.28 -0.12 0.00 0.04 0.00 0.00 61.00 63.18 1niu s PRO 240 Cb -0.06 -2.98 -0.05 0.00 0.04 0.00 0.00 34.50 31.45 1niu s PRO 240 CO -0.00 -0.33 0.33 -0.51 0.04 0.00 0.00 177.00 176.52 1niu s LEU 241 N -2.00 4.44 -0.33 -3.56 1.43 -1.26 -4.95 118.68 112.45 1niu s LEU 241 Ca 0.51 0.80 -0.07 0.00 -1.03 0.00 0.00 54.13 54.34 1niu s LEU 241 Cb -0.41 -2.46 0.03 0.00 0.03 0.00 0.00 46.19 43.38 1niu s LEU 241 CO 0.54 0.34 0.12 -0.54 0.23 0.00 0.00 176.35 177.04 1niu s LYS 242 N -1.13 2.82 0.22 1.70 1.02 -1.26 -4.96 119.74 118.16 1niu s LYS 242 Ca 0.22 -1.05 -0.31 0.00 0.02 0.00 0.00 55.97 54.85 1niu s LYS 242 Cb -0.15 -3.48 -0.11 0.00 -0.52 0.00 0.00 37.83 33.56 1niu s LYS 242 CO 0.11 -0.59 1.66 -2.00 -0.92 0.00 0.00 175.35 173.61 1niu s GLU 243 N 1.47 4.14 -0.09 1.68 2.12 -1.24 -3.67 118.70 123.10 1niu s GLU 243 Ca 0.00 2.56 0.16 0.00 0.36 0.00 0.00 54.97 58.06 1niu s GLU 243 Cb -0.19 -3.07 -0.24 0.00 0.26 0.00 0.00 34.13 30.89 1niu s GLU 243 CO 0.03 -0.70 0.22 0.00 -0.54 0.00 0.00 175.26 174.28 1niu n ALA 244 N 3.50 2.14 -2.68 6.30 0.00 -0.94 -4.89 120.51 123.95 1niu n ALA 244 Ca 0.14 -0.73 -0.37 0.00 0.00 0.00 0.00 53.44 52.47 1niu n ALA 244 Cb 0.36 -0.35 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1niu n ALA 244 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1niu s PHE 245 N -2.82 3.59 0.01 0.00 2.19 -1.26 -0.57 117.98 119.12 1niu s PHE 245 Ca -0.07 0.74 -0.03 0.00 0.33 0.00 0.00 56.93 57.90 1niu s PHE 245 Cb 0.08 -2.25 -0.01 0.00 -1.31 0.00 0.00 43.02 39.53 1niu s PHE 245 CO 0.70 0.49 0.03 -1.54 1.83 0.00 0.00 175.22 176.72 1niu s SER 246 N -0.40 0.17 -0.07 6.13 1.04 -0.72 -4.79 113.70 115.06 1niu s SER 246 Ca 0.19 -0.41 0.03 0.00 0.48 0.00 0.00 55.95 56.24 1niu s SER 246 Cb -0.14 0.14 0.01 0.00 0.10 0.00 0.00 66.02 66.13 1niu s SER 246 CO 0.08 -0.33 -0.14 -0.22 0.98 0.00 0.00 173.24 173.60 1niu s LEU 247 N -1.47 1.72 0.20 2.42 2.96 0.21 -0.68 118.68 124.03 1niu s LEU 247 Ca -0.15 -0.33 0.02 0.00 -0.22 0.00 0.00 54.13 53.44 1niu s LEU 247 Cb -0.09 -0.90 -0.05 0.00 0.50 0.00 0.00 46.19 45.65 1niu s LEU 247 CO -0.00 0.06 0.03 -1.00 -1.32 0.00 0.00 176.35 174.12 1niu s HIS 248 N 0.58 1.31 0.07 5.38 3.76 0.37 -1.22 115.29 125.53 1niu s HIS 248 Ca -0.14 -1.08 -0.02 0.00 -0.15 0.00 0.00 55.06 53.67 1niu s HIS 248 Cb -0.16 -0.75 0.01 0.00 1.11 0.00 0.00 32.58 32.79 1niu s HIS 248 CO 0.04 -0.26 0.11 0.45 -0.85 0.00 0.00 174.74 174.23 1niu n SER 249 N -0.31 -0.33 -3.83 1.40 2.88 0.14 -1.53 113.62 112.04 1niu n SER 249 Ca -0.04 -1.30 -0.12 0.00 -1.33 0.00 0.00 58.87 56.08 1niu n SER 249 Cb 0.64 0.57 -0.09 0.00 -0.75 0.00 0.00 64.21 64.58 1niu n SER 249 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1niu s ARG 250 N -2.07 0.59 -0.01 -1.46 0.52 -1.02 -0.79 118.95 114.71 1niu s ARG 250 Ca 0.04 -0.40 -0.30 0.00 -0.52 0.00 0.00 55.73 54.55 1niu s ARG 250 Cb -0.01 0.25 -0.05 0.00 0.52 0.00 0.00 34.95 35.66 1niu s ARG 250 CO 0.03 -0.15 1.42 -0.51 0.02 0.00 0.00 175.30 176.10 1niu s LEU 251 N -1.54 4.31 -0.01 2.53 1.43 -0.46 -4.21 118.68 120.72 1niu s LEU 251 Ca -0.12 2.11 0.15 0.00 -1.03 0.00 0.00 54.13 55.25 1niu s LEU 251 Cb -0.05 -3.56 -0.21 0.00 0.03 0.00 0.00 46.19 42.40 1niu s LEU 251 CO 0.01 -0.74 0.47 1.33 0.23 0.00 0.00 176.35 177.65 1niu n VAL 252 N 4.76 0.00 -3.75 -1.59 0.24 -0.62 -0.11 118.33 117.26 1niu n VAL 252 Ca 0.14 -0.27 -0.13 0.00 -2.04 0.00 0.00 64.34 62.04 1niu n VAL 252 Cb 0.43 0.50 -0.10 0.00 -1.47 0.00 0.00 33.84 33.20 1niu n VAL 252 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1niu s HIS 253 N -2.82 -0.37 -0.01 6.34 5.65 -1.22 -4.94 115.29 117.94 1niu s HIS 253 Ca -0.01 0.88 0.01 0.00 0.25 0.00 0.00 55.06 56.19 1niu s HIS 253 Cb 0.11 0.13 0.00 0.00 -1.18 0.00 0.00 32.58 31.64 1niu s HIS 253 CO 0.64 -0.21 -0.05 0.08 -0.65 0.00 0.00 174.74 174.56 1niu s VAL 254 N 0.04 0.39 0.01 0.89 1.01 -1.26 -0.76 120.40 120.72 1niu s VAL 254 Ca -0.01 -0.18 -0.28 0.00 0.00 0.00 0.00 61.98 61.51 1niu s VAL 254 Cb -0.03 -0.35 0.08 0.00 0.00 0.00 0.00 36.38 36.08 1niu s VAL 254 CO 0.01 0.13 0.71 -1.59 0.00 0.00 0.00 175.10 174.36 1niu s LYS 255 N 0.08 1.05 -0.15 2.72 -2.85 -0.87 -5.02 119.74 114.70 1niu s LYS 255 Ca -0.00 -0.05 -0.08 0.00 -1.00 0.00 0.00 55.97 54.84 1niu s LYS 255 Cb -0.04 0.49 -0.04 0.00 -2.06 0.00 0.00 37.83 36.18 1niu s LYS 255 CO -0.00 -0.39 0.11 0.21 0.10 0.00 0.00 175.35 175.38 1niu s LYS 256 N -2.21 3.70 0.24 1.78 2.20 -1.26 -0.33 119.74 123.86 1niu s LYS 256 Ca -0.04 -0.21 0.06 0.00 -0.36 0.00 0.00 55.97 55.42 1niu s LYS 256 Cb -0.00 -3.23 -0.03 0.00 -1.51 0.00 0.00 37.83 33.05 1niu s LYS 256 CO -0.00 0.56 0.22 -0.51 -0.36 0.00 0.00 175.35 175.26 1niu s LEU 257 N -0.40 3.91 0.24 5.43 1.43 0.93 -4.96 118.68 125.26 1niu s LEU 257 Ca 0.11 -0.18 0.07 0.00 -1.03 0.00 0.00 54.13 53.10 1niu s LEU 257 Cb -0.12 -2.45 -0.04 0.00 0.03 0.00 0.00 46.19 43.62 1niu s LEU 257 CO 0.01 -0.03 0.21 -1.10 0.23 0.00 0.00 176.35 175.67 1niu s GLN 258 N -3.79 2.98 0.03 1.70 -1.52 -1.26 -2.88 119.66 114.92 1niu s GLN 258 Ca 0.33 -1.01 -0.30 0.00 -1.95 0.00 0.00 55.36 52.43 1niu s GLN 258 Cb -0.08 -2.61 -0.09 0.00 -0.22 0.00 0.00 33.01 30.01 1niu s GLN 258 CO 0.26 0.41 1.96 -1.25 -0.25 0.00 0.00 175.29 176.42 1niu s PRO 259 N -3.78 4.14 0.00 2.91 0.04 -1.26 -2.87 135.00 134.18 1niu s PRO 259 Ca 0.33 2.61 0.00 0.00 0.04 0.00 0.00 61.00 63.97 1niu s PRO 259 Cb -0.08 -4.16 0.00 0.00 0.04 0.00 0.00 34.50 30.30 1niu s PRO 259 CO 0.25 -0.95 0.00 0.41 0.04 0.00 0.00 177.00 176.75 1niu n GLY 260 N 4.54 1.48 3.76 0.56 0.00 -0.68 -5.01 105.19 109.83 1niu n GLY 260 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1niu n GLY 260 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1niu s GLU 261 N -0.22 4.75 0.18 1.61 2.02 -1.14 -4.83 118.70 121.08 1niu s GLU 261 Ca 0.00 1.57 0.02 0.00 0.02 0.00 0.00 54.97 56.57 1niu s GLU 261 Cb 0.00 -3.18 -0.04 0.00 0.10 0.00 0.00 34.13 31.01 1niu s GLU 261 CO 0.00 0.38 0.34 0.15 0.02 0.00 0.00 175.26 176.15 1niu s LYS 262 N -1.38 3.47 -0.05 1.61 1.02 -1.26 -2.27 119.74 120.88 1niu s LYS 262 Ca 0.43 -0.52 0.03 0.00 0.02 0.00 0.00 55.97 55.94 1niu s LYS 262 Cb -0.27 -2.90 0.01 0.00 -0.52 0.00 0.00 37.83 34.14 1niu s LYS 262 CO 0.34 0.46 -0.14 0.08 -0.92 0.00 0.00 175.35 175.17 1niu s VAL 263 N -1.83 1.19 0.24 3.17 1.01 -0.52 -5.00 120.40 118.65 1niu s VAL 263 Ca 0.36 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.79 1niu s VAL 263 Cb -0.11 -1.06 0.00 0.00 0.00 0.00 0.00 36.38 35.22 1niu s VAL 263 CO 0.29 0.36 0.00 -0.24 0.00 0.00 0.00 175.10 175.51 1niu n SER 264 N 3.48 -6.31 -4.60 3.32 2.88 -1.26 -3.61 113.62 107.52 1niu n SER 264 Ca -0.20 1.10 -0.46 0.00 -1.33 0.00 0.00 58.87 57.98 1niu n SER 264 Cb 0.53 -3.10 -0.03 0.00 -0.75 0.00 0.00 64.21 60.86 1niu n SER 264 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1niu n TYR 265 N -3.33 1.42 -0.76 0.66 4.01 -1.26 -0.35 117.16 117.55 1niu n TYR 265 Ca 0.01 0.66 0.00 0.00 -0.16 0.00 0.00 57.90 58.40 1niu n TYR 265 Cb 0.47 -2.29 0.00 0.00 -0.31 0.00 0.00 39.34 37.21 1niu n TYR 265 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1niu n GLY 266 N 1.61 0.60 4.23 2.72 0.00 -1.26 -3.77 105.19 109.32 1niu n GLY 266 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.80 1niu n GLY 266 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1niu n ALA 267 N 0.98 -2.15 -0.09 4.61 0.00 0.53 -4.87 120.51 119.51 1niu n ALA 267 Ca 0.00 -0.44 -0.12 0.00 0.00 0.00 0.00 53.44 52.88 1niu n ALA 267 Cb 0.00 -1.28 -0.04 0.00 0.00 0.00 0.00 19.45 18.13 1niu n ALA 267 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1niu h THR 268 N -1.98 1.29 -3.13 0.00 2.02 -1.65 -3.45 112.91 106.01 1niu h THR 268 Ca -0.67 -1.18 -0.59 0.00 0.77 0.00 0.00 66.41 64.74 1niu h THR 268 Cb 1.40 1.48 -0.04 0.00 -1.74 0.00 0.00 68.15 69.24 1niu h THR 268 CO 0.66 0.37 -0.23 -0.47 0.37 0.00 0.00 175.52 176.23 1niu s TYR 269 N -4.66 3.59 -0.04 3.16 5.04 -1.24 -4.98 117.35 118.22 1niu s TYR 269 Ca -0.13 0.82 0.01 0.00 -2.44 0.00 0.00 57.07 55.33 1niu s TYR 269 Cb 0.08 -2.19 0.02 0.00 0.35 0.00 0.00 41.96 40.23 1niu s TYR 269 CO 0.78 0.51 -0.03 0.99 -1.34 0.00 0.00 175.55 176.47 1niu s THR 270 N -1.40 0.43 0.30 4.34 2.01 -1.26 -1.44 115.64 118.62 1niu s THR 270 Ca 0.33 -0.04 -0.28 0.00 0.31 0.00 0.00 61.69 62.01 1niu s THR 270 Cb -0.14 -0.49 -0.09 0.00 0.01 0.00 0.00 72.50 71.78 1niu s THR 270 CO 0.18 0.21 1.07 0.00 -0.69 0.00 0.00 174.62 175.39 1niu s ALA 271 N 1.10 3.32 -0.10 7.40 0.00 -0.96 -4.93 121.76 127.59 1niu s ALA 271 Ca -0.08 0.81 0.12 0.00 0.00 0.00 0.00 51.96 52.80 1niu s ALA 271 Cb -0.14 -3.30 -0.17 0.00 0.00 0.00 0.00 23.12 19.52 1niu s ALA 271 CO -0.01 -0.12 0.11 1.04 0.00 0.00 0.00 175.76 176.77 1niu n GLN 272 N 0.91 1.56 -1.56 0.00 3.00 -1.26 -1.68 117.38 118.35 1niu n GLN 272 Ca 0.00 -0.04 0.00 0.00 -0.01 0.00 0.00 57.00 56.96 1niu n GLN 272 Cb 0.46 -1.32 0.00 0.00 0.00 0.00 0.00 30.24 29.38 1niu n GLN 272 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.06 179.47 1niu n THR 273 N -2.33 0.00 -2.74 5.09 -1.04 -1.26 -4.69 114.28 107.31 1niu n THR 273 Ca -0.16 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.43 1niu n THR 273 Cb 0.76 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 69.24 1niu n THR 273 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1niu s GLU 274 N -1.34 3.82 0.08 -2.82 2.12 -1.26 -4.06 118.70 115.23 1niu s GLU 274 Ca 0.00 0.61 0.05 0.00 0.36 0.00 0.00 54.97 55.99 1niu s GLU 274 Cb 0.00 -3.83 -0.03 0.00 0.26 0.00 0.00 34.13 30.53 1niu s GLU 274 CO 0.00 -1.06 -0.14 -1.83 -0.54 0.00 0.00 175.26 171.69 1niu s GLU 275 N 3.73 0.84 -0.18 4.30 -1.05 -1.14 -4.94 118.70 120.28 1niu s GLU 275 Ca 0.41 -1.00 -0.18 0.00 -0.15 0.00 0.00 54.97 54.05 1niu s GLU 275 Cb -0.11 -0.81 -0.04 0.00 -0.44 0.00 0.00 34.13 32.74 1niu s GLU 275 CO 0.22 0.17 0.50 -1.58 0.95 0.00 0.00 175.26 175.52 1niu s TRP 276 N -1.47 3.41 -0.11 4.83 0.52 -1.26 -0.05 118.94 124.81 1niu s TRP 276 Ca -0.00 0.80 -0.01 0.00 0.02 0.00 0.00 56.10 56.91 1niu s TRP 276 Cb -0.09 -2.63 -0.02 0.00 -1.15 0.00 0.00 33.47 29.58 1niu s TRP 276 CO 0.02 -0.02 -0.09 0.42 0.02 0.00 0.00 176.95 177.30 1niu s ILE 277 N 1.32 3.43 0.09 2.03 -1.09 0.55 -0.25 121.20 127.28 1niu s ILE 277 Ca 0.24 -0.54 0.08 0.00 -2.23 0.00 0.00 60.65 58.20 1niu s ILE 277 Cb -0.15 -2.44 -0.04 0.00 -1.58 0.00 0.00 42.46 38.25 1niu s ILE 277 CO 0.10 0.54 -0.15 -0.83 -1.23 0.00 0.00 174.94 173.36 1niu s GLY 278 N -0.01 1.70 -0.07 6.18 0.00 -0.35 -2.05 107.32 112.72 1niu s GLY 278 Ca -0.02 -1.27 0.04 0.00 0.00 0.00 0.00 44.72 43.48 1niu s GLY 278 CO 0.03 -1.23 -0.21 -1.59 0.00 0.00 0.00 173.10 170.10 1niu s THR 279 N -1.12 2.39 0.09 0.90 2.01 0.06 -1.40 115.64 118.57 1niu s THR 279 Ca 0.18 -0.94 0.10 0.00 0.31 0.00 0.00 61.69 61.34 1niu s THR 279 Cb -0.11 -1.91 -0.04 0.00 0.01 0.00 0.00 72.50 70.46 1niu s THR 279 CO 0.10 0.57 -0.24 0.27 -0.69 0.00 0.00 174.62 174.63 1niu s ILE 280 N -0.13 2.40 -1.39 1.82 -4.36 -0.47 -1.59 121.20 117.47 1niu s ILE 280 Ca -0.03 -1.52 -0.09 0.00 -0.26 0.00 0.00 60.65 58.75 1niu s ILE 280 Cb -0.14 -2.02 0.08 0.00 1.25 0.00 0.00 42.46 41.63 1niu s ILE 280 CO 0.04 0.21 2.33 -0.81 0.24 0.00 0.00 174.94 176.95 1niu n PRO 281 N 1.25 3.90 -3.72 0.37 -0.04 -1.26 -2.41 135.00 133.08 1niu n PRO 281 Ca -0.17 -3.11 -0.12 0.00 -0.04 0.00 0.00 63.50 60.06 1niu n PRO 281 Cb 0.52 -2.84 -0.11 0.00 -0.04 0.00 0.00 33.50 31.04 1niu n PRO 281 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1niu s ILE 282 N 0.55 -0.01 0.00 0.52 2.07 0.40 -4.75 121.20 119.98 1niu s ILE 282 Ca 0.52 0.05 0.00 0.00 -1.41 0.00 0.00 60.65 59.81 1niu s ILE 282 Cb 0.15 -0.56 0.00 0.00 0.13 0.00 0.00 42.46 42.18 1niu s ILE 282 CO -0.06 0.02 0.00 0.61 -1.91 0.00 0.00 174.94 173.60 1niu n GLY 283 N 3.52 4.10 0.26 1.50 0.00 -1.21 -2.86 105.19 110.49 1niu n GLY 283 Ca -0.18 -1.43 0.12 0.00 0.00 0.00 0.00 46.02 44.52 1niu n GLY 283 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1niu h TYR 284 N 0.58 0.00 0.00 1.61 -0.00 -0.77 -1.28 116.97 117.11 1niu h TYR 284 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1niu h TYR 284 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.73 1niu h TYR 284 CO 0.00 0.13 0.00 0.00 -0.00 0.00 0.00 178.16 178.29 1niu n ALA 285 N -2.31 1.90 1.04 0.10 0.00 -0.73 -1.28 120.51 119.23 1niu n ALA 285 Ca -0.02 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.47 1niu n ALA 285 Cb 0.24 -1.29 0.10 0.00 0.00 0.00 0.00 19.45 18.49 1niu n ALA 285 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1niu n ASP 286 N -1.39 2.45 0.00 0.00 8.00 -0.50 -4.70 116.55 120.42 1niu n ASP 286 Ca 0.07 -1.74 0.00 0.00 0.71 0.00 0.00 54.79 53.83 1niu n ASP 286 Cb 0.18 0.19 0.00 0.00 -0.02 0.00 0.00 41.12 41.47 1niu n ASP 286 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1niu n GLY 287 N 1.37 0.50 3.21 0.44 0.00 -0.41 -2.21 105.19 108.10 1niu n GLY 287 Ca 0.12 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 1niu n GLY 287 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1niu n TRP 288 N -2.00 4.11 -1.55 1.61 -0.00 -1.12 -4.64 117.44 113.85 1niu n TRP 288 Ca 0.00 -3.22 -0.37 0.00 -0.00 0.00 0.00 57.50 53.91 1niu n TRP 288 Cb 0.00 -1.87 0.06 0.00 -0.00 0.00 0.00 31.31 29.50 1niu n TRP 288 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 1niu n LEU 289 N 3.81 3.47 -0.12 5.87 4.77 -1.26 -2.62 117.00 130.92 1niu n LEU 289 Ca 0.33 0.76 0.20 0.00 -0.03 0.00 0.00 56.01 57.27 1niu n LEU 289 Cb 0.39 -1.38 0.62 0.00 -2.33 0.00 0.00 43.42 40.72 1niu n LEU 289 CO 0.65 -2.02 1.21 0.03 -1.33 0.00 0.00 177.39 175.94 1niu h ARG 290 N 0.25 0.16 0.00 3.23 3.08 -1.93 -1.42 114.38 117.76 1niu h ARG 290 Ca -0.48 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.56 1niu h ARG 290 Cb 1.36 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.37 1niu h ARG 290 CO 0.49 0.11 0.00 -0.09 -1.07 0.00 0.00 179.97 179.41 1niu h ARG 291 N 0.17 0.00 -0.60 0.04 2.43 -1.96 -1.29 114.38 113.16 1niu h ARG 291 Ca 0.35 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 1niu h ARG 291 Cb 1.14 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1niu h ARG 291 CO -0.06 0.00 0.00 1.28 -1.51 0.00 0.00 179.97 179.68 1niu n LEU 292 N -2.44 2.21 0.19 3.80 4.77 -0.54 -4.37 117.00 120.63 1niu n LEU 292 Ca -0.02 -1.12 0.14 0.00 -0.03 0.00 0.00 56.01 54.99 1niu n LEU 292 Cb 0.06 -0.40 0.65 0.00 -2.33 0.00 0.00 43.42 41.39 1niu n LEU 292 CO 0.13 0.38 0.92 0.06 -1.33 0.00 0.00 177.39 177.54 1niu h GLN 293 N 1.54 0.00 -0.33 3.23 3.07 -1.45 -2.18 115.11 118.99 1niu h GLN 293 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.73 1niu h GLN 293 Cb 0.76 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.32 1niu h GLN 293 CO 0.11 0.00 0.00 0.72 0.09 0.00 0.00 178.83 179.75 1niu n HIS 294 N -2.51 1.20 -2.56 0.06 8.25 -1.26 -4.55 115.22 113.85 1niu n HIS 294 Ca 0.00 -0.87 0.00 0.00 -0.26 0.00 0.00 57.72 56.60 1niu n HIS 294 Cb 0.17 -0.36 0.00 0.00 1.12 0.00 0.00 29.99 30.92 1niu n HIS 294 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1niu n PHE 295 N -0.29 -2.28 -4.07 4.41 7.35 -0.82 -4.91 117.46 116.85 1niu n PHE 295 Ca 0.23 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.82 1niu n PHE 295 Cb 0.97 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 40.72 1niu n PHE 295 CO 0.00 0.00 0.00 -3.38 -0.76 0.00 0.00 176.76 172.62 1niu s HIS 296 N 1.09 0.69 0.31 -5.13 -3.43 -1.26 -1.86 115.29 105.69 1niu s HIS 296 Ca 0.00 -1.02 0.03 0.00 -0.80 0.00 0.00 55.06 53.28 1niu s HIS 296 Cb 0.00 -0.23 -0.06 0.00 -1.43 0.00 0.00 32.58 30.86 1niu s HIS 296 CO 0.00 -0.70 0.07 0.14 -2.00 0.00 0.00 174.74 172.25 1niu s VAL 297 N -4.04 0.99 -0.17 -5.38 -7.23 -0.58 -4.92 120.40 99.06 1niu s VAL 297 Ca 0.25 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.37 1niu s VAL 297 Cb 0.04 -2.73 -0.03 0.00 0.56 0.00 0.00 36.38 34.23 1niu s VAL 297 CO 0.05 0.00 0.01 -0.76 -0.31 0.00 0.00 175.10 174.09 1niu s LEU 298 N -3.45 3.52 -0.09 1.32 1.43 -0.05 -1.31 118.68 120.05 1niu s LEU 298 Ca 0.36 -0.04 -0.00 0.00 -1.03 0.00 0.00 54.13 53.42 1niu s LEU 298 Cb 0.08 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 44.45 1niu s LEU 298 CO 0.15 0.16 -0.06 -0.69 0.23 0.00 0.00 176.35 176.14 1niu s VAL 299 N 0.42 0.82 -1.32 -1.59 1.01 -0.12 -1.13 120.40 118.50 1niu s VAL 299 Ca -0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 61.98 61.74 1niu s VAL 299 Cb -0.13 -0.86 -0.00 0.00 0.00 0.00 0.00 36.38 35.38 1niu s VAL 299 CO 0.02 0.32 0.58 -0.67 0.00 0.00 0.00 175.10 175.35 1niu n ASP 300 N 4.74 -1.60 -0.15 3.32 2.03 -1.26 -1.72 116.55 121.91 1niu n ASP 300 Ca -0.14 -0.94 -0.02 0.00 0.52 0.00 0.00 54.79 54.21 1niu n ASP 300 Cb 0.50 -3.47 -0.01 0.00 -0.72 0.00 0.00 41.12 37.42 1niu n ASP 300 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1niu n GLY 301 N -1.78 0.37 3.22 0.27 0.00 -1.26 -5.02 105.19 100.98 1niu n GLY 301 Ca -0.26 -0.06 -0.17 0.00 0.00 0.00 0.00 46.02 45.53 1niu n GLY 301 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1niu s GLN 302 N -1.51 0.95 0.16 1.61 -0.21 -0.70 -4.69 119.66 115.27 1niu s GLN 302 Ca 0.00 -1.20 -0.30 0.00 0.02 0.00 0.00 55.36 53.88 1niu s GLN 302 Cb 0.00 -0.77 -0.07 0.00 1.00 0.00 0.00 33.01 33.17 1niu s GLN 302 CO 0.00 0.14 0.98 0.15 -2.12 0.00 0.00 175.29 174.44 1niu s LYS 303 N -2.69 4.72 -0.03 2.91 1.02 -1.26 -0.94 119.74 123.46 1niu s LYS 303 Ca 0.07 1.51 -0.01 0.00 0.02 0.00 0.00 55.97 57.56 1niu s LYS 303 Cb -0.04 -3.33 0.03 0.00 -0.52 0.00 0.00 37.83 33.96 1niu s LYS 303 CO 0.02 0.27 0.06 0.00 -0.92 0.00 0.00 175.35 174.78 1niu s ALA 304 N -0.36 0.12 0.59 5.17 0.00 -0.43 -4.91 121.76 121.94 1niu s ALA 304 Ca 0.46 0.28 -0.17 0.00 0.00 0.00 0.00 51.96 52.53 1niu s ALA 304 Cb -0.25 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.37 1niu s ALA 304 CO 0.31 -0.31 1.08 -1.25 0.00 0.00 0.00 175.76 175.59 1niu s PRO 305 N 1.65 3.26 0.08 0.00 0.04 -1.26 -1.52 135.00 137.25 1niu s PRO 305 Ca -0.02 1.34 -0.28 0.00 0.04 0.00 0.00 61.00 62.08 1niu s PRO 305 Cb -0.12 -2.02 -0.05 0.00 0.04 0.00 0.00 34.50 32.35 1niu s PRO 305 CO -0.03 -0.87 0.90 0.42 0.04 0.00 0.00 177.00 177.46 1niu s ILE 306 N -2.24 4.60 -0.14 0.56 1.01 -0.78 -1.04 121.20 123.18 1niu s ILE 306 Ca 0.67 1.94 0.01 0.00 0.00 0.00 0.00 60.65 63.27 1niu s ILE 306 Cb -0.19 -4.26 0.00 0.00 0.01 0.00 0.00 42.46 38.03 1niu s ILE 306 CO 0.34 0.32 -0.18 -0.69 0.00 0.00 0.00 174.94 174.72 1niu s VAL 307 N 0.08 2.42 0.00 2.92 1.01 0.18 -4.72 120.40 122.29 1niu s VAL 307 Ca 0.45 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 61.56 1niu s VAL 307 Cb -0.22 -1.99 0.00 0.00 0.00 0.00 0.00 36.38 34.17 1niu s VAL 307 CO 0.28 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.52 1niu n GLY 308 N 3.94 -2.12 3.84 4.51 0.00 -1.26 -4.25 105.19 109.84 1niu n GLY 308 Ca -0.19 -1.47 -0.32 0.00 0.00 0.00 0.00 46.02 44.03 1niu n GLY 308 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1niu s ARG 309 N -0.12 3.98 0.07 1.61 0.52 -1.26 -4.86 118.95 118.88 1niu s ARG 309 Ca 0.00 0.97 -0.24 0.00 -0.52 0.00 0.00 55.73 55.94 1niu s ARG 309 Cb 0.00 -2.14 -0.06 0.00 0.52 0.00 0.00 34.95 33.26 1niu s ARG 309 CO 0.00 -0.24 0.73 0.42 0.02 0.00 0.00 175.30 176.23 1niu s ILE 310 N -2.57 4.66 0.65 1.52 1.01 -1.26 -4.67 121.20 120.53 1niu s ILE 310 Ca 0.59 1.56 0.04 0.00 0.00 0.00 0.00 60.65 62.84 1niu s ILE 310 Cb -0.10 -4.08 0.10 0.00 0.01 0.00 0.00 42.46 38.40 1niu s ILE 310 CO 0.29 0.43 0.89 0.00 0.00 0.00 0.00 174.94 176.56 1niu h MET 312 N -0.20 1.08 0.00 0.00 4.05 -1.93 -0.62 114.93 117.31 1niu h MET 312 Ca -0.34 -0.29 0.00 0.00 -0.28 0.00 0.00 59.70 58.79 1niu h MET 312 Cb 1.28 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.95 1niu h MET 312 CO 0.41 1.00 0.00 -0.25 0.23 0.00 0.00 176.91 178.30 1niu n ASP 313 N -4.24 0.60 -3.64 1.39 8.00 -1.26 -1.78 116.55 115.61 1niu n ASP 313 Ca 0.04 -0.80 -0.10 0.00 0.71 0.00 0.00 54.79 54.64 1niu n ASP 313 Cb 0.29 0.36 -0.03 0.00 -0.02 0.00 0.00 41.12 41.72 1niu n ASP 313 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1niu s GLN 314 N -0.36 1.41 0.12 -1.24 -2.07 -1.16 -0.45 119.66 115.90 1niu s GLN 314 Ca 0.00 -0.74 -0.13 0.00 -1.82 0.00 0.00 55.36 52.67 1niu s GLN 314 Cb 0.00 0.56 0.02 0.00 -1.09 0.00 0.00 33.01 32.50 1niu s GLN 314 CO 0.00 -0.61 0.31 0.00 -1.32 0.00 0.00 175.29 173.67 1niu s MET 316 N -3.85 2.85 -0.01 0.00 -1.94 -1.26 -1.37 119.30 113.72 1niu s MET 316 Ca 0.05 -0.86 -0.04 0.00 -1.71 0.00 0.00 55.69 53.14 1niu s MET 316 Cb 0.03 -2.63 -0.00 0.00 2.01 0.00 0.00 34.83 34.24 1niu s MET 316 CO -0.10 0.50 0.08 0.96 -0.01 0.00 0.00 175.02 176.44 1niu s ILE 317 N -1.67 0.05 -0.02 2.53 -4.36 -0.49 -0.64 121.20 116.59 1niu s ILE 317 Ca 0.30 -0.43 -0.30 0.00 -0.26 0.00 0.00 60.65 59.96 1niu s ILE 317 Cb -0.10 -0.26 -0.03 0.00 1.25 0.00 0.00 42.46 43.32 1niu s ILE 317 CO 0.23 -0.24 0.99 -0.60 0.24 0.00 0.00 174.94 175.56 1niu s ARG 318 N -0.76 4.53 0.23 0.37 3.52 -0.21 -1.21 118.95 125.42 1niu s ARG 318 Ca -0.08 1.42 0.01 0.00 -0.13 0.00 0.00 55.73 56.94 1niu s ARG 318 Cb -0.05 -3.48 -0.04 0.00 -1.56 0.00 0.00 34.95 29.82 1niu s ARG 318 CO 0.00 -0.11 0.40 -0.51 -0.81 0.00 0.00 175.30 174.27 1niu s LEU 319 N 1.25 4.22 0.48 -0.88 1.43 0.65 -4.16 118.68 121.67 1niu s LEU 319 Ca 0.51 0.34 0.24 0.00 -1.03 0.00 0.00 54.13 54.19 1niu s LEU 319 Cb -0.20 -3.12 1.22 0.00 0.03 0.00 0.00 46.19 44.11 1niu s LEU 319 CO 0.26 -0.08 1.99 1.55 0.23 0.00 0.00 176.35 180.29 1niu h PRO 320 N 1.69 0.00 0.00 1.29 0.13 -1.93 -3.40 132.00 129.77 1niu h PRO 320 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1niu h PRO 320 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1niu h PRO 320 CO 0.66 0.18 0.00 0.41 -0.23 0.00 0.00 178.00 179.02 1niu n GLY 321 N -0.53 -1.23 3.58 1.56 0.00 -1.26 -4.97 105.19 102.34 1niu n GLY 321 Ca -0.02 -0.86 -0.41 0.00 0.00 0.00 0.00 46.02 44.74 1niu n GLY 321 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1niu s PRO 322 N -0.33 2.87 0.11 1.61 0.04 -1.26 -4.88 135.00 133.15 1niu s PRO 322 Ca 0.00 1.45 0.04 0.00 0.04 0.00 0.00 61.00 62.53 1niu s PRO 322 Cb 0.00 -4.37 -0.04 0.00 0.04 0.00 0.00 34.50 30.13 1niu s PRO 322 CO 0.00 -2.41 0.07 -0.51 0.04 0.00 0.00 177.00 174.19 1niu s LEU 323 N 8.91 3.71 0.52 -3.56 1.43 -1.26 -5.10 118.68 123.31 1niu s LEU 323 Ca 0.88 -0.10 -0.20 0.00 -1.03 0.00 0.00 54.13 53.68 1niu s LEU 323 Cb -0.22 -2.38 -0.07 0.00 0.03 0.00 0.00 46.19 43.55 1niu s LEU 323 CO 0.30 0.14 1.09 -2.16 0.23 0.00 0.00 176.35 175.95 1niu s PRO 324 N -2.59 3.57 0.25 1.29 0.04 -1.26 -4.92 135.00 131.38 1niu s PRO 324 Ca 0.29 1.49 -0.30 0.00 0.04 0.00 0.00 61.00 62.52 1niu s PRO 324 Cb -0.11 -2.05 -0.09 0.00 0.04 0.00 0.00 34.50 32.28 1niu s PRO 324 CO 0.21 -0.65 1.29 0.08 0.04 0.00 0.00 177.00 177.97 1niu s VAL 325 N -1.87 3.05 0.00 -0.36 1.01 -1.26 -2.42 120.40 118.54 1niu s VAL 325 Ca 0.70 0.95 0.00 0.00 0.00 0.00 0.00 61.98 63.63 1niu s VAL 325 Cb -0.20 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.57 1niu s VAL 325 CO 0.24 0.18 0.00 0.61 0.00 0.00 0.00 175.10 176.13 1niu n GLY 326 N 1.70 0.50 3.72 4.51 0.00 0.85 -4.97 105.19 111.50 1niu n GLY 326 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1niu n GLY 326 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1niu s THR 327 N -2.00 3.19 0.25 2.61 2.01 -1.02 -4.60 115.64 116.08 1niu s THR 327 Ca 0.00 0.88 -0.30 0.00 0.31 0.00 0.00 61.69 62.59 1niu s THR 327 Cb 0.00 -3.57 -0.10 0.00 0.01 0.00 0.00 72.50 68.84 1niu s THR 327 CO 0.00 0.09 1.42 -0.75 -0.69 0.00 0.00 174.62 174.68 1niu s LYS 328 N 0.76 4.28 -0.06 4.92 2.20 -1.26 -1.36 119.74 129.22 1niu s LYS 328 Ca 0.63 2.28 0.06 0.00 -0.36 0.00 0.00 55.97 58.58 1niu s LYS 328 Cb -0.38 -3.11 -0.01 0.00 -1.51 0.00 0.00 37.83 32.82 1niu s LYS 328 CO 0.33 -0.39 -0.24 0.08 -0.36 0.00 0.00 175.35 174.77 1niu s VAL 329 N -0.12 2.18 -0.19 4.02 1.01 0.03 -4.21 120.40 123.12 1niu s VAL 329 Ca 0.58 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.53 1niu s VAL 329 Cb -0.41 -1.80 0.00 0.00 0.00 0.00 0.00 36.38 34.17 1niu s VAL 329 CO 0.44 0.57 -0.13 -0.89 0.00 0.00 0.00 175.10 175.10 1niu s THR 330 N -0.21 2.74 -0.08 3.92 2.01 -0.28 -0.69 115.64 123.05 1niu s THR 330 Ca -0.02 -0.72 0.03 0.00 0.31 0.00 0.00 61.69 61.29 1niu s THR 330 Cb -0.13 -2.20 -0.25 0.00 0.01 0.00 0.00 72.50 69.93 1niu s THR 330 CO 0.03 0.49 0.53 0.18 -0.69 0.00 0.00 174.62 175.16 1niu n LEU 331 N 4.53 1.73 -3.65 4.42 7.99 -0.36 -0.87 117.00 130.79 1niu n LEU 331 Ca -0.19 0.32 -0.16 0.00 -0.01 0.00 0.00 56.01 55.96 1niu n LEU 331 Cb 0.51 -0.46 -0.15 0.00 -0.11 0.00 0.00 43.42 43.21 1niu n LEU 331 CO 0.28 0.61 -0.22 -0.63 -1.51 0.00 0.00 177.39 175.93 1niu s ILE 332 N -2.58 -0.29 -5.00 -0.08 1.01 -1.04 -4.88 121.20 108.33 1niu s ILE 332 Ca -0.13 0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.82 1niu s ILE 332 Cb 0.07 -0.35 0.00 0.00 0.01 0.00 0.00 42.46 42.19 1niu s ILE 332 CO 0.80 0.11 0.00 0.61 0.00 0.00 0.00 174.94 176.46 1niu n GLY 333 N 5.33 0.72 3.58 6.18 0.00 0.40 -0.62 105.19 120.78 1niu n GLY 333 Ca -0.05 -1.83 -0.33 0.00 0.00 0.00 0.00 46.02 43.82 1niu n GLY 333 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1niu s ARG 334 N -2.00 2.60 -0.30 1.61 3.52 -1.26 -1.11 118.95 122.01 1niu s ARG 334 Ca 0.00 -0.67 -0.03 0.00 -0.13 0.00 0.00 55.73 54.90 1niu s ARG 334 Cb 0.00 -2.51 0.11 0.00 -1.56 0.00 0.00 34.95 30.99 1niu s ARG 334 CO 0.00 0.62 0.17 -0.65 -0.81 0.00 0.00 175.30 174.64 1niu s GLN 335 N -1.17 0.25 7.86 5.12 -0.21 -0.78 -5.02 119.66 125.71 1niu s GLN 335 Ca 0.15 -0.51 0.00 0.00 0.02 0.00 0.00 55.36 55.02 1niu s GLN 335 Cb -0.11 -1.06 0.00 0.00 1.00 0.00 0.00 33.01 32.84 1niu s GLN 335 CO 0.05 -1.04 0.00 0.41 -2.12 0.00 0.00 175.29 172.59 1niu n GLY 336 N 5.16 2.82 0.05 3.09 0.00 -1.26 -2.55 105.19 112.50 1niu n GLY 336 Ca -0.04 -0.26 0.11 0.00 0.00 0.00 0.00 46.02 45.84 1niu n GLY 336 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1niu n ASP 337 N 9.12 0.52 -4.87 1.61 8.00 -1.26 -4.93 116.55 124.73 1niu n ASP 337 Ca 0.00 -0.03 -0.31 0.00 0.71 0.00 0.00 54.79 55.16 1niu n ASP 337 Cb 0.00 1.05 -0.04 0.00 -0.02 0.00 0.00 41.12 42.11 1niu n ASP 337 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1niu s GLU 338 N -3.33 3.83 -0.14 -1.24 0.41 -1.06 -5.09 118.70 112.08 1niu s GLU 338 Ca -0.01 0.52 -0.20 0.00 -0.41 0.00 0.00 54.97 54.88 1niu s GLU 338 Cb 0.13 -2.39 0.05 0.00 -1.78 0.00 0.00 34.13 30.14 1niu s GLU 338 CO 0.83 -0.00 0.51 0.54 -0.49 0.00 0.00 175.26 176.65 1niu s VAL 339 N -2.30 0.01 -0.13 2.63 0.11 -1.26 -1.86 120.40 117.59 1niu s VAL 339 Ca 0.52 -0.08 0.01 0.00 -2.93 0.00 0.00 61.98 59.50 1niu s VAL 339 Cb -0.10 -0.75 0.02 0.00 -1.53 0.00 0.00 36.38 34.02 1niu s VAL 339 CO 0.28 -0.04 -0.14 -0.63 -3.33 0.00 0.00 175.10 171.24 1niu s ILE 340 N -0.22 1.49 0.39 7.04 1.01 -0.26 -4.98 121.20 125.67 1niu s ILE 340 Ca -0.04 -0.60 0.08 0.00 0.00 0.00 0.00 60.65 60.09 1niu s ILE 340 Cb -0.03 -1.40 -0.01 0.00 0.01 0.00 0.00 42.46 41.03 1niu s ILE 340 CO 0.03 0.44 0.42 -0.94 0.00 0.00 0.00 174.94 174.89 1niu s SER 341 N 1.38 5.34 0.42 3.58 1.04 -1.26 -0.45 113.70 123.74 1niu s SER 341 Ca 0.02 -0.56 0.11 0.00 0.48 0.00 0.00 55.95 56.00 1niu s SER 341 Cb -0.13 -0.74 0.89 0.00 0.10 0.00 0.00 66.02 66.14 1niu s SER 341 CO -0.08 -0.60 1.97 0.40 0.98 0.00 0.00 173.24 175.92 1niu h ILE 342 N 0.96 1.14 -0.27 -1.02 2.04 -1.97 -1.60 117.51 116.80 1niu h ILE 342 Ca -0.42 -0.61 -0.08 0.00 1.00 0.00 0.00 64.86 64.75 1niu h ILE 342 Cb 1.27 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 38.49 1niu h ILE 342 CO 0.54 0.19 -0.19 0.44 0.00 0.00 0.00 178.15 179.13 1niu h ASP 343 N 0.17 0.47 -0.15 1.72 3.32 -1.94 0.31 116.42 120.32 1niu h ASP 343 Ca 0.04 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 1niu h ASP 343 Cb 0.28 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.70 1niu h ASP 343 CO 0.02 0.67 0.04 0.44 -1.72 0.00 0.00 179.24 178.69 1niu h ASP 344 N 0.43 0.23 -0.34 6.45 3.32 -1.69 0.12 116.42 124.95 1niu h ASP 344 Ca 0.07 -0.23 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 1niu h ASP 344 Cb 0.57 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 1niu h ASP 344 CO 0.04 0.40 0.18 0.58 -1.72 0.00 0.00 179.24 178.72 1niu h VAL 345 N 0.05 1.14 -0.49 -1.35 2.07 -1.14 -2.20 116.25 114.33 1niu h VAL 345 Ca 0.05 -0.37 0.08 0.00 0.82 0.00 0.00 66.70 67.27 1niu h VAL 345 Cb 0.26 0.77 -0.06 0.00 -1.52 0.00 0.00 31.29 30.73 1niu h VAL 345 CO 0.00 0.14 0.12 0.00 0.02 0.00 0.00 177.57 177.86 1niu h ALA 346 N 1.05 0.56 -0.69 1.67 0.00 -0.14 -0.19 119.26 121.53 1niu h ALA 346 Ca 0.12 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1niu h ALA 346 Cb 0.07 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1niu h ALA 346 CO -0.02 -0.28 0.45 -0.09 0.00 0.00 0.00 179.25 179.31 1niu h ARG 347 N 0.27 0.89 0.00 0.00 2.43 -0.45 0.54 114.38 118.06 1niu h ARG 347 Ca 0.24 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.28 1niu h ARG 347 Cb 0.30 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1niu h ARG 347 CO -0.29 0.59 -0.37 0.45 -1.51 0.00 0.00 179.97 178.84 1niu h HIS 348 N 0.92 0.00 0.00 2.20 3.86 -0.77 -2.12 115.15 119.24 1niu h HIS 348 Ca 0.26 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.47 1niu h HIS 348 Cb -0.08 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.39 1niu h HIS 348 CO -0.03 0.37 -0.49 1.28 0.86 0.00 0.00 177.93 179.92 1niu n LEU 349 N -3.88 0.57 -3.15 2.43 4.77 -0.14 -4.86 117.00 112.74 1niu n LEU 349 Ca -0.01 0.19 -0.15 0.00 -0.03 0.00 0.00 56.01 56.01 1niu n LEU 349 Cb 0.43 -0.24 0.08 0.00 -2.33 0.00 0.00 43.42 41.36 1niu n LEU 349 CO 0.38 0.01 0.09 -0.62 -1.33 0.00 0.00 177.39 175.91 1niu n GLU 350 N -1.85 -5.60 -2.02 3.23 1.02 0.17 -5.03 120.64 110.56 1niu n GLU 350 Ca 0.04 0.76 -0.00 0.00 -0.02 0.00 0.00 57.16 57.94 1niu n GLU 350 Cb 0.39 -5.48 -0.00 0.00 -0.02 0.00 0.00 31.44 26.33 1niu n GLU 350 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1niu n THR 351 N -3.72 0.00 -3.76 2.62 -2.24 -0.06 -5.02 114.28 102.09 1niu n THR 351 Ca -0.24 -0.02 -0.24 0.00 -2.27 0.00 0.00 64.05 61.28 1niu n THR 351 Cb 0.65 0.01 -0.02 0.00 -2.10 0.00 0.00 70.33 68.87 1niu n THR 351 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1niu s ILE 352 N -1.96 5.22 0.57 2.28 -4.36 -1.26 -4.33 121.20 117.36 1niu s ILE 352 Ca 0.00 -0.68 0.25 0.00 -0.26 0.00 0.00 60.65 59.97 1niu s ILE 352 Cb 0.00 -3.82 0.34 0.00 1.25 0.00 0.00 42.46 40.23 1niu s ILE 352 CO 0.00 -0.32 2.18 -0.55 0.24 0.00 0.00 174.94 176.49 1niu h ASN 353 N 1.39 0.00 -0.93 4.36 7.08 -1.92 -2.67 115.58 122.90 1niu h ASN 353 Ca -0.50 0.00 0.12 0.00 -3.08 0.00 0.00 56.30 52.84 1niu h ASN 353 Cb 1.21 0.00 -0.08 0.00 -2.08 0.00 0.00 38.32 37.37 1niu h ASN 353 CO 0.64 0.00 0.56 1.88 -2.08 0.00 0.00 177.43 178.43 1niu h TYR 354 N 0.00 1.01 0.00 4.14 -1.99 -1.94 -2.39 116.97 115.80 1niu h TYR 354 Ca 0.03 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.80 1niu h TYR 354 Cb 0.17 -0.31 0.00 0.00 2.00 0.00 0.00 36.73 38.58 1niu h TYR 354 CO 0.00 0.38 0.00 1.49 -0.00 0.00 0.00 178.16 180.03 1niu h GLU 355 N 0.88 0.00 0.43 4.88 4.81 -1.89 -3.34 114.58 120.36 1niu h GLU 355 Ca 0.46 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.67 1niu h GLU 355 Cb 0.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1niu h GLU 355 CO -0.27 0.00 -0.21 0.28 -0.73 0.00 0.00 179.01 178.08 1niu h VAL 356 N 0.00 0.00 -0.02 0.32 2.07 -1.56 -2.95 116.25 114.11 1niu h VAL 356 Ca 0.00 -0.48 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 1niu h VAL 356 Cb 0.61 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.38 1niu h VAL 356 CO 0.00 0.00 -0.08 1.55 0.02 0.00 0.00 177.57 179.06 1niu h PRO 357 N -1.06 0.02 0.00 1.57 0.13 -1.72 -1.96 132.00 128.99 1niu h PRO 357 Ca -0.06 -0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.05 1niu h PRO 357 Cb 0.44 -0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.56 1niu h PRO 357 CO 0.10 0.10 -0.10 0.00 -0.23 0.00 0.00 178.00 177.87 1niu h THR 359 N 0.00 0.00 -2.80 0.00 2.02 -1.17 -3.43 112.91 107.52 1niu h THR 359 Ca -0.00 -0.69 -0.57 0.00 0.77 0.00 0.00 66.41 65.92 1niu h THR 359 Cb 0.18 1.37 -0.04 0.00 -1.74 0.00 0.00 68.15 67.93 1niu h THR 359 CO 0.01 0.00 1.22 -0.63 0.37 0.00 0.00 175.52 176.49 1niu s ILE 360 N -3.21 3.59 1.15 3.11 -1.09 -0.96 -3.77 121.20 120.02 1niu s ILE 360 Ca 0.05 0.59 -0.16 0.00 -2.23 0.00 0.00 60.65 58.90 1niu s ILE 360 Cb 0.11 -3.83 0.26 0.00 -1.58 0.00 0.00 42.46 37.42 1niu s ILE 360 CO 0.71 -0.55 1.07 -0.94 -1.23 0.00 0.00 174.94 174.00 1niu s SER 361 N 5.56 1.30 0.57 3.58 1.04 -0.94 -4.92 113.70 119.89 1niu s SER 361 Ca 0.73 0.96 0.26 0.00 0.48 0.00 0.00 55.95 58.38 1niu s SER 361 Cb -0.19 -1.45 1.57 0.00 0.10 0.00 0.00 66.02 66.05 1niu s SER 361 CO 0.33 -3.92 2.12 0.10 0.98 0.00 0.00 173.24 172.84 1niu h TYR 362 N -2.44 0.00 0.00 5.02 -0.00 -1.91 -1.81 116.97 115.83 1niu h TYR 362 Ca -0.51 0.00 -0.03 0.00 -0.00 0.00 0.00 58.73 58.19 1niu h TYR 362 Cb 1.32 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 38.05 1niu h TYR 362 CO -1.02 0.00 -0.12 -0.09 -0.00 0.00 0.00 178.16 176.92 1niu h ARG 363 N 0.00 0.00 -5.15 0.10 2.43 -1.92 -3.33 114.38 106.52 1niu h ARG 363 Ca 0.08 0.00 -0.63 0.00 -0.81 0.00 0.00 59.98 58.62 1niu h ARG 363 Cb 0.40 0.00 -0.15 0.00 -0.42 0.00 0.00 29.97 29.80 1niu h ARG 363 CO -0.00 0.12 -0.24 0.08 -1.51 0.00 0.00 179.97 178.43 1niu s VAL 364 N -4.21 5.17 0.60 0.20 1.01 -0.68 -4.93 120.40 117.56 1niu s VAL 364 Ca -0.03 0.55 -0.19 0.00 0.00 0.00 0.00 61.98 62.32 1niu s VAL 364 Cb 0.13 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.78 1niu s VAL 364 CO 0.59 0.15 1.23 -2.84 0.00 0.00 0.00 175.10 174.23 1niu s PRO 365 N 2.07 2.89 -0.16 2.72 0.02 -1.26 -4.82 135.00 136.47 1niu s PRO 365 Ca 0.15 1.89 -0.00 0.00 0.02 0.00 0.00 61.00 63.06 1niu s PRO 365 Cb -0.16 -1.93 -0.00 0.00 0.02 0.00 0.00 34.50 32.43 1niu s PRO 365 CO 0.10 -1.29 -0.14 1.03 -0.33 0.00 0.00 177.00 176.37 1niu s ARG 366 N -3.32 3.25 -0.23 5.54 3.00 -0.49 -1.14 118.95 125.57 1niu s ARG 366 Ca 0.78 -0.73 -0.05 0.00 0.00 0.00 0.00 55.73 55.73 1niu s ARG 366 Cb -0.32 -2.66 -0.02 0.00 0.00 0.00 0.00 34.95 31.95 1niu s ARG 366 CO 0.35 0.02 0.01 0.42 0.00 0.00 0.00 175.30 176.10 1niu s ILE 367 N 0.82 3.84 -0.13 1.52 1.01 -0.18 -0.67 121.20 127.40 1niu s ILE 367 Ca -0.05 -0.34 -0.14 0.00 0.00 0.00 0.00 60.65 60.13 1niu s ILE 367 Cb -0.15 -2.76 -0.05 0.00 0.01 0.00 0.00 42.46 39.51 1niu s ILE 367 CO 0.00 0.39 0.32 -0.36 0.00 0.00 0.00 174.94 175.29 1niu s PHE 368 N 1.41 3.51 -0.07 3.97 0.08 0.02 -1.21 117.98 125.70 1niu s PHE 368 Ca 0.05 0.67 0.03 0.00 0.12 0.00 0.00 56.93 57.80 1niu s PHE 368 Cb -0.15 -2.33 -0.02 0.00 -0.57 0.00 0.00 43.02 39.95 1niu s PHE 368 CO 0.00 0.32 -0.15 -0.06 -0.10 0.00 0.00 175.22 175.24 1niu s PHE 369 N 0.17 2.71 -0.12 0.36 0.40 -0.68 0.11 117.98 120.92 1niu s PHE 369 Ca 0.18 -0.29 -0.06 0.00 -0.60 0.00 0.00 56.93 56.16 1niu s PHE 369 Cb -0.14 -1.67 0.05 0.00 0.51 0.00 0.00 43.02 41.77 1niu s PHE 369 CO 0.06 0.08 0.29 0.50 0.70 0.00 0.00 175.22 176.85 1niu s ARG 370 N -0.48 0.25 -1.23 0.44 6.06 -0.32 -0.68 118.95 123.00 1niu s ARG 370 Ca 0.06 0.61 -0.06 0.00 -2.50 0.00 0.00 55.73 53.83 1niu s ARG 370 Cb -0.12 -0.09 0.01 0.00 0.06 0.00 0.00 34.95 34.81 1niu s ARG 370 CO 0.02 -0.17 0.82 0.72 -2.50 0.00 0.00 175.30 174.19 1niu n HIS 371 N 4.29 -2.17 -1.12 5.12 8.25 -1.26 -2.20 115.22 126.13 1niu n HIS 371 Ca -0.24 0.71 -0.04 0.00 -0.26 0.00 0.00 57.72 57.88 1niu n HIS 371 Cb 0.53 -4.28 -0.02 0.00 1.12 0.00 0.00 29.99 27.35 1niu n HIS 371 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1niu n LYS 372 N -4.04 -1.59 -4.21 -0.41 5.02 -1.26 -4.98 118.16 106.69 1niu n LYS 372 Ca -0.03 0.59 -0.19 0.00 -2.02 0.00 0.00 58.31 56.65 1niu n LYS 372 Cb 0.57 -4.85 -0.12 0.00 -0.02 0.00 0.00 35.03 30.61 1niu n LYS 372 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1niu s ARG 373 N -2.12 0.94 0.17 1.97 1.70 -0.93 -5.11 118.95 115.57 1niu s ARG 373 Ca 0.00 -1.08 -0.32 0.00 -0.47 0.00 0.00 55.73 53.86 1niu s ARG 373 Cb 0.00 -0.94 -0.11 0.00 -0.57 0.00 0.00 34.95 33.33 1niu s ARG 373 CO 0.00 0.20 1.65 0.42 -1.08 0.00 0.00 175.30 176.49 1niu s ILE 374 N -1.55 2.40 -0.27 4.99 1.01 -1.26 -1.18 121.20 125.35 1niu s ILE 374 Ca 0.03 0.26 -0.14 0.00 0.00 0.00 0.00 60.65 60.80 1niu s ILE 374 Cb -0.08 -3.16 -0.13 0.00 0.01 0.00 0.00 42.46 39.09 1niu s ILE 374 CO 0.03 0.02 -0.29 0.80 0.00 0.00 0.00 174.94 175.49 1niu n MET 375 N 4.15 0.59 -3.47 2.79 1.56 0.30 -4.87 117.12 118.17 1niu n MET 375 Ca 0.15 0.29 -0.10 0.00 -0.27 0.00 0.00 57.70 57.76 1niu n MET 375 Cb 0.37 -1.52 -0.02 0.00 2.15 0.00 0.00 33.22 34.20 1niu n MET 375 CO 0.00 0.00 0.00 -1.83 -0.73 0.00 0.00 175.97 173.41 1niu s GLU 376 N -2.50 1.09 -0.02 2.12 -1.05 -1.21 -5.01 118.70 112.12 1niu s GLU 376 Ca -0.38 -0.41 0.05 0.00 -0.15 0.00 0.00 54.97 54.09 1niu s GLU 376 Cb 0.14 0.50 -0.03 0.00 -0.44 0.00 0.00 34.13 34.30 1niu s GLU 376 CO 0.51 -0.48 -0.18 0.08 0.95 0.00 0.00 175.26 176.14 1niu s VAL 377 N -3.48 2.79 -0.28 1.83 1.01 -1.26 -0.80 120.40 120.21 1niu s VAL 377 Ca 0.03 -0.90 -0.01 0.00 0.00 0.00 0.00 61.98 61.10 1niu s VAL 377 Cb -0.01 -2.09 0.09 0.00 0.00 0.00 0.00 36.38 34.37 1niu s VAL 377 CO -0.11 0.54 0.08 -0.60 0.00 0.00 0.00 175.10 175.01 1niu s ARG 378 N -0.85 0.73 -0.34 2.72 3.52 0.15 -4.37 118.95 120.50 1niu s ARG 378 Ca 0.12 -0.90 -0.09 0.00 -0.13 0.00 0.00 55.73 54.72 1niu s ARG 378 Cb -0.10 -2.01 0.02 0.00 -1.56 0.00 0.00 34.95 31.30 1niu s ARG 378 CO 0.01 -0.89 0.16 1.21 -0.81 0.00 0.00 175.30 174.98 1niu s ASN 379 N 1.68 5.55 0.35 -2.12 3.84 -1.26 -1.39 114.94 121.59 1niu s ASN 379 Ca 0.06 -0.88 0.05 0.00 0.21 0.00 0.00 52.86 52.31 1niu s ASN 379 Cb -0.17 -1.98 0.67 0.00 -0.55 0.00 0.00 41.25 39.22 1niu s ASN 379 CO -0.21 -0.31 1.91 0.00 -2.79 0.00 0.00 177.10 175.70 1niu h ALA 380 N 8.36 1.45 -0.95 1.71 0.00 -1.88 -1.55 119.26 126.39 1niu h ALA 380 Ca -0.27 -0.17 -0.47 0.00 0.00 0.00 0.00 54.91 54.00 1niu h ALA 380 Cb 1.11 -0.15 -0.28 0.00 0.00 0.00 0.00 17.79 18.47 1niu h ALA 380 CO 0.64 0.40 0.60 0.44 0.00 0.00 0.00 179.25 181.33 1niu n ILE 381 N -4.32 3.14 -2.27 0.00 -5.35 -1.26 -4.96 119.36 104.34 1niu n ILE 381 Ca 0.02 -1.85 -0.28 0.00 -0.27 0.00 0.00 62.75 60.36 1niu n ILE 381 Cb 0.21 -0.46 0.02 0.00 -1.74 0.00 0.00 39.64 37.67 1niu n ILE 381 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1niu s GLY 382 N -1.23 1.59 0.00 3.28 0.00 -0.59 -5.15 107.32 105.23 1niu s GLY 382 Ca 0.56 -0.49 0.10 0.00 0.00 0.00 0.00 44.72 44.89 1niu s GLY 382 CO 0.11 -0.22 1.03 0.54 0.00 0.00 0.00 173.10 174.56