#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ci1 s LYS 4 N 0.00 3.86 1.19 4.33 1.02 -1.26 -5.05 119.74 123.83 1ci1 s LYS 4 Ca 0.00 1.46 -0.20 0.00 0.02 0.00 0.00 55.97 57.25 1ci1 s LYS 4 Cb 0.00 -2.23 0.29 0.00 -0.52 0.00 0.00 37.83 35.37 1ci1 s LYS 4 CO 0.00 -0.40 1.14 -1.25 -0.92 0.00 0.00 175.35 173.92 1ci1 s PRO 5 N -3.00 -1.17 0.09 -1.68 0.04 -1.26 -4.91 135.00 123.10 1ci1 s PRO 5 Ca 0.65 -0.17 -0.31 0.00 0.04 0.00 0.00 61.00 61.21 1ci1 s PRO 5 Cb -0.19 -1.61 -0.10 0.00 0.04 0.00 0.00 34.50 32.64 1ci1 s PRO 5 CO 0.24 -3.66 1.90 -1.14 0.04 0.00 0.00 177.00 174.37 1ci1 s GLN 6 N -5.51 4.14 0.77 4.56 0.74 -1.26 -4.96 119.66 118.14 1ci1 s GLN 6 Ca 0.72 2.61 -0.11 0.00 0.05 0.00 0.00 55.36 58.63 1ci1 s GLN 6 Cb -0.08 -3.84 0.06 0.00 1.10 0.00 0.00 33.01 30.25 1ci1 s GLN 6 CO 0.56 -0.90 1.10 -1.25 -0.55 0.00 0.00 175.29 174.25 1ci1 s PRO 7 N 3.49 2.21 -0.04 1.67 0.04 -1.26 -4.88 135.00 136.23 1ci1 s PRO 7 Ca 0.84 1.24 0.02 0.00 0.04 0.00 0.00 61.00 63.14 1ci1 s PRO 7 Cb -0.45 -1.89 0.01 0.00 0.04 0.00 0.00 34.50 32.22 1ci1 s PRO 7 CO 0.39 -1.69 -0.09 0.42 0.04 0.00 0.00 177.00 176.07 1ci1 s ILE 8 N -2.80 0.82 -0.31 0.56 1.01 -0.68 -1.77 121.20 118.02 1ci1 s ILE 8 Ca 0.62 -0.33 0.02 0.00 0.00 0.00 0.00 60.65 60.97 1ci1 s ILE 8 Cb -0.18 -0.77 0.08 0.00 0.01 0.00 0.00 42.46 41.60 1ci1 s ILE 8 CO 0.54 0.27 0.00 0.00 0.00 0.00 0.00 174.94 175.76 1ci1 s ALA 9 N 0.54 2.80 -0.11 9.38 0.00 -0.89 -0.99 121.76 132.49 1ci1 s ALA 9 Ca -0.09 -2.16 -0.03 0.00 0.00 0.00 0.00 51.96 49.68 1ci1 s ALA 9 Cb -0.13 -1.88 -0.03 0.00 0.00 0.00 0.00 23.12 21.09 1ci1 s ALA 9 CO 0.01 -1.47 -0.01 0.00 0.00 0.00 0.00 175.76 174.29 1ci1 s ALA 10 N 1.04 3.19 -0.34 0.00 0.00 0.70 -1.72 121.76 124.64 1ci1 s ALA 10 Ca 0.01 -0.81 -0.07 0.00 0.00 0.00 0.00 51.96 51.09 1ci1 s ALA 10 Cb -0.20 -1.51 0.04 0.00 0.00 0.00 0.00 23.12 21.45 1ci1 s ALA 10 CO -0.06 0.45 0.11 0.00 0.00 0.00 0.00 175.76 176.27 1ci1 s ALA 11 N -0.44 3.06 -0.63 0.00 0.00 0.93 0.16 121.76 124.85 1ci1 s ALA 11 Ca 0.08 -1.73 -0.16 0.00 0.00 0.00 0.00 51.96 50.14 1ci1 s ALA 11 Cb -0.12 -2.29 0.15 0.00 0.00 0.00 0.00 23.12 20.86 1ci1 s ALA 11 CO 0.02 -1.33 0.61 1.21 0.00 0.00 0.00 175.76 176.27 1ci1 s ASN 12 N 1.42 6.34 0.14 0.00 2.47 -0.32 -0.14 114.94 124.86 1ci1 s ASN 12 Ca -0.01 -1.98 0.19 0.00 0.42 0.00 0.00 52.86 51.48 1ci1 s ASN 12 Cb -0.19 -2.23 0.80 0.00 -1.45 0.00 0.00 41.25 38.18 1ci1 s ASN 12 CO 0.03 -0.82 1.58 0.79 -3.72 0.00 0.00 177.10 174.96 1ci1 n TRP 13 N 5.09 0.44 -2.73 0.43 8.01 -0.99 -4.58 117.44 123.11 1ci1 n TRP 13 Ca -0.06 0.18 0.00 0.00 -1.31 0.00 0.00 57.50 56.31 1ci1 n TRP 13 Cb 0.42 -0.78 0.00 0.00 -2.01 0.00 0.00 31.31 28.94 1ci1 n TRP 13 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 1ci1 n LYS 14 N -1.90 0.00 -2.00 -0.99 5.02 -1.26 -3.10 118.16 113.92 1ci1 n LYS 14 Ca 0.02 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.90 1ci1 n LYS 14 Cb 0.19 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.20 1ci1 n LYS 14 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ci1 s ASN 16 N 1.37 0.31 0.00 0.00 0.01 -1.18 -5.15 114.94 110.29 1ci1 s ASN 16 Ca 0.48 -0.85 0.00 0.00 -0.71 0.00 0.00 52.86 51.78 1ci1 s ASN 16 Cb 0.14 0.27 0.00 0.00 0.41 0.00 0.00 41.25 42.07 1ci1 s ASN 16 CO -0.05 -0.67 0.00 0.61 -1.51 0.00 0.00 177.10 175.49 1ci1 n GLY 17 N 0.02 3.61 3.62 0.66 0.00 -1.26 -4.69 105.19 107.15 1ci1 n GLY 17 Ca -0.14 -1.79 -0.04 0.00 0.00 0.00 0.00 46.02 44.06 1ci1 n GLY 17 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ci1 s SER 18 N 0.00 -0.10 0.16 1.61 1.04 -1.26 -5.00 113.70 110.15 1ci1 s SER 18 Ca 0.00 0.05 -0.16 0.00 0.48 0.00 0.00 55.95 56.32 1ci1 s SER 18 Cb 0.00 0.09 0.10 0.00 0.10 0.00 0.00 66.02 66.32 1ci1 s SER 18 CO 0.00 -0.13 1.70 -0.08 0.98 0.00 0.00 173.24 175.70 1ci1 h GLU 19 N 2.07 0.10 -0.58 4.02 4.81 -2.01 0.74 114.58 123.73 1ci1 h GLU 19 Ca -0.08 -0.01 0.11 0.00 -0.13 0.00 0.00 59.36 59.26 1ci1 h GLU 19 Cb 1.16 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.49 1ci1 h GLU 19 CO 0.22 0.06 0.40 0.66 -0.73 0.00 0.00 179.01 179.63 1ci1 h SER 20 N 0.10 0.27 0.13 1.04 4.64 -2.01 -1.49 113.55 116.23 1ci1 h SER 20 Ca 0.19 0.01 -0.34 0.00 -0.47 0.00 0.00 61.79 61.18 1ci1 h SER 20 Cb 0.27 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 1ci1 h SER 20 CO -0.32 0.16 -1.80 0.25 -0.87 0.00 0.00 176.83 174.25 1ci1 h LEU 21 N 0.30 0.43 -0.21 5.97 5.85 -1.76 -3.41 115.31 122.48 1ci1 h LEU 21 Ca 0.27 -0.90 -0.21 0.00 0.84 0.00 0.00 57.88 57.88 1ci1 h LEU 21 Cb 0.67 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 41.57 1ci1 h LEU 21 CO -0.06 1.78 -0.72 -0.07 -0.34 0.00 0.00 178.44 179.02 1ci1 h LEU 22 N -0.06 0.91 -0.27 2.25 3.38 -0.63 -3.23 115.31 117.67 1ci1 h LEU 22 Ca -0.38 -0.57 0.03 0.00 0.09 0.00 0.00 57.88 57.04 1ci1 h LEU 22 Cb 1.96 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 42.41 1ci1 h LEU 22 CO 0.08 1.37 0.08 0.58 0.09 0.00 0.00 178.44 180.64 1ci1 h VAL 23 N 0.55 0.91 -0.04 1.22 2.07 -1.50 0.13 116.25 119.60 1ci1 h VAL 23 Ca -0.04 -0.07 -0.07 0.00 0.82 0.00 0.00 66.70 67.34 1ci1 h VAL 23 Cb 1.34 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1ci1 h VAL 23 CO 0.15 0.04 -0.32 -0.65 0.02 0.00 0.00 177.57 176.80 1ci1 h PRO 24 N 0.19 0.06 -0.34 1.57 0.11 -1.79 -1.71 132.00 130.10 1ci1 h PRO 24 Ca 0.12 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.13 1ci1 h PRO 24 Cb 0.10 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.19 1ci1 h PRO 24 CO -0.13 0.38 -0.08 1.25 -0.21 0.00 0.00 178.00 179.21 1ci1 h LEU 25 N 0.06 0.65 -0.69 2.35 6.46 -1.41 -1.62 115.31 121.11 1ci1 h LEU 25 Ca 0.01 -0.36 -0.06 0.00 -0.12 0.00 0.00 57.88 57.34 1ci1 h LEU 25 Cb 0.60 -0.18 -0.03 0.00 -0.73 0.00 0.00 40.66 40.33 1ci1 h LEU 25 CO 0.04 0.86 0.18 0.40 -0.62 0.00 0.00 178.44 179.31 1ci1 h ILE 26 N 0.43 1.26 -0.92 4.05 2.04 -0.74 -1.90 117.51 121.74 1ci1 h ILE 26 Ca 0.09 -0.94 0.01 0.00 1.00 0.00 0.00 64.86 65.02 1ci1 h ILE 26 Cb 0.57 0.56 -0.05 0.00 -0.74 0.00 0.00 36.82 37.16 1ci1 h ILE 26 CO 0.03 0.36 0.61 -0.33 0.00 0.00 0.00 178.15 178.82 1ci1 h GLU 27 N 1.03 1.19 -0.00 2.37 5.08 -1.18 0.38 114.58 123.45 1ci1 h GLU 27 Ca 0.22 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1ci1 h GLU 27 Cb 0.35 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 1ci1 h GLU 27 CO 0.00 0.79 0.00 1.15 -1.00 0.00 0.00 179.01 179.95 1ci1 h THR 28 N 1.23 1.09 -0.32 1.13 2.02 -0.90 0.13 112.91 117.28 1ci1 h THR 28 Ca 0.34 -0.25 -0.03 0.00 0.77 0.00 0.00 66.41 67.24 1ci1 h THR 28 Cb -0.12 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.53 1ci1 h THR 28 CO -0.08 0.07 0.05 -0.07 0.37 0.00 0.00 175.52 175.86 1ci1 h LEU 29 N -0.10 0.43 -0.53 2.58 3.38 -0.87 -1.59 115.31 118.61 1ci1 h LEU 29 Ca 0.00 -0.06 -0.16 0.00 0.09 0.00 0.00 57.88 57.75 1ci1 h LEU 29 Cb 0.11 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1ci1 h LEU 29 CO -0.00 0.46 -0.70 0.78 0.09 0.00 0.00 178.44 179.06 1ci1 h ASN 30 N 0.46 0.22 1.32 -0.43 2.35 0.07 -3.06 115.58 116.50 1ci1 h ASN 30 Ca 0.11 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1ci1 h ASN 30 Cb 0.22 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.52 1ci1 h ASN 30 CO -0.00 0.85 0.00 0.00 -1.65 0.00 0.00 177.43 176.63 1ci1 h ALA 31 N 1.14 1.00 -2.63 -0.83 0.00 0.17 -3.44 119.26 114.67 1ci1 h ALA 31 Ca -0.02 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.35 1ci1 h ALA 31 Cb 1.25 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.00 1ci1 h ALA 31 CO 0.11 0.00 0.03 0.00 0.00 0.00 0.00 179.25 179.39 1ci1 s ALA 32 N -3.18 3.51 -0.13 0.00 0.00 -0.75 -5.07 121.76 116.15 1ci1 s ALA 32 Ca 0.08 0.09 0.01 0.00 0.00 0.00 0.00 51.96 52.15 1ci1 s ALA 32 Cb 0.11 -2.72 0.02 0.00 0.00 0.00 0.00 23.12 20.53 1ci1 s ALA 32 CO 0.55 0.37 -0.16 0.99 0.00 0.00 0.00 175.76 177.51 1ci1 s THR 33 N -1.31 1.62 -0.21 0.00 2.01 -1.26 -4.98 115.64 111.51 1ci1 s THR 33 Ca 0.36 -0.69 -0.04 0.00 0.31 0.00 0.00 61.69 61.62 1ci1 s THR 33 Cb -0.18 -1.48 -0.02 0.00 0.01 0.00 0.00 72.50 70.83 1ci1 s THR 33 CO 0.21 0.46 -0.03 -0.36 -0.69 0.00 0.00 174.62 174.21 1ci1 s PHE 34 N 1.14 2.97 -2.36 4.92 0.08 -1.26 -5.00 117.98 118.47 1ci1 s PHE 34 Ca -0.03 -0.72 0.21 0.00 0.12 0.00 0.00 56.93 56.51 1ci1 s PHE 34 Cb -0.14 -2.08 0.56 0.00 -0.57 0.00 0.00 43.02 40.79 1ci1 s PHE 34 CO -0.05 -0.40 1.46 -0.25 -0.10 0.00 0.00 175.22 175.88 1ci1 n ASP 35 N 4.48 2.61 -4.84 1.36 9.92 -1.26 -4.92 116.55 123.91 1ci1 n ASP 35 Ca -0.18 -1.88 -0.22 0.00 -0.53 0.00 0.00 54.79 51.99 1ci1 n ASP 35 Cb 0.51 -0.19 -0.04 0.00 -0.64 0.00 0.00 41.12 40.76 1ci1 n ASP 35 CO 0.00 0.00 0.00 -1.38 0.13 0.00 0.00 177.20 175.95 1ci1 s HIS 36 N -1.62 3.02 -0.58 1.24 -3.43 -1.26 -5.04 115.29 107.62 1ci1 s HIS 36 Ca 0.35 -0.20 -0.27 0.00 -0.80 0.00 0.00 55.06 54.14 1ci1 s HIS 36 Cb 0.20 -1.58 0.00 0.00 -1.43 0.00 0.00 32.58 29.77 1ci1 s HIS 36 CO 0.28 0.37 1.56 0.34 -2.00 0.00 0.00 174.74 175.29 1ci1 s ASP 37 N -3.91 5.87 -0.00 7.38 2.15 -1.26 -4.95 116.67 121.94 1ci1 s ASP 37 Ca 0.37 0.30 -0.04 0.00 0.43 0.00 0.00 52.55 53.60 1ci1 s ASP 37 Cb -0.07 -2.54 -0.00 0.00 -0.30 0.00 0.00 42.92 40.01 1ci1 s ASP 37 CO 0.26 -1.92 0.08 0.54 -0.17 0.00 0.00 175.17 173.96 1ci1 s VAL 38 N 6.95 0.07 -0.27 1.11 0.11 -1.26 -4.24 120.40 122.86 1ci1 s VAL 38 Ca 0.57 -0.54 -0.05 0.00 -2.93 0.00 0.00 61.98 59.03 1ci1 s VAL 38 Cb -0.12 -0.30 0.01 0.00 -1.53 0.00 0.00 36.38 34.45 1ci1 s VAL 38 CO 0.23 -0.30 0.02 -1.58 -3.33 0.00 0.00 175.10 170.14 1ci1 s GLN 39 N -0.97 3.02 0.07 1.54 2.00 -0.73 -4.89 119.66 119.70 1ci1 s GLN 39 Ca -0.11 -0.88 0.00 0.00 -2.00 0.00 0.00 55.36 52.37 1ci1 s GLN 39 Cb -0.06 -3.20 -0.04 0.00 0.80 0.00 0.00 33.01 30.51 1ci1 s GLN 39 CO 0.00 -0.41 0.22 0.00 -0.50 0.00 0.00 175.29 174.61 1ci1 s VAL 41 N -1.54 -0.01 -0.07 0.00 1.01 -0.70 -1.28 120.40 117.81 1ci1 s VAL 41 Ca 0.35 0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.41 1ci1 s VAL 41 Cb -0.13 -0.15 0.00 0.00 0.00 0.00 0.00 36.38 36.10 1ci1 s VAL 41 CO 0.28 0.02 -0.19 0.68 0.00 0.00 0.00 175.10 175.89 1ci1 s VAL 42 N 0.30 1.63 -0.48 2.92 -7.23 -0.74 -0.05 120.40 116.74 1ci1 s VAL 42 Ca -0.02 -0.79 0.04 0.00 -1.81 0.00 0.00 61.98 59.39 1ci1 s VAL 42 Cb -0.03 -1.41 0.13 0.00 0.56 0.00 0.00 36.38 35.62 1ci1 s VAL 42 CO -0.01 0.46 0.23 0.00 -0.31 0.00 0.00 175.10 175.47 1ci1 s ALA 43 N 0.26 3.09 0.67 1.32 0.00 0.80 -0.96 121.76 126.94 1ci1 s ALA 43 Ca -0.11 -3.07 -0.06 0.00 0.00 0.00 0.00 51.96 48.72 1ci1 s ALA 43 Cb -0.15 -2.09 0.05 0.00 0.00 0.00 0.00 23.12 20.93 1ci1 s ALA 43 CO 0.05 -1.97 0.97 -1.25 0.00 0.00 0.00 175.76 173.55 1ci1 s PRO 44 N -0.03 2.37 0.82 0.00 0.05 -1.25 -2.36 135.00 134.60 1ci1 s PRO 44 Ca 0.16 -0.26 -0.11 0.00 0.05 0.00 0.00 61.00 60.84 1ci1 s PRO 44 Cb -0.25 -2.22 0.09 0.00 0.05 0.00 0.00 34.50 32.17 1ci1 s PRO 44 CO -0.01 -1.08 1.14 0.95 0.05 0.00 0.00 177.00 178.04 1ci1 s THR 45 N -3.15 2.56 0.24 1.26 -4.23 -1.26 -4.41 115.64 106.64 1ci1 s THR 45 Ca 0.59 0.20 -0.06 0.00 -1.18 0.00 0.00 61.69 61.24 1ci1 s THR 45 Cb -0.11 -2.50 0.22 0.00 1.34 0.00 0.00 72.50 71.45 1ci1 s THR 45 CO 0.44 -0.22 1.70 -0.26 -0.54 0.00 0.00 174.62 175.74 1ci1 h PHE 46 N -1.22 0.30 -0.43 3.99 0.04 -1.96 -1.23 116.94 116.43 1ci1 h PHE 46 Ca -0.44 0.04 0.06 0.00 2.80 0.00 0.00 57.97 60.43 1ci1 h PHE 46 Cb 1.26 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 39.36 1ci1 h PHE 46 CO 0.52 -0.05 0.29 1.25 -0.60 0.00 0.00 178.31 179.73 1ci1 h LEU 47 N 0.30 0.28 -0.65 1.54 5.85 -2.03 -2.53 115.31 118.07 1ci1 h LEU 47 Ca 0.39 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.12 1ci1 h LEU 47 Cb 0.64 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.61 1ci1 h LEU 47 CO -0.47 0.18 -0.36 1.41 -0.34 0.00 0.00 178.44 178.86 1ci1 n HIS 48 N -4.47 0.00 -0.09 1.25 8.25 -0.50 -4.39 115.22 115.27 1ci1 n HIS 48 Ca 0.06 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.44 1ci1 n HIS 48 Cb 0.27 -0.08 -0.00 0.00 1.12 0.00 0.00 29.99 31.31 1ci1 n HIS 48 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1ci1 h ILE 49 N 1.60 0.96 -0.45 1.59 2.04 -1.08 -1.85 117.51 120.32 1ci1 h ILE 49 Ca 0.00 -0.10 0.06 0.00 1.00 0.00 0.00 64.86 65.82 1ci1 h ILE 49 Cb 0.60 0.64 -0.05 0.00 -0.74 0.00 0.00 36.82 37.26 1ci1 h ILE 49 CO 0.00 0.05 0.15 -0.65 0.00 0.00 0.00 178.15 177.70 1ci1 h PRO 50 N 0.29 0.31 -0.12 2.37 0.11 -1.77 -0.19 132.00 133.00 1ci1 h PRO 50 Ca 0.13 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.14 1ci1 h PRO 50 Cb 0.07 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 1ci1 h PRO 50 CO -0.11 0.20 -0.31 0.00 -0.21 0.00 0.00 178.00 177.57 1ci1 h MET 51 N 0.32 0.23 -0.10 1.05 -0.00 -1.80 -2.60 114.93 112.03 1ci1 h MET 51 Ca 0.21 -0.09 -0.20 0.00 -0.00 0.00 0.00 59.70 59.63 1ci1 h MET 51 Cb 0.22 -0.01 0.00 0.00 -0.00 0.00 0.00 31.60 31.80 1ci1 h MET 51 CO -0.23 0.52 -0.75 1.15 -0.00 0.00 0.00 176.91 177.61 1ci1 h THR 52 N 0.20 1.34 0.00 -0.10 2.02 -0.81 -3.04 112.91 112.52 1ci1 h THR 52 Ca 0.03 -2.09 -0.09 0.00 0.77 0.00 0.00 66.41 65.03 1ci1 h THR 52 Cb 0.65 2.07 -0.01 0.00 -1.74 0.00 0.00 68.15 69.12 1ci1 h THR 52 CO 0.05 0.64 -0.42 0.50 0.37 0.00 0.00 175.52 176.66 1ci1 h LYS 53 N 0.37 0.00 0.00 6.66 3.64 -0.89 -0.03 116.57 126.32 1ci1 h LYS 53 Ca -0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1ci1 h LYS 53 Cb 1.34 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.16 1ci1 h LYS 53 CO 0.14 0.42 -0.08 0.00 -2.27 0.00 0.00 179.45 177.65 1ci1 h ALA 54 N 1.58 0.95 0.00 5.00 0.00 -1.44 -3.37 119.26 121.98 1ci1 h ALA 54 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1ci1 h ALA 54 Cb 0.83 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1ci1 h ALA 54 CO 0.05 0.00 -1.24 0.54 0.00 0.00 0.00 179.25 178.60 1ci1 n ARG 55 N -2.82 1.21 -2.18 0.00 1.74 -1.14 -5.01 116.66 108.46 1ci1 n ARG 55 Ca 0.04 -0.03 -0.43 0.00 -0.77 0.00 0.00 57.85 56.67 1ci1 n ARG 55 Cb 0.50 -1.11 -0.02 0.00 -1.02 0.00 0.00 32.46 30.81 1ci1 n ARG 55 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1ci1 s LEU 56 N -3.66 4.18 -0.00 0.55 0.20 -0.04 -4.88 118.68 115.04 1ci1 s LEU 56 Ca -0.02 1.91 0.00 0.00 0.69 0.00 0.00 54.13 56.72 1ci1 s LEU 56 Cb 0.02 -3.53 -0.01 0.00 -0.43 0.00 0.00 46.19 42.24 1ci1 s LEU 56 CO 0.19 -0.94 0.01 0.35 -0.29 0.00 0.00 176.35 175.67 1ci1 n THR 57 N 5.64 0.00 -1.66 3.68 -2.24 -1.26 -4.95 114.28 113.49 1ci1 n THR 57 Ca 0.16 -0.08 -0.51 0.00 -2.27 0.00 0.00 64.05 61.35 1ci1 n THR 57 Cb 0.44 0.56 -0.06 0.00 -2.10 0.00 0.00 70.33 69.18 1ci1 n THR 57 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1ci1 n ASN 58 N -1.44 2.57 0.31 3.42 2.85 -1.26 -4.82 115.26 116.88 1ci1 n ASN 58 Ca -0.00 1.07 0.20 0.00 -0.11 0.00 0.00 54.58 55.74 1ci1 n ASN 58 Cb 0.01 -1.27 0.95 0.00 1.24 0.00 0.00 39.78 40.71 1ci1 n ASN 58 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1ci1 h PRO 59 N 6.60 0.00 -0.35 1.20 0.13 -1.95 -2.68 132.00 134.94 1ci1 h PRO 59 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1ci1 h PRO 59 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1ci1 h PRO 59 CO 0.89 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.29 1ci1 n LYS 60 N -3.09 2.09 -4.28 0.86 5.02 -1.26 -4.92 118.16 112.57 1ci1 n LYS 60 Ca -0.01 -1.66 -0.33 0.00 -2.02 0.00 0.00 58.31 54.29 1ci1 n LYS 60 Cb 0.19 -1.42 -0.09 0.00 -0.02 0.00 0.00 35.03 33.70 1ci1 n LYS 60 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1ci1 s PHE 61 N -1.54 3.09 0.07 2.13 0.40 -1.01 -0.30 117.98 120.82 1ci1 s PHE 61 Ca 0.34 0.09 0.06 0.00 -0.60 0.00 0.00 56.93 56.82 1ci1 s PHE 61 Cb 0.19 -1.68 -0.03 0.00 0.51 0.00 0.00 43.02 42.01 1ci1 s PHE 61 CO 0.26 0.46 -0.17 -0.65 0.70 0.00 0.00 175.22 175.83 1ci1 s GLN 62 N -1.51 1.00 -0.15 0.44 -1.52 -0.41 -4.97 119.66 112.54 1ci1 s GLN 62 Ca 0.19 -0.95 -0.09 0.00 -1.95 0.00 0.00 55.36 52.55 1ci1 s GLN 62 Cb -0.12 -1.09 -0.05 0.00 -0.22 0.00 0.00 33.01 31.54 1ci1 s GLN 62 CO 0.10 0.26 0.17 0.42 -0.25 0.00 0.00 175.29 175.98 1ci1 s ILE 63 N -1.07 5.42 0.23 1.08 1.01 -1.26 -1.79 121.20 124.82 1ci1 s ILE 63 Ca 0.02 0.28 0.09 0.00 0.00 0.00 0.00 60.65 61.04 1ci1 s ILE 63 Cb -0.09 -3.47 -0.05 0.00 0.01 0.00 0.00 42.46 38.86 1ci1 s ILE 63 CO 0.02 0.52 -0.17 0.00 0.00 0.00 0.00 174.94 175.31 1ci1 s ALA 64 N -0.29 2.30 0.11 9.38 0.00 -0.14 -4.04 121.76 129.09 1ci1 s ALA 64 Ca 0.13 -1.74 -0.03 0.00 0.00 0.00 0.00 51.96 50.31 1ci1 s ALA 64 Cb -0.12 -0.16 -0.05 0.00 0.00 0.00 0.00 23.12 22.80 1ci1 s ALA 64 CO 0.02 0.15 0.31 0.00 0.00 0.00 0.00 175.76 176.24 1ci1 s ALA 65 N -2.78 3.88 -1.21 0.00 0.00 -0.32 -3.87 121.76 117.47 1ci1 s ALA 65 Ca 0.25 -0.67 0.29 0.00 0.00 0.00 0.00 51.96 51.82 1ci1 s ALA 65 Cb -0.02 -2.01 1.17 0.00 0.00 0.00 0.00 23.12 22.26 1ci1 s ALA 65 CO 0.10 0.74 1.86 1.04 0.00 0.00 0.00 175.76 179.49 1ci1 n GLN 66 N 0.19 0.21 -3.58 0.00 6.02 -1.26 -0.84 117.38 118.12 1ci1 n GLN 66 Ca -0.04 -0.04 0.02 0.00 -0.01 0.00 0.00 57.00 56.93 1ci1 n GLN 66 Cb 0.51 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 30.27 1ci1 n GLN 66 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1ci1 s ASN 67 N -2.82 -0.01 -0.04 1.08 2.47 -1.20 -4.61 114.94 109.82 1ci1 s ASN 67 Ca 0.19 -0.01 -0.30 0.00 0.42 0.00 0.00 52.86 53.15 1ci1 s ASN 67 Cb 0.19 0.02 0.11 0.00 -1.45 0.00 0.00 41.25 40.12 1ci1 s ASN 67 CO 0.53 -0.04 1.03 0.00 -3.72 0.00 0.00 177.10 174.90 1ci1 s ALA 68 N -2.06 -1.91 0.23 1.71 0.00 -1.26 -4.93 121.76 113.53 1ci1 s ALA 68 Ca 0.14 1.05 0.10 0.00 0.00 0.00 0.00 51.96 53.24 1ci1 s ALA 68 Cb 0.05 0.28 -0.04 0.00 0.00 0.00 0.00 23.12 23.41 1ci1 s ALA 68 CO -0.05 -0.74 -0.07 0.96 0.00 0.00 0.00 175.76 175.86 1ci1 s ILE 69 N -2.87 3.19 0.35 0.00 -4.36 -0.44 -4.94 121.20 112.13 1ci1 s ILE 69 Ca 0.08 -1.89 0.38 0.00 -0.26 0.00 0.00 60.65 58.96 1ci1 s ILE 69 Cb -0.01 -2.65 0.41 0.00 1.25 0.00 0.00 42.46 41.46 1ci1 s ILE 69 CO -0.06 -0.27 2.15 0.71 0.24 0.00 0.00 174.94 177.71 1ci1 h THR 70 N 2.30 0.04 -3.45 8.37 1.35 -1.92 -1.78 112.91 117.82 1ci1 h THR 70 Ca -0.45 -0.31 -0.07 0.00 -0.55 0.00 0.00 66.41 65.04 1ci1 h THR 70 Cb 1.23 1.29 -0.14 0.00 -1.73 0.00 0.00 68.15 68.80 1ci1 h THR 70 CO 0.58 0.01 -0.19 0.00 -0.25 0.00 0.00 175.52 175.67 1ci1 s ARG 71 N -3.90 0.95 0.54 4.72 1.70 -1.26 -4.68 118.95 117.02 1ci1 s ARG 71 Ca -0.02 -0.70 -0.04 0.00 -0.47 0.00 0.00 55.73 54.50 1ci1 s ARG 71 Cb 0.11 0.41 -0.00 0.00 -0.57 0.00 0.00 34.95 34.90 1ci1 s ARG 71 CO 0.49 -0.34 0.83 -1.12 -1.08 0.00 0.00 175.30 174.08 1ci1 s SER 72 N -2.60 5.76 0.00 -2.89 0.01 -1.26 -4.65 113.70 108.07 1ci1 s SER 72 Ca 0.01 0.66 0.00 0.00 1.31 0.00 0.00 55.95 57.93 1ci1 s SER 72 Cb 0.02 -1.76 0.00 0.00 0.21 0.00 0.00 66.02 64.49 1ci1 s SER 72 CO -0.09 -0.90 0.00 0.61 0.41 0.00 0.00 173.24 173.27 1ci1 n GLY 73 N -2.42 0.52 2.89 3.44 0.00 -1.26 -4.97 105.19 103.40 1ci1 n GLY 73 Ca 0.03 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 1ci1 n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ci1 n ALA 74 N -0.88 5.21 -3.23 4.61 0.00 -1.26 -4.69 120.51 120.28 1ci1 n ALA 74 Ca 0.00 -3.97 -0.24 0.00 0.00 0.00 0.00 53.44 49.23 1ci1 n ALA 74 Cb 0.00 -3.43 -0.07 0.00 0.00 0.00 0.00 19.45 15.95 1ci1 n ALA 74 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1ci1 n PHE 75 N 5.97 0.71 -1.59 0.00 3.72 -1.26 -5.11 117.46 119.90 1ci1 n PHE 75 Ca 0.49 -3.73 -0.56 0.00 -0.05 0.00 0.00 57.45 53.60 1ci1 n PHE 75 Cb 0.40 -0.41 -0.07 0.00 -0.94 0.00 0.00 39.48 38.46 1ci1 n PHE 75 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1ci1 n THR 76 N 1.10 0.04 0.00 4.37 -1.04 -1.26 -1.81 114.28 115.67 1ci1 n THR 76 Ca 0.24 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.24 1ci1 n THR 76 Cb 0.51 -0.61 0.00 0.00 -1.82 0.00 0.00 70.33 68.42 1ci1 n THR 76 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ci1 n GLY 77 N 2.56 2.06 3.99 3.41 0.00 -1.26 -5.05 105.19 110.90 1ci1 n GLY 77 Ca 0.21 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.05 1ci1 n GLY 77 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ci1 s GLU 78 N -0.57 2.85 -0.05 1.61 0.41 -0.75 -5.12 118.70 117.08 1ci1 s GLU 78 Ca 0.00 -1.23 0.02 0.00 -0.41 0.00 0.00 54.97 53.35 1ci1 s GLU 78 Cb 0.00 -2.72 0.01 0.00 -1.78 0.00 0.00 34.13 29.64 1ci1 s GLU 78 CO 0.00 -0.19 -0.10 0.08 -0.49 0.00 0.00 175.26 174.56 1ci1 s VAL 79 N -2.33 0.93 0.36 2.63 1.01 -1.26 -5.01 120.40 116.73 1ci1 s VAL 79 Ca 0.52 -0.39 0.01 0.00 0.00 0.00 0.00 61.98 62.12 1ci1 s VAL 79 Cb -0.09 -0.85 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 1ci1 s VAL 79 CO 0.32 0.30 0.56 -0.94 0.00 0.00 0.00 175.10 175.34 1ci1 s SER 80 N 0.50 6.17 0.21 3.32 1.04 -1.26 -1.33 113.70 122.35 1ci1 s SER 80 Ca -0.09 0.35 -0.10 0.00 0.48 0.00 0.00 55.95 56.59 1ci1 s SER 80 Cb -0.13 -1.86 0.25 0.00 0.10 0.00 0.00 66.02 64.39 1ci1 s SER 80 CO 0.02 -0.38 1.78 -0.07 0.98 0.00 0.00 173.24 175.57 1ci1 h LEU 81 N 0.71 0.40 -1.05 2.42 3.38 -1.59 -2.05 115.31 117.52 1ci1 h LEU 81 Ca -0.49 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.50 1ci1 h LEU 81 Cb 1.23 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.93 1ci1 h LEU 81 CO 0.60 0.25 0.26 -0.61 0.09 0.00 0.00 178.44 179.03 1ci1 h GLN 82 N 0.54 0.94 -0.50 1.13 5.75 -1.88 0.54 115.11 121.64 1ci1 h GLN 82 Ca 0.30 -0.15 -0.08 0.00 -0.15 0.00 0.00 58.65 58.57 1ci1 h GLN 82 Cb 0.28 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.64 1ci1 h GLN 82 CO -0.23 0.77 0.01 0.82 -2.65 0.00 0.00 178.83 177.54 1ci1 h ILE 83 N 0.93 1.26 -0.53 2.39 2.04 -1.81 -1.47 117.51 120.33 1ci1 h ILE 83 Ca 0.22 -1.07 -0.09 0.00 1.00 0.00 0.00 64.86 64.92 1ci1 h ILE 83 Cb 0.17 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 1ci1 h ILE 83 CO -0.02 0.38 -0.04 -0.07 0.00 0.00 0.00 178.15 178.40 1ci1 h LEU 84 N 0.74 0.91 -0.40 1.44 3.38 -0.95 -2.85 115.31 117.58 1ci1 h LEU 84 Ca 0.14 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1ci1 h LEU 84 Cb 0.51 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1ci1 h LEU 84 CO 0.02 0.99 0.09 0.50 0.09 0.00 0.00 178.44 180.13 1ci1 h LYS 85 N 0.85 0.65 0.00 1.13 3.64 -0.69 -1.05 116.57 121.09 1ci1 h LYS 85 Ca 0.15 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 1ci1 h LYS 85 Cb 0.55 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1ci1 h LYS 85 CO 0.03 0.68 -0.03 0.22 -2.27 0.00 0.00 179.45 178.08 1ci1 h ASP 86 N 0.51 0.00 0.64 4.20 3.58 -1.16 0.01 116.42 124.20 1ci1 h ASP 86 Ca 0.12 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.57 1ci1 h ASP 86 Cb 0.33 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.38 1ci1 h ASP 86 CO 0.00 0.03 -0.16 0.00 -2.88 0.00 0.00 179.24 176.23 1ci1 n TYR 87 N -4.36 0.00 -0.26 0.28 9.36 -1.06 -4.93 117.16 116.19 1ci1 n TYR 87 Ca -0.03 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.19 1ci1 n TYR 87 Cb 0.11 -0.32 0.00 0.00 -0.63 0.00 0.00 39.34 38.50 1ci1 n TYR 87 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1ci1 n GLY 88 N 1.42 0.95 3.68 2.98 0.00 -0.01 -5.08 105.19 109.13 1ci1 n GLY 88 Ca 0.09 -0.24 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 1ci1 n GLY 88 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ci1 s ILE 89 N -2.00 5.21 -0.04 -0.61 -1.09 -0.42 -4.98 121.20 117.27 1ci1 s ILE 89 Ca 0.00 0.12 0.06 0.00 -2.23 0.00 0.00 60.65 58.61 1ci1 s ILE 89 Cb 0.00 -3.39 0.10 0.00 -1.58 0.00 0.00 42.46 37.59 1ci1 s ILE 89 CO 0.00 0.42 0.97 -1.54 -1.23 0.00 0.00 174.94 173.56 1ci1 n SER 90 N 3.73 1.52 -4.06 3.58 3.41 -1.26 -3.84 113.62 116.69 1ci1 n SER 90 Ca -0.16 -2.21 -0.23 0.00 -0.26 0.00 0.00 58.87 56.01 1ci1 n SER 90 Cb 0.52 -0.17 -0.16 0.00 -0.26 0.00 0.00 64.21 64.14 1ci1 n SER 90 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1ci1 s TRP 91 N -1.33 1.33 -0.03 7.33 0.52 -1.26 -0.62 118.94 124.88 1ci1 s TRP 91 Ca 0.11 -0.37 -0.08 0.00 0.02 0.00 0.00 56.10 55.78 1ci1 s TRP 91 Cb 0.09 -0.92 0.01 0.00 -1.15 0.00 0.00 33.47 31.51 1ci1 s TRP 91 CO 0.01 -0.14 0.18 0.54 0.02 0.00 0.00 176.95 177.56 1ci1 s VAL 92 N 0.16 0.05 -0.22 4.03 0.11 -0.91 -1.17 120.40 122.45 1ci1 s VAL 92 Ca -0.04 -0.39 -0.08 0.00 -2.93 0.00 0.00 61.98 58.54 1ci1 s VAL 92 Cb -0.10 -0.40 -0.04 0.00 -1.53 0.00 0.00 36.38 34.31 1ci1 s VAL 92 CO 0.01 -0.21 0.10 -0.69 -3.33 0.00 0.00 175.10 170.98 1ci1 s VAL 93 N -0.78 4.86 0.04 2.04 1.01 -0.02 -1.78 120.40 125.77 1ci1 s VAL 93 Ca -0.09 0.00 0.03 0.00 0.00 0.00 0.00 61.98 61.92 1ci1 s VAL 93 Cb -0.05 -3.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.07 1ci1 s VAL 93 CO 0.01 0.39 -0.09 -0.76 0.00 0.00 0.00 175.10 174.65 1ci1 s LEU 94 N 0.90 2.21 -0.04 3.92 1.43 -0.76 -3.22 118.68 123.12 1ci1 s LEU 94 Ca 0.05 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 52.68 1ci1 s LEU 94 Cb -0.13 -0.30 0.00 0.00 0.03 0.00 0.00 46.19 45.79 1ci1 s LEU 94 CO 0.03 -0.11 0.00 0.61 0.23 0.00 0.00 176.35 177.11 1ci1 n GLY 95 N 1.74 0.47 3.61 -3.19 0.00 -1.26 -1.56 105.19 105.00 1ci1 n GLY 95 Ca -0.20 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 1ci1 n GLY 95 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1ci1 n HIS 96 N -2.96 1.28 -0.23 1.61 -0.00 -1.26 -4.38 115.22 109.28 1ci1 n HIS 96 Ca -0.00 0.59 0.18 0.00 0.46 0.00 0.00 57.72 58.95 1ci1 n HIS 96 Cb 0.03 -2.25 0.50 0.00 -0.12 0.00 0.00 29.99 28.15 1ci1 n HIS 96 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1ci1 h SER 97 N 1.73 0.42 -0.04 0.26 4.64 -1.94 -0.01 113.55 118.61 1ci1 h SER 97 Ca -0.43 0.04 -0.07 0.00 -0.47 0.00 0.00 61.79 60.86 1ci1 h SER 97 Cb 1.33 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 63.37 1ci1 h SER 97 CO 0.58 0.18 -0.16 -0.33 -0.87 0.00 0.00 176.83 176.23 1ci1 h GLU 98 N 0.42 0.38 0.08 4.77 5.08 -1.99 -0.03 114.58 123.29 1ci1 h GLU 98 Ca 0.45 -0.11 -0.25 0.00 -1.00 0.00 0.00 59.36 58.46 1ci1 h GLU 98 Cb 1.10 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.30 1ci1 h GLU 98 CO -0.17 0.54 -1.14 0.00 -1.00 0.00 0.00 179.01 177.24 1ci1 h ARG 99 N 0.35 0.18 -0.09 2.33 3.08 -1.38 -1.80 114.38 117.05 1ci1 h ARG 99 Ca 0.06 -0.30 -0.12 0.00 0.07 0.00 0.00 59.98 59.70 1ci1 h ARG 99 Cb 0.49 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 1ci1 h ARG 99 CO 0.03 1.13 -0.48 0.00 -1.07 0.00 0.00 179.97 179.59 1ci1 h ARG 100 N 0.05 0.23 0.06 0.04 3.08 -0.92 -1.97 114.38 114.96 1ci1 h ARG 100 Ca -0.09 -0.13 -0.36 0.00 0.07 0.00 0.00 59.98 59.48 1ci1 h ARG 100 Cb 1.88 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 31.89 1ci1 h ARG 100 CO 0.18 0.66 -2.11 1.28 -1.07 0.00 0.00 179.97 178.91 1ci1 n LEU 101 N -3.97 2.26 0.00 3.04 4.77 -0.06 -4.02 117.00 119.03 1ci1 n LEU 101 Ca -0.02 0.13 0.11 0.00 -0.03 0.00 0.00 56.01 56.21 1ci1 n LEU 101 Cb 0.52 -0.75 -0.14 0.00 -2.33 0.00 0.00 43.42 40.73 1ci1 n LEU 101 CO 0.43 0.78 -0.58 -1.22 -1.33 0.00 0.00 177.39 175.46 1ci1 n TYR 102 N -3.30 0.11 -1.09 -1.77 4.01 -0.68 -4.53 117.16 109.91 1ci1 n TYR 102 Ca -0.33 0.03 0.10 0.00 -0.16 0.00 0.00 57.90 57.53 1ci1 n TYR 102 Cb 1.04 -0.50 0.13 0.00 -0.31 0.00 0.00 39.34 39.71 1ci1 n TYR 102 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1ci1 n TYR 103 N -2.22 0.00 -1.58 -0.72 4.01 -0.76 -5.01 117.16 110.88 1ci1 n TYR 103 Ca -0.03 -0.96 -0.16 0.00 -0.16 0.00 0.00 57.90 56.59 1ci1 n TYR 103 Cb 0.54 -0.15 -0.06 0.00 -0.31 0.00 0.00 39.34 39.36 1ci1 n TYR 103 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ci1 n GLY 104 N -1.38 1.29 3.61 2.72 0.00 -1.17 -4.91 105.19 105.35 1ci1 n GLY 104 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 1ci1 n GLY 104 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ci1 s GLU 105 N -3.57 3.47 0.73 1.61 2.02 -1.11 -4.97 118.70 116.88 1ci1 s GLU 105 Ca 0.00 1.45 -0.10 0.00 0.02 0.00 0.00 54.97 56.34 1ci1 s GLU 105 Cb 0.00 -4.14 0.16 0.00 0.10 0.00 0.00 34.13 30.25 1ci1 s GLU 105 CO 0.00 -1.69 1.00 0.25 0.02 0.00 0.00 175.26 174.84 1ci1 n THR 106 N 7.16 0.00 -0.18 3.63 -2.24 -1.26 -4.45 114.28 116.93 1ci1 n THR 106 Ca 0.21 -0.93 -0.10 0.00 -2.27 0.00 0.00 64.05 60.96 1ci1 n THR 106 Cb 0.46 -1.43 0.01 0.00 -2.10 0.00 0.00 70.33 67.28 1ci1 n THR 106 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1ci1 h ASN 107 N -1.15 1.04 -0.42 3.42 2.35 -1.97 -1.79 115.58 117.06 1ci1 h ASN 107 Ca -0.32 -0.35 -0.10 0.00 -0.55 0.00 0.00 56.30 54.97 1ci1 h ASN 107 Cb 0.97 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 39.04 1ci1 h ASN 107 CO 0.26 1.15 -0.12 1.05 -1.65 0.00 0.00 177.43 178.12 1ci1 h GLU 108 N 0.91 0.89 -0.26 0.81 9.09 -1.95 -0.59 114.58 123.47 1ci1 h GLU 108 Ca 0.14 -0.31 -0.07 0.00 0.05 0.00 0.00 59.36 59.16 1ci1 h GLU 108 Cb 0.69 -0.06 -0.01 0.00 -1.65 0.00 0.00 28.75 27.72 1ci1 h GLU 108 CO 0.05 0.96 -0.13 0.82 0.05 0.00 0.00 179.01 180.76 1ci1 h ILE 109 N 0.80 1.30 -0.43 -1.06 2.04 -1.90 -2.43 117.51 115.83 1ci1 h ILE 109 Ca 0.13 -1.21 -0.08 0.00 1.00 0.00 0.00 64.86 64.70 1ci1 h ILE 109 Cb 0.64 1.53 -0.02 0.00 -0.74 0.00 0.00 36.82 38.23 1ci1 h ILE 109 CO 0.04 0.38 -0.05 0.58 0.00 0.00 0.00 178.15 179.11 1ci1 h VAL 110 N 0.28 1.24 -0.52 1.67 2.07 -1.21 -2.26 116.25 117.51 1ci1 h VAL 110 Ca 0.06 -1.03 -0.11 0.00 0.82 0.00 0.00 66.70 66.44 1ci1 h VAL 110 Cb 0.64 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.36 1ci1 h VAL 110 CO 0.04 0.35 -0.12 0.00 0.02 0.00 0.00 177.57 177.87 1ci1 h ALA 111 N 1.29 0.72 -0.67 1.67 0.00 -1.04 -1.43 119.26 119.80 1ci1 h ALA 111 Ca 0.13 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 1ci1 h ALA 111 Cb 0.48 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1ci1 h ALA 111 CO 0.02 0.64 0.15 1.49 0.00 0.00 0.00 179.25 181.55 1ci1 h GLU 112 N 0.87 1.09 -0.77 0.00 4.57 -1.30 0.13 114.58 119.17 1ci1 h GLU 112 Ca 0.13 -0.27 0.00 0.00 -1.18 0.00 0.00 59.36 58.05 1ci1 h GLU 112 Cb 0.68 -0.14 -0.04 0.00 -0.16 0.00 0.00 28.75 29.10 1ci1 h GLU 112 CO 0.05 0.98 0.50 0.87 -1.18 0.00 0.00 179.01 180.22 1ci1 h LYS 113 N 1.01 1.02 -0.16 1.92 1.57 -1.21 -1.09 116.57 119.62 1ci1 h LYS 113 Ca 0.21 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.81 1ci1 h LYS 113 Cb 0.39 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1ci1 h LYS 113 CO 0.01 0.69 -0.33 0.28 -0.57 0.00 0.00 179.45 179.52 1ci1 h VAL 114 N 1.04 1.35 -0.29 0.50 2.07 -0.91 -1.57 116.25 118.44 1ci1 h VAL 114 Ca 0.28 -1.59 0.04 0.00 0.82 0.00 0.00 66.70 66.25 1ci1 h VAL 114 Cb -0.10 1.97 -0.04 0.00 -1.52 0.00 0.00 31.29 31.60 1ci1 h VAL 114 CO -0.06 0.48 0.06 0.00 0.02 0.00 0.00 177.57 178.07 1ci1 h ALA 115 N 0.56 0.30 -0.38 1.67 0.00 -0.59 -0.83 119.26 119.99 1ci1 h ALA 115 Ca 0.00 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 1ci1 h ALA 115 Cb 0.93 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 1ci1 h ALA 115 CO 0.07 -0.36 -0.16 1.96 0.00 0.00 0.00 179.25 180.76 1ci1 h GLN 116 N 0.16 0.71 -0.52 0.00 1.08 -1.23 -1.61 115.11 113.71 1ci1 h GLN 116 Ca 0.13 -0.25 -0.08 0.00 -1.45 0.00 0.00 58.65 57.00 1ci1 h GLN 116 Cb 0.14 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.50 1ci1 h GLN 116 CO -0.18 0.84 0.01 0.00 -0.95 0.00 0.00 178.83 178.55 1ci1 h ALA 117 N 1.18 1.04 -0.32 3.87 0.00 -0.79 -1.62 119.26 122.61 1ci1 h ALA 117 Ca 0.10 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 1ci1 h ALA 117 Cb 0.64 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1ci1 h ALA 117 CO 0.04 0.60 -0.14 0.00 0.00 0.00 0.00 179.25 179.75 1ci1 h ALA 119 N 0.78 1.25 -0.12 0.00 0.00 -1.04 -1.70 119.26 118.43 1ci1 h ALA 119 Ca 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ci1 h ALA 119 Cb 0.67 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1ci1 h ALA 119 CO 0.04 0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.36 1ci1 n ALA 120 N -2.23 2.51 -0.35 0.00 0.00 -0.63 -4.95 120.51 114.86 1ci1 n ALA 120 Ca -0.02 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.81 1ci1 n ALA 120 Cb 0.17 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1ci1 n ALA 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ci1 n GLY 121 N 1.26 0.82 3.88 0.00 0.00 -0.64 -5.07 105.19 105.44 1ci1 n GLY 121 Ca 0.17 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 1ci1 n GLY 121 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ci1 s PHE 122 N -2.00 3.52 -0.16 1.61 0.40 -0.41 -4.98 117.98 115.96 1ci1 s PHE 122 Ca 0.00 1.08 -0.14 0.00 -0.60 0.00 0.00 56.93 57.27 1ci1 s PHE 122 Cb 0.00 -2.50 -0.05 0.00 0.51 0.00 0.00 43.02 40.99 1ci1 s PHE 122 CO 0.00 -0.28 0.31 -1.01 0.70 0.00 0.00 175.22 174.94 1ci1 s HIS 123 N -2.64 3.46 -0.06 0.36 3.76 0.21 -4.54 115.29 115.84 1ci1 s HIS 123 Ca 0.52 0.61 0.05 0.00 -0.15 0.00 0.00 55.06 56.09 1ci1 s HIS 123 Cb -0.10 -2.37 -0.02 0.00 1.11 0.00 0.00 32.58 31.20 1ci1 s HIS 123 CO 0.39 0.21 -0.21 0.08 -0.85 0.00 0.00 174.74 174.36 1ci1 s VAL 124 N 0.54 2.40 -0.44 -0.90 1.01 0.78 -2.15 120.40 121.65 1ci1 s VAL 124 Ca 0.17 -0.95 -0.06 0.00 0.00 0.00 0.00 61.98 61.14 1ci1 s VAL 124 Cb -0.13 -1.90 0.12 0.00 0.00 0.00 0.00 36.38 34.46 1ci1 s VAL 124 CO 0.04 0.57 0.28 -0.63 0.00 0.00 0.00 175.10 175.36 1ci1 s ILE 125 N -0.33 3.72 -0.12 2.22 1.01 -0.74 0.39 121.20 127.36 1ci1 s ILE 125 Ca 0.02 -1.96 -0.20 0.00 0.00 0.00 0.00 60.65 58.51 1ci1 s ILE 125 Cb -0.13 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 1ci1 s ILE 125 CO 0.02 -0.74 0.54 -0.69 0.00 0.00 0.00 174.94 174.08 1ci1 s VAL 126 N 1.21 5.14 -0.06 2.92 1.01 0.14 -1.83 120.40 128.93 1ci1 s VAL 126 Ca 0.07 1.08 -0.11 0.00 0.00 0.00 0.00 61.98 63.02 1ci1 s VAL 126 Cb -0.24 -3.88 -0.05 0.00 0.00 0.00 0.00 36.38 32.21 1ci1 s VAL 126 CO -0.03 0.28 0.28 0.00 0.00 0.00 0.00 175.10 175.63 1ci1 s VAL 128 N -0.98 0.49 0.00 0.00 -7.23 -0.53 -4.67 120.40 107.48 1ci1 s VAL 128 Ca 0.19 -1.53 0.00 0.00 -1.81 0.00 0.00 61.98 58.83 1ci1 s VAL 128 Cb -0.14 -1.16 0.00 0.00 0.56 0.00 0.00 36.38 35.64 1ci1 s VAL 128 CO 0.09 -0.70 0.00 0.61 -0.31 0.00 0.00 175.10 174.78 1ci1 n GLY 129 N 0.64 2.76 3.68 2.32 0.00 -1.26 0.86 105.19 114.20 1ci1 n GLY 129 Ca -0.17 -0.56 -0.30 0.00 0.00 0.00 0.00 46.02 45.00 1ci1 n GLY 129 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ci1 s GLU 130 N -2.00 2.52 0.82 1.61 1.03 -1.24 -4.86 118.70 116.58 1ci1 s GLU 130 Ca 0.00 -0.88 -0.11 0.00 0.03 0.00 0.00 54.97 54.01 1ci1 s GLU 130 Cb 0.00 -2.51 0.11 0.00 -0.80 0.00 0.00 34.13 30.94 1ci1 s GLU 130 CO 0.00 0.53 1.16 0.95 -1.33 0.00 0.00 175.26 176.57 1ci1 s THR 131 N -1.37 2.09 0.20 1.83 -4.23 -1.26 -1.31 115.64 111.59 1ci1 s THR 131 Ca 0.26 -0.13 -0.10 0.00 -1.18 0.00 0.00 61.69 60.54 1ci1 s THR 131 Cb -0.11 -2.96 0.13 0.00 1.34 0.00 0.00 72.50 70.90 1ci1 s THR 131 CO 0.18 0.00 1.80 -1.13 -0.54 0.00 0.00 174.62 174.93 1ci1 h ASN 132 N -1.06 0.94 -0.16 3.99 -1.24 -1.80 -1.42 115.58 114.83 1ci1 h ASN 132 Ca -0.44 -0.12 0.02 0.00 0.71 0.00 0.00 56.30 56.46 1ci1 h ASN 132 Cb 1.29 -0.24 -0.02 0.00 0.73 0.00 0.00 38.32 40.08 1ci1 h ASN 132 CO 0.54 0.80 0.03 1.05 -1.29 0.00 0.00 177.43 178.55 1ci1 h GLU 133 N 1.01 0.09 -0.78 6.67 4.11 -1.96 0.02 114.58 123.75 1ci1 h GLU 133 Ca 0.25 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.67 1ci1 h GLU 133 Cb 0.10 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 1ci1 h GLU 133 CO -0.03 0.06 0.45 0.93 0.07 0.00 0.00 179.01 180.49 1ci1 h GLU 134 N 0.10 1.07 -0.51 1.06 5.08 -1.88 -1.48 114.58 118.03 1ci1 h GLU 134 Ca 0.07 -0.11 -0.10 0.00 -1.00 0.00 0.00 59.36 58.22 1ci1 h GLU 134 Cb 0.06 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 1ci1 h GLU 134 CO -0.09 0.77 -0.08 -0.09 -1.00 0.00 0.00 179.01 178.52 1ci1 h ARG 135 N 1.07 0.94 -0.03 2.33 2.43 -0.91 0.77 114.38 120.99 1ci1 h ARG 135 Ca 0.28 -0.34 -0.08 0.00 -0.81 0.00 0.00 59.98 59.03 1ci1 h ARG 135 Cb -0.01 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 1ci1 h ARG 135 CO -0.05 1.00 -0.34 0.93 -1.51 0.00 0.00 179.97 180.01 1ci1 h GLU 136 N 0.81 0.05 -0.07 0.20 5.08 -0.74 -1.41 114.58 118.49 1ci1 h GLU 136 Ca 0.13 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1ci1 h GLU 136 Cb 0.63 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1ci1 h GLU 136 CO 0.04 0.38 0.00 0.00 -1.00 0.00 0.00 179.01 178.43 1ci1 n ALA 137 N -2.47 2.56 -1.92 3.43 0.00 -0.58 -4.90 120.51 116.63 1ci1 n ALA 137 Ca -0.02 -0.28 -0.09 0.00 0.00 0.00 0.00 53.44 53.05 1ci1 n ALA 137 Cb 0.39 -1.19 -0.01 0.00 0.00 0.00 0.00 19.45 18.63 1ci1 n ALA 137 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ci1 n GLY 138 N 0.91 0.30 1.27 0.00 0.00 -0.53 -4.94 105.19 102.20 1ci1 n GLY 138 Ca 0.14 -0.53 0.07 0.00 0.00 0.00 0.00 46.02 45.69 1ci1 n GLY 138 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ci1 n ARG 139 N -2.13 3.53 -0.08 1.61 1.74 0.24 -4.72 116.66 116.85 1ci1 n ARG 139 Ca -0.10 -2.97 -0.10 0.00 -0.77 0.00 0.00 57.85 53.91 1ci1 n ARG 139 Cb 0.50 -2.00 -0.04 0.00 -1.02 0.00 0.00 32.46 29.91 1ci1 n ARG 139 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1ci1 h THR 140 N 2.48 0.18 -0.29 0.55 2.02 -1.85 0.20 112.91 116.20 1ci1 h THR 140 Ca 0.02 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.19 1ci1 h THR 140 Cb 1.67 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 68.25 1ci1 h THR 140 CO 0.34 0.00 0.12 0.00 0.37 0.00 0.00 175.52 176.35 1ci1 h ALA 141 N 0.47 0.37 -0.66 6.16 0.00 -1.96 -1.80 119.26 121.85 1ci1 h ALA 141 Ca 0.13 -0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.00 1ci1 h ALA 141 Cb 0.57 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.19 1ci1 h ALA 141 CO -0.50 -0.03 0.32 0.00 0.00 0.00 0.00 179.25 179.04 1ci1 h ALA 142 N 0.96 0.89 0.33 0.00 0.00 -1.78 -1.76 119.26 117.90 1ci1 h ALA 142 Ca 0.10 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1ci1 h ALA 142 Cb 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1ci1 h ALA 142 CO -0.01 -0.06 -0.16 0.28 0.00 0.00 0.00 179.25 179.30 1ci1 h VAL 143 N 0.57 0.64 -0.47 0.00 2.07 -0.77 -2.31 116.25 115.98 1ci1 h VAL 143 Ca 0.32 -0.60 -0.11 0.00 0.82 0.00 0.00 66.70 67.13 1ci1 h VAL 143 Cb 0.32 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 1ci1 h VAL 143 CO -0.25 0.11 -0.15 -0.37 0.02 0.00 0.00 177.57 176.92 1ci1 h VAL 144 N -0.80 1.27 0.00 2.57 -1.51 -1.31 -1.42 116.25 115.05 1ci1 h VAL 144 Ca -0.05 -1.28 -0.08 0.00 -1.23 0.00 0.00 66.70 64.07 1ci1 h VAL 144 Cb 0.52 1.07 -0.01 0.00 -2.13 0.00 0.00 31.29 30.74 1ci1 h VAL 144 CO 0.07 0.44 -0.38 -0.07 -1.23 0.00 0.00 177.57 176.40 1ci1 h LEU 145 N 0.79 0.00 -0.07 4.19 3.38 -1.43 0.05 115.31 122.21 1ci1 h LEU 145 Ca 0.12 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.84 1ci1 h LEU 145 Cb 0.69 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.45 1ci1 h LEU 145 CO 0.05 0.38 -0.95 0.74 0.09 0.00 0.00 178.44 178.75 1ci1 h THR 146 N 0.00 1.29 -0.71 0.22 2.02 -1.14 0.33 112.91 114.91 1ci1 h THR 146 Ca -0.00 -2.18 -0.06 0.00 0.77 0.00 0.00 66.41 64.94 1ci1 h THR 146 Cb 0.78 2.26 -0.03 0.00 -1.74 0.00 0.00 68.15 69.42 1ci1 h THR 146 CO 0.05 0.68 0.22 1.56 0.37 0.00 0.00 175.52 178.40 1ci1 h GLN 147 N 0.43 1.11 -0.10 6.66 4.20 -0.91 -2.08 115.11 124.41 1ci1 h GLN 147 Ca -0.10 -0.24 -0.11 0.00 0.06 0.00 0.00 58.65 58.26 1ci1 h GLN 147 Cb 1.60 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 29.22 1ci1 h GLN 147 CO 0.19 0.95 -0.38 1.25 -0.67 0.00 0.00 178.83 180.17 1ci1 h LEU 148 N 1.05 0.51 -1.65 1.46 5.85 -0.95 -3.22 115.31 118.36 1ci1 h LEU 148 Ca 0.23 -0.62 0.06 0.00 0.84 0.00 0.00 57.88 58.39 1ci1 h LEU 148 Cb 0.30 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 1ci1 h LEU 148 CO -0.01 1.05 0.33 0.00 -0.34 0.00 0.00 178.44 179.47 1ci1 h ALA 149 N 0.48 1.92 -0.29 1.25 0.00 -0.23 -0.96 119.26 121.43 1ci1 h ALA 149 Ca -0.02 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1ci1 h ALA 149 Cb 1.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1ci1 h ALA 149 CO 0.08 -0.01 0.18 0.00 0.00 0.00 0.00 179.25 179.50 1ci1 h ALA 150 N 1.73 0.37 -0.00 0.00 0.00 -1.38 -1.99 119.26 118.00 1ci1 h ALA 150 Ca 0.22 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.86 1ci1 h ALA 150 Cb 0.31 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1ci1 h ALA 150 CO -0.06 -0.13 -0.93 -0.39 0.00 0.00 0.00 179.25 177.75 1ci1 h VAL 151 N 0.38 1.42 -0.42 0.00 -1.51 -1.48 -3.28 116.25 111.36 1ci1 h VAL 151 Ca 0.11 -2.47 0.07 0.00 -1.23 0.00 0.00 66.70 63.18 1ci1 h VAL 151 Cb 0.01 2.42 -0.06 0.00 -2.13 0.00 0.00 31.29 31.53 1ci1 h VAL 151 CO -0.02 0.73 0.07 0.00 -1.23 0.00 0.00 177.57 177.13 1ci1 h ALA 152 N 0.78 0.45 -0.22 5.19 0.00 -1.03 -1.68 119.26 122.75 1ci1 h ALA 152 Ca -0.07 0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.99 1ci1 h ALA 152 Cb 1.56 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 1ci1 h ALA 152 CO 0.16 -0.33 0.21 0.37 0.00 0.00 0.00 179.25 179.66 1ci1 h GLN 153 N 0.20 0.00 0.00 0.00 4.15 -1.42 -1.85 115.11 116.19 1ci1 h GLN 153 Ca 0.21 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.63 1ci1 h GLN 153 Cb 0.26 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.95 1ci1 h GLN 153 CO -0.28 0.00 -0.82 0.87 -1.93 0.00 0.00 178.83 176.67 1ci1 h LYS 154 N 0.00 0.00 -5.98 1.69 1.57 -1.42 -3.47 116.57 108.96 1ci1 h LYS 154 Ca 0.11 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 58.27 1ci1 h LYS 154 Cb 0.53 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.79 1ci1 h LYS 154 CO -0.00 0.00 -0.35 -0.51 -0.57 0.00 0.00 179.45 178.02 1ci1 s LEU 155 N -4.59 4.36 0.59 2.94 1.43 -0.70 -4.92 118.68 117.80 1ci1 s LEU 155 Ca 0.03 0.62 -0.06 0.00 -1.03 0.00 0.00 54.13 53.70 1ci1 s LEU 155 Cb 0.12 -2.80 0.01 0.00 0.03 0.00 0.00 46.19 43.55 1ci1 s LEU 155 CO 0.76 0.22 0.90 -0.94 0.23 0.00 0.00 176.35 177.51 1ci1 s SER 156 N -1.78 5.56 0.16 2.29 1.04 -1.26 -4.97 113.70 114.74 1ci1 s SER 156 Ca 0.30 0.68 -0.15 0.00 0.48 0.00 0.00 55.95 57.25 1ci1 s SER 156 Cb -0.13 -1.66 0.09 0.00 0.10 0.00 0.00 66.02 64.41 1ci1 s SER 156 CO 0.17 -1.08 1.75 0.11 0.98 0.00 0.00 173.24 175.18 1ci1 h LYS 157 N -0.17 0.28 0.00 4.02 1.79 -1.99 -2.32 116.57 118.17 1ci1 h LYS 157 Ca -0.45 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 57.99 1ci1 h LYS 157 Cb 1.26 -0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 31.85 1ci1 h LYS 157 CO 0.60 0.18 -0.03 1.05 -1.08 0.00 0.00 179.45 180.18 1ci1 h GLU 158 N 0.29 0.00 -0.47 3.15 9.09 -2.03 -2.90 114.58 121.71 1ci1 h GLU 158 Ca 0.18 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 59.56 1ci1 h GLU 158 Cb 0.17 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.24 1ci1 h GLU 158 CO -0.19 0.03 0.16 0.00 0.05 0.00 0.00 179.01 179.06 1ci1 h ALA 159 N 1.97 1.40 0.00 1.06 0.00 -1.80 -3.04 119.26 118.86 1ci1 h ALA 159 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1ci1 h ALA 159 Cb 0.14 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1ci1 h ALA 159 CO 0.00 0.44 0.03 -1.49 0.00 0.00 0.00 179.25 178.24 1ci1 h TRP 160 N 0.67 0.00 0.00 0.00 4.06 -1.63 -1.44 115.95 117.61 1ci1 h TRP 160 Ca 0.16 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.11 1ci1 h TRP 160 Cb 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.34 1ci1 h TRP 160 CO 0.01 0.00 0.00 0.66 -3.56 0.00 0.00 178.44 175.55 1ci1 h SER 161 N 0.00 0.00 -0.25 -3.49 4.64 -1.75 -2.66 113.55 110.03 1ci1 h SER 161 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ci1 h SER 161 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1ci1 h SER 161 CO 0.00 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.50 1ci1 n ARG 162 N -2.79 2.78 -4.42 4.77 1.74 -0.54 -4.98 116.66 113.22 1ci1 n ARG 162 Ca 0.02 -2.38 -0.34 0.00 -0.77 0.00 0.00 57.85 54.38 1ci1 n ARG 162 Cb 0.32 -1.51 -0.11 0.00 -1.02 0.00 0.00 32.46 30.14 1ci1 n ARG 162 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1ci1 s VAL 163 N -1.93 3.99 -0.01 1.55 1.01 -1.01 -0.15 120.40 123.85 1ci1 s VAL 163 Ca 0.30 -0.34 0.05 0.00 0.00 0.00 0.00 61.98 61.99 1ci1 s VAL 163 Cb 0.22 -2.71 -0.01 0.00 0.00 0.00 0.00 36.38 33.87 1ci1 s VAL 163 CO 0.10 0.54 -0.16 -0.69 0.00 0.00 0.00 175.10 174.89 1ci1 s VAL 164 N -0.15 1.28 -0.07 2.92 1.01 0.16 -4.55 120.40 121.00 1ci1 s VAL 164 Ca 0.03 -0.70 0.00 0.00 0.00 0.00 0.00 61.98 61.32 1ci1 s VAL 164 Cb -0.13 -1.07 -0.03 0.00 0.00 0.00 0.00 36.38 35.15 1ci1 s VAL 164 CO 0.02 0.36 -0.05 -0.63 0.00 0.00 0.00 175.10 174.80 1ci1 s ILE 165 N -0.39 3.83 -0.19 2.22 -1.09 -0.44 -0.69 121.20 124.46 1ci1 s ILE 165 Ca 0.06 -0.43 0.01 0.00 -2.23 0.00 0.00 60.65 58.06 1ci1 s ILE 165 Cb -0.06 -2.57 0.04 0.00 -1.58 0.00 0.00 42.46 38.28 1ci1 s ILE 165 CO -0.01 0.60 -0.11 0.00 -1.23 0.00 0.00 174.94 174.19 1ci1 s ALA 166 N -0.83 1.98 -0.20 9.38 0.00 -0.32 0.10 121.76 131.87 1ci1 s ALA 166 Ca 0.13 -1.15 -0.24 0.00 0.00 0.00 0.00 51.96 50.70 1ci1 s ALA 166 Cb -0.11 -1.24 -0.01 0.00 0.00 0.00 0.00 23.12 21.76 1ci1 s ALA 166 CO 0.02 -0.74 0.78 -0.47 0.00 0.00 0.00 175.76 175.35 1ci1 s TYR 167 N 1.41 3.37 -0.32 0.00 5.04 0.40 -1.45 117.35 125.79 1ci1 s TYR 167 Ca -0.00 1.13 -0.07 0.00 -2.44 0.00 0.00 57.07 55.68 1ci1 s TYR 167 Cb -0.16 -2.97 0.02 0.00 0.35 0.00 0.00 41.96 39.20 1ci1 s TYR 167 CO -0.09 -0.29 0.11 -1.21 -1.34 0.00 0.00 175.55 172.74 1ci1 s GLU 168 N 2.36 2.88 -1.40 4.97 2.02 0.25 0.27 118.70 130.05 1ci1 s GLU 168 Ca 0.35 -1.01 -0.15 0.00 0.02 0.00 0.00 54.97 54.17 1ci1 s GLU 168 Cb -0.16 -3.47 0.05 0.00 0.10 0.00 0.00 34.13 30.65 1ci1 s GLU 168 CO 0.10 -0.57 2.05 -0.35 0.02 0.00 0.00 175.26 176.51 1ci1 n PRO 169 N 4.87 2.99 -0.20 0.39 -0.04 -1.26 -3.73 135.00 138.01 1ci1 n PRO 169 Ca -0.13 -2.87 0.13 0.00 -0.04 0.00 0.00 63.50 60.59 1ci1 n PRO 169 Cb 0.46 -3.35 0.44 0.00 -0.04 0.00 0.00 33.50 31.01 1ci1 n PRO 169 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1ci1 h VAL 170 N 4.54 0.84 -0.77 0.52 2.07 -1.86 -0.51 116.25 121.09 1ci1 h VAL 170 Ca 0.52 -0.19 0.11 0.00 0.82 0.00 0.00 66.70 67.96 1ci1 h VAL 170 Cb 0.72 0.23 -0.08 0.00 -1.52 0.00 0.00 31.29 30.64 1ci1 h VAL 170 CO 1.73 0.10 0.39 4.11 0.02 0.00 0.00 177.57 183.93 1ci1 h TRP 171 N 0.57 0.70 0.13 1.57 5.08 -1.40 0.13 115.95 122.72 1ci1 h TRP 171 Ca 0.39 0.03 -0.22 0.00 1.08 0.00 0.00 58.89 60.17 1ci1 h TRP 171 Cb 0.71 -0.20 0.02 0.00 -3.00 0.00 0.00 29.16 26.70 1ci1 h TRP 171 CO -0.00 0.23 -0.94 0.00 -1.28 0.00 0.00 178.44 176.44 1ci1 h ALA 172 N 1.48 -0.06 -0.22 0.11 0.00 -1.46 -3.23 119.26 115.87 1ci1 h ALA 172 Ca 0.39 -0.71 0.02 0.00 0.00 0.00 0.00 54.91 54.61 1ci1 h ALA 172 Cb 0.46 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1ci1 h ALA 172 CO -0.30 0.47 0.10 0.82 0.00 0.00 0.00 179.25 180.34 1ci1 h ILE 173 N -0.14 0.99 0.00 0.00 2.04 -0.79 -1.27 117.51 118.34 1ci1 h ILE 173 Ca -0.15 -0.08 0.00 0.00 1.00 0.00 0.00 64.86 65.63 1ci1 h ILE 173 Cb 1.71 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.52 1ci1 h ILE 173 CO 0.18 0.04 0.00 0.61 0.00 0.00 0.00 178.15 178.98 1ci1 n GLY 174 N -1.17 -1.13 0.16 5.37 0.00 0.43 -3.23 105.19 105.63 1ci1 n GLY 174 Ca -0.02 -0.10 0.02 0.00 0.00 0.00 0.00 46.02 45.92 1ci1 n GLY 174 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ci1 n THR 175 N -1.37 0.06 -0.94 2.61 -2.24 -1.02 -5.00 114.28 106.38 1ci1 n THR 175 Ca 0.09 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 1ci1 n THR 175 Cb 0.21 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 1ci1 n THR 175 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ci1 n GLY 176 N 0.19 0.62 3.89 3.38 0.00 -0.53 -5.02 105.19 107.73 1ci1 n GLY 176 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1ci1 n GLY 176 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ci1 s LYS 177 N -0.29 2.65 -0.17 1.61 1.02 -0.87 -5.02 119.74 118.67 1ci1 s LYS 177 Ca 0.00 0.37 -0.00 0.00 0.02 0.00 0.00 55.97 56.36 1ci1 s LYS 177 Cb 0.00 -2.01 0.00 0.00 -0.52 0.00 0.00 37.83 35.30 1ci1 s LYS 177 CO 0.00 -1.16 -0.15 0.54 -0.92 0.00 0.00 175.35 173.66 1ci1 s VAL 178 N -3.41 2.64 0.15 3.17 0.11 -1.26 -4.49 120.40 117.32 1ci1 s VAL 178 Ca 0.59 -0.77 -0.30 0.00 -2.93 0.00 0.00 61.98 58.57 1ci1 s VAL 178 Cb -0.11 -2.12 -0.07 0.00 -1.53 0.00 0.00 36.38 32.55 1ci1 s VAL 178 CO 0.51 0.51 1.08 0.00 -3.33 0.00 0.00 175.10 173.86 1ci1 s ALA 179 N 0.98 3.34 0.65 1.54 0.00 -1.26 -5.03 121.76 121.98 1ci1 s ALA 179 Ca -0.02 0.76 -0.11 0.00 0.00 0.00 0.00 51.96 52.59 1ci1 s ALA 179 Cb -0.15 -3.34 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 1ci1 s ALA 179 CO -0.03 -0.19 1.04 0.95 0.00 0.00 0.00 175.76 177.54 1ci1 s THR 180 N -0.09 4.39 0.38 0.00 -4.23 -1.26 -4.92 115.64 109.91 1ci1 s THR 180 Ca 0.49 0.78 0.07 0.00 -1.18 0.00 0.00 61.69 61.86 1ci1 s THR 180 Cb -0.28 -3.65 0.29 0.00 1.34 0.00 0.00 72.50 70.20 1ci1 s THR 180 CO 0.33 -1.01 1.98 -0.65 -0.54 0.00 0.00 174.62 174.73 1ci1 h PRO 181 N -0.48 0.65 -0.44 3.99 0.11 -1.96 -2.15 132.00 131.72 1ci1 h PRO 181 Ca -0.44 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.53 1ci1 h PRO 181 Cb 1.20 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1ci1 h PRO 181 CO 0.60 0.43 -0.13 1.96 -0.21 0.00 0.00 178.00 180.65 1ci1 h GLN 182 N 0.67 0.81 -0.56 1.05 7.50 -1.95 -0.44 115.11 122.18 1ci1 h GLN 182 Ca 0.28 -0.28 -0.08 0.00 0.50 0.00 0.00 58.65 59.07 1ci1 h GLN 182 Cb 0.25 -0.06 -0.02 0.00 0.05 0.00 0.00 27.48 27.70 1ci1 h GLN 182 CO -0.09 0.89 0.04 1.96 -1.50 0.00 0.00 178.83 180.14 1ci1 h GLN 183 N 0.72 0.93 -0.04 1.46 4.20 -1.77 -0.62 115.11 119.99 1ci1 h GLN 183 Ca 0.12 -0.25 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 1ci1 h GLN 183 Cb 0.62 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.29 1ci1 h GLN 183 CO 0.04 0.90 -0.02 0.00 -0.67 0.00 0.00 178.83 179.07 1ci1 h ALA 184 N 1.17 0.06 0.00 3.87 0.00 -1.16 -3.12 119.26 120.08 1ci1 h ALA 184 Ca 0.17 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1ci1 h ALA 184 Cb 0.45 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1ci1 h ALA 184 CO 0.02 -0.20 -0.10 0.37 0.00 0.00 0.00 179.25 179.34 1ci1 h GLN 185 N -0.31 0.00 -0.71 0.00 5.75 -0.94 -1.78 115.11 117.11 1ci1 h GLN 185 Ca 0.01 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.50 1ci1 h GLN 185 Cb 0.47 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.98 1ci1 h GLN 185 CO 0.01 0.10 0.41 1.49 -2.65 0.00 0.00 178.83 178.18 1ci1 h GLU 186 N 0.00 0.97 0.18 1.69 4.81 -1.05 -1.26 114.58 119.92 1ci1 h GLU 186 Ca -0.00 -0.09 -0.33 0.00 -0.13 0.00 0.00 59.36 58.81 1ci1 h GLU 186 Cb 0.18 -0.20 0.01 0.00 0.63 0.00 0.00 28.75 29.37 1ci1 h GLU 186 CO 0.01 0.69 -1.57 0.28 -0.73 0.00 0.00 179.01 177.70 1ci1 h VAL 187 N 0.98 1.15 -0.73 0.32 2.07 -1.38 -3.19 116.25 115.47 1ci1 h VAL 187 Ca 0.25 -2.70 -0.01 0.00 0.82 0.00 0.00 66.70 65.06 1ci1 h VAL 187 Cb -0.01 2.86 -0.03 0.00 -1.52 0.00 0.00 31.29 32.59 1ci1 h VAL 187 CO -0.04 0.84 0.40 0.45 0.02 0.00 0.00 177.57 179.23 1ci1 h HIS 188 N 0.10 0.98 -0.32 1.57 3.86 -1.19 -1.52 115.15 118.63 1ci1 h HIS 188 Ca -0.27 -0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 58.89 1ci1 h HIS 188 Cb 2.08 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 30.22 1ci1 h HIS 188 CO 0.09 0.68 0.06 1.49 0.86 0.00 0.00 177.93 181.12 1ci1 h GLU 189 N 1.01 0.53 -0.80 2.45 4.22 -1.33 -0.42 114.58 120.24 1ci1 h GLU 189 Ca 0.26 -0.14 -0.05 0.00 0.08 0.00 0.00 59.36 59.51 1ci1 h GLU 189 Cb 0.03 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 1ci1 h GLU 189 CO -0.04 0.61 0.32 1.25 -2.18 0.00 0.00 179.01 178.96 1ci1 h LEU 190 N 0.36 1.11 -0.31 1.64 5.85 -1.48 0.29 115.31 122.77 1ci1 h LEU 190 Ca 0.10 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 1ci1 h LEU 190 Cb 0.32 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1ci1 h LEU 190 CO 0.00 0.98 0.12 -0.07 -0.34 0.00 0.00 178.44 179.14 1ci1 h LEU 191 N 1.17 0.44 -0.87 2.25 3.38 -1.04 -1.20 115.31 119.44 1ci1 h LEU 191 Ca 0.27 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 1ci1 h LEU 191 Cb 0.22 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 1ci1 h LEU 191 CO -0.02 0.49 -0.30 -0.09 0.09 0.00 0.00 178.44 178.61 1ci1 h ARG 192 N 0.36 0.48 -0.06 1.13 2.43 -0.84 -2.52 114.38 115.36 1ci1 h ARG 192 Ca 0.10 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1ci1 h ARG 192 Cb 0.19 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1ci1 h ARG 192 CO -0.01 0.73 0.04 -0.09 -1.51 0.00 0.00 179.97 179.14 1ci1 h ARG 193 N 0.42 0.08 -0.54 0.20 2.43 -0.63 0.39 114.38 116.72 1ci1 h ARG 193 Ca 0.05 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 59.25 1ci1 h ARG 193 Cb 0.74 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.23 1ci1 h ARG 193 CO 0.06 0.06 0.31 2.35 -1.51 0.00 0.00 179.97 181.24 1ci1 h TRP 194 N 0.08 0.58 -0.46 2.20 7.01 -1.07 -2.39 115.95 121.90 1ci1 h TRP 194 Ca 0.02 0.02 -0.07 0.00 2.11 0.00 0.00 58.89 60.98 1ci1 h TRP 194 Cb -0.01 -0.18 -0.02 0.00 -2.10 0.00 0.00 29.16 26.85 1ci1 h TRP 194 CO -0.07 0.32 0.03 0.28 -2.79 0.00 0.00 178.44 176.20 1ci1 h VAL 195 N 0.61 1.26 0.00 2.65 2.07 -1.25 -1.06 116.25 120.52 1ci1 h VAL 195 Ca 0.23 -0.99 -0.03 0.00 0.82 0.00 0.00 66.70 66.72 1ci1 h VAL 195 Cb 0.06 0.99 -0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1ci1 h VAL 195 CO -0.12 0.35 -0.14 -0.09 0.02 0.00 0.00 177.57 177.58 1ci1 h ARG 196 N 0.65 0.00 -0.00 1.57 2.43 -0.63 -0.05 114.38 118.35 1ci1 h ARG 196 Ca 0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1ci1 h ARG 196 Cb 0.45 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 1ci1 h ARG 196 CO 0.02 0.14 -0.58 -1.13 -1.51 0.00 0.00 179.97 176.91 1ci1 n SER 197 N -3.85 1.02 -0.06 -3.80 3.41 -0.92 -3.80 113.62 105.62 1ci1 n SER 197 Ca -0.02 -1.01 -0.07 0.00 -0.26 0.00 0.00 58.87 57.51 1ci1 n SER 197 Cb 0.24 0.82 -0.06 0.00 -0.26 0.00 0.00 64.21 64.95 1ci1 n SER 197 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1ci1 n LYS 198 N -0.94 0.86 -0.09 4.33 3.00 -0.41 -4.85 118.16 120.05 1ci1 n LYS 198 Ca 0.04 0.05 -0.14 0.00 -0.00 0.00 0.00 58.31 58.26 1ci1 n LYS 198 Cb 0.27 -1.24 -0.08 0.00 0.00 0.00 0.00 35.03 33.98 1ci1 n LYS 198 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1ci1 n LEU 199 N -2.72 2.55 0.00 3.14 4.77 -0.09 -5.06 117.00 119.58 1ci1 n LEU 199 Ca -0.20 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.78 1ci1 n LEU 199 Cb 0.74 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1ci1 n LEU 199 CO 0.14 0.69 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 1ci1 n GLY 200 N 2.43 3.35 0.13 -0.72 0.00 -0.82 -4.87 105.19 104.69 1ci1 n GLY 200 Ca -0.33 -0.76 -0.07 0.00 0.00 0.00 0.00 46.02 44.86 1ci1 n GLY 200 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1ci1 h THR 201 N 2.60 1.50 -0.35 2.61 1.35 -1.85 -2.51 112.91 116.26 1ci1 h THR 201 Ca 0.00 -2.53 -0.13 0.00 -0.55 0.00 0.00 66.41 63.19 1ci1 h THR 201 Cb 0.00 2.39 -0.01 0.00 -1.73 0.00 0.00 68.15 68.80 1ci1 h THR 201 CO 0.00 0.73 -0.30 -2.24 -0.25 0.00 0.00 175.52 173.46 1ci1 h ASP 202 N 0.09 0.87 0.14 5.36 2.03 -1.93 -2.74 116.42 120.24 1ci1 h ASP 202 Ca -0.03 -0.46 -0.01 0.00 -0.73 0.00 0.00 57.03 55.81 1ci1 h ASP 202 Cb 1.41 -0.24 0.00 0.00 -0.83 0.00 0.00 39.33 39.66 1ci1 h ASP 202 CO 0.12 1.14 -0.07 0.40 -1.03 0.00 0.00 179.24 179.80 1ci1 h ILE 203 N 0.61 0.91 -0.80 4.15 1.08 -1.88 -3.01 117.51 118.58 1ci1 h ILE 203 Ca 0.06 -0.20 0.04 0.00 -0.39 0.00 0.00 64.86 64.37 1ci1 h ILE 203 Cb 0.88 1.04 -0.05 0.00 -3.07 0.00 0.00 36.82 35.62 1ci1 h ILE 203 CO 0.08 0.05 0.53 0.00 -0.69 0.00 0.00 178.15 178.11 1ci1 h ALA 204 N 0.56 1.54 0.00 1.87 0.00 -1.48 -0.92 119.26 120.82 1ci1 h ALA 204 Ca -0.02 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 1ci1 h ALA 204 Cb 0.23 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1ci1 h ALA 204 CO 0.03 0.38 -0.34 0.00 0.00 0.00 0.00 179.25 179.32 1ci1 h ALA 205 N 1.54 1.36 0.00 0.00 0.00 -1.39 -3.17 119.26 117.61 1ci1 h ALA 205 Ca 0.32 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ci1 h ALA 205 Cb 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1ci1 h ALA 205 CO -0.10 0.42 -1.40 1.04 0.00 0.00 0.00 179.25 179.22 1ci1 n GLN 206 N -4.03 0.30 -2.24 0.00 1.13 -0.99 -4.39 117.38 107.17 1ci1 n GLN 206 Ca -0.02 -0.08 -0.42 0.00 -1.94 0.00 0.00 57.00 54.55 1ci1 n GLN 206 Cb 0.39 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 29.21 1ci1 n GLN 206 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1ci1 s LEU 207 N -3.61 4.40 -0.19 1.08 2.96 -0.39 -4.88 118.68 118.06 1ci1 s LEU 207 Ca 0.02 2.32 -0.14 0.00 -0.22 0.00 0.00 54.13 56.11 1ci1 s LEU 207 Cb 0.15 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.20 1ci1 s LEU 207 CO 0.88 -0.54 0.29 -0.13 -1.32 0.00 0.00 176.35 175.53 1ci1 s ARG 208 N 0.37 4.19 -0.29 1.98 3.00 -1.26 -4.90 118.95 122.03 1ci1 s ARG 208 Ca 0.59 0.04 0.03 0.00 0.00 0.00 0.00 55.73 56.38 1ci1 s ARG 208 Cb -0.35 -3.49 0.07 0.00 0.00 0.00 0.00 34.95 31.18 1ci1 s ARG 208 CO 0.35 0.11 -0.04 0.42 0.00 0.00 0.00 175.30 176.14 1ci1 s ILE 209 N 0.88 2.31 0.25 1.52 1.01 -1.26 -1.33 121.20 124.59 1ci1 s ILE 209 Ca 0.15 -1.87 -0.12 0.00 0.00 0.00 0.00 60.65 58.81 1ci1 s ILE 209 Cb -0.14 -2.49 -0.08 0.00 0.01 0.00 0.00 42.46 39.77 1ci1 s ILE 209 CO 0.05 -0.25 0.62 -0.76 0.00 0.00 0.00 174.94 174.60 1ci1 s LEU 210 N 1.05 4.16 -0.22 2.97 1.43 0.29 -1.59 118.68 126.76 1ci1 s LEU 210 Ca -0.01 1.07 -0.17 0.00 -1.03 0.00 0.00 54.13 53.98 1ci1 s LEU 210 Cb -0.20 -3.77 -0.03 0.00 0.03 0.00 0.00 46.19 42.22 1ci1 s LEU 210 CO -0.06 -0.10 0.48 -0.47 0.23 0.00 0.00 176.35 176.44 1ci1 s TYR 211 N -1.83 3.33 -0.32 0.29 5.04 -0.26 -0.45 117.35 123.16 1ci1 s TYR 211 Ca 0.48 0.67 0.08 0.00 -2.44 0.00 0.00 57.07 55.87 1ci1 s TYR 211 Cb -0.11 -2.64 0.56 0.00 0.35 0.00 0.00 41.96 40.11 1ci1 s TYR 211 CO 0.20 -0.14 1.59 0.41 -1.34 0.00 0.00 175.55 176.27 1ci1 n GLY 212 N 4.09 4.65 0.00 8.97 0.00 0.14 -1.50 105.19 121.54 1ci1 n GLY 212 Ca -0.06 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1ci1 n GLY 212 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ci1 n GLY 213 N -1.02 0.77 3.60 -0.02 0.00 -1.26 -4.58 105.19 102.68 1ci1 n GLY 213 Ca 0.39 -1.69 -0.43 0.00 0.00 0.00 0.00 46.02 44.29 1ci1 n GLY 213 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ci1 s SER 214 N -1.00 6.65 -0.06 1.61 0.15 -1.26 -4.72 113.70 115.07 1ci1 s SER 214 Ca 0.00 0.49 0.06 0.00 0.70 0.00 0.00 55.95 57.19 1ci1 s SER 214 Cb 0.00 -2.52 -0.01 0.00 -1.71 0.00 0.00 66.02 61.78 1ci1 s SER 214 CO 0.00 -1.12 -0.23 -0.69 1.20 0.00 0.00 173.24 172.40 1ci1 s VAL 215 N 4.09 2.25 0.21 4.45 1.01 -1.26 -4.98 120.40 126.17 1ci1 s VAL 215 Ca 0.44 -1.00 -0.02 0.00 0.00 0.00 0.00 61.98 61.40 1ci1 s VAL 215 Cb -0.09 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 1ci1 s VAL 215 CO 0.27 0.57 0.17 0.42 0.00 0.00 0.00 175.10 176.53 1ci1 s THR 216 N -0.24 0.00 0.44 3.92 -4.23 -1.26 -4.58 115.64 109.69 1ci1 s THR 216 Ca -0.01 -1.92 0.40 0.00 -1.18 0.00 0.00 61.69 58.98 1ci1 s THR 216 Cb -0.13 -2.46 0.42 0.00 1.34 0.00 0.00 72.50 71.67 1ci1 s THR 216 CO 0.03 -0.00 2.22 0.00 -0.54 0.00 0.00 174.62 176.32 1ci1 h ALA 217 N 2.58 1.00 -0.10 3.99 0.00 -1.93 0.25 119.26 125.05 1ci1 h ALA 217 Ca -0.35 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.47 1ci1 h ALA 217 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1ci1 h ALA 217 CO 0.51 0.00 -0.29 0.87 0.00 0.00 0.00 179.25 180.33 1ci1 h LYS 218 N 0.00 0.38 -0.00 0.00 1.57 -1.98 -3.37 116.57 113.17 1ci1 h LYS 218 Ca 0.00 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 1ci1 h LYS 218 Cb 0.19 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1ci1 h LYS 218 CO 0.00 0.89 -0.71 0.27 -0.57 0.00 0.00 179.45 179.33 1ci1 n ASN 219 N -4.43 1.00 -0.20 0.86 0.23 -1.10 -4.65 115.26 106.97 1ci1 n ASN 219 Ca -0.08 -1.00 0.01 0.00 -0.53 0.00 0.00 54.58 52.98 1ci1 n ASN 219 Cb 0.48 0.89 0.09 0.00 -2.08 0.00 0.00 39.78 39.16 1ci1 n ASN 219 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ci1 h ALA 220 N 2.55 0.58 -0.57 -2.53 0.00 -1.11 -1.96 119.26 116.22 1ci1 h ALA 220 Ca 0.00 0.19 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 1ci1 h ALA 220 Cb 0.44 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1ci1 h ALA 220 CO 0.00 -0.39 -0.04 -0.09 0.00 0.00 0.00 179.25 178.73 1ci1 h ARG 221 N 0.11 1.03 -0.22 0.00 9.65 -1.82 -2.19 114.38 120.94 1ci1 h ARG 221 Ca 0.31 -0.34 -0.06 0.00 -1.10 0.00 0.00 59.98 58.80 1ci1 h ARG 221 Cb 0.50 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.98 1ci1 h ARG 221 CO -0.52 1.03 -0.11 1.79 2.80 0.00 0.00 179.97 184.95 1ci1 h THR 222 N 0.93 1.20 -0.02 0.20 1.35 -1.70 -2.71 112.91 112.16 1ci1 h THR 222 Ca 0.16 -0.86 -0.03 0.00 -0.55 0.00 0.00 66.41 65.13 1ci1 h THR 222 Cb 0.59 1.16 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 1ci1 h THR 222 CO 0.04 0.28 -0.09 -0.07 -0.25 0.00 0.00 175.52 175.42 1ci1 h LEU 223 N 0.33 0.11 -1.68 3.87 3.38 -1.19 -3.26 115.31 116.87 1ci1 h LEU 223 Ca 0.07 -0.68 0.00 0.00 0.09 0.00 0.00 57.88 57.36 1ci1 h LEU 223 Cb 0.41 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1ci1 h LEU 223 CO 0.02 0.77 0.00 0.22 0.09 0.00 0.00 178.44 179.54 1ci1 h TYR 224 N -0.54 0.00 0.00 1.13 3.20 -1.32 -1.91 116.97 117.53 1ci1 h TYR 224 Ca -0.01 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1ci1 h TYR 224 Cb 0.77 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.04 1ci1 h TYR 224 CO 0.16 0.00 0.00 -0.56 -1.64 0.00 0.00 178.16 176.12 1ci1 h GLN 225 N 0.00 0.00 -6.91 1.82 3.07 -1.52 -3.44 115.11 108.13 1ci1 h GLN 225 Ca 0.00 0.00 -0.50 0.00 0.09 0.00 0.00 58.65 58.24 1ci1 h GLN 225 Cb 0.16 0.00 0.04 0.00 0.08 0.00 0.00 27.48 27.76 1ci1 h GLN 225 CO 0.00 0.00 0.50 -1.64 0.09 0.00 0.00 178.83 177.78 1ci1 s MET 226 N -3.25 4.22 0.22 0.06 -1.94 -0.72 -4.96 119.30 112.93 1ci1 s MET 226 Ca 0.07 1.82 -0.07 0.00 -1.71 0.00 0.00 55.69 55.79 1ci1 s MET 226 Cb 0.10 -2.80 0.34 0.00 2.01 0.00 0.00 34.83 34.48 1ci1 s MET 226 CO 0.49 -0.17 1.75 -0.09 -0.01 0.00 0.00 175.02 176.99 1ci1 h ARG 227 N 2.93 0.48 -0.58 2.03 9.65 -1.89 -3.14 114.38 123.86 1ci1 h ARG 227 Ca -0.48 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.37 1ci1 h ARG 227 Cb 1.23 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 29.70 1ci1 h ARG 227 CO 0.64 0.31 0.00 -0.25 2.80 0.00 0.00 179.97 183.47 1ci1 n ASP 228 N -4.95 5.47 -4.44 -3.80 8.00 -1.26 -4.86 116.55 110.71 1ci1 n ASP 228 Ca 0.11 -2.83 -0.37 0.00 0.71 0.00 0.00 54.79 52.40 1ci1 n ASP 228 Cb 0.31 -0.66 -0.12 0.00 -0.02 0.00 0.00 41.12 40.63 1ci1 n ASP 228 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ci1 s ILE 229 N -2.57 4.39 -0.31 0.53 1.01 -1.19 -4.61 121.20 118.44 1ci1 s ILE 229 Ca 0.54 -0.29 0.09 0.00 0.00 0.00 0.00 60.65 60.99 1ci1 s ILE 229 Cb 0.40 -3.13 0.58 0.00 0.01 0.00 0.00 42.46 40.32 1ci1 s ILE 229 CO 0.18 0.23 1.61 0.59 0.00 0.00 0.00 174.94 177.55 1ci1 n ASN 230 N 4.94 3.36 0.00 3.58 4.13 -0.62 -4.83 115.26 125.81 1ci1 n ASN 230 Ca -0.15 -3.53 0.00 0.00 1.68 0.00 0.00 54.58 52.58 1ci1 n ASN 230 Cb 0.50 -0.68 0.00 0.00 -1.54 0.00 0.00 39.78 38.06 1ci1 n ASN 230 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ci1 n GLY 231 N -0.88 0.92 3.11 7.41 0.00 -1.26 -1.69 105.19 112.81 1ci1 n GLY 231 Ca 0.38 -1.94 -0.09 0.00 0.00 0.00 0.00 46.02 44.37 1ci1 n GLY 231 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ci1 s PHE 232 N -2.13 0.65 -0.43 1.61 0.08 -0.16 -1.10 117.98 116.50 1ci1 s PHE 232 Ca 0.00 -0.94 0.04 0.00 0.12 0.00 0.00 56.93 56.14 1ci1 s PHE 232 Cb 0.00 -0.42 0.11 0.00 -0.57 0.00 0.00 43.02 42.14 1ci1 s PHE 232 CO 0.00 -0.27 0.15 -1.17 -0.10 0.00 0.00 175.22 173.83 1ci1 s LEU 233 N -2.79 4.52 0.13 -0.37 2.96 -0.57 -0.21 118.68 122.35 1ci1 s LEU 233 Ca 0.06 -2.57 -0.24 0.00 -0.22 0.00 0.00 54.13 51.17 1ci1 s LEU 233 Cb 0.05 -1.63 -0.07 0.00 0.50 0.00 0.00 46.19 45.04 1ci1 s LEU 233 CO -0.07 -0.31 0.72 -0.69 -1.32 0.00 0.00 176.35 174.69 1ci1 s VAL 234 N 0.34 4.50 0.00 1.68 1.01 0.12 -4.46 120.40 123.58 1ci1 s VAL 234 Ca 0.14 1.57 0.00 0.00 0.00 0.00 0.00 61.98 63.69 1ci1 s VAL 234 Cb -0.22 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.08 1ci1 s VAL 234 CO -0.04 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.18 1ci1 n GLY 235 N 1.71 0.55 0.43 4.51 0.00 -1.26 -1.17 105.19 109.96 1ci1 n GLY 235 Ca -0.06 0.00 0.25 0.00 0.00 0.00 0.00 46.02 46.20 1ci1 n GLY 235 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ci1 h GLY 236 N 0.00 0.27 2.00 -0.02 0.00 -1.92 -0.61 103.07 102.78 1ci1 h GLY 236 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.27 1ci1 h GLY 236 CO 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 1ci1 n ALA 237 N -2.64 1.50 1.37 3.60 0.00 -1.26 -2.26 120.51 120.81 1ci1 n ALA 237 Ca 0.18 0.07 0.14 0.00 0.00 0.00 0.00 53.44 53.83 1ci1 n ALA 237 Cb 0.84 -1.31 0.65 0.00 0.00 0.00 0.00 19.45 19.63 1ci1 n ALA 237 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ci1 n SER 238 N -2.03 0.25 -1.47 0.00 3.41 -0.24 -3.18 113.62 110.36 1ci1 n SER 238 Ca 0.02 -0.32 0.11 0.00 -0.26 0.00 0.00 58.87 58.41 1ci1 n SER 238 Cb 0.16 -0.17 0.34 0.00 -0.26 0.00 0.00 64.21 64.29 1ci1 n SER 238 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ci1 n LEU 239 N -1.15 4.39 -4.30 1.04 4.77 -0.96 -4.90 117.00 115.89 1ci1 n LEU 239 Ca 0.14 -2.24 -0.16 0.00 -0.03 0.00 0.00 56.01 53.71 1ci1 n LEU 239 Cb 0.27 -0.54 -0.10 0.00 -2.33 0.00 0.00 43.42 40.72 1ci1 n LEU 239 CO 0.24 0.90 -0.43 -0.54 -1.33 0.00 0.00 177.39 176.23 1ci1 s LYS 240 N -1.45 1.20 0.64 3.23 1.02 -1.19 -5.04 119.74 118.15 1ci1 s LYS 240 Ca 0.50 -1.53 0.37 0.00 0.02 0.00 0.00 55.97 55.34 1ci1 s LYS 240 Cb 0.29 -0.88 2.10 0.00 -0.52 0.00 0.00 37.83 38.82 1ci1 s LYS 240 CO 0.29 0.13 2.27 -1.35 -0.92 0.00 0.00 175.35 175.77 1ci1 h PRO 241 N 2.66 0.00 0.00 -1.68 0.11 -1.92 -2.12 132.00 129.05 1ci1 h PRO 241 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1ci1 h PRO 241 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1ci1 h PRO 241 CO 0.63 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.57 1ci1 n GLU 242 N -3.36 0.11 0.28 1.05 0.28 -1.26 -2.04 120.64 115.71 1ci1 n GLU 242 Ca -0.02 0.46 0.14 0.00 -0.16 0.00 0.00 57.16 57.58 1ci1 n GLU 242 Cb 0.13 -1.77 0.84 0.00 1.43 0.00 0.00 31.44 32.07 1ci1 n GLU 242 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 177.13 177.32 1ci1 h PHE 243 N 0.00 0.00 -0.61 -1.84 3.57 -1.44 -1.09 116.94 115.53 1ci1 h PHE 243 Ca 0.00 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.41 1ci1 h PHE 243 Cb 0.19 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 1ci1 h PHE 243 CO 0.00 0.04 0.05 0.28 -2.23 0.00 0.00 178.31 176.45 1ci1 h VAL 244 N 0.00 1.26 -0.00 1.41 2.07 -1.66 -2.08 116.25 117.24 1ci1 h VAL 244 Ca -0.00 -1.08 -0.11 0.00 0.82 0.00 0.00 66.70 66.33 1ci1 h VAL 244 Cb 0.11 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1ci1 h VAL 244 CO 0.01 0.40 -0.52 -0.33 0.02 0.00 0.00 177.57 177.14 1ci1 h GLU 245 N 0.96 0.01 -0.21 1.57 3.07 -1.40 -1.99 114.58 116.60 1ci1 h GLU 245 Ca 0.18 -0.01 -0.15 0.00 -0.50 0.00 0.00 59.36 58.89 1ci1 h GLU 245 Cb 0.49 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.39 1ci1 h GLU 245 CO 0.02 0.53 -0.49 0.82 -1.40 0.00 0.00 179.01 178.49 1ci1 h ILE 246 N 0.01 1.31 -0.36 3.13 2.04 -1.10 -1.95 117.51 120.59 1ci1 h ILE 246 Ca -0.00 -1.71 -0.08 0.00 1.00 0.00 0.00 64.86 64.07 1ci1 h ILE 246 Cb 0.92 1.69 -0.01 0.00 -0.74 0.00 0.00 36.82 38.68 1ci1 h ILE 246 CO 0.07 0.53 -0.09 0.40 0.00 0.00 0.00 178.15 179.07 1ci1 h ILE 247 N 0.44 1.28 0.00 -0.67 2.04 -1.09 -2.73 117.51 116.77 1ci1 h ILE 247 Ca 0.02 -1.15 -0.02 0.00 1.00 0.00 0.00 64.86 64.71 1ci1 h ILE 247 Cb 1.01 1.28 -0.00 0.00 -0.74 0.00 0.00 36.82 38.37 1ci1 h ILE 247 CO 0.09 0.38 -0.07 -0.33 0.00 0.00 0.00 178.15 178.22 1ci1 h GLU 248 N 0.49 0.00 0.00 2.37 4.39 -1.23 -2.09 114.58 118.51 1ci1 h GLU 248 Ca 0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1ci1 h GLU 248 Cb 0.59 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 1ci1 h GLU 248 CO 0.04 0.07 0.00 0.00 -1.16 0.00 0.00 179.01 177.96 1ci1 n ALA 249 N -2.29 1.56 0.24 3.43 0.00 -0.75 -1.88 120.51 120.83 1ci1 n ALA 249 Ca -0.02 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.49 1ci1 n ALA 249 Cb 0.18 -1.19 0.26 0.00 0.00 0.00 0.00 19.45 18.69 1ci1 n ALA 249 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ci1 n THR 250 N -1.47 0.61 0.68 0.00 -2.24 -0.78 -4.64 114.28 106.44 1ci1 n THR 250 Ca 0.03 -0.76 0.05 0.00 -2.27 0.00 0.00 64.05 61.10 1ci1 n THR 250 Cb 0.13 0.75 0.32 0.00 -2.10 0.00 0.00 70.33 69.43 1ci1 n THR 250 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67